----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 12:43:03]------------------------- 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 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 8.142890920347236 -2.564489820000000 0.000000000000000 b 8.142890920347236 2.564489820000000 0.000000000000000 c -0.668119164053652 0.000000000000000 11.291117190367997 Atomic positions (fractional): *1 Na 0.72337775531645 0.18730612706982 0.03437913876148 22.990 2 Na 0.18730612706982 0.72337775531645 0.53437913876148 22.990 3 Na 0.81269387293018 0.27662224468355 0.46562086123852 22.990 4 Na 0.27662224468355 0.81269387293018 0.96562086123852 22.990 *5 Ca 0.08387846905058 0.61128320712467 0.79247147881557 40.078 6 Ca 0.61128320712467 0.08387846905058 0.29247147881557 40.078 *7 Ca 0.00000000000000 0.50000000000000 0.50000000000000 40.078 8 Ca 0.38871679287533 0.91612153094942 0.70752852118443 40.078 9 Ca 0.91612153094942 0.38871679287533 0.20752852118443 40.078 10 Ca 0.50000000000000 0.00000000000000 0.00000000000000 40.078 *11 Si 0.20263559201401 0.79736440798599 0.25000000000000 28.085 12 Si 0.79736440798599 0.20263559201401 0.75000000000000 28.085 *13 Si 0.15944061551454 0.53639766249324 0.10341029735660 28.085 14 Si 0.53639766249324 0.15944061551454 0.60341029735660 28.085 15 Si 0.84055938448546 0.46360233750676 0.89658970264340 28.085 16 Si 0.46360233750676 0.84055938448546 0.39658970264340 28.085 *17 O 0.15925503641636 0.15273603172601 0.89013583686907 15.999 *18 O 0.58201534849653 0.70352024052009 0.52736755505204 15.999 *19 O 0.92222065754132 0.99040544342033 0.84951502201861 15.999 20 O 0.00959455657967 0.07777934245868 0.65048497798139 15.999 *21 O 0.48411490558263 0.65159198657224 0.31421696111371 15.999 22 O 0.41798465150347 0.29647975947991 0.47263244494796 15.999 23 O 0.51588509441737 0.34840801342776 0.68578303888629 15.999 24 O 0.70352024052009 0.58201534849653 0.02736755505204 15.999 25 O 0.29647975947991 0.41798465150347 0.97263244494796 15.999 26 O 0.84726396827399 0.84074496358364 0.60986416313093 15.999 27 O 0.99040544342033 0.92222065754132 0.34951502201861 15.999 *28 O 0.30630295350906 0.23779838587286 0.66279080823846 15.999 29 O 0.84074496358364 0.84726396827399 0.10986416313093 15.999 30 O 0.15273603172601 0.15925503641636 0.39013583686907 15.999 31 O 0.34840801342776 0.51588509441737 0.18578303888629 15.999 32 O 0.76220161412714 0.69369704649093 0.83720919176154 15.999 33 O 0.23779838587286 0.30630295350907 0.16279080823846 15.999 34 O 0.07777934245868 0.00959455657967 0.15048497798139 15.999 35 O 0.65159198657224 0.48411490558263 0.81421696111371 15.999 36 O 0.69369704649093 0.76220161412714 0.33720919176154 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 16.285781840694472 0.000000000000000 0.000000000000000 b 0.000000000000000 5.128979640000000 0.000000000000000 c -0.668119164053652 0.000000000000000 11.291117190367997 Atomic positions (fractional): *1 Na 0.45534194119313 0.73196418587669 0.03437913876148 22.990 > 1 2 Na 0.45534194119313 0.26803581412332 0.53437913876148 22.990 > 2 3 Na 0.04465805880687 0.23196418587668 0.46562086123852 22.990 > 3 4 Na 0.04465805880687 0.76803581412331 0.96562086123852 22.990 > 4 5 Na 0.95534194119313 0.23196418587668 0.03437913876148 22.990 > 1 6 Na 0.95534194119313 0.76803581412331 0.53437913876148 22.990 > 2 7 Na 0.54465805880687 0.73196418587669 0.46562086123852 22.990 > 3 8 Na 0.54465805880687 0.26803581412332 0.96562086123852 22.990 > 4 *9 Ca 0.34758083808762 0.26370236903704 0.79247147881557 40.078 > 5 10 Ca 0.34758083808762 0.73629763096296 0.29247147881557 40.078 > 6 *11 Ca 0.25000000000000 0.25000000000000 0.50000000000000 40.078 > 7 12 Ca 0.15241916191238 0.76370236903704 0.70752852118443 40.078 > 8 13 Ca 0.15241916191238 0.23629763096296 0.20752852118443 40.078 > 9 14 Ca 0.25000000000000 0.75000000000000 0.00000000000000 40.078 > 10 15 Ca 0.84758083808762 0.76370236903704 0.79247147881557 40.078 > 5 16 Ca 0.84758083808762 0.23629763096296 0.29247147881557 40.078 > 6 17 Ca 0.75000000000000 0.75000000000000 0.50000000000000 40.078 > 7 18 Ca 0.65241916191238 0.26370236903704 0.70752852118443 40.078 > 8 19 Ca 0.65241916191238 0.73629763096296 0.20752852118443 40.078 > 9 20 Ca 0.75000000000000 0.25000000000000 0.00000000000000 40.078 > 10 *21 Si 0.00000000000000 0.79736440798599 0.25000000000000 28.085 > 11 22 Si 0.00000000000000 0.20263559201401 0.75000000000000 28.085 > 12 *23 Si 0.34791913900389 0.18847852348935 0.10341029735660 28.085 > 13 24 Si 0.34791913900389 0.81152147651065 0.60341029735660 28.085 > 14 25 Si 0.15208086099611 0.31152147651065 0.89658970264340 28.085 > 15 26 Si 0.15208086099611 0.68847852348935 0.39658970264340 28.085 > 16 27 Si 0.50000000000000 0.29736440798599 0.25000000000000 28.085 > 11 28 Si 0.50000000000000 0.70263559201401 0.75000000000000 28.085 > 12 29 Si 0.84791913900389 0.68847852348935 0.10341029735660 28.085 > 13 30 Si 0.84791913900389 0.31152147651065 0.60341029735660 28.085 > 14 31 Si 0.65208086099611 0.81152147651065 0.89658970264340 28.085 > 15 32 Si 0.65208086099611 0.18847852348935 0.39658970264340 28.085 > 16 *33 O 0.15599553407119 0.99674049765482 0.89013583686907 15.999 > 17 *34 O 0.14276779450831 0.56075244601178 0.52736755505204 15.999 > 18 *35 O 0.45631305048082 0.53409239293950 0.84951502201861 15.999 > 19 36 O 0.04368694951917 0.03409239293950 0.65048497798139 15.999 > 20 *37 O 0.06785344607744 0.58373854049481 0.31421696111371 15.999 > 21 38 O 0.35723220549169 0.93924755398822 0.47263244494796 15.999 > 22 39 O 0.43214655392256 0.91626145950519 0.68578303888629 15.999 > 23 40 O 0.14276779450831 0.43924755398822 0.02736755505204 15.999 > 24 41 O 0.35723220549169 0.06075244601178 0.97263244494796 15.999 > 25 42 O 0.34400446592881 0.49674049765482 0.60986416313093 15.999 > 26 43 O 0.45631305048082 0.46590760706050 0.34951502201861 15.999 > 27 *44 O 0.27205066969096 0.96574771618190 0.66279080823846 15.999 > 28 45 O 0.34400446592881 0.50325950234518 0.10986416313093 15.999 > 29 46 O 0.15599553407119 0.00325950234518 0.39013583686907 15.999 > 30 47 O 0.43214655392256 0.08373854049481 0.18578303888629 15.999 > 31 48 O 0.22794933030904 0.46574771618190 0.83720919176154 15.999 > 32 49 O 0.27205066969096 0.03425228381810 0.16279080823846 15.999 > 33 50 O 0.04368694951917 0.96590760706050 0.15048497798139 15.999 > 34 51 O 0.06785344607744 0.41626145950519 0.81421696111371 15.999 > 35 52 O 0.22794933030904 0.53425228381810 0.33720919176154 15.999 > 36 53 O 0.65599553407119 0.49674049765482 0.89013583686907 15.999 > 17 54 O 0.64276779450831 0.06075244601178 0.52736755505204 15.999 > 18 55 O 0.95631305048083 0.03409239293950 0.84951502201861 15.999 > 19 56 O 0.54368694951917 0.53409239293950 0.65048497798139 15.999 > 20 57 O 0.56785344607744 0.08373854049481 0.31421696111371 15.999 > 21 58 O 0.85723220549169 0.43924755398822 0.47263244494796 15.999 > 22 59 O 0.93214655392256 0.41626145950519 0.68578303888629 15.999 > 23 60 O 0.64276779450831 0.93924755398822 0.02736755505204 15.999 > 24 61 O 0.85723220549169 0.56075244601178 0.97263244494796 15.999 > 25 62 O 0.84400446592881 0.99674049765482 0.60986416313093 15.999 > 26 63 O 0.95631305048083 0.96590760706050 0.34951502201861 15.999 > 27 64 O 0.77205066969096 0.46574771618190 0.66279080823846 15.999 > 28 65 O 0.84400446592881 0.00325950234518 0.10986416313093 15.999 > 29 66 O 0.65599553407119 0.50325950234518 0.39013583686907 15.999 > 30 67 O 0.93214655392256 0.58373854049481 0.18578303888629 15.999 > 31 68 O 0.72794933030904 0.96574771618190 0.83720919176154 15.999 > 32 69 O 0.77205066969096 0.53425228381810 0.16279080823846 15.999 > 33 70 O 0.54368694951917 0.46590760706050 0.15048497798139 15.999 > 34 71 O 0.56785344607744 0.91626145950519 0.81421696111371 15.999 > 35 72 O 0.72794933030904 0.03425228381810 0.33720919176154 15.999 > 36 -------------------------------- super cell -------------------------------- Lattice vectors: a 16.285781840694472 0.000000000000000 0.000000000000000 b 0.000000000000000 10.257959280000000 0.000000000000000 c -0.668119164053652 0.000000000000000 11.291117190367997 Atomic positions (fractional): *1 Na 0.45534194119313 0.36598209293834 0.03437913876148 22.990 > 1 2 Na 0.45534194119313 0.86598209293834 0.03437913876148 22.990 > 1 3 Na 0.45534194119313 0.13401790706166 0.53437913876148 22.990 > 2 4 Na 0.45534194119313 0.63401790706166 0.53437913876148 22.990 > 2 5 Na 0.04465805880687 0.11598209293834 0.46562086123852 22.990 > 3 6 Na 0.04465805880687 0.61598209293834 0.46562086123852 22.990 > 3 7 Na 0.04465805880687 0.38401790706166 0.96562086123852 22.990 > 4 8 Na 0.04465805880687 0.88401790706166 0.96562086123852 22.990 > 4 9 Na 0.95534194119313 0.11598209293834 0.03437913876148 22.990 > 1 10 Na 0.95534194119313 0.61598209293834 0.03437913876148 22.990 > 1 11 Na 0.95534194119313 0.38401790706166 0.53437913876148 22.990 > 2 12 Na 0.95534194119313 0.88401790706166 0.53437913876148 22.990 > 2 13 Na 0.54465805880687 0.36598209293834 0.46562086123852 22.990 > 3 14 Na 0.54465805880687 0.86598209293834 0.46562086123852 22.990 > 3 15 Na 0.54465805880687 0.13401790706166 0.96562086123852 22.990 > 4 16 Na 0.54465805880687 0.63401790706166 0.96562086123852 22.990 > 4 *17 Ca 0.34758083808762 0.13185118451852 0.79247147881557 40.078 > 5 18 Ca 0.34758083808762 0.63185118451852 0.79247147881557 40.078 > 5 19 Ca 0.34758083808762 0.36814881548148 0.29247147881557 40.078 > 6 20 Ca 0.34758083808762 0.86814881548148 0.29247147881557 40.078 > 6 *21 Ca 0.25000000000000 0.12500000000000 0.50000000000000 40.078 > 7 22 Ca 0.25000000000000 0.62500000000000 0.50000000000000 40.078 > 7 23 Ca 0.15241916191238 0.38185118451852 0.70752852118443 40.078 > 8 24 Ca 0.15241916191238 0.88185118451852 0.70752852118443 40.078 > 8 25 Ca 0.15241916191238 0.11814881548148 0.20752852118443 40.078 > 9 26 Ca 0.15241916191238 0.61814881548148 0.20752852118443 40.078 > 9 27 Ca 0.25000000000000 0.37500000000000 0.00000000000000 40.078 > 10 28 Ca 0.25000000000000 0.87500000000000 0.00000000000000 40.078 > 10 29 Ca 0.84758083808762 0.38185118451852 0.79247147881557 40.078 > 5 30 Ca 0.84758083808762 0.88185118451852 0.79247147881557 40.078 > 5 31 Ca 0.84758083808762 0.11814881548148 0.29247147881557 40.078 > 6 32 Ca 0.84758083808762 0.61814881548148 0.29247147881557 40.078 > 6 33 Ca 0.75000000000000 0.37500000000000 0.50000000000000 40.078 > 7 34 Ca 0.75000000000000 0.87500000000000 0.50000000000000 40.078 > 7 35 Ca 0.65241916191238 0.13185118451852 0.70752852118443 40.078 > 8 36 Ca 0.65241916191238 0.63185118451852 0.70752852118443 40.078 > 8 37 Ca 0.65241916191238 0.36814881548148 0.20752852118443 40.078 > 9 38 Ca 0.65241916191238 0.86814881548148 0.20752852118443 40.078 > 9 39 Ca 0.75000000000000 0.12500000000000 0.00000000000000 40.078 > 10 40 Ca 0.75000000000000 0.62500000000000 0.00000000000000 40.078 > 10 *41 Si 0.00000000000000 0.39868220399299 0.25000000000000 28.085 > 11 42 Si 0.00000000000000 0.89868220399299 0.25000000000000 28.085 > 11 43 Si 0.00000000000000 0.10131779600700 0.75000000000000 28.085 > 12 44 Si 0.00000000000000 0.60131779600700 0.75000000000000 28.085 > 12 *45 Si 0.34791913900389 0.09423926174468 0.10341029735660 28.085 > 13 46 Si 0.34791913900389 0.59423926174468 0.10341029735660 28.085 > 13 47 Si 0.34791913900389 0.40576073825532 0.60341029735660 28.085 > 14 48 Si 0.34791913900389 0.90576073825532 0.60341029735660 28.085 > 14 49 Si 0.15208086099611 0.15576073825532 0.89658970264340 28.085 > 15 50 Si 0.15208086099611 0.65576073825532 0.89658970264340 28.085 > 15 51 Si 0.15208086099611 0.34423926174468 0.39658970264340 28.085 > 16 52 Si 0.15208086099611 0.84423926174468 0.39658970264340 28.085 > 16 53 Si 0.50000000000000 0.14868220399300 0.25000000000000 28.085 > 11 54 Si 0.50000000000000 0.64868220399300 0.25000000000000 28.085 > 11 55 Si 0.50000000000000 0.35131779600701 0.75000000000000 28.085 > 12 56 Si 0.50000000000000 0.85131779600701 0.75000000000000 28.085 > 12 57 Si 0.84791913900389 0.34423926174468 0.10341029735660 28.085 > 13 58 Si 0.84791913900389 0.84423926174468 0.10341029735660 28.085 > 13 59 Si 0.84791913900389 0.15576073825532 0.60341029735660 28.085 > 14 60 Si 0.84791913900389 0.65576073825532 0.60341029735660 28.085 > 14 61 Si 0.65208086099611 0.40576073825532 0.89658970264340 28.085 > 15 62 Si 0.65208086099611 0.90576073825532 0.89658970264340 28.085 > 15 63 Si 0.65208086099611 0.09423926174468 0.39658970264340 28.085 > 16 64 Si 0.65208086099611 0.59423926174468 0.39658970264340 28.085 > 16 *65 O 0.15599553407119 0.49837024882741 0.89013583686907 15.999 > 17 66 O 0.15599553407119 0.99837024882741 0.89013583686907 15.999 > 17 *67 O 0.14276779450831 0.28037622300589 0.52736755505204 15.999 > 18 68 O 0.14276779450831 0.78037622300589 0.52736755505204 15.999 > 18 *69 O 0.45631305048082 0.26704619646975 0.84951502201861 15.999 > 19 70 O 0.45631305048082 0.76704619646975 0.84951502201861 15.999 > 19 71 O 0.04368694951917 0.01704619646975 0.65048497798139 15.999 > 20 72 O 0.04368694951917 0.51704619646975 0.65048497798139 15.999 > 20 *73 O 0.06785344607744 0.29186927024740 0.31421696111371 15.999 > 21 74 O 0.06785344607744 0.79186927024740 0.31421696111371 15.999 > 21 75 O 0.35723220549169 0.46962377699411 0.47263244494796 15.999 > 22 76 O 0.35723220549169 0.96962377699411 0.47263244494796 15.999 > 22 77 O 0.43214655392256 0.45813072975260 0.68578303888629 15.999 > 23 78 O 0.43214655392256 0.95813072975260 0.68578303888629 15.999 > 23 79 O 0.14276779450831 0.21962377699411 0.02736755505204 15.999 > 24 80 O 0.14276779450831 0.71962377699411 0.02736755505204 15.999 > 24 81 O 0.35723220549169 0.03037622300589 0.97263244494796 15.999 > 25 82 O 0.35723220549169 0.53037622300589 0.97263244494796 15.999 > 25 83 O 0.34400446592881 0.24837024882741 0.60986416313093 15.999 > 26 84 O 0.34400446592881 0.74837024882741 0.60986416313093 15.999 > 26 85 O 0.45631305048082 0.23295380353025 0.34951502201861 15.999 > 27 86 O 0.45631305048082 0.73295380353025 0.34951502201861 15.999 > 27 *87 O 0.27205066969096 0.48287385809095 0.66279080823846 15.999 > 28 88 O 0.27205066969096 0.98287385809095 0.66279080823846 15.999 > 28 89 O 0.34400446592881 0.25162975117259 0.10986416313093 15.999 > 29 90 O 0.34400446592881 0.75162975117259 0.10986416313093 15.999 > 29 91 O 0.15599553407119 0.00162975117259 0.39013583686907 15.999 > 30 92 O 0.15599553407119 0.50162975117259 0.39013583686907 15.999 > 30 93 O 0.43214655392256 0.04186927024740 0.18578303888629 15.999 > 31 94 O 0.43214655392256 0.54186927024740 0.18578303888629 15.999 > 31 95 O 0.22794933030904 0.23287385809095 0.83720919176154 15.999 > 32 96 O 0.22794933030904 0.73287385809095 0.83720919176154 15.999 > 32 97 O 0.27205066969096 0.01712614190905 0.16279080823846 15.999 > 33 98 O 0.27205066969096 0.51712614190905 0.16279080823846 15.999 > 33 99 O 0.04368694951917 0.48295380353025 0.15048497798139 15.999 > 34 100 O 0.04368694951917 0.98295380353025 0.15048497798139 15.999 > 34 101 O 0.06785344607744 0.20813072975260 0.81421696111371 15.999 > 35 102 O 0.06785344607744 0.70813072975260 0.81421696111371 15.999 > 35 103 O 0.22794933030904 0.26712614190905 0.33720919176154 15.999 > 36 104 O 0.22794933030904 0.76712614190905 0.33720919176154 15.999 > 36 105 O 0.65599553407119 0.24837024882741 0.89013583686907 15.999 > 17 106 O 0.65599553407119 0.74837024882741 0.89013583686907 15.999 > 17 107 O 0.64276779450831 0.03037622300589 0.52736755505204 15.999 > 18 108 O 0.64276779450831 0.53037622300589 0.52736755505204 15.999 > 18 109 O 0.95631305048083 0.01704619646975 0.84951502201861 15.999 > 19 110 O 0.95631305048083 0.51704619646975 0.84951502201861 15.999 > 19 111 O 0.54368694951917 0.26704619646975 0.65048497798139 15.999 > 20 112 O 0.54368694951917 0.76704619646975 0.65048497798139 15.999 > 20 113 O 0.56785344607744 0.04186927024740 0.31421696111371 15.999 > 21 114 O 0.56785344607744 0.54186927024740 0.31421696111371 15.999 > 21 115 O 0.85723220549169 0.21962377699411 0.47263244494796 15.999 > 22 116 O 0.85723220549169 0.71962377699411 0.47263244494796 15.999 > 22 117 O 0.93214655392256 0.20813072975260 0.68578303888629 15.999 > 23 118 O 0.93214655392256 0.70813072975260 0.68578303888629 15.999 > 23 119 O 0.64276779450831 0.46962377699411 0.02736755505204 15.999 > 24 120 O 0.64276779450831 0.96962377699411 0.02736755505204 15.999 > 24 121 O 0.85723220549169 0.28037622300589 0.97263244494796 15.999 > 25 122 O 0.85723220549169 0.78037622300589 0.97263244494796 15.999 > 25 123 O 0.84400446592881 0.49837024882741 0.60986416313093 15.999 > 26 124 O 0.84400446592881 0.99837024882741 0.60986416313093 15.999 > 26 125 O 0.95631305048083 0.48295380353025 0.34951502201861 15.999 > 27 126 O 0.95631305048083 0.98295380353025 0.34951502201861 15.999 > 27 127 O 0.77205066969096 0.23287385809095 0.66279080823846 15.999 > 28 128 O 0.77205066969096 0.73287385809095 0.66279080823846 15.999 > 28 129 O 0.84400446592881 0.00162975117259 0.10986416313093 15.999 > 29 130 O 0.84400446592881 0.50162975117259 0.10986416313093 15.999 > 29 131 O 0.65599553407119 0.25162975117259 0.39013583686907 15.999 > 30 132 O 0.65599553407119 0.75162975117259 0.39013583686907 15.999 > 30 133 O 0.93214655392256 0.29186927024740 0.18578303888629 15.999 > 31 134 O 0.93214655392256 0.79186927024740 0.18578303888629 15.999 > 31 135 O 0.72794933030904 0.48287385809095 0.83720919176154 15.999 > 32 136 O 0.72794933030904 0.98287385809095 0.83720919176154 15.999 > 32 137 O 0.77205066969096 0.26712614190905 0.16279080823846 15.999 > 33 138 O 0.77205066969096 0.76712614190905 0.16279080823846 15.999 > 33 139 O 0.54368694951917 0.23295380353025 0.15048497798139 15.999 > 34 140 O 0.54368694951917 0.73295380353025 0.15048497798139 15.999 > 34 141 O 0.56785344607744 0.45813072975260 0.81421696111371 15.999 > 35 142 O 0.56785344607744 0.95813072975260 0.81421696111371 15.999 > 35 143 O 0.72794933030904 0.01712614190905 0.33720919176154 15.999 > 36 144 O 0.72794933030904 0.51712614190905 0.33720919176154 15.999 > 36 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.8371955 0.0000000 0.0620242 0.0000000 2.8133506 0.0000000 0.0620283 0.0000000 2.8077910 -------------------------- Born effective charges -------------------------- 1 Na 1.1121684 -0.0277938 -0.0389027 -0.0412526 1.0563813 0.0047828 -0.0399141 -0.0002098 1.0782053 2 Na 1.1121684 0.0277938 -0.0389027 0.0412526 1.0563813 -0.0047828 -0.0399141 0.0002098 1.0782053 3 Na 1.1121684 0.0277938 -0.0389027 0.0412526 1.0563813 -0.0047828 -0.0399141 0.0002098 1.0782053 4 Na 1.1121684 -0.0277938 -0.0389027 -0.0412526 1.0563813 0.0047828 -0.0399141 -0.0002098 1.0782053 5 Ca 2.3046806 0.0792433 -0.0496991 0.0831483 2.2619536 -0.0041216 -0.0746576 -0.0775315 2.5076931 6 Ca 2.3046806 -0.0792433 -0.0496991 -0.0831483 2.2619536 0.0041216 -0.0746576 0.0775315 2.5076931 7 Ca 2.1451836 -0.1548017 0.3790136 -0.1253460 2.6867584 -0.0036527 0.3956938 -0.0784560 2.2211037 8 Ca 2.3046806 -0.0792433 -0.0496991 -0.0831483 2.2619536 0.0041216 -0.0746576 0.0775315 2.5076931 9 Ca 2.3046806 0.0792433 -0.0496991 0.0831483 2.2619536 -0.0041216 -0.0746576 -0.0775315 2.5076931 10 Ca 2.1451836 0.1548017 0.3790136 0.1253460 2.6867584 0.0036527 0.3956938 0.0784560 2.2211037 11 Si 3.4973853 0.0000000 0.2350892 -0.0000000 2.7186728 0.0000000 0.3711588 0.0000000 2.7416607 12 Si 3.4973853 0.0000000 0.2350892 -0.0000000 2.7186728 0.0000000 0.3711588 0.0000000 2.7416607 13 Si 2.7665321 0.0284321 0.2356636 0.2946254 2.8605874 0.1070877 0.1805019 0.1035035 2.8008835 14 Si 2.7665321 -0.0284321 0.2356636 -0.2946254 2.8605874 -0.1070877 0.1805019 -0.1035035 2.8008835 15 Si 2.7665321 0.0284321 0.2356636 0.2946254 2.8605874 0.1070877 0.1805019 0.1035035 2.8008835 16 Si 2.7665321 -0.0284321 0.2356636 -0.2946254 2.8605874 -0.1070877 0.1805019 -0.1035035 2.8008835 17 O -1.4582286 0.2132452 -0.2121829 0.1783124 -2.3114688 -0.0591946 -0.2199220 -0.0571043 -1.6181869 18 O -1.4567474 0.1056096 0.0871692 0.1667817 -1.6297130 0.0548100 0.1134257 0.1144099 -2.2872253 19 O -1.8814526 -0.4296440 0.1505070 -0.3933204 -1.5479534 0.2118683 0.1271289 0.2176511 -1.6744879 20 O -1.8814526 0.4296440 0.1505070 0.3933204 -1.5479534 -0.2118683 0.1271289 -0.2176511 -1.6744879 21 O -2.2124929 0.3103037 -0.6707125 0.3316466 -1.6344321 0.0896079 -0.6767710 0.0887021 -1.5703892 22 O -1.4567474 0.1056096 0.0871692 0.1667817 -1.6297130 0.0548100 0.1134257 0.1144099 -2.2872253 23 O -2.2124929 0.3103037 -0.6707125 0.3316466 -1.6344321 0.0896079 -0.6767710 0.0887021 -1.5703892 24 O -1.4567474 -0.1056096 0.0871692 -0.1667817 -1.6297130 -0.0548100 0.1134257 -0.1144099 -2.2872253 25 O -1.4567474 -0.1056096 0.0871692 -0.1667817 -1.6297130 -0.0548100 0.1134257 -0.1144099 -2.2872253 26 O -1.4582286 -0.2132452 -0.2121829 -0.1783124 -2.3114688 0.0591946 -0.2199220 0.0571043 -1.6181869 27 O -1.8814526 0.4296440 0.1505070 0.3933204 -1.5479534 -0.2118683 0.1271289 -0.2176511 -1.6744879 28 O -1.9957440 0.0883178 0.1911060 0.1324234 -1.7580707 -0.0979856 0.2067818 -0.0769468 -1.7178748 29 O -1.4582286 0.2132452 -0.2121829 0.1783124 -2.3114688 -0.0591946 -0.2199220 -0.0571043 -1.6181869 30 O -1.4582286 -0.2132452 -0.2121829 -0.1783124 -2.3114688 0.0591946 -0.2199220 0.0571043 -1.6181869 31 O -2.2124929 -0.3103037 -0.6707125 -0.3316466 -1.6344321 -0.0896079 -0.6767710 -0.0887021 -1.5703892 32 O -1.9957440 -0.0883178 0.1911060 -0.1324234 -1.7580707 0.0979856 0.2067818 0.0769468 -1.7178748 33 O -1.9957440 -0.0883178 0.1911060 -0.1324234 -1.7580707 0.0979856 0.2067818 0.0769468 -1.7178748 34 O -1.8814526 -0.4296440 0.1505070 -0.3933204 -1.5479534 0.2118683 0.1271289 0.2176511 -1.6744879 35 O -2.2124929 -0.3103037 -0.6707125 -0.3316466 -1.6344321 -0.0896079 -0.6767710 -0.0887021 -1.5703892 36 O -1.9957440 0.0883178 0.1911060 0.1324234 -1.7580707 -0.0979856 0.2067818 -0.0769468 -1.7178748 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 432/432 Permutation basis: 27828/27828 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 6005 Number of blocks in projector: 6005 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: 1302 Use submatrix version of eigh solver. (1) Block: 500 / 1302 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 231 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 19 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 1000 / 1302 (2) Block: 250 / 500 (2) 233 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 483 eigenvectors found. (1) Block: 1302 / 1302 (1) 291 eigenvectors found. (1) Complementary block size: 47 (1) Compute compressed projector. (1) Use standard solver. (1) 28 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1294 Use submatrix version of eigh solver. (1) Block: 500 / 1294 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 1000 / 1294 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 235 eigenvectors found. (2) Complementary block size: 31 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 483 eigenvectors found. (1) Block: 1294 / 1294 (1) 278 eigenvectors found. (1) Complementary block size: 51 (1) Compute compressed projector. (1) Use standard solver. (1) 33 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1294 Use submatrix version of eigh solver. (1) Block: 500 / 1294 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 1000 / 1294 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 235 eigenvectors found. (2) Complementary block size: 31 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 483 eigenvectors found. (1) Block: 1294 / 1294 (1) 278 eigenvectors found. (1) Complementary block size: 51 (1) Compute compressed projector. (1) Use standard solver. (1) 33 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 705 Use submatrix version of eigh solver. (1) Block: 500 / 705 (2) Block: 250 / 500 (2) 240 eigenvectors found. (2) Block: 500 / 500 (2) 241 eigenvectors found. (2) Complementary block size: 19 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 490 eigenvectors found. (1) Block: 705 / 705 (1) 195 eigenvectors found. (1) Complementary block size: 20 (1) Compute compressed projector. (1) Use standard solver. (1) 10 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 705 Use submatrix version of eigh solver. (1) Block: 500 / 705 (2) Block: 250 / 500 (2) 240 eigenvectors found. (2) Block: 500 / 500 (2) 241 eigenvectors found. (2) Complementary block size: 19 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 490 eigenvectors found. (1) Block: 705 / 705 (1) 195 eigenvectors found. (1) Complementary block size: 20 (1) Compute compressed projector. (1) Use standard solver. (1) 10 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 705 Use submatrix version of eigh solver. (1) Block: 500 / 705 (2) Block: 250 / 500 (2) 240 eigenvectors found. (2) Block: 500 / 500 (2) 241 eigenvectors found. (2) Complementary block size: 19 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 490 eigenvectors found. (1) Block: 705 / 705 (1) 195 eigenvectors found. (1) Complementary block size: 20 (1) Compute compressed projector. (1) Use standard solver. (1) 10 eigenvectors found. Tree of FC basis block matrices: - (6005, 5920), data: False |-- (705, 695), data: False |-- (705, 10), data: (705, 20) @ (20, 10) |-- (205, 195), data: True |-- (500, 490), data: False |-- (500, 9), data: (500, 19) @ (19, 9) |-- (250, 241), data: True |-- (250, 240), data: True |-- (705, 695), data: False |-- (705, 10), data: (705, 20) @ (20, 10) |-- (205, 195), data: True |-- (500, 490), data: False |-- (500, 9), data: (500, 19) @ (19, 9) |-- (250, 241), data: True |-- (250, 240), data: True |-- (705, 695), data: False |-- (705, 10), data: (705, 20) @ (20, 10) |-- (205, 195), data: True |-- (500, 490), data: False |-- (500, 9), data: (500, 19) @ (19, 9) |-- (250, 241), data: True |-- (250, 240), data: True |-- (1294, 1276), data: False |-- (1294, 33), data: (1294, 51) @ (51, 33) |-- (294, 278), data: True |-- (500, 483), data: False |-- (500, 14), data: (500, 31) @ (31, 14) |-- (250, 235), data: True |-- (250, 234), data: True |-- (500, 482), data: False |-- (500, 18), data: (500, 36) @ (36, 18) |-- (250, 232), data: True |-- (250, 232), data: True |-- (1294, 1276), data: False |-- (1294, 33), data: (1294, 51) @ (51, 33) |-- (294, 278), data: True |-- (500, 483), data: False |-- (500, 14), data: (500, 31) @ (31, 14) |-- (250, 235), data: True |-- (250, 234), data: True |-- (500, 482), data: False |-- (500, 18), data: (500, 36) @ (36, 18) |-- (250, 232), data: True |-- (250, 232), data: True |-- (1302, 1283), data: False |-- (1302, 28), data: (1302, 47) @ (47, 28) |-- (302, 291), data: True |-- (500, 483), data: False |-- (500, 11), data: (500, 28) @ (28, 11) |-- (250, 239), data: True |-- (250, 233), data: True |-- (500, 481), data: False |-- (500, 19), data: (500, 38) @ (38, 19) |-- (250, 231), data: True |-- (250, 231), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 1120 - Time: 1.996 Solver_block: 200 / 1120 - Time: 1.792 Solver_block: 300 / 1120 - Time: 1.788 Solver_block: 400 / 1120 - Time: 1.791 Solver_block: 500 / 1120 - Time: 1.795 Solver_block: 600 / 1120 - Time: 1.783 Solver_block: 700 / 1120 - Time: 1.793 Solver_block: 800 / 1120 - Time: 1.787 Solver_block: 900 / 1120 - Time: 1.791 Solver_block: 1000 / 1120 - Time: 1.794 Solver_block: 1100 / 1120 - Time: 1.788 Solver_block: 1120 / 1120 - Time: 0.584 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 20.968 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (zz) 0.00000000 (zz) Permutation basis: 432/432 Permutation basis: 27828/27828 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 6005 Number of blocks in projector: 6005 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: 1302 Use submatrix version of eigh solver. (1) Block: 500 / 1302 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 231 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 19 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 1000 / 1302 (2) Block: 250 / 500 (2) 233 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 483 eigenvectors found. (1) Block: 1302 / 1302 (1) 291 eigenvectors found. (1) Complementary block size: 47 (1) Compute compressed projector. (1) Use standard solver. (1) 28 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1294 Use submatrix version of eigh solver. (1) Block: 500 / 1294 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 1000 / 1294 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 235 eigenvectors found. (2) Complementary block size: 31 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 483 eigenvectors found. (1) Block: 1294 / 1294 (1) 278 eigenvectors found. (1) Complementary block size: 51 (1) Compute compressed projector. (1) Use standard solver. (1) 33 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1294 Use submatrix version of eigh solver. (1) Block: 500 / 1294 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 1000 / 1294 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 235 eigenvectors found. (2) Complementary block size: 31 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 483 eigenvectors found. (1) Block: 1294 / 1294 (1) 278 eigenvectors found. (1) Complementary block size: 51 (1) Compute compressed projector. (1) Use standard solver. (1) 33 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 705 Use submatrix version of eigh solver. (1) Block: 500 / 705 (2) Block: 250 / 500 (2) 240 eigenvectors found. (2) Block: 500 / 500 (2) 241 eigenvectors found. (2) Complementary block size: 19 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 490 eigenvectors found. (1) Block: 705 / 705 (1) 195 eigenvectors found. (1) Complementary block size: 20 (1) Compute compressed projector. (1) Use standard solver. (1) 10 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 705 Use submatrix version of eigh solver. (1) Block: 500 / 705 (2) Block: 250 / 500 (2) 240 eigenvectors found. (2) Block: 500 / 500 (2) 241 eigenvectors found. (2) Complementary block size: 19 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 490 eigenvectors found. (1) Block: 705 / 705 (1) 195 eigenvectors found. (1) Complementary block size: 20 (1) Compute compressed projector. (1) Use standard solver. (1) 10 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 705 Use submatrix version of eigh solver. (1) Block: 500 / 705 (2) Block: 250 / 500 (2) 240 eigenvectors found. (2) Block: 500 / 500 (2) 241 eigenvectors found. (2) Complementary block size: 19 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 490 eigenvectors found. (1) Block: 705 / 705 (1) 195 eigenvectors found. (1) Complementary block size: 20 (1) Compute compressed projector. (1) Use standard solver. (1) 10 eigenvectors found. Tree of FC basis block matrices: - (6005, 5920), data: False |-- (705, 695), data: False |-- (705, 10), data: (705, 20) @ (20, 10) |-- (205, 195), data: True |-- (500, 490), data: False |-- (500, 9), data: (500, 19) @ (19, 9) |-- (250, 241), data: True |-- (250, 240), data: True |-- (705, 695), data: False |-- (705, 10), data: (705, 20) @ (20, 10) |-- (205, 195), data: True |-- (500, 490), data: False |-- (500, 9), data: (500, 19) @ (19, 9) |-- (250, 241), data: True |-- (250, 240), data: True |-- (705, 695), data: False |-- (705, 10), data: (705, 20) @ (20, 10) |-- (205, 195), data: True |-- (500, 490), data: False |-- (500, 9), data: (500, 19) @ (19, 9) |-- (250, 241), data: True |-- (250, 240), data: True |-- (1294, 1276), data: False |-- (1294, 33), data: (1294, 51) @ (51, 33) |-- (294, 278), data: True |-- (500, 483), data: False |-- (500, 14), data: (500, 31) @ (31, 14) |-- (250, 235), data: True |-- (250, 234), data: True |-- (500, 482), data: False |-- (500, 18), data: (500, 36) @ (36, 18) |-- (250, 232), data: True |-- (250, 232), data: True |-- (1294, 1276), data: False |-- (1294, 33), data: (1294, 51) @ (51, 33) |-- (294, 278), data: True |-- (500, 483), data: False |-- (500, 14), data: (500, 31) @ (31, 14) |-- (250, 235), data: True |-- (250, 234), data: True |-- (500, 482), data: False |-- (500, 18), data: (500, 36) @ (36, 18) |-- (250, 232), data: True |-- (250, 232), data: True |-- (1302, 1283), data: False |-- (1302, 28), data: (1302, 47) @ (47, 28) |-- (302, 291), data: True |-- (500, 483), data: False |-- (500, 11), data: (500, 28) @ (28, 11) |-- (250, 239), data: True |-- (250, 233), data: True |-- (500, 481), data: False |-- (500, 19), data: (500, 38) @ (38, 19) |-- (250, 231), data: True |-- (250, 231), data: True Max drift after symmetrization by symfc projector: 0.00000000 (zz) 0.00000000 (zz) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 12:44:26]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 12:44:27]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 8.142890920347236 -2.564489820000000 0.000000000000000 b 8.142890920347236 2.564489820000000 0.000000000000000 c -0.668119164053652 0.000000000000000 11.291117190367997 Atomic positions (fractional): 1 Na 0.72337775531645 0.18730612706982 0.03437913876148 22.990 2 Na 0.18730612706982 0.72337775531645 0.53437913876148 22.990 3 Na 0.81269387293018 0.27662224468355 0.46562086123852 22.990 4 Na 0.27662224468355 0.81269387293018 0.96562086123852 22.990 5 Ca 0.08387846905058 0.61128320712467 0.79247147881557 40.078 6 Ca 0.61128320712467 0.08387846905058 0.29247147881557 40.078 7 Ca 0.00000000000000 0.50000000000000 0.50000000000000 40.078 8 Ca 0.38871679287533 0.91612153094942 0.70752852118443 40.078 9 Ca 0.91612153094942 0.38871679287533 0.20752852118443 40.078 10 Ca 0.50000000000000 0.00000000000000 0.00000000000000 40.078 11 Si 0.20263559201401 0.79736440798599 0.25000000000000 28.085 12 Si 0.79736440798599 0.20263559201401 0.75000000000000 28.085 13 Si 0.15944061551454 0.53639766249324 0.10341029735660 28.085 14 Si 0.53639766249324 0.15944061551454 0.60341029735660 28.085 15 Si 0.84055938448546 0.46360233750676 0.89658970264340 28.085 16 Si 0.46360233750676 0.84055938448546 0.39658970264340 28.085 17 O 0.15925503641636 0.15273603172601 0.89013583686907 15.999 18 O 0.58201534849653 0.70352024052009 0.52736755505204 15.999 19 O 0.92222065754132 0.99040544342033 0.84951502201861 15.999 20 O 0.00959455657967 0.07777934245868 0.65048497798139 15.999 21 O 0.48411490558263 0.65159198657224 0.31421696111371 15.999 22 O 0.41798465150347 0.29647975947991 0.47263244494796 15.999 23 O 0.51588509441737 0.34840801342776 0.68578303888629 15.999 24 O 0.70352024052009 0.58201534849653 0.02736755505204 15.999 25 O 0.29647975947991 0.41798465150347 0.97263244494796 15.999 26 O 0.84726396827399 0.84074496358364 0.60986416313093 15.999 27 O 0.99040544342033 0.92222065754132 0.34951502201861 15.999 28 O 0.30630295350906 0.23779838587286 0.66279080823846 15.999 29 O 0.84074496358364 0.84726396827399 0.10986416313093 15.999 30 O 0.15273603172601 0.15925503641636 0.39013583686907 15.999 31 O 0.34840801342776 0.51588509441737 0.18578303888629 15.999 32 O 0.76220161412714 0.69369704649093 0.83720919176154 15.999 33 O 0.23779838587286 0.30630295350907 0.16279080823846 15.999 34 O 0.07777934245868 0.00959455657967 0.15048497798139 15.999 35 O 0.65159198657224 0.48411490558263 0.81421696111371 15.999 36 O 0.69369704649093 0.76220161412714 0.33720919176154 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 16.285781840694472 0.000000000000000 0.000000000000000 b 0.000000000000000 10.257959280000000 0.000000000000000 c -0.668119164053652 0.000000000000000 11.291117190367997 Atomic positions (fractional): 1 Na 0.45534194119313 0.36598209293834 0.03437913876148 22.990 > 1 2 Na 0.45534194119313 0.86598209293834 0.03437913876148 22.990 > 1 3 Na 0.45534194119313 0.13401790706166 0.53437913876148 22.990 > 3 4 Na 0.45534194119313 0.63401790706166 0.53437913876148 22.990 > 3 5 Na 0.04465805880687 0.11598209293834 0.46562086123852 22.990 > 5 6 Na 0.04465805880687 0.61598209293834 0.46562086123852 22.990 > 5 7 Na 0.04465805880687 0.38401790706166 0.96562086123852 22.990 > 7 8 Na 0.04465805880687 0.88401790706166 0.96562086123852 22.990 > 7 9 Na 0.95534194119313 0.11598209293834 0.03437913876148 22.990 > 1 10 Na 0.95534194119313 0.61598209293834 0.03437913876148 22.990 > 1 11 Na 0.95534194119313 0.38401790706166 0.53437913876148 22.990 > 3 12 Na 0.95534194119313 0.88401790706166 0.53437913876148 22.990 > 3 13 Na 0.54465805880687 0.36598209293834 0.46562086123852 22.990 > 5 14 Na 0.54465805880687 0.86598209293834 0.46562086123852 22.990 > 5 15 Na 0.54465805880687 0.13401790706166 0.96562086123852 22.990 > 7 16 Na 0.54465805880687 0.63401790706166 0.96562086123852 22.990 > 7 17 Ca 0.34758083808762 0.13185118451852 0.79247147881557 40.078 > 17 18 Ca 0.34758083808762 0.63185118451852 0.79247147881557 40.078 > 17 19 Ca 0.34758083808762 0.36814881548148 0.29247147881557 40.078 > 19 20 Ca 0.34758083808762 0.86814881548148 0.29247147881557 40.078 > 19 21 Ca 0.25000000000000 0.12500000000000 0.50000000000000 40.078 > 21 22 Ca 0.25000000000000 0.62500000000000 0.50000000000000 40.078 > 21 23 Ca 0.15241916191238 0.38185118451852 0.70752852118443 40.078 > 23 24 Ca 0.15241916191238 0.88185118451852 0.70752852118443 40.078 > 23 25 Ca 0.15241916191238 0.11814881548148 0.20752852118443 40.078 > 25 26 Ca 0.15241916191238 0.61814881548148 0.20752852118443 40.078 > 25 27 Ca 0.25000000000000 0.37500000000000 0.00000000000000 40.078 > 27 28 Ca 0.25000000000000 0.87500000000000 0.00000000000000 40.078 > 27 29 Ca 0.84758083808762 0.38185118451852 0.79247147881557 40.078 > 17 30 Ca 0.84758083808762 0.88185118451852 0.79247147881557 40.078 > 17 31 Ca 0.84758083808762 0.11814881548148 0.29247147881557 40.078 > 19 32 Ca 0.84758083808762 0.61814881548148 0.29247147881557 40.078 > 19 33 Ca 0.75000000000000 0.37500000000000 0.50000000000000 40.078 > 21 34 Ca 0.75000000000000 0.87500000000000 0.50000000000000 40.078 > 21 35 Ca 0.65241916191238 0.13185118451852 0.70752852118443 40.078 > 23 36 Ca 0.65241916191238 0.63185118451852 0.70752852118443 40.078 > 23 37 Ca 0.65241916191238 0.36814881548148 0.20752852118443 40.078 > 25 38 Ca 0.65241916191238 0.86814881548148 0.20752852118443 40.078 > 25 39 Ca 0.75000000000000 0.12500000000000 0.00000000000000 40.078 > 27 40 Ca 0.75000000000000 0.62500000000000 0.00000000000000 40.078 > 27 41 Si 0.00000000000000 0.39868220399299 0.25000000000000 28.085 > 41 42 Si 0.00000000000000 0.89868220399299 0.25000000000000 28.085 > 41 43 Si 0.00000000000000 0.10131779600700 0.75000000000000 28.085 > 43 44 Si 0.00000000000000 0.60131779600700 0.75000000000000 28.085 > 43 45 Si 0.34791913900389 0.09423926174468 0.10341029735660 28.085 > 45 46 Si 0.34791913900389 0.59423926174468 0.10341029735660 28.085 > 45 47 Si 0.34791913900389 0.40576073825532 0.60341029735660 28.085 > 47 48 Si 0.34791913900389 0.90576073825532 0.60341029735660 28.085 > 47 49 Si 0.15208086099611 0.15576073825532 0.89658970264340 28.085 > 49 50 Si 0.15208086099611 0.65576073825532 0.89658970264340 28.085 > 49 51 Si 0.15208086099611 0.34423926174468 0.39658970264340 28.085 > 51 52 Si 0.15208086099611 0.84423926174468 0.39658970264340 28.085 > 51 53 Si 0.50000000000000 0.14868220399300 0.25000000000000 28.085 > 41 54 Si 0.50000000000000 0.64868220399300 0.25000000000000 28.085 > 41 55 Si 0.50000000000000 0.35131779600701 0.75000000000000 28.085 > 43 56 Si 0.50000000000000 0.85131779600701 0.75000000000000 28.085 > 43 57 Si 0.84791913900389 0.34423926174468 0.10341029735660 28.085 > 45 58 Si 0.84791913900389 0.84423926174468 0.10341029735660 28.085 > 45 59 Si 0.84791913900389 0.15576073825532 0.60341029735660 28.085 > 47 60 Si 0.84791913900389 0.65576073825532 0.60341029735660 28.085 > 47 61 Si 0.65208086099611 0.40576073825532 0.89658970264340 28.085 > 49 62 Si 0.65208086099611 0.90576073825532 0.89658970264340 28.085 > 49 63 Si 0.65208086099611 0.09423926174468 0.39658970264340 28.085 > 51 64 Si 0.65208086099611 0.59423926174468 0.39658970264340 28.085 > 51 65 O 0.15599553407119 0.49837024882741 0.89013583686907 15.999 > 65 66 O 0.15599553407119 0.99837024882741 0.89013583686907 15.999 > 65 67 O 0.14276779450831 0.28037622300589 0.52736755505204 15.999 > 67 68 O 0.14276779450831 0.78037622300589 0.52736755505204 15.999 > 67 69 O 0.45631305048082 0.26704619646975 0.84951502201861 15.999 > 69 70 O 0.45631305048082 0.76704619646975 0.84951502201861 15.999 > 69 71 O 0.04368694951917 0.01704619646975 0.65048497798139 15.999 > 71 72 O 0.04368694951917 0.51704619646975 0.65048497798139 15.999 > 71 73 O 0.06785344607744 0.29186927024740 0.31421696111371 15.999 > 73 74 O 0.06785344607744 0.79186927024740 0.31421696111371 15.999 > 73 75 O 0.35723220549169 0.46962377699411 0.47263244494796 15.999 > 75 76 O 0.35723220549169 0.96962377699411 0.47263244494796 15.999 > 75 77 O 0.43214655392256 0.45813072975260 0.68578303888629 15.999 > 77 78 O 0.43214655392256 0.95813072975260 0.68578303888629 15.999 > 77 79 O 0.14276779450831 0.21962377699411 0.02736755505204 15.999 > 79 80 O 0.14276779450831 0.71962377699411 0.02736755505204 15.999 > 79 81 O 0.35723220549169 0.03037622300589 0.97263244494796 15.999 > 81 82 O 0.35723220549169 0.53037622300589 0.97263244494796 15.999 > 81 83 O 0.34400446592881 0.24837024882741 0.60986416313093 15.999 > 83 84 O 0.34400446592881 0.74837024882741 0.60986416313093 15.999 > 83 85 O 0.45631305048082 0.23295380353025 0.34951502201861 15.999 > 85 86 O 0.45631305048082 0.73295380353025 0.34951502201861 15.999 > 85 87 O 0.27205066969096 0.48287385809095 0.66279080823846 15.999 > 87 88 O 0.27205066969096 0.98287385809095 0.66279080823846 15.999 > 87 89 O 0.34400446592881 0.25162975117259 0.10986416313093 15.999 > 89 90 O 0.34400446592881 0.75162975117259 0.10986416313093 15.999 > 89 91 O 0.15599553407119 0.00162975117259 0.39013583686907 15.999 > 91 92 O 0.15599553407119 0.50162975117259 0.39013583686907 15.999 > 91 93 O 0.43214655392256 0.04186927024740 0.18578303888629 15.999 > 93 94 O 0.43214655392256 0.54186927024740 0.18578303888629 15.999 > 93 95 O 0.22794933030904 0.23287385809095 0.83720919176154 15.999 > 95 96 O 0.22794933030904 0.73287385809095 0.83720919176154 15.999 > 95 97 O 0.27205066969096 0.01712614190905 0.16279080823846 15.999 > 97 98 O 0.27205066969096 0.51712614190905 0.16279080823846 15.999 > 97 99 O 0.04368694951917 0.48295380353025 0.15048497798139 15.999 > 99 100 O 0.04368694951917 0.98295380353025 0.15048497798139 15.999 > 99 101 O 0.06785344607744 0.20813072975260 0.81421696111371 15.999 > 101 102 O 0.06785344607744 0.70813072975260 0.81421696111371 15.999 > 101 103 O 0.22794933030904 0.26712614190905 0.33720919176154 15.999 > 103 104 O 0.22794933030904 0.76712614190905 0.33720919176154 15.999 > 103 105 O 0.65599553407119 0.24837024882741 0.89013583686907 15.999 > 65 106 O 0.65599553407119 0.74837024882741 0.89013583686907 15.999 > 65 107 O 0.64276779450831 0.03037622300589 0.52736755505204 15.999 > 67 108 O 0.64276779450831 0.53037622300589 0.52736755505204 15.999 > 67 109 O 0.95631305048083 0.01704619646975 0.84951502201861 15.999 > 69 110 O 0.95631305048083 0.51704619646975 0.84951502201861 15.999 > 69 111 O 0.54368694951917 0.26704619646975 0.65048497798139 15.999 > 71 112 O 0.54368694951917 0.76704619646975 0.65048497798139 15.999 > 71 113 O 0.56785344607744 0.04186927024740 0.31421696111371 15.999 > 73 114 O 0.56785344607744 0.54186927024740 0.31421696111371 15.999 > 73 115 O 0.85723220549169 0.21962377699411 0.47263244494796 15.999 > 75 116 O 0.85723220549169 0.71962377699411 0.47263244494796 15.999 > 75 117 O 0.93214655392256 0.20813072975260 0.68578303888629 15.999 > 77 118 O 0.93214655392256 0.70813072975260 0.68578303888629 15.999 > 77 119 O 0.64276779450831 0.46962377699411 0.02736755505204 15.999 > 79 120 O 0.64276779450831 0.96962377699411 0.02736755505204 15.999 > 79 121 O 0.85723220549169 0.28037622300589 0.97263244494796 15.999 > 81 122 O 0.85723220549169 0.78037622300589 0.97263244494796 15.999 > 81 123 O 0.84400446592881 0.49837024882741 0.60986416313093 15.999 > 83 124 O 0.84400446592881 0.99837024882741 0.60986416313093 15.999 > 83 125 O 0.95631305048083 0.48295380353025 0.34951502201861 15.999 > 85 126 O 0.95631305048083 0.98295380353025 0.34951502201861 15.999 > 85 127 O 0.77205066969096 0.23287385809095 0.66279080823846 15.999 > 87 128 O 0.77205066969096 0.73287385809095 0.66279080823846 15.999 > 87 129 O 0.84400446592881 0.00162975117259 0.10986416313093 15.999 > 89 130 O 0.84400446592881 0.50162975117259 0.10986416313093 15.999 > 89 131 O 0.65599553407119 0.25162975117259 0.39013583686907 15.999 > 91 132 O 0.65599553407119 0.75162975117259 0.39013583686907 15.999 > 91 133 O 0.93214655392256 0.29186927024740 0.18578303888629 15.999 > 93 134 O 0.93214655392256 0.79186927024740 0.18578303888629 15.999 > 93 135 O 0.72794933030904 0.48287385809095 0.83720919176154 15.999 > 95 136 O 0.72794933030904 0.98287385809095 0.83720919176154 15.999 > 95 137 O 0.77205066969096 0.26712614190905 0.16279080823846 15.999 > 97 138 O 0.77205066969096 0.76712614190905 0.16279080823846 15.999 > 97 139 O 0.54368694951917 0.23295380353025 0.15048497798139 15.999 > 99 140 O 0.54368694951917 0.73295380353025 0.15048497798139 15.999 > 99 141 O 0.56785344607744 0.45813072975260 0.81421696111371 15.999 > 101 142 O 0.56785344607744 0.95813072975260 0.81421696111371 15.999 > 101 143 O 0.72794933030904 0.01712614190905 0.33720919176154 15.999 > 103 144 O 0.72794933030904 0.51712614190905 0.33720919176154 15.999 > 103 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.8371955 0.0000000 0.0620242 0.0000000 2.8133506 0.0000000 0.0620283 0.0000000 2.8077910 -------------------------- Born effective charges -------------------------- 1 Na 1.1121684 -0.0277938 -0.0389027 -0.0412526 1.0563813 0.0047828 -0.0399141 -0.0002098 1.0782053 2 Na 1.1121684 0.0277938 -0.0389027 0.0412526 1.0563813 -0.0047828 -0.0399141 0.0002098 1.0782053 3 Na 1.1121684 0.0277938 -0.0389027 0.0412526 1.0563813 -0.0047828 -0.0399141 0.0002098 1.0782053 4 Na 1.1121684 -0.0277938 -0.0389027 -0.0412526 1.0563813 0.0047828 -0.0399141 -0.0002098 1.0782053 5 Ca 2.3046806 0.0792433 -0.0496991 0.0831483 2.2619536 -0.0041216 -0.0746576 -0.0775315 2.5076931 6 Ca 2.3046806 -0.0792433 -0.0496991 -0.0831483 2.2619536 0.0041216 -0.0746576 0.0775315 2.5076931 7 Ca 2.1451836 -0.1548017 0.3790136 -0.1253460 2.6867584 -0.0036527 0.3956938 -0.0784560 2.2211037 8 Ca 2.3046806 -0.0792433 -0.0496991 -0.0831483 2.2619536 0.0041216 -0.0746576 0.0775315 2.5076931 9 Ca 2.3046806 0.0792433 -0.0496991 0.0831483 2.2619536 -0.0041216 -0.0746576 -0.0775315 2.5076931 10 Ca 2.1451836 0.1548017 0.3790136 0.1253460 2.6867584 0.0036527 0.3956938 0.0784560 2.2211037 11 Si 3.4973853 0.0000000 0.2350892 -0.0000000 2.7186728 0.0000000 0.3711588 0.0000000 2.7416607 12 Si 3.4973853 0.0000000 0.2350892 -0.0000000 2.7186728 0.0000000 0.3711588 0.0000000 2.7416607 13 Si 2.7665321 0.0284321 0.2356636 0.2946254 2.8605874 0.1070877 0.1805019 0.1035035 2.8008835 14 Si 2.7665321 -0.0284321 0.2356636 -0.2946254 2.8605874 -0.1070877 0.1805019 -0.1035035 2.8008835 15 Si 2.7665321 0.0284321 0.2356636 0.2946254 2.8605874 0.1070877 0.1805019 0.1035035 2.8008835 16 Si 2.7665321 -0.0284321 0.2356636 -0.2946254 2.8605874 -0.1070877 0.1805019 -0.1035035 2.8008835 17 O -1.4582286 0.2132452 -0.2121829 0.1783124 -2.3114688 -0.0591946 -0.2199220 -0.0571043 -1.6181869 18 O -1.4567474 0.1056096 0.0871692 0.1667817 -1.6297130 0.0548100 0.1134257 0.1144099 -2.2872253 19 O -1.8814526 -0.4296440 0.1505070 -0.3933204 -1.5479534 0.2118683 0.1271289 0.2176511 -1.6744879 20 O -1.8814526 0.4296440 0.1505070 0.3933204 -1.5479534 -0.2118683 0.1271289 -0.2176511 -1.6744879 21 O -2.2124929 0.3103037 -0.6707125 0.3316466 -1.6344321 0.0896079 -0.6767710 0.0887021 -1.5703892 22 O -1.4567474 0.1056096 0.0871692 0.1667817 -1.6297130 0.0548100 0.1134257 0.1144099 -2.2872253 23 O -2.2124929 0.3103037 -0.6707125 0.3316466 -1.6344321 0.0896079 -0.6767710 0.0887021 -1.5703892 24 O -1.4567474 -0.1056096 0.0871692 -0.1667817 -1.6297130 -0.0548100 0.1134257 -0.1144099 -2.2872253 25 O -1.4567474 -0.1056096 0.0871692 -0.1667817 -1.6297130 -0.0548100 0.1134257 -0.1144099 -2.2872253 26 O -1.4582286 -0.2132452 -0.2121829 -0.1783124 -2.3114688 0.0591946 -0.2199220 0.0571043 -1.6181869 27 O -1.8814526 0.4296440 0.1505070 0.3933204 -1.5479534 -0.2118683 0.1271289 -0.2176511 -1.6744879 28 O -1.9957440 0.0883178 0.1911060 0.1324234 -1.7580707 -0.0979856 0.2067818 -0.0769468 -1.7178748 29 O -1.4582286 0.2132452 -0.2121829 0.1783124 -2.3114688 -0.0591946 -0.2199220 -0.0571043 -1.6181869 30 O -1.4582286 -0.2132452 -0.2121829 -0.1783124 -2.3114688 0.0591946 -0.2199220 0.0571043 -1.6181869 31 O -2.2124929 -0.3103037 -0.6707125 -0.3316466 -1.6344321 -0.0896079 -0.6767710 -0.0887021 -1.5703892 32 O -1.9957440 -0.0883178 0.1911060 -0.1324234 -1.7580707 0.0979856 0.2067818 0.0769468 -1.7178748 33 O -1.9957440 -0.0883178 0.1911060 -0.1324234 -1.7580707 0.0979856 0.2067818 0.0769468 -1.7178748 34 O -1.8814526 -0.4296440 0.1505070 -0.3933204 -1.5479534 0.2118683 0.1271289 0.2176511 -1.6744879 35 O -2.2124929 -0.3103037 -0.6707125 -0.3316466 -1.6344321 -0.0896079 -0.6767710 -0.0887021 -1.5703892 36 O -1.9957440 0.0883178 0.1911060 0.1324234 -1.7580707 -0.0979856 0.2067818 -0.0769468 -1.7178748 ---------------------------------------------------------------------------- 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] [-0.0006 0.0000 0.0100] [ 0.0006 0.0000 -0.0100] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0006 0.0000 0.0100] [ 0.0006 0.0000 -0.0100] Computing fc3[ 21, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0006 0.0000 0.0100] [ 0.0006 0.0000 -0.0100] Computing fc3[ 41, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0006 0.0000 0.0100] [ 0.0006 0.0000 -0.0100] 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] [-0.0006 0.0000 0.0100] [ 0.0006 0.0000 -0.0100] Computing fc3[ 65, 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] [-0.0006 0.0000 0.0100] [ 0.0006 0.0000 -0.0100] Computing fc3[ 67, 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] [-0.0006 0.0000 0.0100] [ 0.0006 0.0000 -0.0100] 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] [-0.0006 0.0000 0.0100] [ 0.0006 0.0000 -0.0100] Computing fc3[ 73, 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] [-0.0006 0.0000 0.0100] [ 0.0006 0.0000 -0.0100] Computing fc3[ 87, 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] [-0.0006 0.0000 0.0100] [ 0.0006 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000001 (yyy) 0.00000001 (yyy) 0.00000001 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (xz) -0.00000000 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 12:45:33]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 12:45:33]------------------------- 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 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 8.142890920347236 -2.564489820000000 0.000000000000000 b 8.142890920347236 2.564489820000000 0.000000000000000 c -0.668119164053652 0.000000000000000 11.291117190367997 Atomic positions (fractional): 1 Na 0.72337775531645 0.18730612706982 0.03437913876148 22.990 2 Na 0.18730612706982 0.72337775531645 0.53437913876148 22.990 3 Na 0.81269387293018 0.27662224468355 0.46562086123852 22.990 4 Na 0.27662224468355 0.81269387293018 0.96562086123852 22.990 5 Ca 0.08387846905058 0.61128320712467 0.79247147881557 40.078 6 Ca 0.61128320712467 0.08387846905058 0.29247147881557 40.078 7 Ca 0.00000000000000 0.50000000000000 0.50000000000000 40.078 8 Ca 0.38871679287533 0.91612153094942 0.70752852118443 40.078 9 Ca 0.91612153094942 0.38871679287533 0.20752852118443 40.078 10 Ca 0.50000000000000 0.00000000000000 0.00000000000000 40.078 11 Si 0.20263559201401 0.79736440798599 0.25000000000000 28.085 12 Si 0.79736440798599 0.20263559201401 0.75000000000000 28.085 13 Si 0.15944061551454 0.53639766249324 0.10341029735660 28.085 14 Si 0.53639766249324 0.15944061551454 0.60341029735660 28.085 15 Si 0.84055938448546 0.46360233750676 0.89658970264340 28.085 16 Si 0.46360233750676 0.84055938448546 0.39658970264340 28.085 17 O 0.15925503641636 0.15273603172601 0.89013583686907 15.999 18 O 0.58201534849653 0.70352024052009 0.52736755505204 15.999 19 O 0.92222065754132 0.99040544342033 0.84951502201861 15.999 20 O 0.00959455657967 0.07777934245868 0.65048497798139 15.999 21 O 0.48411490558263 0.65159198657224 0.31421696111371 15.999 22 O 0.41798465150347 0.29647975947991 0.47263244494796 15.999 23 O 0.51588509441737 0.34840801342776 0.68578303888629 15.999 24 O 0.70352024052009 0.58201534849653 0.02736755505204 15.999 25 O 0.29647975947991 0.41798465150347 0.97263244494796 15.999 26 O 0.84726396827399 0.84074496358364 0.60986416313093 15.999 27 O 0.99040544342033 0.92222065754132 0.34951502201861 15.999 28 O 0.30630295350906 0.23779838587286 0.66279080823846 15.999 29 O 0.84074496358364 0.84726396827399 0.10986416313093 15.999 30 O 0.15273603172601 0.15925503641636 0.39013583686907 15.999 31 O 0.34840801342776 0.51588509441737 0.18578303888629 15.999 32 O 0.76220161412714 0.69369704649093 0.83720919176154 15.999 33 O 0.23779838587286 0.30630295350907 0.16279080823846 15.999 34 O 0.07777934245868 0.00959455657967 0.15048497798139 15.999 35 O 0.65159198657224 0.48411490558263 0.81421696111371 15.999 36 O 0.69369704649093 0.76220161412714 0.33720919176154 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 16.285781840694472 0.000000000000000 0.000000000000000 b 0.000000000000000 10.257959280000000 0.000000000000000 c -0.668119164053652 0.000000000000000 11.291117190367997 Atomic positions (fractional): 1 Na 0.45534194119313 0.36598209293834 0.03437913876148 22.990 > 1 2 Na 0.45534194119313 0.86598209293834 0.03437913876148 22.990 > 1 3 Na 0.45534194119313 0.13401790706166 0.53437913876148 22.990 > 3 4 Na 0.45534194119313 0.63401790706166 0.53437913876148 22.990 > 3 5 Na 0.04465805880687 0.11598209293834 0.46562086123852 22.990 > 5 6 Na 0.04465805880687 0.61598209293834 0.46562086123852 22.990 > 5 7 Na 0.04465805880687 0.38401790706166 0.96562086123852 22.990 > 7 8 Na 0.04465805880687 0.88401790706166 0.96562086123852 22.990 > 7 9 Na 0.95534194119313 0.11598209293834 0.03437913876148 22.990 > 1 10 Na 0.95534194119313 0.61598209293834 0.03437913876148 22.990 > 1 11 Na 0.95534194119313 0.38401790706166 0.53437913876148 22.990 > 3 12 Na 0.95534194119313 0.88401790706166 0.53437913876148 22.990 > 3 13 Na 0.54465805880687 0.36598209293834 0.46562086123852 22.990 > 5 14 Na 0.54465805880687 0.86598209293834 0.46562086123852 22.990 > 5 15 Na 0.54465805880687 0.13401790706166 0.96562086123852 22.990 > 7 16 Na 0.54465805880687 0.63401790706166 0.96562086123852 22.990 > 7 17 Ca 0.34758083808762 0.13185118451852 0.79247147881557 40.078 > 17 18 Ca 0.34758083808762 0.63185118451852 0.79247147881557 40.078 > 17 19 Ca 0.34758083808762 0.36814881548148 0.29247147881557 40.078 > 19 20 Ca 0.34758083808762 0.86814881548148 0.29247147881557 40.078 > 19 21 Ca 0.25000000000000 0.12500000000000 0.50000000000000 40.078 > 21 22 Ca 0.25000000000000 0.62500000000000 0.50000000000000 40.078 > 21 23 Ca 0.15241916191238 0.38185118451852 0.70752852118443 40.078 > 23 24 Ca 0.15241916191238 0.88185118451852 0.70752852118443 40.078 > 23 25 Ca 0.15241916191238 0.11814881548148 0.20752852118443 40.078 > 25 26 Ca 0.15241916191238 0.61814881548148 0.20752852118443 40.078 > 25 27 Ca 0.25000000000000 0.37500000000000 0.00000000000000 40.078 > 27 28 Ca 0.25000000000000 0.87500000000000 0.00000000000000 40.078 > 27 29 Ca 0.84758083808762 0.38185118451852 0.79247147881557 40.078 > 17 30 Ca 0.84758083808762 0.88185118451852 0.79247147881557 40.078 > 17 31 Ca 0.84758083808762 0.11814881548148 0.29247147881557 40.078 > 19 32 Ca 0.84758083808762 0.61814881548148 0.29247147881557 40.078 > 19 33 Ca 0.75000000000000 0.37500000000000 0.50000000000000 40.078 > 21 34 Ca 0.75000000000000 0.87500000000000 0.50000000000000 40.078 > 21 35 Ca 0.65241916191238 0.13185118451852 0.70752852118443 40.078 > 23 36 Ca 0.65241916191238 0.63185118451852 0.70752852118443 40.078 > 23 37 Ca 0.65241916191238 0.36814881548148 0.20752852118443 40.078 > 25 38 Ca 0.65241916191238 0.86814881548148 0.20752852118443 40.078 > 25 39 Ca 0.75000000000000 0.12500000000000 0.00000000000000 40.078 > 27 40 Ca 0.75000000000000 0.62500000000000 0.00000000000000 40.078 > 27 41 Si 0.00000000000000 0.39868220399299 0.25000000000000 28.085 > 41 42 Si 0.00000000000000 0.89868220399299 0.25000000000000 28.085 > 41 43 Si 0.00000000000000 0.10131779600700 0.75000000000000 28.085 > 43 44 Si 0.00000000000000 0.60131779600700 0.75000000000000 28.085 > 43 45 Si 0.34791913900389 0.09423926174468 0.10341029735660 28.085 > 45 46 Si 0.34791913900389 0.59423926174468 0.10341029735660 28.085 > 45 47 Si 0.34791913900389 0.40576073825532 0.60341029735660 28.085 > 47 48 Si 0.34791913900389 0.90576073825532 0.60341029735660 28.085 > 47 49 Si 0.15208086099611 0.15576073825532 0.89658970264340 28.085 > 49 50 Si 0.15208086099611 0.65576073825532 0.89658970264340 28.085 > 49 51 Si 0.15208086099611 0.34423926174468 0.39658970264340 28.085 > 51 52 Si 0.15208086099611 0.84423926174468 0.39658970264340 28.085 > 51 53 Si 0.50000000000000 0.14868220399300 0.25000000000000 28.085 > 41 54 Si 0.50000000000000 0.64868220399300 0.25000000000000 28.085 > 41 55 Si 0.50000000000000 0.35131779600701 0.75000000000000 28.085 > 43 56 Si 0.50000000000000 0.85131779600701 0.75000000000000 28.085 > 43 57 Si 0.84791913900389 0.34423926174468 0.10341029735660 28.085 > 45 58 Si 0.84791913900389 0.84423926174468 0.10341029735660 28.085 > 45 59 Si 0.84791913900389 0.15576073825532 0.60341029735660 28.085 > 47 60 Si 0.84791913900389 0.65576073825532 0.60341029735660 28.085 > 47 61 Si 0.65208086099611 0.40576073825532 0.89658970264340 28.085 > 49 62 Si 0.65208086099611 0.90576073825532 0.89658970264340 28.085 > 49 63 Si 0.65208086099611 0.09423926174468 0.39658970264340 28.085 > 51 64 Si 0.65208086099611 0.59423926174468 0.39658970264340 28.085 > 51 65 O 0.15599553407119 0.49837024882741 0.89013583686907 15.999 > 65 66 O 0.15599553407119 0.99837024882741 0.89013583686907 15.999 > 65 67 O 0.14276779450831 0.28037622300589 0.52736755505204 15.999 > 67 68 O 0.14276779450831 0.78037622300589 0.52736755505204 15.999 > 67 69 O 0.45631305048082 0.26704619646975 0.84951502201861 15.999 > 69 70 O 0.45631305048082 0.76704619646975 0.84951502201861 15.999 > 69 71 O 0.04368694951917 0.01704619646975 0.65048497798139 15.999 > 71 72 O 0.04368694951917 0.51704619646975 0.65048497798139 15.999 > 71 73 O 0.06785344607744 0.29186927024740 0.31421696111371 15.999 > 73 74 O 0.06785344607744 0.79186927024740 0.31421696111371 15.999 > 73 75 O 0.35723220549169 0.46962377699411 0.47263244494796 15.999 > 75 76 O 0.35723220549169 0.96962377699411 0.47263244494796 15.999 > 75 77 O 0.43214655392256 0.45813072975260 0.68578303888629 15.999 > 77 78 O 0.43214655392256 0.95813072975260 0.68578303888629 15.999 > 77 79 O 0.14276779450831 0.21962377699411 0.02736755505204 15.999 > 79 80 O 0.14276779450831 0.71962377699411 0.02736755505204 15.999 > 79 81 O 0.35723220549169 0.03037622300589 0.97263244494796 15.999 > 81 82 O 0.35723220549169 0.53037622300589 0.97263244494796 15.999 > 81 83 O 0.34400446592881 0.24837024882741 0.60986416313093 15.999 > 83 84 O 0.34400446592881 0.74837024882741 0.60986416313093 15.999 > 83 85 O 0.45631305048082 0.23295380353025 0.34951502201861 15.999 > 85 86 O 0.45631305048082 0.73295380353025 0.34951502201861 15.999 > 85 87 O 0.27205066969096 0.48287385809095 0.66279080823846 15.999 > 87 88 O 0.27205066969096 0.98287385809095 0.66279080823846 15.999 > 87 89 O 0.34400446592881 0.25162975117259 0.10986416313093 15.999 > 89 90 O 0.34400446592881 0.75162975117259 0.10986416313093 15.999 > 89 91 O 0.15599553407119 0.00162975117259 0.39013583686907 15.999 > 91 92 O 0.15599553407119 0.50162975117259 0.39013583686907 15.999 > 91 93 O 0.43214655392256 0.04186927024740 0.18578303888629 15.999 > 93 94 O 0.43214655392256 0.54186927024740 0.18578303888629 15.999 > 93 95 O 0.22794933030904 0.23287385809095 0.83720919176154 15.999 > 95 96 O 0.22794933030904 0.73287385809095 0.83720919176154 15.999 > 95 97 O 0.27205066969096 0.01712614190905 0.16279080823846 15.999 > 97 98 O 0.27205066969096 0.51712614190905 0.16279080823846 15.999 > 97 99 O 0.04368694951917 0.48295380353025 0.15048497798139 15.999 > 99 100 O 0.04368694951917 0.98295380353025 0.15048497798139 15.999 > 99 101 O 0.06785344607744 0.20813072975260 0.81421696111371 15.999 > 101 102 O 0.06785344607744 0.70813072975260 0.81421696111371 15.999 > 101 103 O 0.22794933030904 0.26712614190905 0.33720919176154 15.999 > 103 104 O 0.22794933030904 0.76712614190905 0.33720919176154 15.999 > 103 105 O 0.65599553407119 0.24837024882741 0.89013583686907 15.999 > 65 106 O 0.65599553407119 0.74837024882741 0.89013583686907 15.999 > 65 107 O 0.64276779450831 0.03037622300589 0.52736755505204 15.999 > 67 108 O 0.64276779450831 0.53037622300589 0.52736755505204 15.999 > 67 109 O 0.95631305048083 0.01704619646975 0.84951502201861 15.999 > 69 110 O 0.95631305048083 0.51704619646975 0.84951502201861 15.999 > 69 111 O 0.54368694951917 0.26704619646975 0.65048497798139 15.999 > 71 112 O 0.54368694951917 0.76704619646975 0.65048497798139 15.999 > 71 113 O 0.56785344607744 0.04186927024740 0.31421696111371 15.999 > 73 114 O 0.56785344607744 0.54186927024740 0.31421696111371 15.999 > 73 115 O 0.85723220549169 0.21962377699411 0.47263244494796 15.999 > 75 116 O 0.85723220549169 0.71962377699411 0.47263244494796 15.999 > 75 117 O 0.93214655392256 0.20813072975260 0.68578303888629 15.999 > 77 118 O 0.93214655392256 0.70813072975260 0.68578303888629 15.999 > 77 119 O 0.64276779450831 0.46962377699411 0.02736755505204 15.999 > 79 120 O 0.64276779450831 0.96962377699411 0.02736755505204 15.999 > 79 121 O 0.85723220549169 0.28037622300589 0.97263244494796 15.999 > 81 122 O 0.85723220549169 0.78037622300589 0.97263244494796 15.999 > 81 123 O 0.84400446592881 0.49837024882741 0.60986416313093 15.999 > 83 124 O 0.84400446592881 0.99837024882741 0.60986416313093 15.999 > 83 125 O 0.95631305048083 0.48295380353025 0.34951502201861 15.999 > 85 126 O 0.95631305048083 0.98295380353025 0.34951502201861 15.999 > 85 127 O 0.77205066969096 0.23287385809095 0.66279080823846 15.999 > 87 128 O 0.77205066969096 0.73287385809095 0.66279080823846 15.999 > 87 129 O 0.84400446592881 0.00162975117259 0.10986416313093 15.999 > 89 130 O 0.84400446592881 0.50162975117259 0.10986416313093 15.999 > 89 131 O 0.65599553407119 0.25162975117259 0.39013583686907 15.999 > 91 132 O 0.65599553407119 0.75162975117259 0.39013583686907 15.999 > 91 133 O 0.93214655392256 0.29186927024740 0.18578303888629 15.999 > 93 134 O 0.93214655392256 0.79186927024740 0.18578303888629 15.999 > 93 135 O 0.72794933030904 0.48287385809095 0.83720919176154 15.999 > 95 136 O 0.72794933030904 0.98287385809095 0.83720919176154 15.999 > 95 137 O 0.77205066969096 0.26712614190905 0.16279080823846 15.999 > 97 138 O 0.77205066969096 0.76712614190905 0.16279080823846 15.999 > 97 139 O 0.54368694951917 0.23295380353025 0.15048497798139 15.999 > 99 140 O 0.54368694951917 0.73295380353025 0.15048497798139 15.999 > 99 141 O 0.56785344607744 0.45813072975260 0.81421696111371 15.999 > 101 142 O 0.56785344607744 0.95813072975260 0.81421696111371 15.999 > 101 143 O 0.72794933030904 0.01712614190905 0.33720919176154 15.999 > 103 144 O 0.72794933030904 0.51712614190905 0.33720919176154 15.999 > 103 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.8371955 0.0000000 0.0620242 0.0000000 2.8133506 0.0000000 0.0620283 0.0000000 2.8077910 -------------------------- Born effective charges -------------------------- 1 Na 1.1121684 -0.0277938 -0.0389027 -0.0412526 1.0563813 0.0047828 -0.0399141 -0.0002098 1.0782053 2 Na 1.1121684 0.0277938 -0.0389027 0.0412526 1.0563813 -0.0047828 -0.0399141 0.0002098 1.0782053 3 Na 1.1121684 0.0277938 -0.0389027 0.0412526 1.0563813 -0.0047828 -0.0399141 0.0002098 1.0782053 4 Na 1.1121684 -0.0277938 -0.0389027 -0.0412526 1.0563813 0.0047828 -0.0399141 -0.0002098 1.0782053 5 Ca 2.3046806 0.0792433 -0.0496991 0.0831483 2.2619536 -0.0041216 -0.0746576 -0.0775315 2.5076931 6 Ca 2.3046806 -0.0792433 -0.0496991 -0.0831483 2.2619536 0.0041216 -0.0746576 0.0775315 2.5076931 7 Ca 2.1451836 -0.1548017 0.3790136 -0.1253460 2.6867584 -0.0036527 0.3956938 -0.0784560 2.2211037 8 Ca 2.3046806 -0.0792433 -0.0496991 -0.0831483 2.2619536 0.0041216 -0.0746576 0.0775315 2.5076931 9 Ca 2.3046806 0.0792433 -0.0496991 0.0831483 2.2619536 -0.0041216 -0.0746576 -0.0775315 2.5076931 10 Ca 2.1451836 0.1548017 0.3790136 0.1253460 2.6867584 0.0036527 0.3956938 0.0784560 2.2211037 11 Si 3.4973853 0.0000000 0.2350892 -0.0000000 2.7186728 0.0000000 0.3711588 0.0000000 2.7416607 12 Si 3.4973853 0.0000000 0.2350892 -0.0000000 2.7186728 0.0000000 0.3711588 0.0000000 2.7416607 13 Si 2.7665321 0.0284321 0.2356636 0.2946254 2.8605874 0.1070877 0.1805019 0.1035035 2.8008835 14 Si 2.7665321 -0.0284321 0.2356636 -0.2946254 2.8605874 -0.1070877 0.1805019 -0.1035035 2.8008835 15 Si 2.7665321 0.0284321 0.2356636 0.2946254 2.8605874 0.1070877 0.1805019 0.1035035 2.8008835 16 Si 2.7665321 -0.0284321 0.2356636 -0.2946254 2.8605874 -0.1070877 0.1805019 -0.1035035 2.8008835 17 O -1.4582286 0.2132452 -0.2121829 0.1783124 -2.3114688 -0.0591946 -0.2199220 -0.0571043 -1.6181869 18 O -1.4567474 0.1056096 0.0871692 0.1667817 -1.6297130 0.0548100 0.1134257 0.1144099 -2.2872253 19 O -1.8814526 -0.4296440 0.1505070 -0.3933204 -1.5479534 0.2118683 0.1271289 0.2176511 -1.6744879 20 O -1.8814526 0.4296440 0.1505070 0.3933204 -1.5479534 -0.2118683 0.1271289 -0.2176511 -1.6744879 21 O -2.2124929 0.3103037 -0.6707125 0.3316466 -1.6344321 0.0896079 -0.6767710 0.0887021 -1.5703892 22 O -1.4567474 0.1056096 0.0871692 0.1667817 -1.6297130 0.0548100 0.1134257 0.1144099 -2.2872253 23 O -2.2124929 0.3103037 -0.6707125 0.3316466 -1.6344321 0.0896079 -0.6767710 0.0887021 -1.5703892 24 O -1.4567474 -0.1056096 0.0871692 -0.1667817 -1.6297130 -0.0548100 0.1134257 -0.1144099 -2.2872253 25 O -1.4567474 -0.1056096 0.0871692 -0.1667817 -1.6297130 -0.0548100 0.1134257 -0.1144099 -2.2872253 26 O -1.4582286 -0.2132452 -0.2121829 -0.1783124 -2.3114688 0.0591946 -0.2199220 0.0571043 -1.6181869 27 O -1.8814526 0.4296440 0.1505070 0.3933204 -1.5479534 -0.2118683 0.1271289 -0.2176511 -1.6744879 28 O -1.9957440 0.0883178 0.1911060 0.1324234 -1.7580707 -0.0979856 0.2067818 -0.0769468 -1.7178748 29 O -1.4582286 0.2132452 -0.2121829 0.1783124 -2.3114688 -0.0591946 -0.2199220 -0.0571043 -1.6181869 30 O -1.4582286 -0.2132452 -0.2121829 -0.1783124 -2.3114688 0.0591946 -0.2199220 0.0571043 -1.6181869 31 O -2.2124929 -0.3103037 -0.6707125 -0.3316466 -1.6344321 -0.0896079 -0.6767710 -0.0887021 -1.5703892 32 O -1.9957440 -0.0883178 0.1911060 -0.1324234 -1.7580707 0.0979856 0.2067818 0.0769468 -1.7178748 33 O -1.9957440 -0.0883178 0.1911060 -0.1324234 -1.7580707 0.0979856 0.2067818 0.0769468 -1.7178748 34 O -1.8814526 -0.4296440 0.1505070 -0.3933204 -1.5479534 0.2118683 0.1271289 0.2176511 -1.6744879 35 O -2.2124929 -0.3103037 -0.6707125 -0.3316466 -1.6344321 -0.0896079 -0.6767710 -0.0887021 -1.5703892 36 O -1.9957440 0.0883178 0.1911060 0.1324234 -1.7580707 -0.0979856 0.2067818 -0.0769468 -1.7178748 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000001 (yyy) 0.00000001 (yyy) 0.00000001 (yyy) Max drift of fc2: 0.00000000 (zz) 0.00000000 (zz) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 10 10 4 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.53, Number of G-points: 303, Lambda: 0.09 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/117) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 117 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 2.815 ( 0.000 0.000 0.000) 0.000 2.833 ( 0.000 0.000 0.000) 0.000 3.336 ( 0.000 0.000 0.000) 0.000 3.453 ( 0.000 0.000 0.000) 0.000 3.707 ( 0.000 0.000 0.000) 0.000 3.745 ( 0.000 0.000 0.000) 0.000 3.748 ( 0.000 0.000 0.000) 0.000 3.994 ( 0.000 0.000 0.000) 0.000 4.069 ( 0.000 0.000 0.000) 0.000 4.464 ( 0.000 0.000 0.000) 0.000 4.529 ( 0.000 0.000 0.000) 0.000 4.704 ( 0.000 0.000 0.000) 0.000 4.789 ( 0.000 0.000 0.000) 0.000 4.808 ( 0.000 0.000 0.000) 0.000 4.824 ( 0.000 0.000 0.000) 0.000 5.135 ( 0.000 0.000 0.000) 0.000 5.231 ( 0.000 0.000 0.000) 0.000 5.248 ( 0.000 0.000 0.000) 0.000 5.581 ( 0.000 0.000 0.000) 0.000 5.588 ( 0.000 0.000 0.000) 0.000 5.689 ( 0.000 0.000 0.000) 0.000 5.810 ( 0.000 0.000 0.000) 0.000 5.875 ( 0.000 0.000 0.000) 0.000 5.989 ( 0.000 0.000 0.000) 0.000 6.227 ( 0.000 0.000 0.000) 0.000 6.241 ( 0.000 0.000 0.000) 0.000 6.268 ( 0.000 0.000 0.000) 0.000 6.420 ( 0.000 0.000 0.000) 0.000 6.431 ( 0.000 0.000 0.000) 0.000 6.508 ( 0.000 0.000 0.000) 0.000 6.943 ( 0.000 0.000 0.000) 0.000 6.951 ( 0.000 0.000 0.000) 0.000 7.065 ( 0.000 0.000 0.000) 0.000 7.097 ( 0.000 0.000 0.000) 0.000 7.157 ( 0.000 0.000 0.000) 0.000 7.512 ( 0.000 0.000 0.000) 0.000 7.628 ( 0.000 0.000 0.000) 0.000 7.643 ( 0.000 0.000 0.000) 0.000 7.663 ( 0.000 0.000 0.000) 0.000 7.800 ( 0.000 0.000 0.000) 0.000 7.936 ( 0.000 0.000 0.000) 0.000 7.938 ( 0.000 0.000 0.000) 0.000 8.016 ( 0.000 0.000 0.000) 0.000 8.191 ( 0.000 0.000 0.000) 0.000 8.399 ( 0.000 0.000 0.000) 0.000 8.410 ( 0.000 0.000 0.000) 0.000 8.498 ( 0.000 0.000 0.000) 0.000 8.621 ( 0.000 0.000 0.000) 0.000 8.628 ( 0.000 0.000 0.000) 0.000 8.708 ( 0.000 0.000 0.000) 0.000 8.851 ( 0.000 0.000 0.000) 0.000 9.588 ( 0.000 0.000 0.000) 0.000 10.027 ( 0.000 0.000 0.000) 0.000 10.033 ( 0.000 0.000 0.000) 0.000 10.098 ( 0.000 0.000 0.000) 0.000 10.350 ( 0.000 0.000 0.000) 0.000 10.452 ( 0.000 0.000 0.000) 0.000 10.623 ( 0.000 0.000 0.000) 0.000 10.789 ( 0.000 0.000 0.000) 0.000 10.944 ( 0.000 0.000 0.000) 0.000 11.271 ( 0.000 0.000 0.000) 0.000 11.827 ( 0.000 0.000 0.000) 0.000 11.837 ( 0.000 0.000 0.000) 0.000 12.258 ( 0.000 0.000 0.000) 0.000 12.416 ( 0.000 0.000 0.000) 0.000 12.424 ( 0.000 0.000 0.000) 0.000 12.530 ( 0.000 0.000 0.000) 0.000 12.681 ( 0.000 0.000 0.000) 0.000 13.927 ( 0.000 0.000 0.000) 0.000 14.127 ( 0.000 0.000 0.000) 0.000 14.153 ( 0.000 0.000 0.000) 0.000 14.400 ( 0.000 0.000 0.000) 0.000 14.461 ( 0.000 0.000 0.000) 0.000 14.635 ( 0.000 0.000 0.000) 0.000 14.788 ( 0.000 0.000 0.000) 0.000 14.856 ( 0.000 0.000 0.000) 0.000 15.098 ( 0.000 0.000 0.000) 0.000 15.597 ( 0.000 0.000 0.000) 0.000 16.047 ( 0.000 0.000 0.000) 0.000 16.370 ( 0.000 0.000 0.000) 0.000 16.463 ( 0.000 0.000 0.000) 0.000 19.914 ( 0.000 0.000 0.000) 0.000 19.982 ( 0.000 0.000 0.000) 0.000 20.082 ( 0.000 0.000 0.000) 0.000 20.169 ( 0.000 0.000 0.000) 0.000 24.255 ( 0.000 0.000 0.000) 0.000 24.529 ( 0.000 0.000 0.000) 0.000 24.772 ( 0.000 0.000 0.000) 0.000 24.901 ( 0.000 0.000 0.000) 0.000 26.178 ( 0.000 0.000 0.000) 0.000 26.350 ( 0.000 0.000 0.000) 0.000 26.704 ( 0.000 0.000 0.000) 0.000 26.764 ( 0.000 0.000 0.000) 0.000 26.908 ( 0.000 0.000 0.000) 0.000 27.014 ( 0.000 0.000 0.000) 0.000 27.199 ( 0.000 0.000 0.000) 0.000 27.292 ( 0.000 0.000 0.000) 0.000 27.318 ( 0.000 0.000 0.000) 0.000 28.122 ( 0.000 0.000 0.000) 0.000 28.758 ( 0.000 0.000 0.000) 0.000 28.829 ( 0.000 0.000 0.000) 0.000 29.031 ( 0.000 0.000 0.000) 0.000 29.278 ( 0.000 0.000 0.000) 0.000 29.352 ( 0.000 0.000 0.000) 0.000 30.014 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/117) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.743 ( 2.197 -36.730 2.704) 36.895 0.920 ( 14.782 -41.658 5.378) 44.529 1.417 ( 20.405 -64.607 4.463) 67.899 2.705 ( -5.371 7.797 -8.360) 12.630 2.812 ( 7.955 4.228 5.962) 10.803 3.311 ( -10.762 0.916 -4.249) 11.606 3.463 ( -7.729 2.687 -22.422) 23.868 3.510 ( -1.761 3.524 12.834) 13.425 3.773 ( 4.475 -2.537 8.164) 9.649 3.880 ( 13.408 0.433 4.663) 14.202 3.996 ( -1.041 -1.044 1.027) 1.796 4.140 ( -2.208 -3.814 -3.461) 5.604 4.385 ( -0.509 11.207 -1.008) 11.263 4.530 ( -2.559 -4.506 2.590) 5.793 4.626 ( -8.782 3.454 1.458) 9.549 4.714 ( -0.584 2.886 -0.653) 3.016 4.872 ( -1.220 -7.247 5.258) 9.036 5.001 ( -3.853 -9.703 -2.547) 10.746 5.071 ( 5.217 4.644 -3.770) 7.937 5.227 ( -2.722 2.595 -6.713) 7.694 5.387 ( 8.546 -5.725 3.793) 10.963 5.522 ( 3.102 3.425 -2.936) 5.475 5.641 ( -7.731 -6.687 4.503) 11.170 5.726 ( -3.756 4.715 1.395) 6.188 5.812 ( 1.429 1.319 1.497) 2.454 5.854 ( 11.691 3.112 -3.705) 12.653 5.971 ( -1.231 1.180 -5.153) 5.428 6.185 ( -8.570 4.028 -7.056) 11.809 6.253 ( 0.995 -2.542 4.313) 5.104 6.312 ( 7.485 -0.392 3.292) 8.186 6.385 ( 1.353 2.718 6.149) 6.858 6.458 ( 0.523 0.221 -12.843) 12.855 6.602 ( 8.168 -3.959 7.353) 11.682 6.859 ( 0.758 6.708 2.107) 7.071 6.933 ( 3.085 6.196 -1.098) 7.008 7.024 ( -1.212 3.171 0.529) 3.436 7.117 ( 0.990 -0.476 -3.995) 4.144 7.230 ( 2.063 -0.672 -1.521) 2.650 7.372 ( -0.909 16.104 1.233) 16.177 7.509 ( 1.067 1.305 0.501) 1.759 7.566 ( -5.375 3.093 -4.288) 7.539 7.697 ( 1.024 2.500 2.585) 3.739 7.836 ( -5.335 -0.237 -2.474) 5.886 7.915 ( -4.466 2.455 -0.764) 5.153 7.964 ( 3.850 2.694 3.648) 5.949 8.043 ( 7.881 2.184 5.436) 9.820 8.201 ( 2.313 -0.586 2.750) 3.641 8.432 ( -6.350 -0.269 -0.971) 6.429 8.488 ( 0.946 -1.435 0.200) 1.731 8.556 ( -2.539 1.194 -1.118) 3.020 8.654 ( 2.375 -2.565 2.108) 4.082 8.690 ( -1.716 0.262 -3.105) 3.557 8.802 ( 0.409 3.994 -0.552) 4.052 9.399 ( -5.811 10.296 -3.411) 12.305 9.748 ( -9.443 7.581 -7.064) 14.019 10.072 ( -16.095 -6.630 -7.924) 19.126 10.158 ( -3.625 -5.339 -4.956) 8.136 10.320 ( 5.751 0.164 6.106) 8.389 10.379 ( -3.023 -3.494 -1.270) 4.792 10.463 ( 6.126 -2.764 1.887) 6.981 10.739 ( -4.526 -6.002 -5.667) 9.414 10.964 ( -3.702 -2.865 -6.922) 8.356 11.037 ( -9.419 -4.284 -0.877) 10.384 11.311 ( -1.725 -4.397 -1.399) 4.926 11.864 ( -0.629 -2.585 4.437) 5.174 11.894 ( 0.165 -5.385 1.088) 5.496 12.306 ( 6.551 2.149 5.817) 9.021 12.404 ( 3.998 1.904 1.060) 4.553 12.522 ( -0.105 0.460 1.474) 1.548 12.670 ( -4.795 -4.428 -1.173) 6.631 13.154 ( 49.225 20.728 31.337) 61.925 13.777 ( -16.468 7.890 -8.869) 20.300 14.110 ( -6.028 1.009 -1.544) 6.304 14.195 ( 3.946 0.715 6.198) 7.383 14.397 ( -2.044 2.659 1.230) 3.572 14.413 ( -0.110 1.936 -0.150) 1.944 14.656 ( 9.447 5.441 0.957) 10.943 14.810 ( -4.683 -1.771 4.085) 6.462 14.876 ( 3.241 -0.951 -4.974) 6.012 15.288 ( -6.063 0.383 1.545) 6.268 15.591 ( 11.322 4.892 4.983) 13.302 15.981 ( -6.540 4.826 -5.240) 9.671 16.311 ( 5.412 3.427 2.972) 7.062 16.569 ( 1.055 -5.686 0.193) 5.786 19.907 ( 1.348 1.071 0.602) 1.824 20.136 ( -0.693 -4.637 -0.156) 4.691 20.156 ( -2.979 -0.437 -1.832) 3.525 20.291 ( -5.730 -4.020 1.386) 7.136 24.365 ( 32.900 11.352 18.769) 39.542 24.497 ( -0.959 2.667 -2.270) 3.631 24.805 ( 2.666 -0.497 1.358) 3.033 24.906 ( 0.931 -0.153 -0.221) 0.969 26.188 ( 1.594 0.402 1.185) 2.027 26.339 ( -1.359 0.770 -0.245) 1.581 26.699 ( -2.614 -0.430 -0.258) 2.662 26.768 ( 0.305 -0.284 0.127) 0.435 26.933 ( 0.818 -1.644 -4.082) 4.476 27.075 ( 4.525 2.342 -0.234) 5.100 27.172 ( 0.307 3.020 -0.445) 3.068 27.275 ( 0.533 1.137 -0.134) 1.263 27.528 ( 2.430 -2.336 -2.500) 4.197 28.498 ( -5.192 7.900 1.017) 9.507 28.869 ( 0.371 -3.648 -0.274) 3.677 28.924 ( -2.265 -11.781 -0.980) 12.037 29.130 ( -0.145 -9.813 0.508) 9.827 29.350 ( 0.024 -0.174 1.616) 1.626 29.982 ( 1.724 3.741 2.074) 4.612 30.891 ( -26.934 -6.637 -12.507) 30.429 ======================= Grid point 2 (3/117) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.448 ( 1.018 -34.001 3.632) 34.210 1.792 ( 12.319 -38.431 4.566) 40.614 2.507 ( -3.973 4.650 -4.693) 7.709 2.712 ( 8.188 -34.567 2.959) 35.646 2.807 ( 14.922 -16.108 0.860) 21.974 3.157 ( -8.486 4.516 -3.923) 10.383 3.403 ( -2.538 -1.730 -14.607) 14.926 3.504 ( 2.036 -0.587 8.553) 8.811 3.862 ( 4.341 -0.720 8.395) 9.478 3.890 ( 8.643 4.619 0.743) 9.828 4.035 ( -1.824 -3.694 6.036) 7.308 4.204 ( -1.514 3.480 -3.427) 5.113 4.232 ( -3.191 -6.338 -3.261) 7.809 4.453 ( -7.271 4.883 6.673) 11.011 4.586 ( -4.521 1.083 -6.067) 7.644 4.688 ( -1.342 -0.745 -0.149) 1.542 4.966 ( -2.547 2.060 -3.680) 4.927 5.055 ( 1.609 -3.884 8.197) 9.212 5.116 ( -2.243 -0.974 -1.978) 3.145 5.206 ( 1.143 -6.037 -5.469) 8.226 5.377 ( 2.620 14.690 -2.407) 15.115 5.412 ( 5.793 8.135 0.485) 9.998 5.586 ( -4.339 -1.657 -1.182) 4.792 5.728 ( -7.656 6.737 -7.042) 12.393 5.772 ( -2.327 -3.283 7.243) 8.285 5.841 ( 5.366 5.419 2.641) 8.070 5.959 ( 3.284 1.736 -9.131) 9.857 6.103 ( -2.558 -0.499 0.371) 2.633 6.330 ( -0.648 -1.267 1.096) 1.796 6.355 ( 5.301 -3.690 3.941) 7.567 6.388 ( 0.249 2.535 2.482) 3.557 6.452 ( 3.255 -3.348 -6.340) 7.874 6.697 ( 7.644 1.768 7.300) 10.717 6.739 ( -0.266 4.497 0.443) 4.527 6.780 ( 3.955 7.739 -0.069) 8.691 6.965 ( -4.244 5.885 0.864) 7.307 7.057 ( -0.157 9.482 -4.172) 10.361 7.137 ( -1.650 -1.076 -3.748) 4.234 7.222 ( 1.381 3.475 3.265) 4.964 7.433 ( -4.404 5.530 1.303) 7.189 7.492 ( -3.887 2.588 -8.392) 9.604 7.615 ( -6.900 6.599 -2.844) 9.962 7.721 ( 5.313 3.413 11.889) 13.462 7.875 ( 1.219 1.279 0.048) 1.768 7.937 ( 3.197 4.360 0.433) 5.424 7.994 ( 4.648 6.290 3.403) 8.529 8.239 ( 7.113 1.011 5.014) 8.761 8.348 ( -8.758 2.861 -3.913) 10.010 8.519 ( -1.299 -0.570 0.227) 1.436 8.528 ( -3.184 -1.928 -1.136) 3.892 8.633 ( -4.826 2.559 -4.512) 7.085 8.676 ( 2.919 3.125 1.069) 4.408 8.855 ( 4.560 -6.944 4.988) 9.690 9.128 ( -0.639 13.310 -0.373) 13.331 9.496 ( -5.676 12.716 -4.929) 14.772 10.062 ( -18.482 -3.295 -12.069) 22.318 10.235 ( 0.265 -3.719 -0.961) 3.851 10.319 ( 1.911 -0.577 1.002) 2.234 10.459 ( -1.755 -3.692 0.041) 4.088 10.609 ( 10.168 -4.306 7.680) 13.450 10.842 ( -3.353 -7.151 -5.316) 9.521 10.985 ( -1.377 -1.644 -5.054) 5.490 11.099 ( 4.601 -3.321 7.338) 9.276 11.399 ( -4.305 -5.934 -2.939) 7.898 11.913 ( -0.042 -2.185 4.919) 5.382 12.030 ( -2.184 -8.428 -1.705) 8.872 12.289 ( -0.493 1.319 1.403) 1.987 12.415 ( 7.497 0.694 2.758) 8.018 12.521 ( 1.421 0.042 2.568) 2.936 12.745 ( 0.389 -4.372 -0.968) 4.494 13.036 ( 23.008 14.302 9.949) 28.860 13.470 ( -20.198 10.419 -12.127) 25.760 14.034 ( -5.898 2.073 0.195) 6.255 14.184 ( -2.997 1.381 2.980) 4.446 14.283 ( -2.042 5.443 2.178) 6.208 14.387 ( 1.698 2.784 0.188) 3.266 14.636 ( 11.386 3.186 1.098) 11.875 14.793 ( -5.612 0.042 2.495) 6.142 14.914 ( 2.700 -0.871 -3.544) 4.540 15.247 ( -3.860 0.590 0.976) 4.025 15.545 ( 14.172 7.586 7.878) 17.902 15.787 ( -11.771 8.411 -8.679) 16.871 16.339 ( 8.659 -0.788 4.097) 9.612 16.659 ( -0.161 -3.304 -1.665) 3.703 19.894 ( 2.896 1.475 1.718) 3.676 20.116 ( -5.453 0.552 -3.289) 6.392 20.264 ( -0.684 -7.034 -0.573) 7.090 20.350 ( -0.421 -3.710 1.841) 4.163 24.348 ( 15.278 5.991 8.316) 18.398 24.428 ( -0.637 3.398 -2.886) 4.504 24.837 ( 2.627 -0.864 0.772) 2.871 24.918 ( 1.816 -0.260 0.012) 1.835 26.185 ( -0.051 0.575 0.647) 0.867 26.302 ( -2.620 1.750 -0.480) 3.187 26.695 ( -2.928 -1.049 -0.560) 3.161 26.777 ( 0.396 -0.389 0.814) 0.985 26.965 ( -3.596 -1.908 -1.854) 4.473 27.057 ( 5.023 2.558 0.361) 5.649 27.097 ( 0.158 3.956 -0.172) 3.963 27.270 ( 3.564 0.612 -0.210) 3.623 27.587 ( 3.156 -1.745 -1.998) 4.123 28.321 ( -4.936 6.807 1.509) 8.543 28.958 ( 1.517 -4.463 0.118) 4.716 29.146 ( -3.279 -12.284 -2.935) 13.049 29.319 ( 0.036 -3.776 0.032) 3.776 29.430 ( 1.974 -12.244 1.821) 12.536 29.901 ( 1.535 5.175 4.180) 6.827 30.833 ( -15.369 -1.061 -6.465) 16.707 ======================= Grid point 3 (4/117) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.056 ( -1.780 -27.215 4.617) 27.661 2.399 ( -3.480 1.110 -2.077) 4.202 2.524 ( 6.977 -26.579 1.206) 27.506 2.813 ( 2.311 -8.660 -6.637) 11.153 3.109 ( 5.872 -2.445 -1.514) 6.538 3.418 ( 1.904 -1.061 0.262) 2.196 3.540 ( 5.536 -2.473 5.583) 8.242 3.732 ( 9.466 -17.837 4.861) 20.770 3.830 ( -0.819 -1.192 1.242) 1.906 3.910 ( 8.034 -5.888 -1.568) 10.083 4.106 ( -1.208 -3.371 3.890) 5.287 4.216 ( -7.871 -6.392 1.279) 10.220 4.298 ( -1.114 3.031 -1.373) 3.509 4.400 ( -1.649 -3.995 2.189) 4.845 4.536 ( -4.967 -0.843 -3.608) 6.197 4.650 ( 3.058 0.715 -8.365) 8.935 4.863 ( -0.387 16.599 -4.321) 17.157 4.975 ( -2.563 -4.813 -0.326) 5.463 5.128 ( -7.810 4.382 -3.068) 9.467 5.213 ( 5.976 5.595 13.577) 15.854 5.256 ( 7.722 5.912 0.953) 9.772 5.419 ( -2.018 -8.237 -0.825) 8.521 5.509 ( 4.158 3.118 -1.179) 5.329 5.565 ( -9.578 7.602 -4.559) 13.050 5.654 ( -6.259 1.856 1.879) 6.794 5.822 ( 5.105 5.023 1.276) 7.275 5.911 ( 0.640 4.151 -7.363) 8.477 6.088 ( -4.408 3.121 -0.025) 5.402 6.208 ( -1.406 8.522 0.361) 8.645 6.366 ( -2.034 -1.419 -5.417) 5.957 6.446 ( 1.539 -1.126 7.647) 7.881 6.581 ( 2.823 4.534 -2.333) 5.829 6.609 ( 4.226 -5.692 0.561) 7.111 6.717 ( 2.319 6.519 -1.456) 7.070 6.777 ( -1.819 4.391 0.360) 4.766 6.778 ( 3.240 -3.478 3.996) 6.210 6.951 ( 1.230 5.246 -0.503) 5.411 7.093 ( -8.340 3.957 -4.176) 10.132 7.161 ( -1.534 3.786 2.166) 4.624 7.303 ( -1.075 1.277 0.893) 1.893 7.408 ( -2.231 7.533 1.512) 8.000 7.465 ( -0.920 -0.156 -4.994) 5.081 7.740 ( 2.160 14.051 1.201) 14.266 7.794 ( 3.426 -4.166 11.273) 12.497 7.875 ( 5.684 3.210 2.898) 7.142 7.958 ( 5.232 0.063 -5.817) 7.824 8.199 ( -3.971 5.165 -1.431) 6.671 8.252 ( 0.829 2.736 2.176) 3.593 8.515 ( -0.209 1.580 -0.254) 1.614 8.551 ( -7.366 -1.295 -5.721) 9.416 8.585 ( 0.231 -3.022 -0.853) 3.148 8.648 ( 3.295 1.974 1.998) 4.330 8.918 ( -2.844 5.804 -1.372) 6.607 8.984 ( 1.606 -1.208 6.569) 6.869 9.248 ( 0.669 8.251 -3.158) 8.860 9.955 ( -16.508 3.193 -8.803) 18.979 10.301 ( 0.717 -2.684 -0.362) 2.802 10.360 ( 1.369 -1.935 1.561) 2.838 10.496 ( -1.410 -1.382 -1.404) 2.423 10.695 ( 8.869 1.907 7.227) 11.599 10.960 ( -1.840 -6.157 -2.768) 6.997 11.048 ( 2.051 -4.992 -1.853) 5.706 11.203 ( 5.932 -3.142 4.722) 8.207 11.469 ( -6.911 -4.680 -4.391) 9.431 11.947 ( 0.269 -1.112 4.187) 4.340 12.164 ( -3.249 -6.408 -1.089) 7.267 12.272 ( 0.535 0.100 1.153) 1.275 12.459 ( 5.404 -0.826 4.458) 7.054 12.543 ( 3.307 -0.715 2.831) 4.411 12.808 ( 3.828 1.314 -0.559) 4.086 12.922 ( 11.183 6.612 1.781) 13.113 13.165 ( -17.194 7.301 -12.808) 22.649 13.984 ( -2.374 0.133 2.851) 3.712 14.105 ( -6.136 3.067 0.222) 6.863 14.191 ( -1.313 3.037 2.195) 3.970 14.327 ( 0.952 4.050 0.670) 4.214 14.665 ( 11.336 1.223 2.486) 11.669 14.753 ( -6.209 -0.014 -0.128) 6.210 14.937 ( 1.209 -0.453 -2.773) 3.059 15.215 ( -2.679 0.838 0.310) 2.824 15.471 ( 0.794 7.553 -1.644) 7.771 15.548 ( -1.073 8.359 0.637) 8.451 16.417 ( 8.072 -1.264 3.755) 8.992 16.699 ( -0.677 -1.340 -2.580) 2.985 19.891 ( 4.467 1.178 3.058) 5.541 20.064 ( -6.710 0.749 -4.357) 8.036 20.382 ( -0.170 -4.918 -0.065) 4.922 20.426 ( 0.024 -4.002 1.099) 4.150 24.325 ( 6.761 3.554 3.034) 8.219 24.367 ( 1.417 2.796 -1.130) 3.332 24.862 ( 1.703 -0.202 -0.238) 1.732 24.941 ( 2.448 -0.762 0.896) 2.715 26.167 ( -0.381 1.014 0.714) 1.297 26.245 ( -3.100 2.108 -0.738) 3.820 26.704 ( -2.183 -1.463 -1.072) 2.838 26.786 ( 0.345 -0.224 1.800) 1.846 26.954 ( -1.862 0.789 -0.472) 2.076 26.994 ( -2.535 3.310 -0.984) 4.284 27.072 ( 1.213 0.580 0.817) 1.573 27.297 ( 6.959 -0.087 -0.809) 7.007 27.627 ( 2.468 -0.641 -1.282) 2.854 28.184 ( -3.768 4.377 1.381) 5.939 29.040 ( 1.852 -2.501 0.271) 3.124 29.335 ( -2.647 -7.713 -1.667) 8.323 29.379 ( 0.864 -4.731 -1.674) 5.092 29.671 ( 3.234 -3.636 -1.703) 5.156 29.878 ( 0.069 -7.275 8.185) 10.951 30.740 ( -11.399 1.951 -4.761) 12.506 ======================= Grid point 4 (5/117) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.388 ( -0.179 -6.028 4.210) 7.355 2.456 ( -5.756 -9.923 -2.511) 11.744 2.842 ( 4.168 -8.982 -8.535) 13.073 3.157 ( 0.603 -15.236 2.531) 15.457 3.309 ( 10.703 -12.184 -0.454) 16.224 3.388 ( 3.090 3.571 4.318) 6.399 3.670 ( 1.914 -7.595 6.055) 9.900 3.777 ( 0.201 -0.245 3.471) 3.485 3.901 ( 4.261 -2.224 2.076) 5.235 4.061 ( 4.927 6.066 2.016) 8.071 4.124 ( -3.153 -0.016 -5.070) 5.971 4.231 ( -1.416 1.485 -4.212) 4.685 4.320 ( 2.357 -3.475 5.344) 6.797 4.366 ( -3.046 -1.953 -7.886) 8.677 4.495 ( -1.829 6.359 0.840) 6.670 4.593 ( -1.420 0.339 -4.881) 5.095 4.731 ( -4.655 6.499 -1.662) 8.166 4.879 ( -0.164 10.000 6.141) 11.736 5.066 ( 1.359 6.115 -1.227) 6.383 5.170 ( -2.030 -4.662 1.321) 5.254 5.261 ( -12.876 1.279 -11.621) 17.392 5.351 ( 9.315 -0.806 7.460) 11.961 5.538 ( -7.134 1.625 0.797) 7.360 5.626 ( 4.486 -10.219 4.122) 11.897 5.668 ( -1.840 -4.100 -4.128) 6.102 5.706 ( 1.404 9.484 1.338) 9.680 5.783 ( 5.070 3.487 -3.510) 7.084 6.017 ( 1.716 -2.596 3.324) 4.554 6.125 ( -1.053 -0.292 -1.220) 1.637 6.370 ( 5.268 2.219 6.543) 8.689 6.423 ( -8.063 3.596 -1.437) 8.945 6.538 ( 1.760 5.954 1.350) 6.354 6.573 ( 2.147 -0.916 -1.761) 2.924 6.679 ( -1.875 2.804 -3.055) 4.551 6.731 ( -2.512 -1.439 -1.679) 3.347 6.858 ( 3.023 0.067 -1.276) 3.282 6.900 ( 3.911 0.868 1.154) 4.169 6.965 ( -7.501 2.575 -3.360) 8.613 7.084 ( -1.802 3.853 0.668) 4.306 7.232 ( -1.116 3.067 4.640) 5.673 7.323 ( 1.488 3.087 1.869) 3.903 7.439 ( 1.570 10.251 -2.674) 10.710 7.574 ( 1.131 -4.445 1.647) 4.873 7.853 ( 4.009 3.802 2.379) 6.016 7.872 ( 1.694 -1.863 1.602) 2.984 7.984 ( 2.525 1.767 -4.741) 5.655 8.086 ( -7.398 0.523 0.101) 7.417 8.230 ( 3.809 0.275 1.797) 4.220 8.459 ( -0.544 2.422 -1.573) 2.939 8.582 ( -2.390 -2.943 -3.072) 4.880 8.625 ( 0.345 -0.527 3.055) 3.119 8.635 ( 0.639 0.451 -1.858) 2.015 8.835 ( -1.903 1.732 -0.702) 2.667 8.953 ( -1.348 1.730 3.365) 4.017 9.234 ( 7.590 -2.707 -0.649) 8.084 9.731 ( -13.853 9.418 -3.621) 17.138 10.346 ( 0.536 -1.465 -0.180) 1.570 10.399 ( 1.419 -0.985 1.264) 2.140 10.506 ( -0.633 -0.524 -1.181) 1.439 10.684 ( 3.833 2.411 3.532) 5.743 11.045 ( -0.789 -3.317 -1.228) 3.624 11.163 ( 3.416 -3.960 0.073) 5.230 11.278 ( 3.953 -1.072 2.324) 4.709 11.494 ( -6.370 -2.438 -4.037) 7.926 11.966 ( 0.409 -0.571 2.375) 2.477 12.227 ( -3.058 -2.309 0.261) 3.841 12.292 ( 1.933 -0.874 1.227) 2.450 12.515 ( 1.552 -2.488 5.641) 6.357 12.584 ( 6.029 -0.129 2.395) 6.488 12.727 ( 0.206 5.699 -5.116) 7.661 12.911 ( 6.132 2.575 2.222) 7.012 13.006 ( -10.386 -0.263 -9.571) 14.126 13.995 ( 4.340 0.693 6.555) 7.892 14.026 ( -8.375 -0.593 -3.237) 8.999 14.144 ( -0.451 1.235 0.374) 1.367 14.251 ( -0.612 3.505 0.972) 3.689 14.708 ( 12.349 3.161 6.723) 14.411 14.740 ( -7.910 -3.964 -4.682) 10.010 14.945 ( 0.029 -0.063 -1.919) 1.920 15.176 ( -1.965 1.910 -1.024) 2.926 15.260 ( -10.227 6.056 -7.606) 14.111 15.484 ( 8.361 3.991 6.804) 11.495 16.478 ( 4.724 -0.687 2.242) 5.274 16.709 ( -0.540 -0.271 -1.907) 2.001 19.908 ( 5.932 0.442 4.232) 7.300 20.004 ( -7.303 0.672 -4.970) 8.859 20.452 ( 0.787 -2.129 0.757) 2.392 20.493 ( -0.781 -2.724 -0.153) 2.838 24.298 ( 1.426 1.592 -0.067) 2.138 24.337 ( 2.424 1.632 0.649) 2.994 24.868 ( 0.760 0.215 -0.528) 0.950 24.971 ( 1.757 -0.742 0.946) 2.129 26.147 ( -0.019 0.717 0.762) 1.046 26.190 ( -2.376 1.488 -0.832) 2.924 26.721 ( -1.330 -1.315 -1.393) 2.332 26.790 ( 0.375 0.165 2.242) 2.279 26.925 ( 0.356 1.963 0.142) 2.000 26.932 ( -2.570 0.791 -0.930) 2.845 27.061 ( -0.913 0.536 0.348) 1.114 27.345 ( 5.321 -0.504 -0.767) 5.399 27.644 ( 1.098 -0.103 -0.544) 1.230 28.106 ( -1.990 1.968 0.755) 2.899 29.076 ( 0.954 -0.494 0.245) 1.102 29.419 ( 2.435 -2.179 0.955) 3.405 29.492 ( -3.192 -5.653 -4.347) 7.813 29.647 ( 1.351 2.978 1.294) 3.516 30.134 ( 2.939 -12.912 5.581) 14.371 30.612 ( -8.357 4.777 -4.228) 10.513 ======================= Grid point 5 (6/117) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.490 ( 0.000 -0.000 0.000) 0.000 2.493 ( -0.000 0.000 -0.000) 0.000 2.953 ( 0.000 -0.000 -0.000) 0.000 3.303 ( 0.000 -0.000 -0.000) 0.000 3.347 ( 0.000 -0.000 0.000) 0.000 3.594 ( 0.000 -0.000 -0.000) 0.000 3.676 ( 0.000 -0.000 -0.000) 0.000 3.839 ( 0.000 -0.000 0.000) 0.000 3.940 ( 0.000 -0.000 0.000) 0.000 3.955 ( 0.000 -0.000 -0.000) 0.000 4.134 ( 0.000 -0.000 -0.000) 0.000 4.159 ( 0.000 -0.000 -0.000) 0.000 4.282 ( -0.000 -0.000 0.000) 0.000 4.469 ( 0.000 -0.000 0.000) 0.000 4.488 ( 0.000 -0.000 0.000) 0.000 4.552 ( 0.000 -0.000 0.000) 0.000 4.671 ( 0.000 -0.000 -0.000) 0.000 4.780 ( 0.000 -0.000 0.000) 0.000 4.856 ( 0.000 -0.000 0.000) 0.000 5.222 ( 0.000 -0.000 -0.000) 0.000 5.269 ( 0.000 0.000 0.000) 0.000 5.438 ( 0.000 -0.000 0.000) 0.000 5.463 ( 0.000 0.000 -0.000) 0.000 5.481 ( -0.000 0.000 -0.000) 0.000 5.649 ( 0.000 -0.000 -0.000) 0.000 5.760 ( 0.000 -0.000 -0.000) 0.000 5.908 ( 0.000 -0.000 -0.000) 0.000 6.142 ( -0.000 -0.000 0.000) 0.000 6.156 ( 0.000 0.000 -0.000) 0.000 6.300 ( 0.000 0.000 0.000) 0.000 6.358 ( -0.000 -0.000 -0.000) 0.000 6.489 ( -0.000 0.000 0.000) 0.000 6.615 ( -0.000 -0.000 0.000) 0.000 6.628 ( 0.000 -0.000 -0.000) 0.000 6.738 ( 0.000 -0.000 0.000) 0.000 6.816 ( 0.000 -0.000 -0.000) 0.000 6.877 ( -0.000 -0.000 -0.000) 0.000 6.935 ( 0.000 -0.000 -0.000) 0.000 7.041 ( -0.000 -0.000 0.000) 0.000 7.232 ( 0.000 -0.000 0.000) 0.000 7.268 ( -0.000 -0.000 -0.000) 0.000 7.324 ( 0.000 -0.000 0.000) 0.000 7.718 ( 0.000 -0.000 0.000) 0.000 7.732 ( -0.000 0.000 -0.000) 0.000 7.902 ( 0.000 -0.000 0.000) 0.000 7.968 ( -0.000 -0.000 0.000) 0.000 8.062 ( 0.000 -0.000 -0.000) 0.000 8.263 ( -0.000 -0.000 0.000) 0.000 8.425 ( 0.000 -0.000 0.000) 0.000 8.596 ( 0.000 -0.000 -0.000) 0.000 8.629 ( 0.000 0.000 0.000) 0.000 8.642 ( 0.000 -0.000 0.000) 0.000 8.810 ( -0.000 0.000 -0.000) 0.000 8.939 ( 0.000 -0.000 0.000) 0.000 9.373 ( 0.000 -0.000 -0.000) 0.000 9.499 ( -0.000 0.000 -0.000) 0.000 10.362 ( 0.000 -0.000 0.000) 0.000 10.414 ( 0.000 -0.000 0.000) 0.000 10.509 ( 0.000 -0.000 0.000) 0.000 10.671 ( 0.000 -0.000 0.000) 0.000 11.075 ( 0.000 -0.000 -0.000) 0.000 11.216 ( 0.000 -0.000 -0.000) 0.000 11.299 ( 0.000 -0.000 0.000) 0.000 11.495 ( -0.000 -0.000 -0.000) 0.000 11.974 ( -0.000 -0.000 -0.000) 0.000 12.237 ( 0.000 -0.000 0.000) 0.000 12.311 ( 0.000 -0.000 0.000) 0.000 12.558 ( 0.000 -0.000 0.000) 0.000 12.622 ( 0.000 -0.000 0.000) 0.000 12.638 ( -0.000 0.000 -0.000) 0.000 12.899 ( 0.000 -0.000 0.000) 0.000 12.987 ( -0.000 -0.000 -0.000) 0.000 13.985 ( 0.000 -0.000 0.000) 0.000 14.027 ( -0.000 -0.000 -0.000) 0.000 14.136 ( 0.000 -0.000 0.000) 0.000 14.208 ( 0.000 -0.000 -0.000) 0.000 14.713 ( 0.000 -0.000 0.000) 0.000 14.765 ( -0.000 -0.000 -0.000) 0.000 14.944 ( 0.000 -0.000 0.000) 0.000 15.123 ( 0.000 -0.000 0.000) 0.000 15.184 ( 0.000 -0.000 -0.000) 0.000 15.473 ( 0.000 -0.000 -0.000) 0.000 16.500 ( 0.000 -0.000 -0.000) 0.000 16.708 ( 0.000 -0.000 0.000) 0.000 19.947 ( 0.000 -0.000 0.000) 0.000 19.950 ( -0.000 0.000 -0.000) 0.000 20.475 ( 0.000 -0.000 0.000) 0.000 20.517 ( -0.000 -0.000 -0.000) 0.000 24.287 ( 0.000 -0.000 0.000) 0.000 24.329 ( 0.000 -0.000 -0.000) 0.000 24.868 ( 0.000 -0.000 0.000) 0.000 24.985 ( 0.000 -0.000 -0.000) 0.000 26.141 ( -0.000 -0.000 -0.000) 0.000 26.166 ( 0.000 -0.000 0.000) 0.000 26.732 ( 0.000 -0.000 -0.000) 0.000 26.789 ( 0.000 -0.000 0.000) 0.000 26.903 ( 0.000 -0.000 0.000) 0.000 26.919 ( 0.000 -0.000 -0.000) 0.000 27.051 ( 0.000 -0.000 0.000) 0.000 27.368 ( 0.000 -0.000 0.000) 0.000 27.648 ( 0.000 -0.000 0.000) 0.000 28.081 ( 0.000 -0.000 -0.000) 0.000 29.082 ( 0.000 -0.000 -0.000) 0.000 29.449 ( 0.000 -0.000 0.000) 0.000 29.537 ( -0.000 -0.000 0.000) 0.000 29.621 ( 0.000 -0.000 0.000) 0.000 30.323 ( 0.000 -0.000 -0.000) 0.000 30.490 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 12 (7/117) ======================= q-point: ( 0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.413 ( 34.121 0.000 -22.985) 41.141 0.512 ( 41.098 0.000 9.967) 42.289 0.847 ( 65.924 0.000 36.980) 75.587 2.731 ( -10.714 -0.000 -13.644) 17.348 2.911 ( 9.571 0.000 8.556) 12.838 3.264 ( -20.049 -0.000 -8.733) 21.868 3.403 ( -7.162 -0.000 -25.477) 26.464 3.605 ( 1.617 0.000 16.902) 16.980 3.686 ( -8.709 -0.000 3.146) 9.260 3.970 ( -3.495 -0.000 -5.734) 6.715 4.054 ( 25.776 0.000 9.164) 27.356 4.056 ( -1.904 -0.000 -3.930) 4.367 4.440 ( -9.299 -0.000 11.490) 14.781 4.544 ( -6.467 -0.000 6.597) 9.238 4.626 ( -1.202 -0.000 -1.648) 2.040 4.725 ( -10.016 -0.000 -7.014) 12.228 4.792 ( -5.202 -0.000 0.965) 5.291 4.851 ( 1.454 0.000 0.479) 1.531 5.198 ( 7.791 0.000 -10.754) 13.280 5.267 ( 1.279 0.000 0.503) 1.374 5.298 ( 9.341 0.000 -5.964) 11.082 5.484 ( -7.621 -0.000 4.537) 8.869 5.667 ( 1.874 0.000 4.536) 4.908 5.722 ( 11.987 0.000 -4.802) 12.913 5.825 ( -1.864 -0.000 6.593) 6.852 5.977 ( 11.587 0.000 -9.059) 14.708 5.985 ( -0.371 -0.000 -6.044) 6.056 6.157 ( -11.152 -0.000 -12.012) 16.391 6.263 ( 4.463 0.000 9.734) 10.709 6.367 ( 5.136 0.000 11.646) 12.728 6.452 ( -4.683 -0.000 -22.051) 22.543 6.494 ( 6.474 0.000 12.467) 14.048 6.647 ( 6.542 0.000 -4.973) 8.218 6.904 ( -3.133 -0.000 3.977) 5.063 6.989 ( 3.008 0.000 2.205) 3.730 7.051 ( -1.667 -0.000 -4.815) 5.095 7.141 ( -2.865 -0.000 1.111) 3.073 7.534 ( 2.353 0.000 2.919) 3.749 7.538 ( 1.042 0.000 -65.848) 65.856 7.547 ( -11.926 -0.000 -8.492) 14.640 7.598 ( -5.299 -0.000 -4.493) 6.947 7.653 ( -3.968 -0.000 11.917) 12.560 7.823 ( 4.890 0.000 5.299) 7.210 7.915 ( -2.461 -0.000 -4.380) 5.024 8.025 ( 10.674 0.000 7.503) 13.047 8.063 ( -3.759 -0.000 15.633) 16.079 8.205 ( 2.262 0.000 4.409) 4.956 8.403 ( 0.672 0.000 -1.955) 2.067 8.431 ( -10.011 -0.000 -8.630) 13.217 8.521 ( 3.728 0.000 2.697) 4.601 8.590 ( -5.600 -0.000 -1.061) 5.699 8.684 ( 1.284 0.000 -9.670) 9.755 8.756 ( 3.469 0.000 -11.135) 11.663 8.863 ( 1.417 0.000 -0.694) 1.578 9.962 ( 3.765 0.000 13.244) 13.769 10.000 ( -4.934 -0.000 -1.710) 5.222 10.049 ( 2.721 0.000 0.008) 2.721 10.081 ( -1.568 -0.000 -1.691) 2.306 10.405 ( 0.850 0.000 -11.910) 11.940 10.496 ( 6.526 0.000 1.834) 6.779 10.602 ( -2.833 -0.000 -3.846) 4.776 10.812 ( 3.403 0.000 -0.332) 3.420 10.973 ( 4.145 0.000 3.614) 5.499 11.253 ( -2.497 -0.000 -2.844) 3.785 11.790 ( -5.500 -0.000 -3.871) 6.726 11.876 ( 2.197 0.000 9.227) 9.485 12.408 ( -2.073 -0.000 1.235) 2.413 12.412 ( -0.442 -0.000 -0.318) 0.545 12.568 ( 2.192 0.000 6.328) 6.696 12.571 ( 5.803 0.000 0.572) 5.831 13.679 ( -31.893 -0.000 -16.604) 35.956 14.091 ( -1.299 -0.000 4.669) 4.847 14.168 ( -1.308 -0.000 1.867) 2.280 14.397 ( -0.768 -0.000 11.359) 11.385 14.404 ( -6.113 -0.000 -0.417) 6.128 14.603 ( -10.374 -0.000 97.700) 98.249 14.754 ( 14.741 0.000 2.811) 15.007 14.839 ( 4.156 0.000 24.063) 24.420 14.937 ( 2.139 0.000 -22.665) 22.765 15.117 ( 1.817 0.000 4.067) 4.454 15.689 ( 13.625 0.000 4.061) 14.217 15.982 ( -9.392 -0.000 -8.339) 12.560 16.463 ( 0.116 0.000 -0.764) 0.773 16.513 ( 1.679 0.000 19.772) 19.843 19.947 ( 1.717 0.000 4.349) 4.675 19.980 ( -0.309 -0.000 -1.156) 1.197 20.087 ( 0.765 0.000 0.874) 1.161 20.167 ( -0.286 -0.000 0.314) 0.425 24.503 ( -3.438 -0.000 -5.079) 6.133 24.800 ( 4.022 0.000 0.322) 4.035 24.911 ( 1.758 0.000 -0.923) 1.986 25.552 ( -8.857 -0.000 103.502) 103.880 26.332 ( -2.830 -0.000 -0.297) 2.846 26.422 ( -4.556 -0.000 78.721) 78.853 26.671 ( -4.492 -0.000 -0.152) 4.495 26.769 ( 0.704 0.000 2.315) 2.419 27.068 ( 7.734 0.000 1.343) 7.850 27.181 ( -2.588 -0.000 -6.329) 6.837 27.292 ( 0.074 0.000 -1.118) 1.121 27.325 ( 1.032 0.000 0.421) 1.114 27.717 ( 7.461 0.000 -85.287) 85.613 28.100 ( -3.467 -0.000 -1.125) 3.645 28.756 ( -0.322 -0.000 0.267) 0.418 28.837 ( 0.185 0.000 3.978) 3.983 29.025 ( -0.976 -0.000 0.255) 1.008 29.249 ( -4.122 -0.000 -2.036) 4.597 29.893 ( 4.588 0.000 -77.926) 78.061 30.044 ( 4.247 0.000 4.590) 6.253 ======================= Grid point 13 (8/117) ======================= q-point: ( 0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.837 ( 13.138 -27.967 2.438) 30.995 1.224 ( 30.596 -31.533 6.486) 44.413 1.828 ( 40.910 -48.304 16.502) 65.416 2.601 ( -11.018 4.425 -10.920) 16.132 2.912 ( 2.697 6.834 1.324) 7.466 3.136 ( -8.665 -1.242 -1.661) 8.910 3.360 ( -5.334 -0.495 -23.569) 24.170 3.525 ( 2.161 3.590 10.029) 10.869 3.761 ( -6.604 -7.700 4.969) 11.296 3.959 ( -2.301 -2.283 1.861) 3.738 4.084 ( -2.790 -1.731 -6.893) 7.635 4.127 ( 13.511 4.089 11.678) 18.320 4.343 ( -7.109 9.631 -2.062) 12.147 4.465 ( -5.942 -2.908 2.233) 6.982 4.521 ( -7.505 2.922 6.955) 10.641 4.721 ( 3.809 2.898 2.008) 5.191 4.828 ( -6.104 -4.978 3.843) 8.764 4.929 ( -4.604 -10.189 -4.452) 12.035 5.170 ( 2.687 7.044 -6.676) 10.071 5.205 ( 6.135 0.668 -9.217) 11.092 5.486 ( -6.129 -3.594 -1.491) 7.260 5.503 ( 5.022 -7.258 2.353) 9.134 5.625 ( 7.278 5.953 -4.103) 10.259 5.757 ( 6.174 4.543 1.040) 7.736 5.806 ( -3.621 6.422 -1.181) 7.467 5.887 ( -3.493 -0.756 -4.609) 5.832 6.017 ( 5.841 2.549 -2.716) 6.928 6.135 ( 3.120 -1.157 -11.263) 11.744 6.301 ( 3.620 0.653 10.874) 11.480 6.368 ( 1.835 2.046 10.236) 10.599 6.414 ( 1.540 0.773 -2.499) 3.036 6.459 ( 5.487 1.744 -5.529) 7.982 6.704 ( 4.613 -2.495 7.294) 8.984 6.860 ( -0.873 3.933 1.479) 4.292 7.002 ( 0.785 2.631 -5.342) 6.006 7.011 ( 3.973 8.459 5.252) 10.720 7.092 ( -3.937 -0.251 -3.162) 5.055 7.276 ( 3.330 8.685 -10.404) 13.955 7.370 ( 1.774 12.133 3.503) 12.753 7.438 ( -12.014 1.321 -5.288) 13.193 7.539 ( 0.891 1.935 2.104) 2.994 7.642 ( -8.133 1.741 -6.312) 10.441 7.831 ( 3.874 3.255 5.884) 7.761 7.892 ( 0.502 0.075 1.943) 2.008 8.020 ( 2.362 2.105 7.709) 8.333 8.103 ( 1.319 2.300 1.945) 3.288 8.271 ( 8.539 -2.873 8.990) 12.728 8.339 ( -9.404 1.472 -3.902) 10.287 8.470 ( -1.483 -2.144 -0.530) 2.660 8.497 ( -6.648 2.523 -3.489) 7.921 8.670 ( 0.407 0.612 -4.360) 4.421 8.698 ( 3.057 -4.789 5.993) 8.258 8.807 ( 0.566 2.450 -2.096) 3.273 9.214 ( -18.957 -17.112 -12.798) 28.565 9.616 ( -5.253 15.519 -4.216) 16.917 9.937 ( -4.789 3.258 -1.300) 5.936 10.153 ( 0.616 -5.055 -0.481) 5.115 10.325 ( -3.893 -9.491 0.604) 10.276 10.400 ( 5.661 3.921 -4.030) 7.979 10.534 ( 5.286 -5.467 3.132) 8.224 10.666 ( -3.570 -7.205 -5.698) 9.856 10.926 ( 1.342 -5.042 -2.916) 5.977 11.045 ( 4.311 -4.079 5.815) 8.309 11.274 ( -3.788 -3.827 -3.434) 6.386 11.801 ( -7.819 -4.774 -3.745) 9.897 11.930 ( 3.706 -3.455 6.396) 8.160 12.336 ( 0.049 3.114 2.005) 3.704 12.444 ( 0.277 -0.955 0.218) 1.018 12.556 ( 5.484 1.367 3.125) 6.458 12.669 ( 3.207 -3.997 -0.285) 5.132 13.416 ( -33.162 4.789 -17.592) 37.844 13.760 ( 30.218 36.308 30.742) 56.360 14.064 ( -2.977 2.985 4.434) 6.118 14.211 ( -0.694 3.715 9.564) 10.283 14.375 ( -0.705 4.356 7.549) 8.744 14.425 ( 2.388 1.828 -0.773) 3.105 14.730 ( -1.052 3.050 -4.982) 5.936 14.829 ( 8.599 2.497 6.887) 11.296 14.915 ( 5.091 -0.687 -4.359) 6.737 15.222 ( -4.173 -1.357 2.536) 5.068 15.778 ( 15.608 4.503 9.266) 18.701 15.847 ( -12.592 5.918 -10.715) 17.561 16.401 ( 7.096 2.003 4.079) 8.426 16.582 ( 0.588 -4.114 0.716) 4.217 19.937 ( 3.241 0.762 1.244) 3.555 20.075 ( -7.160 -1.928 -3.486) 8.193 20.132 ( -0.552 -4.564 0.000) 4.598 20.247 ( -1.247 -6.498 2.691) 7.142 24.455 ( -3.546 2.191 -5.915) 7.236 24.793 ( 14.637 11.279 8.936) 20.526 24.906 ( 10.815 10.568 8.540) 17.366 24.947 ( 13.820 11.899 17.658) 25.385 26.225 ( 3.561 4.762 5.504) 8.102 26.308 ( -3.452 0.990 -0.013) 3.591 26.652 ( -4.240 -0.948 -0.301) 4.355 26.775 ( 0.903 -0.149 1.105) 1.434 26.944 ( 1.631 3.053 -10.183) 10.756 27.152 ( 4.545 2.731 -1.039) 5.403 27.187 ( 4.518 4.510 -0.241) 6.389 27.288 ( 1.676 -0.100 0.019) 1.679 27.581 ( 6.484 -1.038 -6.642) 9.340 28.382 ( -12.965 2.143 1.612) 13.240 28.872 ( -0.711 -7.237 -2.203) 7.599 28.892 ( -1.154 -8.371 0.059) 8.451 29.125 ( -0.894 -9.893 1.006) 9.984 29.344 ( -1.537 -3.072 4.129) 5.371 30.020 ( 3.575 4.292 4.365) 7.089 30.466 ( -30.978 -25.821 -22.809) 46.332 ======================= Grid point 14 (9/117) ======================= q-point: ( 0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.473 ( 2.373 -30.576 5.560) 31.167 2.012 ( 21.993 -31.124 6.933) 38.736 2.450 ( -4.820 3.777 -6.114) 8.653 2.698 ( -8.696 -6.605 -3.843) 11.577 3.087 ( 26.158 -31.673 4.699) 41.347 3.156 ( 9.276 -6.380 2.585) 11.551 3.356 ( -1.906 -3.555 -12.117) 12.770 3.573 ( 7.455 -3.266 8.268) 11.602 3.812 ( -8.420 -1.970 -6.180) 10.629 4.003 ( -5.835 2.119 6.088) 8.695 4.036 ( 7.604 3.080 3.158) 8.791 4.127 ( -3.436 -0.360 4.583) 5.739 4.239 ( 1.060 -5.105 -7.615) 9.229 4.390 ( -3.951 3.112 8.965) 10.280 4.529 ( -5.002 0.262 1.809) 5.326 4.637 ( -6.543 -1.187 0.022) 6.650 4.935 ( -3.809 -1.303 -3.501) 5.335 5.032 ( -1.252 1.541 -1.273) 2.359 5.049 ( -6.412 -2.027 -7.294) 9.921 5.276 ( 10.016 -2.253 -5.348) 11.576 5.435 ( 1.382 11.049 -4.296) 11.935 5.491 ( 6.510 8.524 7.701) 13.205 5.563 ( 0.543 1.389 0.750) 1.669 5.623 ( -3.530 5.418 -4.448) 7.849 5.747 ( -1.896 0.570 3.236) 3.794 5.920 ( 3.978 2.701 1.626) 5.076 5.929 ( -4.471 1.254 -6.462) 7.957 6.121 ( 2.937 5.147 0.672) 5.964 6.292 ( -4.378 -0.757 -6.610) 7.964 6.360 ( -1.520 5.124 -6.928) 8.750 6.466 ( 8.828 -3.202 15.085) 17.769 6.516 ( 6.708 -4.787 -2.514) 8.616 6.718 ( -1.724 6.358 -1.250) 6.705 6.772 ( 2.465 1.051 4.430) 5.178 6.829 ( -0.600 7.538 0.070) 7.562 6.924 ( -2.310 7.270 -3.254) 8.293 7.025 ( -1.639 3.110 -1.712) 3.911 7.118 ( -2.133 5.610 -1.706) 6.239 7.247 ( 2.362 4.361 2.144) 5.403 7.357 ( -6.013 5.712 -0.638) 8.318 7.438 ( -2.838 2.605 -7.230) 8.192 7.574 ( 0.255 2.711 5.742) 6.355 7.772 ( 0.090 2.485 8.585) 8.938 7.885 ( 0.855 2.114 -2.893) 3.684 7.996 ( 5.942 3.596 3.253) 7.669 8.044 ( 2.536 3.245 4.146) 5.844 8.233 ( -8.590 3.744 -2.849) 9.794 8.339 ( 4.764 2.613 4.714) 7.193 8.461 ( -3.913 -1.556 -3.919) 5.752 8.513 ( 2.025 -4.253 0.079) 4.711 8.600 ( -0.689 4.520 0.284) 4.581 8.708 ( 1.917 2.251 0.687) 3.036 8.917 ( 4.531 -6.954 6.602) 10.606 9.112 ( -1.789 14.470 -0.651) 14.595 9.381 ( -11.534 4.974 -9.389) 15.682 9.851 ( -13.266 -0.132 -7.420) 15.200 10.245 ( 1.120 -3.817 0.319) 3.991 10.372 ( 5.551 1.467 -0.336) 5.752 10.422 ( -4.129 -4.490 -3.450) 7.008 10.719 ( 7.245 -6.167 7.089) 11.865 10.804 ( -1.258 -8.009 -4.386) 9.217 10.992 ( 2.128 -2.006 -2.555) 3.884 11.165 ( 5.274 -4.623 6.476) 9.545 11.334 ( -5.163 -4.899 -3.596) 7.974 11.850 ( -8.926 -5.223 -2.148) 10.563 12.051 ( 3.970 -5.681 3.793) 7.901 12.294 ( 1.053 1.448 2.010) 2.692 12.461 ( 0.178 -0.722 1.478) 1.654 12.576 ( 6.434 0.525 2.219) 6.826 12.770 ( 3.294 -4.229 -0.565) 5.390 13.109 ( -27.436 6.103 -16.512) 32.598 13.376 ( 21.321 21.997 12.107) 32.940 13.994 ( -2.380 2.319 4.446) 5.551 14.141 ( -3.070 2.989 4.192) 5.995 14.271 ( 0.054 5.517 4.913) 7.387 14.397 ( 0.341 2.614 -0.659) 2.718 14.668 ( -4.088 1.455 -4.796) 6.468 14.830 ( 8.063 2.669 4.343) 9.539 14.944 ( 3.585 0.387 -2.046) 4.146 15.208 ( -2.893 0.155 1.117) 3.105 15.589 ( -15.032 9.276 -13.595) 22.289 15.759 ( 15.139 7.898 12.309) 21.049 16.454 ( 8.587 -1.013 3.631) 9.378 16.650 ( -0.996 -2.966 -2.695) 4.130 19.944 ( 4.745 1.083 2.773) 5.601 20.036 ( -6.560 0.670 -4.048) 7.737 20.241 ( -2.581 -6.893 -1.788) 7.574 20.356 ( 0.834 -4.822 2.682) 5.580 24.384 ( -2.746 2.588 -5.197) 6.422 24.596 ( 18.467 13.943 11.899) 26.020 24.878 ( 3.713 0.438 0.453) 3.766 24.952 ( 3.607 -0.056 1.203) 3.803 26.187 ( 0.450 1.465 1.527) 2.164 26.258 ( -4.245 1.623 -0.487) 4.570 26.656 ( -3.162 -1.711 -0.534) 3.635 26.785 ( 0.785 -0.211 1.499) 1.705 26.919 ( -3.234 -0.391 -3.145) 4.528 27.066 ( -1.836 4.961 -1.753) 5.573 27.154 ( 6.758 3.888 1.205) 7.889 27.325 ( 5.510 -1.150 -0.318) 5.637 27.637 ( 4.865 -0.645 -3.100) 5.805 28.238 ( -8.405 4.406 2.103) 9.720 28.984 ( 2.631 -4.760 0.290) 5.447 29.097 ( -3.836 -11.995 -3.964) 13.203 29.315 ( -0.727 -6.109 0.709) 6.193 29.465 ( 3.274 -12.254 2.909) 13.013 29.927 ( 1.718 6.577 5.888) 8.993 30.595 ( -20.534 -7.826 -10.013) 24.148 ======================= Grid point 15 (10/117) ======================= q-point: ( 0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.021 ( -4.736 -25.413 4.872) 26.306 2.379 ( 0.468 1.223 -1.346) 1.878 2.628 ( 8.906 -17.989 -0.854) 20.091 2.843 ( 6.308 -16.237 -5.494) 18.265 3.225 ( 10.474 -3.626 0.953) 11.125 3.449 ( 3.375 -5.693 2.160) 6.961 3.620 ( 5.843 3.798 5.868) 9.110 3.745 ( -5.455 -0.720 1.099) 5.611 3.877 ( 4.637 -11.043 2.390) 12.213 3.972 ( 1.791 -3.518 -2.120) 4.480 4.066 ( -4.434 -13.558 -7.741) 16.229 4.203 ( 5.523 0.668 11.488) 12.765 4.295 ( -0.473 0.544 -2.926) 3.013 4.384 ( -0.920 -0.173 5.548) 5.627 4.457 ( -4.837 -1.385 -1.288) 5.194 4.693 ( 1.284 -2.022 -8.613) 8.940 4.852 ( 0.638 12.568 -1.469) 12.670 4.922 ( -13.402 -7.001 -1.791) 15.226 5.040 ( 3.122 -0.654 -7.864) 8.486 5.197 ( -4.289 13.505 2.255) 14.348 5.355 ( -3.945 3.375 -0.171) 5.194 5.367 ( -2.510 2.877 0.641) 3.872 5.529 ( 2.872 0.742 4.096) 5.058 5.545 ( 7.402 5.390 4.845) 10.359 5.684 ( 8.316 0.028 5.220) 9.818 5.884 ( 4.720 4.265 2.055) 6.686 5.913 ( 0.037 4.333 -7.855) 8.971 6.044 ( -2.518 1.357 -1.065) 3.052 6.154 ( -5.690 8.365 -5.068) 11.315 6.285 ( -8.760 -3.583 -3.688) 10.157 6.483 ( 1.056 4.748 5.295) 7.189 6.636 ( 1.451 0.475 1.339) 2.031 6.647 ( 5.813 0.338 -4.825) 7.562 6.709 ( -7.304 3.162 0.870) 8.007 6.723 ( -1.510 6.360 -5.812) 8.747 6.830 ( 2.474 -3.065 0.642) 3.991 6.966 ( -9.169 5.056 -1.875) 10.637 6.999 ( 6.303 2.780 2.098) 7.202 7.166 ( 1.918 4.086 2.029) 4.949 7.283 ( -2.632 0.760 -0.128) 2.742 7.389 ( 0.176 3.275 -0.121) 3.282 7.489 ( 2.514 4.477 4.675) 6.944 7.738 ( -0.887 6.246 6.939) 9.378 7.834 ( 2.635 0.061 -1.237) 2.911 7.968 ( 6.731 2.963 3.868) 8.309 8.020 ( 3.995 2.327 -1.734) 4.938 8.091 ( -7.837 4.771 -3.031) 9.663 8.295 ( 0.613 3.387 3.115) 4.642 8.453 ( -6.171 -3.488 -5.619) 9.046 8.537 ( 3.681 2.749 1.275) 4.768 8.617 ( 5.041 -0.352 0.627) 5.092 8.683 ( 1.380 1.979 0.397) 2.445 8.864 ( -4.436 4.904 -2.816) 7.187 9.004 ( 0.969 1.793 6.351) 6.670 9.256 ( 0.703 1.569 -2.246) 2.828 9.742 ( -16.492 2.331 -7.040) 18.083 10.314 ( 1.306 -2.477 0.399) 2.829 10.397 ( 3.710 -0.518 1.300) 3.965 10.466 ( -3.067 -2.512 -3.571) 5.336 10.787 ( 5.490 3.097 6.352) 8.948 10.939 ( -0.842 -6.341 -3.195) 7.150 11.094 ( 4.770 -5.864 -0.806) 7.602 11.273 ( 4.007 -2.531 3.946) 6.167 11.392 ( -3.930 -4.281 -2.329) 6.261 11.886 ( -8.795 -4.182 -2.621) 10.085 12.171 ( 2.698 -3.944 2.932) 5.607 12.300 ( 3.496 -0.303 3.031) 4.637 12.480 ( -0.321 -1.387 2.794) 3.136 12.612 ( 5.196 -0.338 0.965) 5.296 12.810 ( -9.301 4.054 -5.434) 11.510 12.906 ( -7.339 -2.624 -8.668) 11.657 13.138 ( 13.961 14.060 4.793) 20.386 13.957 ( -3.564 -0.065 3.116) 4.734 14.074 ( 1.496 2.677 5.564) 6.353 14.184 ( 0.284 3.459 3.499) 4.928 14.325 ( -1.069 4.296 -0.016) 4.427 14.626 ( -7.813 -1.106 -7.036) 10.572 14.833 ( 8.694 2.434 2.773) 9.445 14.946 ( 0.565 0.511 -1.807) 1.961 15.184 ( -2.718 0.536 0.524) 2.819 15.316 ( -14.262 7.970 -11.939) 20.235 15.689 ( 13.207 8.567 11.023) 19.217 16.516 ( 6.857 0.051 2.894) 7.443 16.686 ( -0.957 -1.529 -3.096) 3.583 19.959 ( 6.001 0.790 4.130) 7.327 19.976 ( -6.738 1.028 -4.392) 8.109 20.348 ( -3.961 -5.920 -2.882) 7.685 20.449 ( 2.185 -3.572 2.731) 4.999 24.324 ( -2.108 1.878 -3.792) 4.728 24.478 ( 10.782 8.283 5.933) 14.835 24.885 ( 1.891 0.746 -0.805) 2.187 24.977 ( 3.150 -0.254 1.525) 3.509 26.164 ( -0.108 1.066 1.169) 1.586 26.200 ( -3.863 1.513 -0.806) 4.226 26.676 ( -2.270 -2.002 -0.874) 3.151 26.793 ( 0.595 -0.076 1.856) 1.950 26.908 ( -3.975 -0.829 -0.952) 4.171 26.969 ( -2.038 3.290 -1.184) 4.047 27.110 ( 3.808 3.760 0.754) 5.404 27.383 ( 7.231 -0.329 -1.254) 7.346 27.657 ( 2.243 0.549 -1.021) 2.524 28.129 ( -5.045 2.454 1.492) 5.805 29.066 ( 2.127 -1.765 0.344) 2.785 29.287 ( -4.014 -9.657 -4.612) 11.430 29.409 ( 3.582 -4.023 1.702) 5.649 29.718 ( 4.423 -1.301 -2.576) 5.281 29.881 ( -0.795 -9.418 9.989) 13.752 30.572 ( -14.476 -1.809 -6.323) 15.900 ======================= Grid point 16 (11/117) ======================= q-point: ( 0.50 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.387 ( -4.544 -13.394 -2.795) 14.417 2.418 ( 3.975 -4.718 3.904) 7.301 2.901 ( 6.189 -7.168 -8.162) 12.502 3.200 ( 5.900 -9.990 6.598) 13.347 3.404 ( 4.290 -2.482 2.813) 5.699 3.462 ( 8.427 -2.173 -0.253) 8.706 3.683 ( -0.469 -6.100 5.873) 8.481 3.766 ( -2.140 -3.680 0.766) 4.325 3.935 ( 0.400 -0.530 3.816) 3.873 4.033 ( -7.116 2.449 -7.590) 10.688 4.127 ( 0.760 5.182 -0.634) 5.275 4.193 ( -2.089 0.496 -3.627) 4.214 4.306 ( -3.052 -2.292 -2.869) 4.775 4.389 ( 4.746 -4.664 4.167) 7.851 4.495 ( 0.539 8.140 -3.798) 8.999 4.592 ( 1.876 -9.037 5.585) 10.788 4.690 ( -1.936 11.712 0.310) 11.875 4.913 ( 2.924 9.748 3.759) 10.849 5.001 ( -13.331 12.257 -4.316) 18.617 5.113 ( -1.232 -9.979 -6.547) 11.998 5.138 ( -6.123 -3.435 -4.758) 8.481 5.418 ( -4.741 4.413 -0.054) 6.477 5.470 ( 5.006 -4.062 4.413) 7.812 5.634 ( -1.570 6.187 1.055) 6.470 5.678 ( 1.694 2.953 -2.622) 4.297 5.795 ( 8.871 1.772 4.742) 10.213 5.891 ( 11.795 -1.605 0.759) 11.928 6.051 ( 3.251 -2.718 3.372) 5.416 6.094 ( -3.499 -5.033 -3.442) 7.030 6.296 ( -10.766 0.930 -2.140) 11.016 6.429 ( 3.769 0.212 6.126) 7.196 6.525 ( -5.978 4.257 -2.796) 7.854 6.570 ( -4.335 1.908 -0.915) 4.824 6.684 ( 5.379 3.232 -1.944) 6.569 6.705 ( -1.126 -3.262 -3.380) 4.830 6.858 ( -4.843 2.355 0.042) 5.386 6.912 ( 3.711 -0.240 -0.663) 3.778 7.002 ( 9.548 2.983 3.911) 10.741 7.071 ( -0.307 5.693 1.086) 5.804 7.193 ( -5.467 1.524 -0.150) 5.677 7.306 ( -1.671 5.280 -1.856) 5.841 7.518 ( 6.176 3.629 1.974) 7.430 7.573 ( -0.035 0.636 4.089) 4.139 7.827 ( -6.277 4.331 -0.435) 7.638 7.921 ( 3.438 2.968 -2.026) 4.973 7.991 ( -1.413 1.954 -0.595) 2.483 8.040 ( 1.364 -2.340 2.098) 3.426 8.252 ( -0.392 -0.093 -0.816) 0.910 8.472 ( 1.745 3.803 -1.586) 4.474 8.557 ( -1.141 -5.078 -2.155) 5.633 8.595 ( -3.590 -0.330 -0.794) 3.692 8.649 ( 0.336 1.288 1.397) 1.929 8.841 ( 2.883 1.435 -0.606) 3.277 8.957 ( 2.445 1.335 2.802) 3.951 9.318 ( 5.857 -4.778 0.355) 7.567 9.548 ( -15.099 6.669 -2.780) 16.738 10.356 ( 0.965 -1.005 0.318) 1.430 10.420 ( 1.621 0.177 1.225) 2.040 10.486 ( -2.230 -1.566 -2.383) 3.620 10.736 ( 4.081 4.321 3.944) 7.133 11.031 ( -1.125 -3.700 -2.924) 4.848 11.209 ( 3.495 -2.332 0.739) 4.266 11.298 ( -1.813 0.220 -0.956) 2.061 11.470 ( 3.732 -3.611 2.674) 5.841 11.905 ( -8.457 -3.354 -4.426) 10.117 12.244 ( 3.213 -1.842 3.359) 5.000 12.322 ( 3.162 0.689 1.614) 3.617 12.518 ( -0.583 -2.324 4.092) 4.741 12.625 ( -6.976 1.311 -7.298) 10.180 12.668 ( -0.626 2.045 -0.990) 2.356 12.933 ( -1.048 1.332 -3.298) 3.708 13.025 ( 10.341 3.755 4.947) 12.062 13.938 ( -4.544 -0.698 0.399) 4.615 14.084 ( 7.849 0.283 8.222) 11.371 14.141 ( 0.150 1.173 0.448) 1.264 14.237 ( -1.501 3.294 0.885) 3.727 14.598 ( -12.456 -2.155 -10.116) 16.190 14.842 ( 6.068 1.427 0.199) 6.237 14.936 ( -1.687 -0.151 -1.636) 2.355 15.142 ( -3.678 2.799 -2.808) 5.408 15.160 ( -3.388 -0.086 -0.820) 3.487 15.594 ( 8.165 8.167 6.670) 13.336 16.532 ( 3.494 1.632 1.515) 4.143 16.701 ( -0.424 -0.621 -1.669) 1.831 19.915 ( -6.319 0.770 -4.295) 7.679 19.992 ( 6.883 0.104 4.945) 8.476 20.414 ( -4.627 -3.673 -3.415) 6.823 20.518 ( 2.643 -1.763 2.486) 4.034 24.284 ( -1.862 0.837 -2.355) 3.117 24.400 ( 5.634 5.061 2.912) 8.114 24.876 ( 0.558 0.748 -0.573) 1.095 24.994 ( 1.673 0.300 0.935) 1.940 26.146 ( -0.783 0.692 0.429) 1.130 26.163 ( -1.389 0.193 -0.220) 1.420 26.703 ( -1.459 -1.966 -1.134) 2.698 26.794 ( 0.149 0.349 1.687) 1.729 26.898 ( -2.152 0.136 -0.603) 2.239 26.925 ( -0.587 0.071 -0.142) 0.609 27.064 ( 1.100 2.210 0.323) 2.489 27.409 ( 5.159 1.857 -1.282) 5.631 27.652 ( 0.082 0.480 0.187) 0.521 28.080 ( -2.099 0.501 0.581) 2.234 29.087 ( 0.728 0.146 0.224) 0.775 29.406 ( -3.386 -4.709 -4.389) 7.273 29.506 ( 4.813 -2.518 1.797) 5.721 29.663 ( 0.862 3.214 2.070) 3.918 30.174 ( 2.990 -13.885 4.396) 14.868 30.495 ( -9.716 1.541 -4.601) 10.860 ======================= Grid point 17 (12/117) ======================= q-point: (-0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.498 ( 2.654 1.514 -6.385) 7.078 2.527 ( 3.499 -2.985 5.996) 7.557 2.965 ( 1.568 3.205 1.000) 3.705 3.316 ( 1.524 0.617 2.884) 3.320 3.353 ( 0.961 1.987 -2.241) 3.145 3.530 ( -6.534 11.987 1.376) 13.721 3.709 ( 1.991 -7.434 -1.583) 7.857 3.815 ( -3.612 7.023 -1.387) 8.018 3.927 ( -1.188 -0.884 -0.289) 1.509 3.950 ( -0.286 0.089 -0.759) 0.816 4.092 ( -4.264 0.461 -4.009) 5.871 4.172 ( -0.547 -4.881 0.086) 4.912 4.294 ( 2.514 0.154 3.594) 4.389 4.472 ( -1.952 0.330 -1.596) 2.543 4.506 ( 1.443 2.535 5.586) 6.302 4.547 ( 1.241 -3.009 2.177) 3.916 4.629 ( -2.374 3.644 -6.414) 7.749 4.768 ( -2.109 -1.954 3.318) 4.390 4.933 ( 8.715 -7.764 2.106) 11.860 5.193 ( -4.087 -6.904 -3.544) 8.771 5.275 ( -0.156 4.011 2.195) 4.575 5.375 ( -4.383 2.370 -0.989) 5.079 5.479 ( 1.232 -6.387 -2.299) 6.899 5.503 ( 0.475 -3.939 -2.033) 4.458 5.703 ( 7.824 0.814 4.142) 8.889 5.762 ( 0.335 2.832 2.179) 3.589 5.929 ( 2.952 8.228 -2.715) 9.153 6.126 ( -2.419 1.052 3.826) 4.648 6.148 ( -0.818 3.869 -5.807) 7.025 6.231 ( -5.872 -4.298 -4.256) 8.430 6.383 ( -5.216 4.856 -0.937) 7.188 6.475 ( 4.779 -2.951 1.833) 5.908 6.595 ( -2.253 -2.518 1.145) 3.567 6.642 ( 1.643 -0.586 1.609) 2.373 6.777 ( -0.153 2.629 -1.176) 2.884 6.795 ( 1.848 -4.463 4.569) 6.649 6.890 ( 0.364 1.836 3.983) 4.401 6.993 ( 6.031 0.982 0.523) 6.133 7.053 ( 4.238 -0.721 0.749) 4.363 7.168 ( -7.701 -1.461 -7.086) 10.566 7.238 ( -0.562 -0.873 -1.622) 1.925 7.425 ( 9.484 4.634 3.575) 11.145 7.651 ( -7.741 3.434 -0.181) 8.471 7.725 ( -2.405 -6.246 0.118) 6.694 7.890 ( -1.585 0.972 -4.198) 4.592 7.951 ( -2.270 0.796 4.063) 4.722 8.110 ( 5.840 -2.026 1.359) 6.329 8.245 ( -2.949 2.272 -2.930) 4.738 8.433 ( 2.052 -0.603 -0.039) 2.139 8.581 ( -1.944 -0.998 -1.855) 2.866 8.627 ( -1.014 1.091 0.207) 1.504 8.642 ( -0.106 -1.953 2.548) 3.212 8.831 ( 3.045 0.237 -0.471) 3.090 8.965 ( 3.961 1.064 -0.750) 4.169 9.284 ( -10.278 7.492 0.681) 12.737 9.566 ( 6.644 -12.579 0.567) 14.237 10.365 ( 0.397 0.484 0.372) 0.728 10.411 ( -0.417 0.959 0.024) 1.045 10.500 ( -1.276 -0.907 -0.830) 1.772 10.684 ( 1.672 2.920 0.993) 3.508 11.067 ( -1.118 -0.773 -2.067) 2.474 11.213 ( -0.881 2.324 -0.163) 2.491 11.277 ( -1.673 0.671 -0.564) 1.889 11.556 ( 7.927 -0.900 5.432) 9.652 11.910 ( -8.071 -2.548 -6.133) 10.453 12.283 ( 1.527 -0.120 2.677) 3.084 12.319 ( 5.599 1.840 -0.454) 5.911 12.505 ( -10.367 0.694 -5.458) 11.736 12.577 ( 2.435 0.141 0.464) 2.483 12.660 ( -2.474 -0.402 1.744) 3.053 12.878 ( -1.964 1.532 -1.261) 2.792 13.071 ( 9.448 -0.305 6.667) 11.568 13.944 ( -0.881 -1.615 -0.605) 1.937 14.111 ( 6.081 1.504 4.134) 7.505 14.142 ( 2.128 0.667 1.700) 2.804 14.201 ( -1.111 -1.187 -1.076) 1.950 14.552 ( -15.500 -2.959 -10.777) 19.109 14.847 ( 5.017 1.781 0.091) 5.325 14.938 ( -1.021 -0.787 0.739) 1.486 15.148 ( 1.204 -1.483 2.395) 3.063 15.181 ( 1.506 -5.343 0.718) 5.598 15.484 ( 1.475 6.017 0.948) 6.267 16.498 ( -0.350 2.829 -0.202) 2.858 16.708 ( 0.006 -0.398 0.150) 0.425 19.869 ( -5.131 0.137 -3.606) 6.273 20.040 ( 6.944 -0.399 4.928) 8.524 20.433 ( -4.501 -1.343 -3.456) 5.831 20.546 ( 2.563 0.692 2.008) 3.328 24.264 ( -2.250 -0.086 -1.541) 2.729 24.352 ( 2.340 2.383 1.517) 3.668 24.866 ( -0.203 0.327 0.051) 0.388 24.984 ( -0.076 1.151 -0.070) 1.156 26.135 ( -0.660 -0.292 -0.404) 0.827 26.173 ( 0.842 -1.197 0.616) 1.588 26.731 ( -0.078 -1.193 -0.389) 1.257 26.784 ( -0.671 0.391 0.220) 0.807 26.893 ( -0.768 -0.757 -0.821) 1.356 26.936 ( 1.673 -0.282 0.889) 1.915 27.051 ( 0.007 -0.765 0.007) 0.765 27.370 ( 0.380 3.666 -0.432) 3.711 27.643 ( -0.642 0.279 0.486) 0.852 28.081 ( 0.023 -1.164 -0.115) 1.169 29.081 ( -0.148 0.491 -0.022) 0.513 29.424 ( -2.541 0.243 -2.716) 3.728 29.563 ( 2.660 -1.143 2.511) 3.832 29.629 ( 1.326 1.782 1.397) 2.624 30.296 ( -3.319 5.076 -3.543) 7.024 30.507 ( 2.077 -8.705 2.344) 9.251 ======================= Grid point 18 (13/117) ======================= q-point: (-0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.421 ( 5.316 7.598 -3.907) 10.062 2.511 ( 1.945 8.306 2.558) 8.906 2.811 ( -1.872 10.505 5.491) 12.001 3.168 ( -0.513 11.330 0.883) 11.376 3.183 ( -6.218 19.811 -0.189) 20.765 3.362 ( -0.977 -1.887 -3.372) 3.986 3.637 ( -2.228 8.160 -3.862) 9.298 3.765 ( -0.783 -1.086 -4.157) 4.367 3.841 ( -4.680 2.314 0.171) 5.224 3.974 ( -7.118 1.098 -3.464) 7.992 4.154 ( -0.720 -6.453 2.743) 7.048 4.228 ( 2.971 2.160 1.714) 4.053 4.335 ( 0.750 -3.402 0.443) 3.512 4.381 ( -0.794 -1.421 4.467) 4.755 4.555 ( 7.372 -3.403 1.193) 8.207 4.629 ( 3.258 -3.261 6.537) 7.999 4.790 ( 3.719 -2.170 0.853) 4.390 4.870 ( -3.000 -11.547 -9.972) 15.549 5.063 ( 2.240 -2.525 5.164) 6.169 5.183 ( 0.148 4.327 -0.192) 4.334 5.225 ( -6.452 3.125 -6.204) 9.481 5.349 ( -2.402 -6.817 2.142) 7.538 5.520 ( -2.224 15.895 -3.336) 16.393 5.619 ( -1.323 -0.619 0.701) 1.620 5.695 ( 0.725 -5.536 4.569) 7.214 5.745 ( 4.191 -2.831 -0.483) 5.081 5.815 ( 10.570 -3.900 4.920) 12.294 6.004 ( -0.409 1.789 -3.157) 3.651 6.121 ( -1.654 -2.333 -0.497) 2.903 6.316 ( -1.578 -3.603 -0.443) 3.958 6.418 ( -6.842 -10.441 -5.335) 13.576 6.558 ( 3.145 1.034 -2.202) 3.976 6.563 ( 0.090 2.134 3.358) 3.980 6.689 ( -0.030 0.904 2.067) 2.256 6.756 ( 1.557 -1.909 -0.889) 2.619 6.841 ( -0.490 1.607 1.084) 2.000 6.867 ( -1.020 -0.499 1.400) 1.803 7.052 ( 4.479 -3.473 4.437) 7.198 7.115 ( 2.487 -2.478 0.520) 3.549 7.225 ( -0.735 -7.944 -5.405) 9.637 7.269 ( -3.898 -2.954 -2.463) 5.476 7.482 ( 4.177 -5.991 1.003) 7.371 7.552 ( -1.218 2.262 2.857) 3.842 7.787 ( -4.661 -1.313 -1.768) 5.155 7.865 ( 0.721 1.889 -5.455) 5.818 7.941 ( -4.821 -0.165 5.849) 7.582 8.133 ( -2.415 1.196 -4.459) 5.210 8.220 ( 4.889 -3.076 3.240) 6.623 8.483 ( 2.297 -1.826 1.879) 3.485 8.589 ( -2.714 -0.340 -1.917) 3.340 8.600 ( -0.673 -0.213 -0.524) 0.879 8.653 ( 2.436 1.293 3.049) 4.111 8.869 ( 2.492 -1.678 0.549) 3.054 8.973 ( 2.085 -0.636 -4.885) 5.349 9.145 ( -6.305 0.169 2.545) 6.801 9.880 ( 9.190 -12.717 3.043) 15.983 10.343 ( -0.015 1.820 0.444) 1.874 10.388 ( -0.154 0.843 -0.596) 1.044 10.505 ( -0.639 -0.283 -0.413) 0.812 10.636 ( -3.586 1.701 -2.256) 4.566 11.045 ( -0.773 2.281 -0.564) 2.474 11.143 ( 0.378 4.273 0.785) 4.361 11.228 ( -3.682 2.935 -1.272) 4.877 11.593 ( 8.073 2.744 5.445) 10.117 11.905 ( -6.937 -2.092 -6.374) 9.650 12.274 ( 0.093 0.737 1.175) 1.390 12.317 ( 8.711 4.018 0.579) 9.610 12.428 ( -8.434 0.932 -5.082) 9.891 12.563 ( -0.138 2.150 -2.797) 3.530 12.674 ( -6.201 -4.169 3.672) 8.326 12.862 ( -2.282 -0.778 -0.849) 2.556 13.152 ( 9.510 -2.580 8.159) 12.794 13.985 ( 3.740 -1.577 -0.337) 4.072 14.122 ( 4.372 0.756 2.100) 4.909 14.152 ( 1.459 -2.087 -0.511) 2.597 14.248 ( -0.264 -2.922 -1.536) 3.312 14.522 ( -14.404 -3.474 -7.065) 16.415 14.838 ( 6.660 2.320 0.274) 7.058 14.940 ( -1.276 0.241 2.838) 3.121 15.193 ( 0.579 -2.919 0.403) 3.003 15.375 ( 4.910 -5.955 4.125) 8.751 15.397 ( -2.882 -2.794 -2.915) 4.961 16.423 ( -3.496 3.326 -1.685) 5.111 16.715 ( 0.229 -0.006 1.178) 1.200 19.847 ( -3.455 -0.671 -2.457) 4.292 20.092 ( 5.788 -0.580 3.981) 7.049 20.412 ( -3.574 0.754 -2.875) 4.648 20.521 ( 2.063 3.457 1.362) 4.250 24.253 ( -3.493 -0.472 -1.794) 3.956 24.342 ( 1.030 -0.340 1.410) 1.779 24.860 ( -0.552 0.183 0.309) 0.659 24.952 ( -1.110 1.555 -0.584) 1.998 26.148 ( 0.049 -1.044 -0.409) 1.122 26.216 ( 1.544 -2.239 0.589) 2.782 26.739 ( 1.365 0.813 1.528) 2.204 26.780 ( -0.911 -0.556 -2.192) 2.438 26.913 ( -1.086 -1.703 -0.325) 2.046 26.961 ( 1.633 -1.626 1.020) 2.520 27.089 ( 3.348 -1.438 -0.529) 3.682 27.282 ( -4.828 3.571 0.421) 6.020 27.630 ( -0.977 0.635 0.575) 1.299 28.125 ( 1.161 -3.037 -0.522) 3.293 29.065 ( -0.699 1.039 -0.166) 1.263 29.387 ( -1.905 1.782 -1.392) 2.957 29.542 ( 3.396 6.334 4.476) 8.467 29.631 ( -0.960 -2.527 -0.929) 2.859 30.097 ( -2.176 11.752 -4.163) 12.655 30.697 ( 4.819 -7.209 2.481) 9.020 ======================= Grid point 19 (14/117) ======================= q-point: (-0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.065 ( 0.325 28.325 -1.854) 28.388 2.455 ( 4.030 -1.012 1.876) 4.559 2.468 ( -2.101 31.326 -0.533) 31.401 2.753 ( -5.680 7.846 -0.069) 9.686 3.109 ( 2.745 -2.332 4.022) 5.399 3.393 ( -1.783 0.342 -1.582) 2.408 3.492 ( -1.602 5.068 -1.005) 5.410 3.626 ( -5.212 24.974 -1.663) 25.566 3.818 ( -4.467 2.453 3.263) 6.052 3.825 ( -1.416 -1.236 -6.271) 6.547 4.141 ( 2.736 4.963 0.258) 5.673 4.286 ( 3.788 9.277 -3.572) 10.638 4.332 ( 3.813 0.068 0.662) 3.871 4.395 ( -4.190 -1.863 1.521) 4.831 4.561 ( 1.645 0.819 5.132) 5.451 4.673 ( 2.959 -1.680 1.757) 3.829 4.861 ( -0.606 -15.129 2.045) 15.279 5.034 ( 5.470 0.899 1.630) 5.778 5.070 ( -8.156 0.765 -7.443) 11.069 5.152 ( -3.082 -9.309 -0.555) 9.822 5.233 ( -0.165 -3.441 -1.424) 3.727 5.414 ( -1.208 4.414 -1.247) 4.743 5.528 ( 4.603 -9.545 4.643) 11.570 5.632 ( -0.037 -9.704 -0.752) 9.733 5.724 ( 0.735 3.146 1.503) 3.563 5.802 ( 3.609 -0.357 -0.240) 3.635 5.934 ( 3.234 -1.445 4.050) 5.381 6.134 ( 2.382 -4.672 2.876) 5.981 6.173 ( -4.797 -8.937 -6.276) 11.928 6.371 ( 0.269 -0.292 6.092) 6.105 6.431 ( -1.800 4.894 -6.817) 8.582 6.554 ( -0.877 -4.988 1.786) 5.370 6.583 ( -0.498 6.888 -0.591) 6.932 6.673 ( -2.990 -6.132 -0.140) 6.824 6.739 ( -1.036 3.396 -0.693) 3.618 6.806 ( 0.947 -4.183 -1.627) 4.587 6.949 ( 0.287 -4.950 0.901) 5.039 7.145 ( 1.308 -2.767 1.333) 3.339 7.187 ( 1.385 -1.752 -0.940) 2.423 7.315 ( 0.398 -5.032 -0.752) 5.103 7.425 ( 1.690 -12.478 0.348) 12.597 7.538 ( 7.456 1.681 7.600) 10.778 7.677 ( -6.748 -5.849 -3.980) 9.776 7.718 ( -4.991 -3.529 -5.995) 8.561 7.855 ( 0.624 -0.057 -3.213) 3.273 7.922 ( -1.298 -2.038 5.052) 5.600 8.151 ( -3.630 -3.559 -2.470) 5.652 8.330 ( 5.525 -3.936 2.672) 7.291 8.508 ( -1.399 -0.503 -0.743) 1.662 8.582 ( 0.950 1.414 -0.351) 1.739 8.602 ( -1.700 -1.435 -0.735) 2.343 8.655 ( 4.059 0.003 3.904) 5.632 8.921 ( -1.364 -1.363 -2.215) 2.937 8.972 ( 0.201 -0.404 -1.200) 1.283 9.245 ( -0.090 -11.953 1.440) 12.040 10.118 ( 7.002 -5.413 4.917) 10.125 10.297 ( -0.157 2.801 0.379) 2.831 10.393 ( 7.830 1.179 3.227) 8.550 10.499 ( -1.926 0.126 -3.598) 4.083 10.564 ( -9.911 1.287 -4.166) 10.827 10.974 ( 0.218 4.708 0.587) 4.749 11.061 ( 3.397 4.976 3.841) 7.145 11.128 ( -5.470 3.549 -4.298) 7.809 11.545 ( 3.902 5.939 2.549) 7.550 11.906 ( -3.162 -1.179 -3.720) 5.023 12.227 ( 4.210 8.223 2.142) 9.483 12.287 ( 2.901 -0.135 -0.272) 2.917 12.362 ( -7.326 0.684 -2.811) 7.876 12.523 ( -0.968 0.955 -2.267) 2.644 12.744 ( -4.423 -6.000 0.975) 7.518 12.840 ( -2.184 2.026 -0.477) 3.017 13.331 ( 6.832 -10.474 5.350) 13.601 14.045 ( 6.242 -1.424 1.604) 6.600 14.172 ( 2.694 -3.317 0.942) 4.376 14.216 ( 4.251 -1.809 -2.187) 5.112 14.291 ( -5.298 -3.615 -1.385) 6.561 14.509 ( -9.194 -3.243 -2.591) 10.087 14.848 ( 7.056 1.097 -1.261) 7.251 14.914 ( -3.404 0.976 3.033) 4.662 15.259 ( 4.906 -1.362 1.416) 5.285 15.350 ( -9.564 -3.593 -5.102) 11.420 15.651 ( 5.799 -11.489 4.020) 13.483 16.334 ( -4.074 3.050 -1.956) 5.452 16.705 ( 0.144 1.300 0.942) 1.612 19.851 ( -1.670 -1.366 -1.139) 2.439 20.133 ( 3.392 -0.607 2.232) 4.105 20.360 ( -1.804 2.866 -1.462) 3.689 20.441 ( 1.106 5.380 0.459) 5.512 24.239 ( -4.108 -0.678 -2.050) 4.641 24.377 ( 0.652 -2.455 1.278) 2.843 24.847 ( -0.704 0.895 -0.023) 1.138 24.920 ( -0.887 0.927 -0.246) 1.306 26.170 ( 0.203 -1.070 -0.228) 1.112 26.272 ( 1.185 -2.453 0.307) 2.742 26.728 ( 1.236 0.995 0.710) 1.738 26.782 ( -0.196 0.130 -1.019) 1.046 26.948 ( -1.233 -2.800 0.115) 3.062 27.021 ( 0.887 -3.465 0.519) 3.614 27.098 ( 4.283 4.533 -0.739) 6.280 27.216 ( -5.627 -1.763 0.580) 5.925 27.605 ( -1.005 1.342 0.547) 1.763 28.216 ( 1.372 -5.500 -0.554) 5.696 29.024 ( -0.724 2.862 -0.098) 2.954 29.343 ( -0.218 1.768 -0.962) 2.024 29.392 ( 1.206 10.170 2.549) 10.554 29.644 ( -1.148 4.424 0.579) 4.607 29.871 ( -0.256 6.519 -3.282) 7.303 30.843 ( 4.371 -4.780 1.769) 6.714 ======================= Grid point 20 (15/117) ======================= q-point: (-0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.441 ( 0.000 34.621 0.000) 34.621 1.714 ( 0.000 41.696 0.000) 41.696 2.542 ( 0.000 3.470 0.000) 3.470 2.630 ( 0.000 49.275 0.000) 49.275 2.715 ( -0.000 -2.672 -0.000) 2.672 3.248 ( -0.000 -8.994 -0.000) 8.994 3.418 ( 0.000 1.806 0.000) 1.806 3.497 ( -0.000 -2.742 -0.000) 2.742 3.781 ( 0.000 1.642 0.000) 1.642 3.849 ( -0.000 -0.962 -0.000) 0.962 4.055 ( 0.000 4.237 0.000) 4.237 4.197 ( -0.000 -0.922 -0.000) 0.922 4.267 ( 0.000 3.152 0.000) 3.152 4.512 ( -0.000 -5.664 -0.000) 5.664 4.628 ( -0.000 -4.323 -0.000) 4.323 4.686 ( 0.000 2.634 0.000) 2.634 4.998 ( -0.000 -1.596 -0.000) 1.596 5.009 ( 0.000 3.406 0.000) 3.406 5.130 ( -0.000 -0.159 -0.000) 0.159 5.209 ( 0.000 1.488 0.000) 1.488 5.333 ( -0.000 -9.221 -0.000) 9.221 5.424 ( -0.000 -5.825 -0.000) 5.825 5.591 ( -0.000 -0.699 -0.000) 0.699 5.785 ( -0.000 -2.710 -0.000) 2.710 5.812 ( -0.000 -2.867 -0.000) 2.867 5.816 ( -0.000 -0.213 -0.000) 0.213 5.899 ( 0.000 0.711 0.000) 0.711 6.148 ( -0.000 -1.594 -0.000) 1.594 6.314 ( 0.000 3.863 0.000) 3.863 6.319 ( -0.000 -0.982 -0.000) 0.982 6.384 ( 0.000 1.722 0.000) 1.722 6.433 ( 0.000 1.214 0.000) 1.214 6.639 ( 0.000 1.553 0.000) 1.553 6.727 ( -0.000 -4.460 -0.000) 4.460 6.767 ( -0.000 -8.842 -0.000) 8.842 7.005 ( -0.000 -0.905 -0.000) 0.905 7.040 ( -0.000 -15.252 -0.000) 15.252 7.157 ( 0.000 2.316 0.000) 2.316 7.210 ( -0.000 -3.071 -0.000) 3.071 7.448 ( -0.000 -5.846 -0.000) 5.846 7.548 ( 0.000 0.138 0.000) 0.138 7.627 ( -0.000 -1.780 -0.000) 1.780 7.717 ( -0.000 -14.270 -0.000) 14.270 7.852 ( -0.000 -1.093 -0.000) 1.093 7.918 ( -0.000 -7.950 -0.000) 7.950 7.958 ( -0.000 -0.643 -0.000) 0.643 8.190 ( -0.000 -1.178 -0.000) 1.178 8.421 ( -0.000 -3.238 -0.000) 3.238 8.504 ( 0.000 0.428 0.000) 0.428 8.558 ( 0.000 0.527 0.000) 0.527 8.651 ( -0.000 -3.576 -0.000) 3.576 8.682 ( -0.000 -0.753 -0.000) 0.753 8.816 ( 0.000 6.810 0.000) 6.810 9.131 ( -0.000 -12.883 -0.000) 12.883 9.531 ( -0.000 -15.107 -0.000) 15.107 10.193 ( -0.000 -0.140 -0.000) 0.140 10.243 ( 0.000 1.410 0.000) 1.410 10.352 ( 0.000 7.196 0.000) 7.196 10.475 ( 0.000 3.597 0.000) 3.597 10.487 ( 0.000 1.368 0.000) 1.368 10.866 ( 0.000 6.110 0.000) 6.110 11.036 ( 0.000 3.575 0.000) 3.575 11.037 ( -0.000 -1.298 -0.000) 1.298 11.429 ( 0.000 6.575 0.000) 6.575 11.896 ( 0.000 1.259 0.000) 1.259 12.058 ( 0.000 9.507 0.000) 9.507 12.301 ( 0.000 1.549 0.000) 1.549 12.341 ( -0.000 -2.645 -0.000) 2.645 12.514 ( -0.000 -0.212 -0.000) 0.212 12.761 ( 0.000 3.964 0.000) 3.964 12.857 ( -0.000 -6.437 -0.000) 6.437 13.603 ( -0.000 -13.392 -0.000) 13.392 14.112 ( -0.000 -2.689 -0.000) 2.689 14.189 ( 0.000 2.076 0.000) 2.076 14.306 ( -0.000 -6.048 -0.000) 6.048 14.359 ( -0.000 -4.366 -0.000) 4.366 14.540 ( -0.000 -3.107 -0.000) 3.107 14.863 ( 0.000 1.499 0.000) 1.499 14.874 ( 0.000 0.404 0.000) 0.404 15.288 ( -0.000 -0.706 -0.000) 0.706 15.431 ( -0.000 -6.990 -0.000) 6.990 15.874 ( -0.000 -8.720 -0.000) 8.720 16.273 ( 0.000 1.141 0.000) 1.141 16.660 ( 0.000 3.548 0.000) 3.548 19.875 ( -0.000 -1.590 -0.000) 1.590 20.156 ( -0.000 -0.567 -0.000) 0.567 20.263 ( 0.000 6.502 0.000) 6.502 20.356 ( 0.000 3.175 0.000) 3.175 24.234 ( -0.000 -0.687 -0.000) 0.687 24.439 ( -0.000 -3.422 -0.000) 3.422 24.820 ( 0.000 1.380 0.000) 1.380 24.907 ( 0.000 0.256 0.000) 0.256 26.185 ( -0.000 -0.284 -0.000) 0.284 26.319 ( -0.000 -1.800 -0.000) 1.800 26.717 ( 0.000 0.623 0.000) 0.623 26.774 ( 0.000 0.444 0.000) 0.444 27.003 ( 0.000 4.861 0.000) 4.861 27.006 ( -0.000 -3.256 -0.000) 3.256 27.099 ( -0.000 -4.056 -0.000) 4.056 27.246 ( -0.000 -1.778 -0.000) 1.778 27.568 ( 0.000 2.136 0.000) 2.136 28.351 ( -0.000 -7.719 -0.000) 7.719 28.948 ( 0.000 4.344 0.000) 4.344 29.170 ( 0.000 12.333 0.000) 12.333 29.317 ( 0.000 2.708 0.000) 2.708 29.416 ( 0.000 12.558 0.000) 12.558 29.889 ( -0.000 -4.607 -0.000) 4.607 30.937 ( -0.000 -3.185 -0.000) 3.185 ======================= Grid point 23 (16/117) ======================= q-point: ( 0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.793 ( 30.097 0.000 -22.725) 37.713 1.023 ( 40.799 0.000 9.025) 41.785 1.657 ( 60.551 0.000 38.354) 71.676 2.530 ( -19.808 -0.000 -15.303) 25.031 2.997 ( -19.837 -0.000 -1.238) 19.876 3.065 ( 13.430 0.000 5.079) 14.359 3.321 ( -3.024 -0.000 -28.543) 28.703 3.556 ( -13.171 -0.000 2.403) 13.388 3.649 ( 2.221 0.000 14.005) 14.180 3.903 ( -6.092 -0.000 -5.227) 8.027 4.022 ( -2.654 -0.000 -3.159) 4.126 4.249 ( -6.604 -0.000 17.715) 18.905 4.377 ( 2.986 0.000 6.931) 7.547 4.404 ( -10.421 -0.000 2.443) 10.703 4.619 ( 1.262 0.000 -9.893) 9.973 4.674 ( 1.414 0.000 7.260) 7.396 4.741 ( -0.433 -0.000 -2.036) 2.082 4.896 ( 5.967 0.000 4.301) 7.356 5.190 ( -4.446 -0.000 -15.503) 16.128 5.327 ( -10.869 -0.000 -4.168) 11.641 5.340 ( 7.728 0.000 -0.426) 7.740 5.461 ( 8.998 0.000 -7.955) 12.010 5.736 ( 4.264 0.000 -3.273) 5.375 5.795 ( 0.886 0.000 4.618) 4.702 5.867 ( 5.584 0.000 -9.591) 11.099 5.978 ( 1.286 0.000 3.166) 3.418 6.008 ( -4.393 -0.000 -3.786) 5.800 6.119 ( 7.851 0.000 -13.964) 16.020 6.357 ( 8.952 0.000 15.738) 18.106 6.397 ( -0.939 -0.000 -20.551) 20.573 6.448 ( 5.617 0.000 14.600) 15.643 6.555 ( 2.030 0.000 11.800) 11.973 6.730 ( 7.177 0.000 3.895) 8.166 6.874 ( -2.725 -0.000 1.365) 3.048 7.023 ( -1.382 -0.000 -4.113) 4.339 7.051 ( 7.181 0.000 6.839) 9.917 7.076 ( -8.527 -0.000 0.826) 8.566 7.344 ( -18.182 -0.000 -5.574) 19.018 7.483 ( -4.312 -0.000 -30.598) 30.900 7.492 ( -7.277 -0.000 -0.449) 7.291 7.602 ( 4.108 0.000 -1.371) 4.331 7.612 ( -2.728 -0.000 -1.865) 3.304 7.886 ( -1.905 -0.000 -1.403) 2.366 7.918 ( 8.627 0.000 10.666) 13.719 8.013 ( -5.247 -0.000 2.143) 5.668 8.149 ( 6.945 0.000 4.113) 8.072 8.267 ( 7.607 0.000 10.597) 13.045 8.269 ( -14.177 -0.000 -6.911) 15.772 8.412 ( 1.154 0.000 -1.649) 2.013 8.508 ( -6.603 -0.000 -0.818) 6.653 8.582 ( 5.504 0.000 3.434) 6.487 8.708 ( 2.380 0.000 -1.865) 3.023 8.778 ( 1.196 0.000 -2.625) 2.885 8.875 ( 0.494 0.000 -2.052) 2.111 9.904 ( -9.492 -0.000 -4.137) 10.354 10.010 ( 2.357 0.000 11.818) 12.051 10.071 ( 0.029 0.000 -2.498) 2.498 10.098 ( 4.445 0.000 -1.040) 4.566 10.417 ( 2.216 0.000 -4.915) 5.391 10.559 ( -3.284 -0.000 -5.002) 5.984 10.606 ( 10.742 0.000 2.167) 10.958 10.862 ( 4.393 0.000 -0.945) 4.494 11.040 ( 5.946 0.000 5.885) 8.366 11.212 ( -3.575 -0.000 -4.371) 5.647 11.697 ( -8.696 -0.000 -6.270) 10.721 11.917 ( 3.197 0.000 6.726) 7.447 12.382 ( -2.270 -0.000 1.930) 2.980 12.406 ( -0.508 -0.000 -0.240) 0.562 12.612 ( 4.283 0.000 1.549) 4.554 12.654 ( 7.114 0.000 0.458) 7.128 13.222 ( -37.920 -0.000 -20.058) 42.899 14.058 ( -4.835 -0.000 3.508) 5.974 14.128 ( -3.978 -0.000 -1.356) 4.203 14.335 ( -5.224 -0.000 0.521) 5.250 14.415 ( 2.852 0.000 13.451) 13.750 14.558 ( -4.464 -0.000 32.913) 33.214 14.877 ( 0.276 0.000 -0.309) 0.414 14.945 ( 14.995 0.000 4.384) 15.623 14.972 ( 4.026 0.000 6.973) 8.052 15.133 ( 0.274 0.000 2.862) 2.876 15.829 ( -13.328 -0.000 -12.937) 18.574 15.894 ( 17.295 0.000 6.732) 18.559 16.462 ( -0.263 -0.000 -1.562) 1.584 16.547 ( 1.679 0.000 11.243) 11.368 19.972 ( -0.802 -0.000 -2.124) 2.270 19.978 ( 2.760 0.000 1.972) 3.393 20.102 ( 1.452 0.000 1.659) 2.205 20.164 ( -0.268 -0.000 0.608) 0.664 24.449 ( -4.254 -0.000 -7.233) 8.391 24.860 ( 5.475 0.000 -0.319) 5.484 24.942 ( 3.406 0.000 -1.899) 3.900 25.503 ( -7.734 -0.000 45.909) 46.556 26.285 ( -4.689 -0.000 -0.255) 4.696 26.425 ( -1.815 -0.000 37.830) 37.874 26.614 ( -4.353 -0.000 0.158) 4.356 26.783 ( 1.175 0.000 4.504) 4.655 27.131 ( -4.261 -0.000 -10.736) 11.551 27.181 ( 9.713 0.000 1.306) 9.800 27.294 ( 0.429 0.000 -0.683) 0.807 27.345 ( 2.331 0.000 0.978) 2.528 27.754 ( 5.347 0.000 -33.710) 34.132 28.035 ( -6.864 -0.000 -1.939) 7.133 28.751 ( -0.472 -0.000 0.376) 0.604 28.844 ( 0.534 0.000 1.604) 1.690 29.005 ( -2.506 -0.000 0.361) 2.532 29.193 ( -3.903 -0.000 -2.246) 4.503 29.893 ( 2.019 0.000 -34.773) 34.832 30.111 ( 5.390 0.000 6.403) 8.369 ======================= Grid point 24 (17/117) ======================= q-point: ( 0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.039 ( 17.966 -15.223 -2.280) 23.658 1.630 ( 33.969 -25.952 4.187) 42.952 2.318 ( 26.199 -23.912 22.022) 41.751 2.421 ( -14.513 -3.134 -9.892) 17.841 2.865 ( 2.928 -2.246 -0.728) 3.762 3.181 ( 8.427 -1.451 0.212) 8.554 3.325 ( 2.675 -1.934 -15.482) 15.830 3.529 ( -7.228 -4.173 -0.044) 8.346 3.658 ( -5.505 -2.779 0.850) 6.225 3.926 ( -3.180 -5.613 5.005) 8.165 4.024 ( -3.440 -0.352 -2.875) 4.497 4.201 ( -13.485 0.310 3.442) 13.921 4.206 ( -3.308 2.744 9.221) 10.174 4.437 ( -7.036 1.482 6.154) 9.464 4.489 ( 6.554 9.771 -1.773) 11.898 4.759 ( -3.837 -3.632 3.064) 6.107 4.796 ( 7.307 4.190 2.744) 8.859 4.924 ( 3.701 -5.993 -4.245) 8.223 5.120 ( -3.621 3.609 -11.145) 12.261 5.318 ( -1.580 -4.673 -3.566) 6.087 5.386 ( 0.629 -2.715 -2.518) 3.756 5.570 ( 3.047 -2.895 -3.837) 5.691 5.691 ( -1.262 3.673 -8.383) 9.239 5.741 ( 0.028 10.440 -10.597) 14.876 5.829 ( 1.623 1.557 2.458) 3.332 5.881 ( 5.656 4.313 3.289) 7.836 6.051 ( 0.704 2.180 5.902) 6.331 6.206 ( 6.300 -4.652 -11.830) 14.187 6.303 ( 0.741 9.885 -3.418) 10.486 6.417 ( -0.168 0.885 -1.961) 2.158 6.461 ( 9.037 -2.769 16.252) 18.801 6.566 ( 9.750 3.276 4.737) 11.324 6.730 ( -1.886 0.240 4.786) 5.150 6.850 ( 0.527 2.399 -0.382) 2.486 6.939 ( -12.259 6.197 -2.698) 13.998 6.992 ( -1.403 2.501 -5.991) 6.642 7.117 ( 1.747 3.833 5.024) 6.556 7.268 ( -3.842 9.483 -8.435) 13.260 7.294 ( -3.777 -3.661 3.149) 6.130 7.431 ( 4.281 5.315 -1.986) 7.108 7.486 ( -7.110 5.956 -4.064) 10.126 7.605 ( 1.215 2.027 0.441) 2.405 7.843 ( -1.272 3.403 0.862) 3.734 7.922 ( -0.260 1.832 0.134) 1.855 8.029 ( 1.908 -2.788 9.393) 9.982 8.113 ( -3.162 4.594 0.694) 5.620 8.210 ( -6.395 -0.642 -3.137) 7.152 8.396 ( -0.971 -3.716 -2.620) 4.649 8.417 ( 5.928 1.189 9.570) 11.321 8.481 ( 2.009 -0.626 0.340) 2.132 8.676 ( 0.488 1.542 1.897) 2.493 8.734 ( 1.866 -2.667 3.519) 4.794 8.818 ( 1.820 -1.962 -1.986) 3.332 9.026 ( -10.458 -16.147 -7.512) 20.653 9.581 ( -1.473 20.479 -1.667) 20.600 9.887 ( -4.305 6.973 -0.922) 8.247 10.160 ( 0.393 -5.278 0.157) 5.295 10.275 ( -3.490 -7.430 -3.986) 9.126 10.457 ( 3.507 1.568 -5.533) 6.735 10.595 ( 3.716 -7.577 3.142) 9.005 10.678 ( 6.212 -3.776 1.790) 7.487 10.956 ( 2.786 -3.927 -1.855) 5.160 11.114 ( 5.636 -3.391 6.105) 8.974 11.223 ( -3.668 -3.378 -3.616) 6.160 11.686 ( -9.867 -4.504 -5.857) 12.327 11.980 ( 3.494 -3.955 5.141) 7.367 12.335 ( -0.255 2.127 1.818) 2.810 12.434 ( -1.240 -1.735 0.596) 2.214 12.629 ( 5.523 0.824 0.852) 5.648 12.725 ( 5.242 -2.664 -0.359) 5.891 12.971 ( -34.294 1.469 -19.016) 39.241 13.956 ( 3.143 15.747 2.907) 16.318 14.025 ( -3.646 3.611 7.156) 8.806 14.208 ( -1.718 6.199 8.738) 10.850 14.414 ( 5.447 5.141 17.577) 19.106 14.463 ( 2.402 5.485 7.170) 9.341 14.746 ( 5.282 9.442 -8.138) 13.538 14.876 ( 0.311 0.121 0.758) 0.829 15.027 ( 10.222 2.362 3.356) 11.015 15.184 ( -2.398 -1.098 0.765) 2.746 15.657 ( -14.750 7.486 -14.806) 22.200 15.983 ( 14.747 3.715 11.238) 18.910 16.469 ( 3.292 -1.369 0.459) 3.595 16.585 ( 0.222 -2.667 2.191) 3.459 19.977 ( 1.549 -0.723 -0.590) 1.808 20.005 ( -2.486 -0.112 -1.428) 2.870 20.130 ( 0.220 -2.701 0.434) 2.744 20.243 ( -0.093 -6.395 2.008) 6.704 24.404 ( -3.669 1.612 -6.744) 7.845 24.888 ( 5.738 0.962 -0.208) 5.822 24.960 ( 4.026 0.815 -2.626) 4.875 25.169 ( 9.290 23.844 28.832) 38.550 26.241 ( -3.658 1.750 0.679) 4.111 26.293 ( 2.559 7.038 9.490) 12.089 26.604 ( -3.471 -1.334 0.016) 3.719 26.791 ( 1.334 0.088 3.397) 3.651 26.951 ( 0.608 6.206 -12.448) 13.923 27.165 ( 0.307 6.034 -2.008) 6.367 27.274 ( 5.170 3.693 0.443) 6.369 27.328 ( 6.634 -1.513 0.954) 6.871 27.664 ( 7.129 0.597 -7.526) 10.383 28.207 ( -14.754 -2.930 0.731) 15.060 28.848 ( -1.771 -9.524 -2.249) 9.945 28.903 ( 1.738 -5.266 0.874) 5.614 29.105 ( -2.505 -10.143 1.193) 10.516 29.319 ( -2.624 -8.067 4.281) 9.502 30.053 ( -0.597 0.621 -2.239) 2.398 30.185 ( -11.325 -15.171 -12.659) 22.775 ======================= Grid point 25 (18/117) ======================= q-point: ( 0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.504 ( 1.510 -23.835 4.838) 24.368 2.318 ( 25.413 -23.106 7.432) 35.141 2.378 ( -5.406 -2.199 -5.896) 8.296 2.583 ( -7.176 -10.155 -4.277) 13.149 3.265 ( 9.460 -2.290 5.065) 10.972 3.332 ( 3.424 -2.979 -8.697) 9.810 3.457 ( 21.083 -26.213 9.497) 34.954 3.643 ( -6.055 -9.366 -6.099) 12.712 3.715 ( 2.776 -4.657 0.174) 5.424 3.906 ( -3.035 4.420 -3.354) 6.324 4.101 ( 1.003 -6.626 1.846) 6.951 4.133 ( 1.827 5.126 12.709) 13.825 4.229 ( -2.169 -5.815 -4.262) 7.528 4.359 ( -2.711 -1.607 4.940) 5.859 4.429 ( -10.216 -5.033 8.757) 14.366 4.575 ( -2.370 8.326 -3.817) 9.461 4.878 ( -8.264 6.939 -11.399) 15.696 4.925 ( -5.199 -4.459 0.899) 6.908 5.126 ( 11.951 0.680 -4.907) 12.937 5.374 ( 2.982 6.628 -4.326) 8.458 5.419 ( -0.116 0.294 -4.918) 4.928 5.478 ( -7.180 6.621 1.605) 9.898 5.576 ( 4.829 2.200 5.508) 7.648 5.703 ( 6.517 0.866 -1.024) 6.653 5.758 ( 4.594 3.530 3.923) 6.997 5.883 ( -1.324 3.518 -4.063) 5.535 5.927 ( -1.213 2.500 2.339) 3.632 6.146 ( 0.707 6.289 4.067) 7.522 6.229 ( -4.618 4.483 -10.594) 12.396 6.342 ( -0.839 7.724 -6.676) 10.244 6.547 ( -2.978 2.824 0.089) 4.105 6.575 ( 4.649 -4.188 1.368) 6.405 6.715 ( -5.088 4.516 1.772) 7.030 6.741 ( 2.012 0.096 -0.245) 2.029 6.800 ( -2.136 2.638 -3.049) 4.563 6.883 ( -2.740 8.303 1.058) 8.807 7.030 ( -1.189 4.433 2.491) 5.222 7.096 ( 1.331 5.215 0.398) 5.397 7.277 ( 1.869 6.152 -0.453) 6.446 7.295 ( -3.383 3.482 -5.686) 7.476 7.456 ( 4.419 2.424 0.589) 5.075 7.603 ( 3.831 -0.975 12.802) 13.399 7.745 ( -4.033 3.637 3.485) 6.453 7.884 ( -0.976 1.857 -6.860) 7.173 8.016 ( -4.030 2.122 -1.911) 4.939 8.084 ( 2.487 0.010 6.146) 6.630 8.171 ( -0.325 3.470 1.100) 3.655 8.331 ( -1.695 0.691 -0.303) 1.855 8.425 ( -2.648 4.900 -0.085) 5.570 8.587 ( 1.517 0.015 0.052) 1.518 8.640 ( 11.056 -3.305 5.421) 12.749 8.722 ( 0.806 1.325 0.101) 1.554 8.970 ( 2.737 -4.995 6.027) 8.293 9.098 ( 0.586 13.465 1.774) 13.594 9.228 ( -11.183 1.166 -9.419) 14.668 9.710 ( -10.189 5.667 -5.716) 12.984 10.259 ( 0.757 -4.227 1.091) 4.431 10.357 ( -4.945 -4.612 -6.366) 9.287 10.444 ( 5.528 1.255 -0.759) 5.720 10.800 ( 4.365 -6.916 6.821) 10.650 10.814 ( 3.734 -5.864 -1.689) 7.154 11.018 ( 2.138 -2.985 -2.608) 4.504 11.223 ( 1.459 -4.258 3.223) 5.536 11.290 ( 0.393 -4.750 0.359) 4.779 11.724 ( -10.618 -5.587 -4.848) 12.940 12.099 ( 3.060 -5.297 3.088) 6.852 12.316 ( 2.025 0.128 2.821) 3.475 12.455 ( -0.943 -1.163 1.521) 2.134 12.641 ( 1.920 0.845 -2.176) 3.022 12.758 ( -22.421 1.087 -12.813) 25.847 12.817 ( 3.365 -3.924 -1.265) 5.322 13.600 ( 11.774 21.850 6.540) 25.667 13.964 ( -2.752 1.562 7.242) 7.904 14.121 ( -1.429 2.676 3.040) 4.295 14.311 ( 6.153 7.591 12.614) 15.956 14.398 ( -0.083 3.769 -0.725) 3.839 14.631 ( -0.461 4.805 -6.864) 8.391 14.882 ( 0.862 -0.402 0.314) 1.002 15.011 ( 5.477 4.368 -0.498) 7.023 15.170 ( -3.714 0.164 -0.487) 3.749 15.390 ( -13.825 8.954 -12.572) 20.722 15.948 ( 13.190 8.293 11.910) 19.611 16.534 ( 3.305 -2.149 -0.076) 3.943 16.641 ( 0.451 -2.527 -1.003) 2.756 19.959 ( -5.264 1.100 -3.561) 6.450 20.009 ( 5.248 0.405 3.103) 6.110 20.207 ( -2.634 -5.499 -2.005) 6.418 20.367 ( 0.645 -5.776 2.071) 6.170 24.346 ( -2.646 1.983 -5.051) 6.037 24.795 ( 12.154 15.338 8.845) 21.476 24.922 ( 3.280 1.892 -0.843) 3.879 25.003 ( 3.956 0.992 3.609) 5.446 26.190 ( -1.991 1.421 0.258) 2.459 26.213 ( -1.047 2.868 1.891) 3.592 26.619 ( -2.716 -2.083 -0.318) 3.438 26.799 ( 1.196 0.052 2.869) 3.109 26.885 ( -1.844 1.055 -5.278) 5.689 27.037 ( -2.454 5.440 -1.339) 6.117 27.225 ( 4.278 4.581 0.923) 6.335 27.409 ( 8.242 -1.591 -0.708) 8.424 27.690 ( 3.462 0.822 -2.493) 4.345 28.129 ( -9.055 1.376 1.576) 9.293 29.016 ( 1.831 -5.866 -0.447) 6.161 29.057 ( -1.523 -10.298 -2.503) 10.707 29.302 ( -1.530 -9.312 1.412) 9.542 29.511 ( 3.747 -13.347 3.484) 14.294 29.946 ( 0.649 7.987 4.566) 9.223 30.351 ( -16.973 -10.219 -9.660) 22.042 ======================= Grid point 26 (19/117) ======================= q-point: ( 0.50 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.956 ( -5.599 -23.770 3.002) 24.604 2.401 ( 2.599 -1.277 -1.107) 3.100 2.719 ( 6.089 -13.499 -3.845) 15.300 2.986 ( 16.026 -20.203 3.299) 25.997 3.328 ( 5.582 -2.679 0.110) 6.193 3.495 ( 2.117 -9.724 4.383) 10.874 3.657 ( 0.889 7.412 -2.825) 7.982 3.705 ( -2.396 -3.175 0.586) 4.021 3.852 ( -3.186 -5.396 2.141) 6.622 3.988 ( -0.143 3.557 2.003) 4.085 4.061 ( 3.286 -14.289 -5.913) 15.810 4.239 ( -2.160 5.078 1.807) 5.807 4.283 ( -0.142 -3.120 -0.188) 3.129 4.401 ( 2.289 3.173 1.515) 4.195 4.439 ( 1.079 -5.399 7.052) 8.947 4.607 ( -14.873 -5.270 -2.672) 16.003 4.739 ( -10.235 -3.639 -12.517) 16.573 4.908 ( 7.157 4.144 4.366) 9.351 5.114 ( 1.025 6.134 -10.725) 12.397 5.158 ( 1.446 11.718 1.016) 11.850 5.274 ( 0.857 7.157 8.861) 11.423 5.416 ( 3.254 3.178 0.483) 4.574 5.502 ( -0.457 5.704 -2.352) 6.186 5.719 ( 10.935 -0.161 9.915) 14.761 5.739 ( -0.159 1.436 3.813) 4.078 5.934 ( 3.664 1.793 -4.371) 5.978 5.961 ( 6.930 -1.854 -0.868) 7.226 5.993 ( -4.596 5.843 1.827) 7.655 6.077 ( -7.355 -1.206 -4.704) 8.814 6.205 ( -0.465 3.622 -2.699) 4.540 6.444 ( -8.832 0.231 -7.378) 11.511 6.588 ( -8.493 7.057 -2.575) 11.338 6.610 ( -3.918 1.766 1.894) 4.696 6.667 ( -4.179 4.884 -3.096) 7.135 6.762 ( 7.557 1.460 0.082) 7.697 6.860 ( 2.206 -4.265 -1.176) 4.943 6.892 ( -3.589 4.645 1.385) 6.031 7.086 ( 7.070 0.756 2.592) 7.568 7.197 ( 2.157 4.372 -0.292) 4.884 7.259 ( -0.294 1.688 -0.278) 1.735 7.388 ( -0.960 4.171 0.432) 4.302 7.513 ( 0.431 8.427 6.789) 10.830 7.762 ( 4.037 1.178 9.132) 10.054 7.830 ( -3.539 1.502 -4.630) 6.018 7.977 ( -2.350 -0.077 -1.568) 2.826 8.047 ( -0.879 3.897 -5.240) 6.589 8.089 ( 6.900 5.498 5.923) 10.626 8.272 ( -3.302 4.187 1.197) 5.465 8.415 ( 0.022 -5.891 0.438) 5.907 8.567 ( 0.931 1.395 -0.005) 1.678 8.652 ( -6.263 7.593 -6.666) 11.888 8.697 ( 4.740 7.274 1.687) 8.845 8.863 ( 5.960 -2.188 0.188) 6.352 9.030 ( 3.252 3.295 5.817) 7.434 9.256 ( -0.596 -4.784 0.119) 4.823 9.545 ( -14.901 3.755 -5.965) 16.483 10.331 ( 1.185 -2.439 1.227) 2.976 10.406 ( -3.360 -3.480 -4.420) 6.553 10.458 ( 3.209 0.802 0.681) 3.377 10.845 ( 3.470 3.176 4.596) 6.576 10.934 ( 0.161 -5.292 -2.398) 5.812 11.150 ( 4.121 -6.307 -0.541) 7.553 11.272 ( -3.190 -1.504 -1.198) 3.725 11.413 ( 6.239 -5.227 5.013) 9.559 11.761 ( -10.372 -4.988 -5.425) 12.724 12.202 ( 1.697 -3.637 1.833) 4.412 12.351 ( 3.858 -0.849 3.313) 5.156 12.473 ( -2.479 -1.624 2.418) 3.825 12.587 ( -10.105 0.208 -10.272) 14.410 12.682 ( -0.557 0.642 -0.558) 1.017 12.908 ( 2.185 -3.194 -0.859) 3.964 13.296 ( 9.488 15.795 3.707) 18.796 13.933 ( 0.198 1.140 7.827) 7.912 14.092 ( -0.776 -0.664 0.249) 1.051 14.228 ( 6.519 5.157 9.788) 12.841 14.308 ( -1.402 4.613 -0.063) 4.822 14.535 ( -5.802 2.921 -8.851) 10.980 14.891 ( 0.478 1.619 -4.013) 4.353 14.926 ( -4.746 2.102 -4.835) 7.094 15.139 ( -3.415 0.585 -1.060) 3.623 15.196 ( -3.092 4.395 -1.723) 5.643 15.842 ( 9.809 10.220 8.646) 16.596 16.575 ( 2.198 -0.126 -0.049) 2.202 16.681 ( 0.772 -1.183 -1.114) 1.799 19.900 ( -4.865 1.359 -3.234) 5.998 20.038 ( 6.100 0.296 4.259) 7.446 20.293 ( -4.430 -5.361 -3.323) 7.708 20.473 ( 1.409 -4.230 1.877) 4.837 24.296 ( -1.791 1.547 -3.072) 3.878 24.600 ( 7.968 11.051 4.709) 14.415 24.905 ( 1.378 1.616 -1.044) 2.366 25.015 ( 2.496 0.401 1.479) 2.929 26.155 ( -3.195 0.893 -0.581) 3.368 26.166 ( 0.289 1.320 1.240) 1.834 26.648 ( -2.042 -2.374 -0.583) 3.185 26.804 ( 0.978 0.279 2.009) 2.252 26.869 ( -2.294 -0.802 -1.824) 3.039 26.942 ( -2.122 2.631 -0.841) 3.483 27.152 ( 2.722 4.866 0.633) 5.612 27.474 ( 7.662 0.417 -1.907) 7.907 27.671 ( -0.353 1.565 0.342) 1.641 28.070 ( -4.328 0.369 0.857) 4.427 29.089 ( 1.475 -0.930 0.246) 1.761 29.240 ( -2.897 -9.310 -3.568) 10.383 29.463 ( 4.742 -6.360 2.048) 8.193 29.763 ( 2.415 4.708 -1.951) 5.640 29.881 ( 0.512 -14.901 8.054) 16.946 30.394 ( -13.109 -4.554 -5.878) 15.071 ======================= Grid point 27 (20/117) ======================= q-point: ( 0.60 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.346 ( -1.888 -16.926 -1.871) 17.133 2.472 ( 3.617 -4.273 2.375) 6.081 2.969 ( 5.006 -6.535 -5.195) 9.734 3.305 ( 9.623 -2.761 9.035) 13.486 3.440 ( 1.181 1.795 1.104) 2.416 3.559 ( 7.100 -3.296 -2.554) 8.234 3.673 ( -1.444 -2.936 4.249) 5.363 3.740 ( -1.728 -6.135 -1.607) 6.573 3.904 ( -10.002 -4.097 -5.784) 12.259 3.923 ( -3.498 4.057 3.898) 6.625 4.113 ( -2.264 3.551 -1.675) 4.532 4.181 ( 0.197 3.678 -3.225) 4.896 4.303 ( 1.950 -2.767 -0.077) 3.386 4.431 ( 1.182 -3.214 0.915) 3.545 4.499 ( 1.399 2.192 -3.667) 4.495 4.621 ( -0.031 -6.800 9.038) 11.311 4.687 ( 0.424 6.801 -0.628) 6.843 4.812 ( -7.667 8.322 -0.504) 11.327 4.931 ( -6.946 6.345 1.111) 9.473 5.080 ( -2.201 2.892 -4.562) 5.832 5.141 ( 6.123 -11.446 -4.700) 13.806 5.395 ( 1.303 6.619 1.656) 6.947 5.501 ( -2.406 5.943 -1.831) 6.668 5.623 ( 0.044 8.251 -0.613) 8.274 5.723 ( 6.664 -3.715 3.169) 8.261 5.885 ( 5.003 7.320 5.638) 10.507 6.021 ( 6.610 -1.095 -3.629) 7.620 6.044 ( -3.601 -7.737 -0.849) 8.576 6.095 ( 2.585 -2.542 1.790) 4.043 6.178 ( -6.992 -0.763 -1.011) 7.106 6.413 ( -8.387 2.670 -2.985) 9.294 6.487 ( 5.257 -0.970 4.315) 6.870 6.517 ( -3.627 0.817 -1.973) 4.209 6.675 ( -4.047 -7.443 -2.738) 8.903 6.755 ( 4.388 5.038 2.322) 7.072 6.825 ( -0.496 1.659 -0.697) 1.867 6.950 ( 2.634 -2.383 0.396) 3.574 7.080 ( 1.331 7.404 1.403) 7.653 7.114 ( -5.071 5.510 -2.510) 7.898 7.150 ( 12.239 3.190 2.985) 12.996 7.292 ( -0.567 4.751 -2.616) 5.453 7.480 ( -8.568 -7.298 3.299) 11.729 7.646 ( 6.609 10.332 0.854) 12.295 7.747 ( -5.323 5.133 1.222) 7.495 7.912 ( -3.965 3.542 -5.424) 7.595 8.003 ( 3.995 4.391 4.552) 7.480 8.084 ( 3.712 -2.589 1.910) 4.912 8.229 ( -2.946 -1.430 -1.725) 3.701 8.465 ( -2.252 3.156 -4.731) 6.117 8.551 ( 0.095 -6.069 0.953) 6.144 8.563 ( -1.185 -0.047 -0.874) 1.474 8.648 ( -0.420 1.777 1.302) 2.243 8.881 ( 2.810 2.666 -0.602) 3.920 9.034 ( 9.651 1.381 2.813) 10.147 9.354 ( -10.431 5.327 -2.295) 11.935 9.381 ( -1.502 -7.281 0.669) 7.465 10.368 ( 0.804 -0.706 0.538) 1.197 10.438 ( 0.946 1.111 0.903) 1.716 10.456 ( -2.029 -2.022 -2.213) 3.620 10.786 ( 3.277 4.797 2.949) 6.516 11.015 ( -0.974 -3.382 -2.570) 4.358 11.235 ( -0.392 0.267 -1.043) 1.146 11.270 ( -0.271 -1.238 0.103) 1.271 11.557 ( 8.423 -4.215 6.393) 11.384 11.787 ( -9.442 -4.082 -6.826) 12.345 12.264 ( 0.042 -1.903 1.386) 2.355 12.377 ( 3.807 0.239 0.074) 3.815 12.460 ( -6.274 0.049 -0.552) 6.299 12.576 ( 1.266 -1.312 -0.472) 1.883 12.660 ( -2.154 1.271 -1.093) 2.730 12.929 ( 0.015 2.737 -0.955) 2.899 13.142 ( 6.926 4.143 3.299) 8.719 13.935 ( 3.877 -0.053 6.822) 7.847 14.123 ( -1.862 -2.162 -2.022) 3.497 14.191 ( 4.958 2.661 4.272) 7.065 14.223 ( 0.141 3.321 3.403) 4.757 14.434 ( -11.412 1.024 -11.242) 16.052 14.842 ( -3.907 -1.797 -6.279) 7.611 14.921 ( 0.060 -0.228 -0.150) 0.280 15.125 ( -0.428 -0.600 -0.368) 0.824 15.147 ( 0.976 0.608 2.520) 2.770 15.682 ( 5.002 10.815 4.092) 12.599 16.562 ( 1.290 2.589 0.348) 2.914 16.698 ( 0.115 -0.520 -0.665) 0.852 19.850 ( -3.654 0.854 -2.488) 4.502 20.076 ( 5.705 -0.166 4.127) 7.043 20.353 ( -4.433 -3.718 -3.293) 6.657 20.545 ( 1.471 -2.101 1.408) 2.926 24.262 ( -1.252 0.877 -1.507) 2.146 24.461 ( 3.608 7.002 1.858) 8.093 24.880 ( 0.208 1.195 -0.387) 1.274 25.011 ( 0.971 1.155 0.562) 1.610 26.128 ( -1.382 0.192 -0.288) 1.425 26.160 ( 0.159 -0.359 0.566) 0.689 26.686 ( -1.136 -2.489 -0.675) 2.818 26.797 ( 0.168 0.872 0.864) 1.239 26.879 ( -0.888 -0.637 -0.157) 1.104 26.916 ( -0.736 -1.309 -0.359) 1.544 27.079 ( 1.016 3.516 0.291) 3.671 27.466 ( 4.023 4.129 -1.384) 5.929 27.645 ( -1.091 0.399 0.833) 1.430 28.059 ( -1.318 -0.791 0.225) 1.554 29.093 ( 0.337 0.622 0.127) 0.719 29.366 ( -2.288 -5.023 -2.724) 6.156 29.575 ( 5.585 -0.445 0.707) 5.647 29.665 ( -0.935 2.004 2.656) 3.456 30.216 ( 3.556 -13.860 2.247) 14.485 30.378 ( -8.470 -1.610 -3.325) 9.241 ======================= Grid point 28 (21/117) ======================= q-point: (-0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.531 ( 2.214 -1.506 -2.622) 3.748 2.569 ( 2.021 -2.135 2.316) 3.742 2.982 ( 0.696 6.561 0.757) 6.641 3.328 ( -0.272 6.827 2.966) 7.449 3.358 ( 0.041 2.179 -2.501) 3.317 3.493 ( 0.587 9.925 0.165) 9.943 3.687 ( -4.076 -5.591 -0.090) 6.920 3.783 ( -0.679 5.716 -1.386) 5.921 3.921 ( 0.147 4.970 -0.814) 5.038 3.954 ( 0.349 -1.572 1.564) 2.245 4.046 ( -1.978 -0.097 -3.083) 3.664 4.149 ( -1.881 -6.043 -0.311) 6.336 4.345 ( 4.312 1.886 3.876) 6.097 4.424 ( -4.006 -1.226 -2.758) 5.016 4.503 ( -2.036 1.853 3.905) 4.778 4.585 ( 3.776 -3.322 2.944) 5.828 4.641 ( 3.229 0.198 -8.440) 9.039 4.726 ( -4.619 -5.834 4.177) 8.533 5.040 ( 8.063 -5.578 1.142) 9.870 5.128 ( -5.846 -6.917 -0.052) 9.057 5.263 ( -1.432 2.522 0.744) 2.994 5.349 ( -0.494 4.593 -1.146) 4.760 5.488 ( 0.322 -11.839 -4.522) 12.677 5.494 ( -0.608 -2.544 0.919) 2.772 5.742 ( -0.554 5.187 1.520) 5.433 5.839 ( 8.235 -1.928 4.343) 9.508 5.962 ( 2.053 12.429 -2.950) 12.938 6.101 ( -1.435 2.812 0.017) 3.157 6.126 ( -1.498 5.994 -3.808) 7.258 6.152 ( -6.216 -4.440 0.724) 7.673 6.335 ( -0.696 1.133 -0.710) 1.507 6.531 ( 2.325 -4.140 -1.090) 4.872 6.568 ( -1.774 -3.889 1.261) 4.457 6.676 ( 3.102 0.539 3.362) 4.606 6.748 ( -2.299 0.595 -0.751) 2.491 6.829 ( 1.188 -2.159 0.913) 2.628 6.895 ( 0.154 4.050 2.134) 4.581 7.028 ( 1.950 -1.017 2.025) 2.990 7.075 ( -4.519 -1.342 -5.166) 6.994 7.164 ( 7.540 1.122 4.729) 8.971 7.223 ( -1.943 1.068 -4.661) 5.161 7.521 ( 4.002 4.519 -0.708) 6.078 7.575 ( -2.498 1.807 2.685) 4.088 7.681 ( -3.711 -6.795 -0.663) 7.771 7.867 ( -1.222 -1.025 -2.726) 3.159 7.934 ( -0.764 2.999 2.818) 4.186 8.171 ( 3.231 -3.071 -0.319) 4.469 8.201 ( -2.872 2.989 -0.935) 4.249 8.471 ( 2.941 -1.736 0.463) 3.446 8.558 ( -1.124 -0.470 -0.926) 1.531 8.599 ( -2.348 0.441 -0.520) 2.445 8.647 ( 0.305 -1.974 1.387) 2.432 8.865 ( 1.797 0.001 -0.101) 1.800 9.027 ( 5.643 4.177 -1.559) 7.192 9.164 ( -8.153 5.020 1.466) 9.686 9.626 ( 2.622 -15.091 0.276) 15.320 10.370 ( 0.271 0.762 0.253) 0.848 10.406 ( -0.239 1.565 0.017) 1.583 10.485 ( -0.715 -1.395 -0.461) 1.634 10.703 ( 0.928 5.013 0.540) 5.126 11.051 ( -0.808 -0.891 -1.186) 1.689 11.198 ( -0.898 1.938 -0.699) 2.247 11.272 ( 0.219 1.934 0.624) 2.044 11.667 ( 8.476 -0.809 6.550) 10.742 11.799 ( -8.445 -3.338 -6.979) 11.453 12.279 ( -0.285 -0.145 0.618) 0.696 12.387 ( -2.111 0.107 -4.027) 4.548 12.434 ( 4.481 1.478 2.805) 5.490 12.601 ( -4.706 2.283 -2.166) 5.661 12.604 ( 0.693 -0.730 2.266) 2.479 12.858 ( -0.897 2.263 -0.437) 2.473 13.166 ( 4.157 -1.021 2.875) 5.156 13.988 ( 6.805 -1.495 5.457) 8.850 14.123 ( -3.035 -0.423 -2.522) 3.969 14.148 ( -2.999 1.951 -1.938) 4.068 14.228 ( 5.059 -1.277 2.368) 5.730 14.382 ( -8.871 -2.276 -5.610) 10.740 14.888 ( 2.258 -1.503 -1.874) 3.297 14.921 ( -1.737 -0.574 1.148) 2.160 15.138 ( -0.972 -1.781 -0.179) 2.037 15.220 ( 2.296 -7.082 1.820) 7.664 15.501 ( 0.862 9.117 0.552) 9.174 16.493 ( -0.217 4.491 -0.125) 4.498 16.709 ( 0.002 -0.556 0.091) 0.563 19.823 ( -1.888 0.064 -1.326) 2.308 20.112 ( 3.537 -0.423 2.530) 4.369 20.382 ( -2.674 -1.636 -2.026) 3.733 20.570 ( 0.948 0.515 0.743) 1.310 24.243 ( -0.928 0.498 -0.640) 1.232 24.375 ( 0.987 3.245 0.626) 3.449 24.864 ( -0.130 0.514 0.031) 0.531 24.983 ( -0.047 1.850 -0.044) 1.851 26.129 ( -0.283 -0.714 -0.166) 0.786 26.182 ( 0.399 -1.695 0.299) 1.766 26.730 ( -0.066 -2.298 -0.273) 2.315 26.777 ( -0.375 1.059 0.166) 1.136 26.887 ( -0.204 -0.759 -0.318) 0.848 26.952 ( 0.738 -1.064 0.361) 1.344 27.051 ( 0.004 -1.226 0.005) 1.226 27.375 ( 0.251 6.132 -0.280) 6.144 27.636 ( -0.413 0.310 0.312) 0.603 28.081 ( 0.014 -1.869 -0.070) 1.870 29.079 ( -0.091 0.797 -0.015) 0.802 29.399 ( -1.049 0.089 -1.132) 1.546 29.585 ( 0.709 -0.798 0.558) 1.204 29.651 ( 1.310 2.181 1.389) 2.899 30.258 ( -1.825 5.833 -1.932) 6.409 30.529 ( 0.980 -11.752 1.114) 11.845 ======================= Grid point 29 (22/117) ======================= q-point: (-0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.482 ( 0.000 12.746 0.000) 12.746 2.501 ( 0.000 3.436 0.000) 3.436 2.801 ( 0.000 11.625 0.000) 11.625 3.119 ( 0.000 10.290 0.000) 10.290 3.191 ( 0.000 21.200 0.000) 21.200 3.355 ( -0.000 -1.060 -0.000) 1.060 3.621 ( 0.000 8.559 0.000) 8.559 3.759 ( -0.000 -0.980 -0.000) 0.980 3.807 ( 0.000 1.402 0.000) 1.402 3.922 ( 0.000 4.135 0.000) 4.135 4.145 ( -0.000 -7.971 -0.000) 7.971 4.287 ( 0.000 5.326 0.000) 5.326 4.303 ( -0.000 -7.804 -0.000) 7.804 4.380 ( -0.000 -4.637 -0.000) 4.637 4.629 ( -0.000 -2.379 -0.000) 2.379 4.652 ( -0.000 -1.095 -0.000) 1.095 4.815 ( -0.000 -18.014 -0.000) 18.014 4.819 ( 0.000 3.562 0.000) 3.562 5.108 ( 0.000 0.364 0.000) 0.364 5.140 ( 0.000 1.874 0.000) 1.874 5.229 ( 0.000 5.995 0.000) 5.995 5.297 ( -0.000 -7.154 -0.000) 7.154 5.515 ( 0.000 15.855 0.000) 15.855 5.597 ( 0.000 1.510 0.000) 1.510 5.698 ( -0.000 -9.774 -0.000) 9.774 5.778 ( -0.000 -5.779 -0.000) 5.779 5.922 ( -0.000 -5.852 -0.000) 5.852 5.988 ( 0.000 5.932 0.000) 5.932 6.103 ( -0.000 -2.315 -0.000) 2.315 6.335 ( -0.000 -13.791 -0.000) 13.791 6.337 ( -0.000 -1.559 -0.000) 1.559 6.561 ( 0.000 3.249 0.000) 3.249 6.576 ( 0.000 1.097 0.000) 1.097 6.692 ( 0.000 3.369 0.000) 3.369 6.766 ( -0.000 -3.461 -0.000) 3.461 6.841 ( 0.000 2.187 0.000) 2.187 6.863 ( -0.000 -1.214 -0.000) 1.214 7.090 ( -0.000 -3.463 -0.000) 3.463 7.111 ( -0.000 -4.975 -0.000) 4.975 7.236 ( -0.000 -3.265 -0.000) 3.265 7.237 ( -0.000 -6.098 -0.000) 6.098 7.497 ( -0.000 -3.020 -0.000) 3.020 7.561 ( -0.000 -1.381 -0.000) 1.381 7.754 ( 0.000 0.364 0.000) 0.364 7.885 ( 0.000 1.393 0.000) 1.393 7.892 ( 0.000 0.489 0.000) 0.489 8.106 ( 0.000 1.753 0.000) 1.753 8.264 ( -0.000 -4.315 -0.000) 4.315 8.499 ( -0.000 -0.190 -0.000) 0.190 8.570 ( -0.000 -1.097 -0.000) 1.097 8.589 ( -0.000 -0.440 -0.000) 0.440 8.675 ( -0.000 -0.240 -0.000) 0.240 8.884 ( -0.000 -0.839 -0.000) 0.839 8.988 ( 0.000 0.727 0.000) 0.727 9.102 ( -0.000 -1.853 -0.000) 1.853 9.941 ( -0.000 -14.490 -0.000) 14.490 10.344 ( 0.000 1.958 0.000) 1.958 10.390 ( -0.000 -0.500 -0.000) 0.500 10.498 ( -0.000 -0.090 -0.000) 0.090 10.608 ( 0.000 4.661 0.000) 4.661 11.038 ( 0.000 1.978 0.000) 1.978 11.156 ( 0.000 2.326 0.000) 2.326 11.197 ( 0.000 5.433 0.000) 5.433 11.661 ( 0.000 4.036 0.000) 4.036 11.842 ( -0.000 -3.675 -0.000) 3.675 12.281 ( -0.000 -0.120 -0.000) 0.120 12.359 ( 0.000 1.241 0.000) 1.241 12.398 ( 0.000 5.553 0.000) 5.553 12.541 ( 0.000 1.578 0.000) 1.578 12.636 ( -0.000 -3.235 -0.000) 3.235 12.847 ( -0.000 -0.687 -0.000) 0.687 13.216 ( -0.000 -3.408 -0.000) 3.408 14.047 ( -0.000 -0.904 -0.000) 0.904 14.114 ( -0.000 -1.992 -0.000) 1.992 14.164 ( -0.000 -3.589 -0.000) 3.589 14.265 ( 0.000 0.157 0.000) 0.157 14.406 ( -0.000 -3.618 -0.000) 3.618 14.894 ( 0.000 0.942 0.000) 0.942 14.920 ( 0.000 0.649 0.000) 0.649 15.195 ( -0.000 -4.329 -0.000) 4.329 15.359 ( 0.000 5.231 0.000) 5.231 15.429 ( -0.000 -12.272 -0.000) 12.272 16.400 ( 0.000 4.575 0.000) 4.575 16.716 ( -0.000 -0.085 -0.000) 0.085 19.824 ( -0.000 -0.748 -0.000) 0.748 20.133 ( -0.000 -0.529 -0.000) 0.529 20.384 ( 0.000 0.515 0.000) 0.515 20.535 ( 0.000 3.396 0.000) 3.396 24.229 ( 0.000 0.453 0.000) 0.453 24.350 ( -0.000 -0.276 -0.000) 0.276 24.856 ( 0.000 0.324 0.000) 0.324 24.945 ( 0.000 1.855 0.000) 1.855 26.148 ( -0.000 -1.193 -0.000) 1.193 26.226 ( -0.000 -2.503 -0.000) 2.503 26.752 ( 0.000 1.144 0.000) 1.144 26.769 ( -0.000 -1.411 -0.000) 1.411 26.905 ( -0.000 -1.260 -0.000) 1.260 26.971 ( -0.000 -1.628 -0.000) 1.628 27.118 ( -0.000 -4.331 -0.000) 4.331 27.245 ( 0.000 6.814 0.000) 6.814 27.624 ( 0.000 0.823 0.000) 0.823 28.132 ( -0.000 -3.420 -0.000) 3.420 29.060 ( 0.000 1.250 0.000) 1.250 29.374 ( 0.000 1.678 0.000) 1.678 29.567 ( 0.000 6.783 0.000) 6.783 29.624 ( -0.000 -2.570 -0.000) 2.570 30.081 ( 0.000 11.244 0.000) 11.244 30.728 ( -0.000 -8.127 -0.000) 8.127 ======================= Grid point 34 (23/117) ======================= q-point: ( 0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.105 ( 22.591 0.000 -20.606) 30.577 1.524 ( 39.713 0.000 7.747) 40.462 2.251 ( -22.298 -0.000 -14.631) 26.670 2.310 ( 32.721 0.000 35.199) 48.059 2.865 ( 5.967 0.000 4.706) 7.599 3.212 ( 7.817 0.000 1.066) 7.889 3.292 ( 2.019 0.000 -22.304) 22.395 3.339 ( -21.642 -0.000 -1.503) 21.694 3.672 ( 0.470 0.000 7.255) 7.271 3.843 ( -2.684 -0.000 -4.283) 5.054 4.011 ( 1.884 0.000 8.723) 8.924 4.116 ( -12.584 -0.000 18.630) 22.482 4.283 ( -12.755 -0.000 -9.478) 15.891 4.323 ( -3.028 -0.000 -4.329) 5.283 4.648 ( -4.402 -0.000 10.196) 11.105 4.788 ( 6.574 0.000 -4.758) 8.115 4.818 ( 22.440 0.000 3.876) 22.772 4.967 ( -1.928 -0.000 -3.682) 4.156 5.126 ( -3.979 -0.000 -13.006) 13.601 5.144 ( -10.400 -0.000 0.021) 10.400 5.380 ( -3.154 -0.000 -2.529) 4.043 5.578 ( 9.076 0.000 -9.433) 13.091 5.708 ( -3.813 -0.000 -9.170) 9.931 5.816 ( -1.145 -0.000 6.483) 6.583 5.848 ( -1.543 -0.000 -14.239) 14.322 6.031 ( 3.473 0.000 7.204) 7.998 6.040 ( 6.186 0.000 2.727) 6.761 6.201 ( 7.450 0.000 -12.249) 14.337 6.398 ( 1.790 0.000 -9.669) 9.833 6.488 ( 9.390 0.000 12.606) 15.719 6.521 ( 5.228 0.000 5.226) 7.392 6.575 ( 0.890 0.000 11.485) 11.520 6.798 ( -2.202 -0.000 6.187) 6.568 6.832 ( -3.702 -0.000 -1.379) 3.951 6.943 ( -6.589 -0.000 -1.740) 6.815 7.008 ( 0.215 0.000 -7.364) 7.368 7.155 ( -11.225 -0.000 -0.153) 11.226 7.190 ( 12.635 0.000 15.053) 19.653 7.398 ( -6.025 -0.000 -20.260) 21.136 7.399 ( -7.540 -0.000 -0.683) 7.570 7.584 ( -1.571 -0.000 -4.416) 4.687 7.646 ( 2.861 0.000 -0.718) 2.950 7.865 ( -1.634 -0.000 1.360) 2.127 7.945 ( -5.309 -0.000 -2.059) 5.695 8.026 ( 7.155 0.000 10.513) 12.717 8.093 ( -13.117 -0.000 -3.762) 13.646 8.189 ( -0.552 -0.000 0.172) 0.578 8.346 ( -0.141 -0.000 -2.663) 2.667 8.451 ( 5.228 0.000 3.999) 6.582 8.469 ( 3.288 0.000 11.570) 12.028 8.653 ( 5.318 0.000 3.237) 6.226 8.730 ( 1.289 0.000 0.021) 1.289 8.785 ( 0.363 0.000 -1.535) 1.578 8.873 ( -0.341 -0.000 -3.439) 3.456 9.781 ( -9.283 -0.000 -5.940) 11.020 10.044 ( 2.000 0.000 11.114) 11.293 10.072 ( 0.148 0.000 -2.574) 2.579 10.135 ( 1.703 0.000 -5.663) 5.913 10.449 ( 2.932 0.000 -0.290) 2.947 10.522 ( -2.015 -0.000 -4.212) 4.669 10.749 ( 11.533 0.000 3.539) 12.064 10.910 ( 3.251 0.000 -1.115) 3.437 11.123 ( 6.689 0.000 7.160) 9.798 11.163 ( -3.700 -0.000 -4.754) 6.025 11.575 ( -10.044 -0.000 -7.412) 12.483 11.959 ( 2.716 0.000 4.455) 5.217 12.357 ( -2.107 -0.000 1.893) 2.832 12.401 ( -0.257 -0.000 0.042) 0.260 12.669 ( 4.614 0.000 0.158) 4.617 12.731 ( 0.691 0.000 -3.370) 3.440 12.771 ( -27.185 -0.000 -14.809) 30.957 13.986 ( -6.593 -0.000 3.437) 7.436 14.090 ( -1.433 -0.000 -2.092) 2.536 14.271 ( -5.368 -0.000 1.002) 5.461 14.477 ( 4.414 0.000 3.513) 5.642 14.550 ( 1.162 0.000 23.849) 23.877 14.867 ( -0.939 -0.000 -3.441) 3.567 15.013 ( 0.838 0.000 7.025) 7.075 15.105 ( 6.791 0.000 5.293) 8.610 15.142 ( 4.628 0.000 0.322) 4.639 15.658 ( -12.040 -0.000 -13.503) 18.091 16.094 ( 13.841 0.000 6.777) 15.411 16.453 ( -1.089 -0.000 -2.171) 2.429 16.567 ( 0.611 0.000 6.909) 6.936 19.957 ( -1.208 -0.000 -2.406) 2.692 20.012 ( 2.352 0.000 0.752) 2.469 20.124 ( 1.812 0.000 1.974) 2.680 20.163 ( 0.003 0.000 0.698) 0.698 24.395 ( -3.517 -0.000 -6.639) 7.513 24.927 ( 5.125 0.000 -0.749) 5.179 24.991 ( 4.623 0.000 -2.854) 5.433 25.433 ( -7.711 -0.000 24.937) 26.102 26.224 ( -4.839 -0.000 -0.002) 4.839 26.432 ( -0.568 -0.000 21.748) 21.755 26.569 ( -2.935 -0.000 0.294) 2.950 26.803 ( 1.412 0.000 6.188) 6.347 27.067 ( -4.453 -0.000 -11.863) 12.672 27.286 ( 6.151 0.000 0.178) 6.154 27.300 ( 0.530 0.000 -0.227) 0.577 27.396 ( 6.652 0.000 1.979) 6.940 27.793 ( 3.844 0.000 -15.799) 16.260 27.932 ( -9.649 -0.000 -2.233) 9.904 28.746 ( -0.432 -0.000 0.329) 0.543 28.852 ( 0.541 0.000 0.766) 0.938 28.968 ( -3.212 -0.000 0.275) 3.224 29.158 ( -1.662 -0.000 -1.430) 2.192 29.892 ( 1.045 0.000 -18.306) 18.336 30.176 ( 4.275 0.000 5.614) 7.057 ======================= Grid point 35 (24/117) ======================= q-point: ( 0.40 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.237 ( 13.593 -6.360 -5.081) 15.844 2.044 ( 31.391 -22.224 2.868) 38.568 2.196 ( -14.906 -7.643 -9.624) 19.319 2.429 ( -4.170 -0.912 11.741) 12.493 3.131 ( 22.556 -14.580 7.307) 27.834 3.262 ( -6.202 -5.149 1.994) 8.303 3.308 ( -2.783 -8.359 0.131) 8.811 3.429 ( 10.040 -5.205 -10.705) 15.572 3.667 ( 3.863 -2.111 -2.907) 5.276 3.884 ( -4.711 -4.959 3.805) 7.827 4.012 ( -4.052 1.095 2.203) 4.740 4.050 ( -3.036 -1.814 16.310) 16.689 4.165 ( -3.788 0.648 -1.783) 4.237 4.366 ( -4.365 -1.483 -0.597) 4.648 4.523 ( -0.820 10.206 2.621) 10.569 4.748 ( 0.304 4.602 -1.305) 4.793 4.843 ( -3.271 5.004 -8.644) 10.510 4.967 ( -1.689 5.098 -6.317) 8.291 5.079 ( -0.124 -8.659 -2.879) 9.126 5.239 ( 1.291 -7.262 3.104) 8.002 5.429 ( -1.853 -5.132 3.563) 6.517 5.582 ( 3.501 6.444 -9.666) 12.133 5.687 ( 3.996 0.499 -7.499) 8.512 5.713 ( -5.987 3.586 -12.248) 14.097 5.864 ( 3.692 0.432 5.504) 6.641 5.961 ( 5.129 7.509 4.307) 10.062 6.049 ( -1.820 3.145 7.101) 7.977 6.252 ( 3.882 1.382 -10.266) 11.063 6.339 ( 2.576 10.881 -1.601) 11.296 6.423 ( 2.294 -0.921 -2.450) 3.480 6.563 ( 2.453 0.883 5.749) 6.313 6.618 ( -7.515 6.473 3.243) 10.435 6.694 ( 5.775 -3.594 3.641) 7.715 6.793 ( -8.460 5.488 -1.557) 10.203 6.895 ( 4.614 3.785 -0.067) 5.968 6.969 ( -3.003 3.715 -0.188) 4.780 7.087 ( -2.319 1.358 1.146) 2.922 7.223 ( -1.616 6.361 -0.226) 6.567 7.312 ( -1.954 1.050 -5.771) 6.183 7.410 ( 0.707 1.202 -0.148) 1.402 7.500 ( 5.351 1.297 4.660) 7.214 7.620 ( 0.667 3.948 1.995) 4.474 7.825 ( -1.317 4.450 -0.699) 4.693 7.882 ( -3.785 0.116 -4.037) 5.535 7.997 ( -10.768 1.304 -3.926) 11.536 8.085 ( 4.280 -1.009 10.367) 11.261 8.194 ( -1.339 -0.837 0.267) 1.602 8.327 ( -4.897 0.577 -6.140) 7.875 8.518 ( 4.349 0.485 4.364) 6.180 8.555 ( 8.849 -4.255 9.166) 13.432 8.692 ( 2.239 2.807 4.309) 5.609 8.747 ( 0.352 0.504 -0.188) 0.643 8.849 ( 2.859 -6.325 1.121) 7.032 8.921 ( -6.666 -10.196 -5.016) 13.174 9.571 ( 0.353 17.304 -1.904) 17.412 9.820 ( -6.350 11.111 -1.872) 12.934 10.157 ( -0.988 -4.933 -0.431) 5.050 10.245 ( -0.833 -4.870 -3.945) 6.322 10.482 ( 1.504 -0.592 -4.142) 4.446 10.637 ( 2.892 -10.650 3.171) 11.482 10.787 ( 9.526 0.166 4.186) 10.406 10.979 ( 0.830 -2.798 -2.183) 3.644 11.151 ( -1.847 -2.259 -1.166) 3.142 11.220 ( 5.290 -4.158 4.713) 8.215 11.556 ( -10.434 -4.292 -6.772) 13.159 12.019 ( 2.356 -4.180 2.954) 5.635 12.333 ( -0.339 0.796 1.640) 1.854 12.419 ( -1.543 -1.518 0.584) 2.242 12.583 ( -22.903 -0.317 -14.862) 27.304 12.695 ( 3.053 0.070 -0.176) 3.059 12.785 ( 3.990 -1.756 0.018) 4.359 13.931 ( -4.363 3.520 0.925) 5.682 14.008 ( -0.024 7.782 1.563) 7.937 14.177 ( -3.482 4.185 3.207) 6.318 14.467 ( 0.453 2.723 0.292) 2.776 14.533 ( 8.445 6.098 22.789) 25.057 14.820 ( 5.750 11.217 -6.376) 14.126 14.872 ( -0.772 1.322 3.300) 3.638 15.117 ( 2.396 1.083 3.257) 4.185 15.169 ( 0.940 2.732 -2.981) 4.152 15.483 ( -10.786 8.584 -12.241) 18.436 16.147 ( 10.393 3.643 8.974) 14.207 16.478 ( -1.277 -3.111 -2.806) 4.379 16.599 ( 1.471 -2.482 2.857) 4.060 19.948 ( -2.666 0.396 -2.583) 3.733 20.029 ( 2.655 -0.818 0.812) 2.894 20.137 ( 0.727 -0.839 0.637) 1.279 20.244 ( -0.086 -6.437 1.283) 6.564 24.361 ( -2.613 1.265 -5.129) 5.894 24.950 ( 4.252 0.677 -0.612) 4.349 25.012 ( 4.588 0.798 -3.456) 5.799 25.231 ( -0.286 15.071 17.857) 23.369 26.188 ( -4.027 0.759 -0.094) 4.099 26.335 ( 2.402 7.834 9.268) 12.371 26.568 ( -2.290 -1.386 0.087) 2.678 26.812 ( 1.456 0.222 5.617) 5.807 26.940 ( -0.901 5.752 -11.705) 13.074 27.169 ( 0.505 9.189 -1.400) 9.309 27.305 ( 1.193 1.357 0.249) 1.824 27.447 ( 10.952 -0.309 1.116) 11.013 27.726 ( 2.920 1.374 -5.062) 6.003 28.039 ( -11.812 -5.176 -0.299) 12.900 28.830 ( -1.045 -8.291 -1.327) 8.462 28.930 ( 2.511 -6.575 0.949) 7.102 29.065 ( -4.055 -10.207 0.956) 11.025 29.295 ( -1.612 -11.471 2.522) 11.855 29.987 ( -5.320 -7.417 -11.553) 14.724 30.153 ( 1.468 3.215 2.977) 4.621 ======================= Grid point 36 (25/117) ======================= q-point: ( 0.50 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.512 ( -0.438 -17.180 2.499) 17.366 2.305 ( -4.404 -9.286 -3.896) 10.992 2.502 ( -1.316 -10.541 -0.288) 10.627 2.675 ( 25.223 -21.638 4.903) 33.592 3.303 ( -8.614 -9.082 -0.874) 12.547 3.386 ( 5.767 2.687 1.871) 6.631 3.480 ( -5.522 -11.547 -5.468) 13.919 3.595 ( -1.396 -7.000 -2.801) 7.668 3.851 ( 11.347 -8.540 -0.766) 14.222 3.964 ( 9.594 0.777 2.177) 9.868 4.083 ( -2.694 -6.190 -7.424) 10.035 4.145 ( -8.420 -3.784 15.746) 18.253 4.193 ( 4.047 -3.719 11.486) 12.734 4.330 ( 0.296 -5.469 -5.838) 8.005 4.403 ( 4.103 0.695 9.837) 10.681 4.546 ( -2.657 10.361 -4.895) 11.763 4.725 ( -11.345 5.789 -14.325) 19.168 4.901 ( -2.418 -3.245 3.792) 5.545 5.277 ( 7.617 -7.537 -2.769) 11.068 5.335 ( -2.965 1.053 -3.479) 4.691 5.400 ( 0.155 12.107 -5.794) 13.423 5.469 ( 2.793 4.315 8.099) 9.593 5.605 ( -0.726 -2.260 -1.892) 3.035 5.744 ( 0.073 9.278 -1.451) 9.391 5.797 ( 0.339 0.660 1.259) 1.461 5.889 ( 2.769 -1.206 -0.795) 3.124 5.972 ( 6.991 2.474 8.340) 11.160 6.134 ( -2.508 8.987 -5.682) 10.924 6.183 ( -1.557 9.412 1.511) 9.659 6.300 ( -6.502 5.902 -9.296) 12.788 6.458 ( -4.890 8.211 -5.903) 11.233 6.609 ( 0.618 -0.794 0.909) 1.356 6.654 ( -2.674 1.810 3.187) 4.537 6.731 ( -5.472 4.212 -1.476) 7.061 6.828 ( 3.770 0.822 -0.869) 3.955 6.875 ( 2.189 5.075 2.464) 6.051 6.993 ( -3.722 7.207 2.127) 8.385 7.157 ( 6.586 2.311 2.765) 7.508 7.263 ( -0.920 0.295 -4.406) 4.511 7.290 ( -0.298 5.339 -2.262) 5.806 7.487 ( 0.450 6.312 1.592) 6.525 7.699 ( -3.144 4.994 1.313) 6.046 7.706 ( 10.017 -5.241 13.966) 17.968 7.849 ( -3.337 1.973 -5.731) 6.919 7.949 ( -5.299 -1.713 -6.018) 8.200 8.102 ( 0.441 1.811 5.509) 5.816 8.166 ( -1.399 2.192 -2.404) 3.542 8.336 ( 0.453 -3.280 1.836) 3.786 8.409 ( 0.810 9.931 2.298) 10.226 8.593 ( 0.171 1.348 -0.070) 1.361 8.691 ( -1.113 2.079 -1.729) 2.923 8.812 ( 10.388 -6.532 4.443) 13.051 8.977 ( -1.861 1.309 2.146) 3.128 9.085 ( -7.199 -8.709 -3.677) 11.882 9.184 ( 8.896 17.759 4.714) 20.414 9.572 ( -11.717 8.129 -6.971) 15.873 10.255 ( -1.557 -5.703 0.141) 5.913 10.311 ( -1.275 -3.215 -4.043) 5.320 10.499 ( 3.287 0.379 -0.592) 3.361 10.838 ( 2.154 -5.884 2.634) 6.797 10.876 ( 4.676 -2.432 2.155) 5.694 11.032 ( 0.310 -5.651 -2.677) 6.261 11.204 ( -2.131 -3.489 -0.687) 4.145 11.353 ( 7.268 -5.217 5.784) 10.654 11.589 ( -10.571 -5.575 -5.972) 13.360 12.129 ( 1.557 -4.985 1.360) 5.396 12.340 ( 1.333 -1.383 1.912) 2.711 12.418 ( -7.757 -1.061 -1.697) 8.011 12.508 ( -6.728 -2.025 -7.049) 9.953 12.703 ( 1.907 0.820 -0.018) 2.076 12.854 ( 2.240 -3.235 -0.274) 3.944 13.681 ( 2.515 17.689 0.411) 17.872 13.945 ( -1.144 -0.292 6.148) 6.260 14.102 ( -1.536 2.575 0.581) 3.054 14.391 ( -0.176 4.761 2.080) 5.199 14.435 ( 10.003 9.361 14.333) 19.827 14.643 ( 2.428 9.180 -5.900) 11.179 14.880 ( -0.680 -1.469 -0.108) 1.622 15.004 ( -7.348 9.184 -10.582) 15.822 15.129 ( -1.410 -0.179 0.271) 1.447 15.280 ( -2.870 6.152 -2.611) 7.273 16.086 ( 7.635 8.314 7.535) 13.572 16.536 ( -1.391 -3.469 -2.696) 4.609 16.663 ( 2.163 -2.148 0.957) 3.195 19.906 ( -2.900 1.689 -2.075) 3.946 20.074 ( 4.776 -0.708 2.854) 5.609 20.172 ( -2.942 -3.692 -2.160) 5.191 20.374 ( 0.269 -6.364 1.098) 6.464 24.317 ( -1.549 1.655 -3.009) 3.767 24.910 ( 6.105 13.484 4.402) 15.442 24.954 ( 1.895 3.316 -1.759) 4.205 25.042 ( 1.739 1.375 3.598) 4.226 26.151 ( -2.754 0.786 -0.320) 2.882 26.226 ( 1.274 4.580 2.293) 5.278 26.591 ( -1.723 -2.145 -0.183) 2.757 26.818 ( 1.314 0.226 5.033) 5.207 26.864 ( -0.966 1.733 -7.128) 7.399 27.009 ( -1.805 6.046 -0.427) 6.325 27.261 ( 1.684 4.101 0.520) 4.464 27.521 ( 9.605 -0.511 -1.150) 9.687 27.701 ( -1.984 1.885 -0.359) 2.760 28.035 ( -5.572 -1.168 0.373) 5.705 29.010 ( -1.283 -9.786 -1.753) 10.024 29.072 ( 2.424 -4.929 0.159) 5.495 29.282 ( -1.645 -13.207 1.258) 13.369 29.556 ( 2.924 -15.271 2.958) 15.828 29.946 ( -0.890 7.952 1.102) 8.077 30.184 ( -8.797 -7.515 -5.253) 12.707 ======================= Grid point 37 (26/117) ======================= q-point: ( 0.60 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.905 ( -2.374 -23.514 0.940) 23.652 2.426 ( 1.274 -3.729 -0.500) 3.972 2.772 ( 2.516 -14.248 -1.665) 14.564 3.192 ( 14.008 -19.077 4.951) 24.180 3.368 ( 1.627 -2.236 1.126) 2.985 3.467 ( -6.126 -6.674 -2.509) 9.400 3.619 ( -6.085 -9.138 -2.472) 11.254 3.722 ( 7.097 -2.730 0.780) 7.644 3.843 ( -3.342 9.272 -1.957) 10.048 3.987 ( 2.321 5.721 7.518) 9.728 4.132 ( 6.731 -10.865 -2.188) 12.967 4.199 ( -1.479 2.540 -7.176) 7.755 4.268 ( -4.047 -3.244 4.898) 7.134 4.384 ( -7.209 4.159 -2.578) 8.713 4.425 ( -5.165 -6.035 -0.311) 7.950 4.483 ( 2.184 -3.544 7.530) 8.604 4.654 ( -3.144 -6.433 -8.569) 11.167 5.000 ( 5.761 5.687 5.836) 9.980 5.065 ( -3.572 14.314 -5.813) 15.857 5.196 ( 2.036 9.539 2.063) 9.970 5.333 ( 2.582 15.198 1.563) 15.495 5.420 ( -0.738 0.013 -2.252) 2.370 5.573 ( 9.451 -9.906 2.108) 13.852 5.731 ( 2.976 6.469 5.926) 9.264 5.816 ( 2.511 6.269 3.610) 7.657 5.871 ( -11.186 -3.833 -5.663) 13.111 5.890 ( -8.141 2.114 -8.130) 11.698 6.054 ( 7.075 1.245 2.295) 7.541 6.109 ( 8.059 -3.973 11.020) 14.219 6.239 ( -0.901 10.289 -4.754) 11.370 6.302 ( -5.854 -10.752 -9.049) 15.223 6.492 ( -6.427 7.385 -1.192) 9.862 6.587 ( 0.003 4.664 2.857) 5.470 6.613 ( -3.615 4.719 -2.105) 6.306 6.832 ( 3.605 1.233 -1.279) 4.019 6.863 ( -1.742 3.218 2.799) 4.607 6.877 ( 0.652 -3.112 -1.368) 3.461 7.154 ( 2.452 3.653 3.078) 5.369 7.222 ( 3.368 0.472 -4.772) 5.860 7.262 ( -0.865 0.920 1.562) 2.008 7.375 ( -0.649 4.905 0.564) 4.980 7.513 ( -0.575 11.835 3.621) 12.390 7.775 ( -2.813 3.266 -2.379) 4.923 7.829 ( 3.636 1.492 6.271) 7.401 7.941 ( -2.544 0.983 -3.069) 4.106 8.049 ( 1.088 0.756 -2.069) 2.457 8.145 ( 0.710 -0.096 1.165) 1.367 8.266 ( 2.894 6.834 3.017) 8.011 8.416 ( -1.368 -4.015 1.583) 4.527 8.563 ( -4.610 8.931 -5.426) 11.422 8.571 ( 0.010 1.131 -0.281) 1.166 8.727 ( 0.857 8.430 0.411) 8.483 8.941 ( 3.834 0.511 -0.309) 3.881 9.104 ( 6.559 -2.099 3.796) 7.863 9.257 ( 2.487 -4.813 4.120) 6.806 9.368 ( -12.786 4.649 -6.635) 15.137 10.345 ( 0.895 -2.650 2.413) 3.694 10.365 ( -2.217 -4.291 -3.996) 6.268 10.491 ( 1.577 2.117 0.422) 2.673 10.878 ( 1.337 2.568 1.776) 3.397 10.935 ( 0.151 -4.113 -0.929) 4.219 11.188 ( 1.869 -6.535 -0.407) 6.809 11.236 ( -1.878 -0.979 -0.502) 2.176 11.513 ( 8.727 -5.642 6.578) 12.299 11.632 ( -9.838 -5.428 -6.555) 13.008 12.216 ( 0.516 -3.260 0.609) 3.357 12.372 ( -2.196 -0.830 -1.273) 2.671 12.414 ( -1.507 -2.516 0.747) 3.027 12.539 ( 0.198 -2.701 -1.192) 2.959 12.683 ( -0.020 1.767 -0.370) 1.806 12.927 ( 0.822 -2.669 -0.198) 2.799 13.367 ( 2.405 14.897 0.665) 15.105 13.976 ( 4.806 -0.911 9.169) 10.392 14.055 ( -4.329 -0.106 -4.922) 6.556 14.295 ( -0.583 4.854 -0.165) 4.892 14.331 ( 7.205 6.865 9.753) 13.934 14.468 ( -4.385 7.558 -7.612) 11.589 14.811 ( -6.194 3.355 -7.342) 10.175 14.908 ( -0.064 -1.247 -0.008) 1.249 15.125 ( -0.179 0.210 0.085) 0.288 15.188 ( 0.327 3.108 0.914) 3.256 15.931 ( 3.618 11.098 3.298) 12.130 16.581 ( -0.190 -1.304 -0.840) 1.562 16.696 ( 0.950 -0.251 0.160) 0.996 19.857 ( -1.770 1.591 -1.193) 2.663 20.106 ( 3.776 0.156 2.684) 4.635 20.241 ( -3.112 -5.065 -2.331) 6.385 20.485 ( 0.467 -4.630 0.656) 4.699 24.279 ( -0.683 1.403 -1.158) 1.943 24.671 ( 2.920 12.182 1.797) 12.656 24.916 ( 0.477 2.166 -0.512) 2.276 25.037 ( 0.907 0.785 0.605) 1.343 26.126 ( -1.246 0.469 -0.212) 1.348 26.171 ( 0.220 1.630 0.565) 1.739 26.629 ( -0.871 -2.554 -0.221) 2.707 26.818 ( 0.880 0.937 1.862) 2.262 26.847 ( -0.994 -1.098 -1.993) 2.483 26.921 ( -0.990 2.193 -0.201) 2.414 27.175 ( 0.916 5.143 0.252) 5.230 27.563 ( 6.547 2.296 -2.107) 7.251 27.644 ( -3.838 1.000 1.647) 4.295 28.033 ( -1.627 -0.921 0.167) 1.877 29.101 ( 0.466 -0.518 0.065) 0.700 29.214 ( -0.998 -8.815 -1.269) 8.961 29.516 ( 2.756 -9.111 0.890) 9.560 29.767 ( -0.806 8.581 0.151) 8.620 29.909 ( 2.258 -17.924 2.532) 18.242 30.265 ( -6.183 -5.362 -2.737) 8.630 ======================= Grid point 38 (27/117) ======================= q-point: ( 0.70 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.334 ( -0.000 -18.585 -0.000) 18.585 2.497 ( -0.000 -4.074 -0.000) 4.074 3.000 ( -0.000 -6.593 -0.000) 6.593 3.404 ( -0.000 -0.636 -0.000) 0.636 3.427 ( 0.000 5.007 0.000) 5.007 3.631 ( 0.000 3.200 0.000) 3.200 3.649 ( -0.000 -12.662 -0.000) 12.662 3.714 ( 0.000 3.839 0.000) 3.839 3.826 ( -0.000 -10.432 -0.000) 10.432 3.903 ( 0.000 2.866 0.000) 2.866 4.093 ( 0.000 1.200 0.000) 1.200 4.183 ( 0.000 5.878 0.000) 5.878 4.320 ( 0.000 0.825 0.000) 0.825 4.432 ( -0.000 -3.488 -0.000) 3.488 4.515 ( -0.000 -5.587 -0.000) 5.587 4.618 ( -0.000 -4.736 -0.000) 4.736 4.671 ( 0.000 4.046 0.000) 4.046 4.792 ( 0.000 13.877 0.000) 13.877 4.872 ( -0.000 -1.809 -0.000) 1.809 5.063 ( 0.000 4.174 0.000) 4.174 5.189 ( -0.000 -8.836 -0.000) 8.836 5.434 ( 0.000 3.937 0.000) 3.937 5.446 ( 0.000 13.288 0.000) 13.288 5.623 ( 0.000 9.201 0.000) 9.201 5.794 ( -0.000 -5.878 -0.000) 5.878 5.934 ( 0.000 12.271 0.000) 12.271 5.982 ( -0.000 -4.985 -0.000) 4.985 6.055 ( -0.000 -13.340 -0.000) 13.340 6.105 ( 0.000 0.824 0.000) 0.824 6.148 ( 0.000 1.715 0.000) 1.715 6.361 ( 0.000 2.391 0.000) 2.391 6.490 ( 0.000 0.738 0.000) 0.738 6.543 ( 0.000 1.869 0.000) 1.869 6.626 ( -0.000 -12.895 -0.000) 12.895 6.784 ( 0.000 5.159 0.000) 5.159 6.824 ( 0.000 0.941 0.000) 0.941 6.974 ( -0.000 -5.655 -0.000) 5.655 7.064 ( 0.000 5.932 0.000) 5.932 7.095 ( 0.000 11.896 0.000) 11.896 7.270 ( 0.000 4.493 0.000) 4.493 7.295 ( 0.000 6.978 0.000) 6.978 7.382 ( -0.000 -10.660 -0.000) 10.660 7.687 ( 0.000 4.981 0.000) 4.981 7.717 ( 0.000 9.216 0.000) 9.216 7.876 ( 0.000 2.930 0.000) 2.930 8.044 ( 0.000 7.513 0.000) 7.513 8.112 ( -0.000 -1.333 -0.000) 1.333 8.197 ( -0.000 -2.611 -0.000) 2.611 8.445 ( -0.000 -1.382 -0.000) 1.382 8.553 ( -0.000 -4.700 -0.000) 4.700 8.557 ( 0.000 0.470 0.000) 0.470 8.646 ( 0.000 2.303 0.000) 2.303 8.900 ( 0.000 2.765 0.000) 2.765 9.180 ( 0.000 6.650 0.000) 6.650 9.184 ( 0.000 0.533 0.000) 0.533 9.393 ( -0.000 -8.477 -0.000) 8.477 10.374 ( -0.000 -0.555 -0.000) 0.555 10.438 ( -0.000 -3.250 -0.000) 3.250 10.447 ( 0.000 2.492 0.000) 2.492 10.809 ( 0.000 4.882 0.000) 4.882 11.007 ( -0.000 -3.149 -0.000) 3.149 11.224 ( 0.000 1.087 0.000) 1.087 11.277 ( -0.000 -1.888 -0.000) 1.888 11.669 ( -0.000 -4.870 -0.000) 4.870 11.671 ( -0.000 -3.766 -0.000) 3.766 12.263 ( -0.000 -1.487 -0.000) 1.487 12.375 ( -0.000 -0.413 -0.000) 0.413 12.449 ( -0.000 -1.018 -0.000) 1.018 12.592 ( -0.000 -1.888 -0.000) 1.888 12.636 ( 0.000 2.781 0.000) 2.781 12.928 ( 0.000 3.416 0.000) 3.416 13.186 ( 0.000 3.610 0.000) 3.610 14.001 ( 0.000 0.261 0.000) 0.261 14.080 ( -0.000 -3.156 -0.000) 3.156 14.200 ( 0.000 4.369 0.000) 4.369 14.251 ( 0.000 3.114 0.000) 3.114 14.351 ( 0.000 1.994 0.000) 1.994 14.807 ( -0.000 -4.034 -0.000) 4.034 14.922 ( -0.000 -0.120 -0.000) 0.120 15.120 ( 0.000 0.003 0.000) 0.003 15.160 ( -0.000 -0.384 -0.000) 0.384 15.715 ( 0.000 11.702 0.000) 11.702 16.569 ( 0.000 2.622 0.000) 2.622 16.699 ( -0.000 -0.252 -0.000) 0.252 19.826 ( 0.000 0.889 0.000) 0.889 20.118 ( -0.000 -0.166 -0.000) 0.166 20.319 ( -0.000 -3.805 -0.000) 3.805 20.555 ( -0.000 -2.246 -0.000) 2.246 24.254 ( 0.000 0.910 0.000) 0.910 24.485 ( 0.000 7.695 0.000) 7.695 24.881 ( 0.000 1.365 0.000) 1.365 25.017 ( 0.000 1.479 0.000) 1.479 26.119 ( -0.000 -0.141 -0.000) 0.141 26.161 ( -0.000 -0.423 -0.000) 0.423 26.678 ( -0.000 -2.685 -0.000) 2.685 26.799 ( 0.000 1.168 0.000) 1.168 26.874 ( -0.000 -0.890 -0.000) 0.890 26.911 ( -0.000 -1.858 -0.000) 1.858 27.086 ( 0.000 3.903 0.000) 3.903 27.494 ( 0.000 5.571 0.000) 5.571 27.636 ( -0.000 -0.216 -0.000) 0.216 28.050 ( -0.000 -1.298 -0.000) 1.298 29.095 ( 0.000 0.792 0.000) 0.792 29.350 ( -0.000 -5.035 -0.000) 5.035 29.625 ( 0.000 4.813 0.000) 4.813 29.647 ( -0.000 -3.126 -0.000) 3.126 30.256 ( -0.000 -16.146 -0.000) 16.146 30.304 ( -0.000 -0.392 -0.000) 0.392 ======================= Grid point 46 (28/117) ======================= q-point: ( 0.40 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.305 ( 11.735 0.000 -13.402) 17.813 1.991 ( 11.815 0.000 0.262) 11.818 2.012 ( 9.244 0.000 -3.551) 9.902 2.433 ( -2.963 -0.000 12.663) 13.005 2.987 ( -29.442 -0.000 -3.806) 29.687 3.114 ( 13.253 0.000 4.017) 13.848 3.304 ( 3.249 0.000 -0.168) 3.253 3.435 ( 27.951 0.000 5.408) 28.469 3.683 ( 1.070 0.000 6.292) 6.383 3.820 ( -0.919 -0.000 -4.773) 4.861 3.996 ( -7.790 -0.000 10.018) 12.690 4.082 ( 6.556 0.000 15.535) 16.862 4.141 ( -7.371 -0.000 -12.976) 14.923 4.307 ( 0.400 0.000 -7.198) 7.209 4.598 ( -4.185 -0.000 4.788) 6.359 4.696 ( -30.172 -0.000 -15.220) 33.794 4.887 ( 9.739 0.000 -3.844) 10.470 5.075 ( -2.624 -0.000 -8.089) 8.504 5.087 ( 18.648 0.000 5.387) 19.410 5.208 ( 9.971 0.000 9.780) 13.967 5.261 ( -13.653 -0.000 -0.787) 13.676 5.635 ( -1.085 -0.000 -7.140) 7.222 5.691 ( 0.932 0.000 -5.495) 5.574 5.746 ( -3.308 -0.000 -10.483) 10.992 5.883 ( 3.193 0.000 4.499) 5.517 6.052 ( 0.007 0.000 2.565) 2.565 6.092 ( 1.833 0.000 2.468) 3.075 6.290 ( 7.353 0.000 -8.544) 11.272 6.398 ( -1.257 -0.000 0.111) 1.262 6.519 ( -8.372 -0.000 -7.292) 11.103 6.549 ( 0.181 0.000 5.062) 5.065 6.635 ( 5.989 0.000 10.616) 12.189 6.743 ( 3.757 0.000 6.180) 7.232 6.790 ( -2.608 -0.000 -2.596) 3.680 6.976 ( 4.424 0.000 2.337) 5.004 7.032 ( 5.147 0.000 -6.146) 8.017 7.048 ( -7.137 -0.000 2.716) 7.636 7.253 ( -8.449 -0.000 6.017) 10.373 7.320 ( -3.848 -0.000 -13.518) 14.055 7.401 ( 10.811 0.000 7.930) 13.407 7.563 ( -1.434 -0.000 -2.880) 3.217 7.667 ( 0.484 0.000 -1.189) 1.283 7.851 ( -0.760 -0.000 3.174) 3.264 7.890 ( -3.014 -0.000 -3.493) 4.613 7.955 ( -8.727 -0.000 -1.477) 8.851 8.109 ( 5.043 0.000 10.106) 11.295 8.151 ( -3.446 -0.000 -2.973) 4.551 8.290 ( -6.158 -0.000 -8.593) 10.572 8.501 ( 3.601 0.000 4.179) 5.517 8.580 ( 7.852 0.000 12.438) 14.710 8.712 ( 3.800 0.000 3.018) 4.852 8.741 ( 0.504 0.000 0.026) 0.505 8.783 ( -0.549 -0.000 -1.745) 1.829 8.867 ( -0.049 -0.000 -3.063) 3.063 9.681 ( -5.812 -0.000 -5.058) 7.705 10.070 ( -0.103 -0.000 -1.630) 1.633 10.077 ( 2.094 0.000 11.132) 11.328 10.134 ( -0.692 -0.000 -9.299) 9.324 10.481 ( 1.988 0.000 0.869) 2.170 10.504 ( -0.617 -0.000 -2.308) 2.389 10.878 ( 8.319 0.000 3.868) 9.174 10.938 ( 1.427 0.000 -0.754) 1.614 11.115 ( -3.426 -0.000 -4.121) 5.359 11.215 ( 7.473 0.000 7.758) 10.772 11.444 ( -10.107 -0.000 -7.940) 12.853 11.988 ( 1.569 0.000 2.100) 2.621 12.331 ( -2.838 -0.000 0.412) 2.867 12.399 ( -0.032 -0.000 0.148) 0.152 12.442 ( -16.756 -0.000 -10.478) 19.762 12.717 ( 2.971 0.000 -0.100) 2.973 12.792 ( 3.024 0.000 0.069) 3.025 13.917 ( -4.421 -0.000 1.991) 4.848 14.094 ( 2.238 0.000 -1.862) 2.911 14.204 ( -5.572 -0.000 1.220) 5.704 14.496 ( -0.082 -0.000 0.709) 0.714 14.636 ( 8.111 0.000 15.291) 17.309 14.858 ( 0.069 0.000 -0.280) 0.289 14.988 ( -5.219 -0.000 -0.652) 5.259 15.116 ( -0.513 -0.000 1.218) 1.321 15.245 ( 6.765 0.000 1.905) 7.028 15.535 ( -6.142 -0.000 -8.416) 10.419 16.234 ( 8.017 0.000 4.709) 9.298 16.433 ( -1.659 -0.000 -2.114) 2.687 16.574 ( 0.029 0.000 3.360) 3.360 19.942 ( -0.946 -0.000 -1.608) 1.865 20.034 ( 1.218 0.000 0.160) 1.229 20.146 ( 1.318 0.000 1.341) 1.880 20.164 ( 0.134 0.000 0.454) 0.474 24.357 ( -1.953 -0.000 -3.909) 4.370 24.979 ( 3.175 0.000 -0.584) 3.228 25.046 ( 4.322 0.000 -3.032) 5.280 25.359 ( -6.007 -0.000 12.518) 13.885 26.174 ( -3.101 -0.000 0.111) 3.103 26.441 ( -0.028 -0.000 10.394) 10.394 26.542 ( -1.433 -0.000 0.203) 1.447 26.825 ( 1.270 0.000 5.779) 5.917 27.011 ( -3.149 -0.000 -9.065) 9.596 27.306 ( 0.344 0.000 -0.041) 0.346 27.329 ( 1.706 0.000 -0.120) 1.710 27.510 ( 10.678 0.000 2.040) 10.871 27.801 ( -11.100 -0.000 -2.096) 11.297 27.822 ( 2.027 0.000 -6.522) 6.829 28.742 ( -0.253 -0.000 0.186) 0.314 28.858 ( 0.328 0.000 0.321) 0.459 28.934 ( -1.998 -0.000 0.160) 2.004 29.146 ( -0.441 -0.000 -0.638) 0.776 29.892 ( 0.459 0.000 -8.169) 8.182 30.220 ( 2.260 0.000 3.192) 3.912 ======================= Grid point 47 (29/117) ======================= q-point: ( 0.50 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.348 ( 4.726 -1.801 -2.775) 5.768 2.044 ( -6.418 -10.931 -3.780) 13.227 2.299 ( 2.906 -7.217 2.748) 8.251 2.517 ( 22.735 -11.899 4.047) 25.978 2.951 ( -25.764 -12.205 -2.923) 28.658 3.270 ( 3.863 -10.035 -0.490) 10.764 3.381 ( 1.271 -5.414 -1.275) 5.705 3.597 ( 5.979 3.705 -4.208) 8.197 3.805 ( 1.122 -8.841 15.062) 17.501 3.830 ( 12.426 -3.756 3.451) 13.432 3.952 ( -2.777 -2.033 -1.657) 3.820 4.110 ( 4.112 0.260 1.915) 4.544 4.159 ( 5.932 -4.430 6.039) 9.554 4.324 ( -3.030 0.030 -7.097) 7.717 4.473 ( -9.565 1.862 -0.380) 9.752 4.651 ( -9.833 -3.178 -2.651) 10.669 4.813 ( -0.452 11.900 -7.871) 14.275 4.884 ( -2.517 8.222 -2.784) 9.038 5.105 ( -1.007 -0.332 1.779) 2.071 5.335 ( 9.601 -8.654 4.851) 13.806 5.427 ( 2.053 -8.377 3.607) 9.348 5.602 ( -8.080 3.916 -7.988) 12.017 5.615 ( 0.560 7.376 -2.602) 7.842 5.748 ( 4.929 -3.458 -5.616) 8.233 5.888 ( -0.583 2.747 3.390) 4.402 6.007 ( 1.532 7.791 -1.526) 8.086 6.030 ( -0.867 2.209 6.745) 7.151 6.272 ( -0.369 3.260 -3.606) 4.875 6.360 ( 1.549 9.401 -4.963) 10.742 6.422 ( -3.240 8.435 2.000) 9.254 6.500 ( -0.598 -3.964 -1.444) 4.261 6.646 ( 3.216 2.256 6.996) 8.023 6.707 ( -4.641 7.269 -4.177) 9.583 6.779 ( 5.259 1.580 1.698) 5.748 6.902 ( -4.012 5.665 0.469) 6.958 6.945 ( 0.702 2.531 0.517) 2.677 7.105 ( 3.986 2.251 1.386) 4.783 7.204 ( -4.366 -0.957 3.878) 5.917 7.257 ( -0.900 2.833 -8.828) 9.315 7.431 ( 0.551 7.343 -0.388) 7.374 7.585 ( 5.478 -6.801 6.386) 10.819 7.625 ( 0.048 5.157 1.075) 5.268 7.821 ( 1.341 4.163 -1.672) 4.683 7.843 ( -1.881 -0.493 -0.942) 2.161 7.884 ( -6.655 1.428 -2.547) 7.267 8.136 ( 1.971 -0.291 7.464) 7.725 8.169 ( -0.567 -0.370 -1.920) 2.036 8.263 ( -4.290 -2.192 -5.042) 6.973 8.577 ( 3.471 -1.401 3.329) 5.009 8.620 ( 1.474 2.647 2.274) 3.788 8.746 ( 2.700 3.058 0.439) 4.103 8.752 ( 3.378 -2.804 4.855) 6.546 8.833 ( -5.951 -4.755 -5.500) 9.395 8.886 ( 1.247 -9.084 1.584) 9.305 9.589 ( 2.117 8.339 -0.820) 8.642 9.742 ( -4.848 19.864 -1.333) 20.490 10.144 ( -0.666 -3.800 -0.522) 3.893 10.241 ( 0.123 -4.311 -1.290) 4.502 10.492 ( 0.546 -1.691 -1.395) 2.259 10.666 ( 1.273 -11.663 1.365) 11.812 10.896 ( 7.252 0.801 4.274) 8.455 10.965 ( -3.048 -1.029 -3.342) 4.638 11.123 ( -1.466 -3.048 -1.136) 3.567 11.310 ( 8.075 -3.999 6.861) 11.326 11.425 ( -9.759 -4.132 -7.128) 12.772 12.041 ( 0.893 -4.239 0.937) 4.432 12.320 ( -3.156 -1.137 -0.979) 3.494 12.355 ( -4.674 0.412 -2.489) 5.311 12.436 ( -1.407 -2.565 -1.325) 3.212 12.727 ( 1.453 0.472 -0.046) 1.529 12.819 ( 1.423 -1.473 -0.032) 2.049 13.889 ( -2.008 1.528 0.713) 2.622 14.015 ( 0.771 9.381 -0.290) 9.417 14.140 ( -2.120 1.974 1.037) 3.076 14.466 ( -0.198 2.923 0.452) 2.964 14.648 ( 6.508 4.892 10.232) 13.076 14.853 ( 0.737 1.340 -3.152) 3.503 14.862 ( -1.470 7.241 1.743) 7.591 15.117 ( -0.420 -0.315 0.379) 0.647 15.175 ( -0.486 10.272 -3.515) 10.867 15.399 ( -2.304 7.711 -3.243) 8.676 16.244 ( 4.111 3.659 3.897) 6.744 16.454 ( -1.445 -3.069 -1.848) 3.863 16.615 ( 0.689 -3.339 1.042) 3.565 19.924 ( -0.962 1.274 -0.968) 1.867 20.052 ( 0.972 -1.968 0.209) 2.205 20.145 ( 0.420 0.557 0.317) 0.767 20.243 ( -0.068 -6.467 0.452) 6.483 24.336 ( -0.938 1.100 -1.899) 2.387 24.987 ( 1.630 0.785 -0.299) 1.834 25.058 ( 2.669 0.830 -2.370) 3.665 25.221 ( -1.734 10.930 6.864) 13.022 26.152 ( -1.608 0.643 -0.009) 1.731 26.360 ( 0.880 7.166 3.598) 8.066 26.549 ( -0.830 -1.269 0.002) 1.517 26.831 ( 0.857 0.212 3.929) 4.027 26.920 ( -0.853 4.723 -6.047) 7.720 27.174 ( 0.269 10.930 -0.475) 10.944 27.314 ( 0.348 0.888 0.108) 0.960 27.585 ( 10.971 0.226 0.866) 11.008 27.703 ( -6.611 0.842 -1.695) 6.877 27.942 ( -3.506 -5.733 -0.723) 6.759 28.820 ( -0.359 -7.644 -0.438) 7.665 28.966 ( 3.271 -8.711 0.667) 9.329 29.014 ( -4.061 -8.989 0.111) 9.864 29.284 ( -0.436 -12.655 0.763) 12.686 29.939 ( -1.577 -4.307 -4.128) 6.170 30.171 ( 0.762 5.424 1.428) 5.661 ======================= Grid point 48 (30/117) ======================= q-point: ( 0.60 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.508 ( -0.000 -14.573 -0.000) 14.573 2.274 ( -0.000 -12.062 -0.000) 12.062 2.492 ( -0.000 -13.670 -0.000) 13.670 2.911 ( -0.000 -15.130 -0.000) 15.130 3.150 ( -0.000 -17.522 -0.000) 17.522 3.423 ( 0.000 4.354 0.000) 4.354 3.482 ( -0.000 -7.477 -0.000) 7.477 3.568 ( -0.000 -6.393 -0.000) 6.393 3.909 ( -0.000 -10.472 -0.000) 10.472 4.045 ( -0.000 -8.025 -0.000) 8.025 4.046 ( 0.000 0.398 0.000) 0.398 4.110 ( 0.000 1.009 0.000) 1.009 4.220 ( 0.000 3.700 0.000) 3.700 4.340 ( -0.000 -6.938 -0.000) 6.938 4.473 ( 0.000 0.210 0.000) 0.210 4.516 ( 0.000 11.773 0.000) 11.773 4.629 ( 0.000 4.035 0.000) 4.035 4.879 ( -0.000 -9.881 -0.000) 9.881 5.241 ( -0.000 -13.569 -0.000) 13.569 5.386 ( 0.000 14.533 0.000) 14.533 5.423 ( 0.000 8.927 0.000) 8.927 5.499 ( 0.000 2.974 0.000) 2.974 5.587 ( -0.000 -10.434 -0.000) 10.434 5.723 ( 0.000 16.831 0.000) 16.831 5.798 ( 0.000 1.645 0.000) 1.645 5.915 ( -0.000 -8.493 -0.000) 8.493 6.036 ( 0.000 3.323 0.000) 3.323 6.115 ( 0.000 13.860 0.000) 13.860 6.176 ( 0.000 8.101 0.000) 8.101 6.227 ( 0.000 5.011 0.000) 5.011 6.438 ( 0.000 9.780 0.000) 9.780 6.614 ( 0.000 4.754 0.000) 4.754 6.638 ( -0.000 -2.684 -0.000) 2.684 6.684 ( 0.000 6.402 0.000) 6.402 6.842 ( 0.000 0.856 0.000) 0.856 6.911 ( 0.000 2.234 0.000) 2.234 6.960 ( 0.000 9.064 0.000) 9.064 7.217 ( 0.000 0.909 0.000) 0.909 7.257 ( -0.000 -2.298 -0.000) 2.298 7.276 ( 0.000 7.013 0.000) 7.013 7.488 ( 0.000 6.961 0.000) 6.961 7.678 ( 0.000 4.273 0.000) 4.273 7.805 ( -0.000 -4.379 -0.000) 4.379 7.821 ( 0.000 2.395 0.000) 2.395 7.892 ( -0.000 -3.809 -0.000) 3.809 8.107 ( 0.000 4.107 0.000) 4.107 8.152 ( 0.000 0.512 0.000) 0.512 8.333 ( -0.000 -4.702 -0.000) 4.702 8.425 ( 0.000 11.143 0.000) 11.143 8.594 ( 0.000 1.171 0.000) 1.171 8.680 ( 0.000 3.662 0.000) 3.662 8.916 ( -0.000 -5.560 -0.000) 5.560 8.930 ( -0.000 -4.136 -0.000) 4.136 9.031 ( -0.000 -0.831 -0.000) 0.831 9.289 ( 0.000 13.583 0.000) 13.583 9.457 ( 0.000 8.560 0.000) 8.560 10.241 ( -0.000 -6.017 -0.000) 6.017 10.306 ( -0.000 -2.696 -0.000) 2.696 10.520 ( -0.000 -0.179 -0.000) 0.179 10.853 ( -0.000 -5.527 -0.000) 5.527 10.911 ( 0.000 0.957 0.000) 0.957 11.029 ( -0.000 -8.531 -0.000) 8.531 11.190 ( -0.000 -3.295 -0.000) 3.295 11.457 ( -0.000 -5.530 -0.000) 5.530 11.464 ( -0.000 -5.408 -0.000) 5.408 12.139 ( -0.000 -4.860 -0.000) 4.860 12.338 ( -0.000 -1.557 -0.000) 1.557 12.357 ( -0.000 -2.077 -0.000) 2.077 12.485 ( -0.000 -2.751 -0.000) 2.751 12.715 ( 0.000 1.214 0.000) 1.214 12.868 ( -0.000 -3.038 -0.000) 3.038 13.693 ( 0.000 16.320 0.000) 16.320 13.941 ( -0.000 -1.534 -0.000) 1.534 14.092 ( 0.000 2.801 0.000) 2.801 14.388 ( 0.000 4.741 0.000) 4.741 14.525 ( 0.000 8.946 0.000) 8.946 14.659 ( 0.000 12.104 0.000) 12.104 14.875 ( -0.000 -1.828 -0.000) 1.828 14.923 ( 0.000 10.819 0.000) 10.819 15.123 ( -0.000 -0.278 -0.000) 0.278 15.270 ( 0.000 5.207 0.000) 5.207 16.137 ( 0.000 8.398 0.000) 8.398 16.523 ( -0.000 -3.908 -0.000) 3.908 16.678 ( -0.000 -2.217 -0.000) 2.217 19.887 ( 0.000 1.930 0.000) 1.930 20.128 ( -0.000 -4.904 -0.000) 4.904 20.130 ( 0.000 0.789 0.000) 0.789 20.376 ( -0.000 -6.568 -0.000) 6.568 24.306 ( 0.000 1.551 0.000) 1.551 24.953 ( 0.000 14.981 0.000) 14.981 24.963 ( 0.000 2.165 0.000) 2.165 25.052 ( 0.000 0.592 0.000) 0.592 26.133 ( 0.000 0.693 0.000) 0.693 26.236 ( 0.000 5.078 0.000) 5.078 26.580 ( -0.000 -2.124 -0.000) 2.124 26.832 ( -0.000 -0.008 -0.000) 0.008 26.853 ( 0.000 2.099 0.000) 2.099 26.996 ( 0.000 6.409 0.000) 6.409 27.271 ( 0.000 3.843 0.000) 3.843 27.617 ( 0.000 0.137 0.000) 0.137 27.651 ( 0.000 2.009 0.000) 2.009 28.001 ( -0.000 -1.981 -0.000) 1.981 29.001 ( -0.000 -9.929 -0.000) 9.929 29.090 ( -0.000 -3.566 -0.000) 3.566 29.271 ( -0.000 -15.518 -0.000) 15.518 29.577 ( -0.000 -16.534 -0.000) 16.534 29.937 ( 0.000 6.937 0.000) 6.937 30.129 ( -0.000 -4.498 -0.000) 4.498 ======================= Grid point 59 (31/117) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 66 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.372 ( 0.000 0.000 -0.000) 0.000 1.900 ( 0.000 0.000 0.000) 0.000 2.317 ( -0.000 -0.000 -0.000) 0.000 2.412 ( 0.000 0.000 -0.000) 0.000 2.711 ( 0.000 0.000 0.000) 0.000 3.167 ( 0.000 0.000 0.000) 0.000 3.322 ( 0.000 0.000 -0.000) 0.000 3.660 ( 0.000 0.000 0.000) 0.000 3.740 ( -0.000 -0.000 0.000) 0.000 3.812 ( 0.000 0.000 -0.000) 0.000 3.970 ( 0.000 0.000 -0.000) 0.000 4.105 ( -0.000 -0.000 -0.000) 0.000 4.139 ( 0.000 0.000 -0.000) 0.000 4.310 ( 0.000 0.000 0.000) 0.000 4.406 ( 0.000 0.000 0.000) 0.000 4.569 ( 0.000 0.000 -0.000) 0.000 4.975 ( 0.000 0.000 -0.000) 0.000 5.074 ( 0.000 0.000 -0.000) 0.000 5.121 ( -0.000 -0.000 0.000) 0.000 5.225 ( 0.000 0.000 0.000) 0.000 5.289 ( -0.000 -0.000 -0.000) 0.000 5.586 ( 0.000 0.000 -0.000) 0.000 5.697 ( 0.000 0.000 -0.000) 0.000 5.737 ( 0.000 0.000 0.000) 0.000 5.905 ( 0.000 0.000 -0.000) 0.000 6.052 ( 0.000 0.000 0.000) 0.000 6.102 ( 0.000 0.000 -0.000) 0.000 6.337 ( 0.000 0.000 0.000) 0.000 6.383 ( 0.000 0.000 -0.000) 0.000 6.444 ( 0.000 0.000 -0.000) 0.000 6.548 ( 0.000 0.000 -0.000) 0.000 6.679 ( 0.000 0.000 -0.000) 0.000 6.771 ( 0.000 0.000 -0.000) 0.000 6.805 ( 0.000 0.000 -0.000) 0.000 6.991 ( 0.000 0.000 0.000) 0.000 7.002 ( 0.000 0.000 -0.000) 0.000 7.117 ( -0.000 -0.000 0.000) 0.000 7.140 ( 0.000 0.000 0.000) 0.000 7.294 ( 0.000 0.000 -0.000) 0.000 7.492 ( 0.000 0.000 -0.000) 0.000 7.551 ( 0.000 0.000 0.000) 0.000 7.663 ( 0.000 0.000 -0.000) 0.000 7.848 ( 0.000 0.000 0.000) 0.000 7.880 ( -0.000 -0.000 0.000) 0.000 7.887 ( 0.000 0.000 -0.000) 0.000 8.111 ( 0.000 0.000 -0.000) 0.000 8.188 ( 0.000 0.000 0.000) 0.000 8.213 ( -0.000 -0.000 -0.000) 0.000 8.527 ( 0.000 0.000 -0.000) 0.000 8.637 ( 0.000 0.000 0.000) 0.000 8.742 ( 0.000 0.000 0.000) 0.000 8.743 ( 0.000 0.000 -0.000) 0.000 8.775 ( 0.000 0.000 0.000) 0.000 8.866 ( 0.000 0.000 0.000) 0.000 9.642 ( 0.000 0.000 0.000) 0.000 10.069 ( 0.000 0.000 0.000) 0.000 10.108 ( 0.000 0.000 0.000) 0.000 10.112 ( 0.000 0.000 -0.000) 0.000 10.494 ( 0.000 0.000 0.000) 0.000 10.500 ( 0.000 0.000 -0.000) 0.000 10.938 ( 0.000 0.000 0.000) 0.000 10.946 ( 0.000 0.000 -0.000) 0.000 11.086 ( 0.000 0.000 -0.000) 0.000 11.315 ( 0.000 0.000 0.000) 0.000 11.327 ( -0.000 -0.000 -0.000) 0.000 11.998 ( 0.000 0.000 -0.000) 0.000 12.288 ( 0.000 0.000 -0.000) 0.000 12.358 ( 0.000 0.000 0.000) 0.000 12.400 ( 0.000 0.000 -0.000) 0.000 12.736 ( 0.000 0.000 0.000) 0.000 12.810 ( 0.000 0.000 -0.000) 0.000 13.889 ( 0.000 0.000 0.000) 0.000 14.130 ( 0.000 0.000 -0.000) 0.000 14.148 ( 0.000 0.000 -0.000) 0.000 14.495 ( 0.000 0.000 -0.000) 0.000 14.707 ( 0.000 0.000 0.000) 0.000 14.873 ( 0.000 0.000 -0.000) 0.000 14.925 ( 0.000 0.000 0.000) 0.000 15.113 ( 0.000 0.000 -0.000) 0.000 15.288 ( 0.000 0.000 0.000) 0.000 15.495 ( 0.000 0.000 -0.000) 0.000 16.288 ( 0.000 0.000 -0.000) 0.000 16.419 ( 0.000 0.000 0.000) 0.000 16.575 ( 0.000 0.000 0.000) 0.000 19.935 ( 0.000 0.000 -0.000) 0.000 20.042 ( 0.000 0.000 0.000) 0.000 20.155 ( 0.000 0.000 0.000) 0.000 20.165 ( 0.000 0.000 -0.000) 0.000 24.344 ( 0.000 0.000 0.000) 0.000 24.999 ( 0.000 0.000 -0.000) 0.000 25.076 ( 0.000 0.000 -0.000) 0.000 25.322 ( 0.000 0.000 0.000) 0.000 26.154 ( 0.000 0.000 -0.000) 0.000 26.445 ( 0.000 0.000 -0.000) 0.000 26.534 ( 0.000 0.000 -0.000) 0.000 26.837 ( 0.000 0.000 0.000) 0.000 26.986 ( 0.000 0.000 0.000) 0.000 27.308 ( 0.000 0.000 0.000) 0.000 27.339 ( 0.000 0.000 -0.000) 0.000 27.626 ( 0.000 0.000 -0.000) 0.000 27.683 ( 0.000 0.000 0.000) 0.000 27.832 ( 0.000 0.000 0.000) 0.000 28.740 ( 0.000 0.000 -0.000) 0.000 28.860 ( 0.000 0.000 0.000) 0.000 28.922 ( 0.000 0.000 0.000) 0.000 29.143 ( 0.000 0.000 -0.000) 0.000 29.892 ( 0.000 0.000 -0.000) 0.000 30.235 ( 0.000 0.000 -0.000) 0.000 ======================= Grid point 107 (32/117) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.913 ( 10.571 0.000 39.966) 41.340 0.944 ( 7.498 0.000 42.207) 42.868 1.542 ( 13.694 0.000 67.673) 69.045 2.408 ( -8.829 -0.000 -25.250) 26.749 2.727 ( -6.343 -0.000 -35.991) 36.546 2.946 ( 4.626 0.000 2.976) 5.500 3.359 ( -15.956 -0.000 -11.816) 19.855 3.734 ( 4.938 0.000 2.315) 5.453 3.810 ( -1.820 -0.000 -2.753) 3.300 3.942 ( -10.571 -0.000 -2.310) 10.820 4.071 ( 13.233 0.000 6.491) 14.740 4.139 ( -10.756 -0.000 -7.914) 13.354 4.445 ( 6.818 0.000 -4.262) 8.041 4.581 ( 12.070 0.000 7.255) 14.082 4.601 ( -2.655 -0.000 -10.711) 11.035 4.713 ( 7.006 0.000 1.581) 7.183 4.808 ( 18.314 0.000 1.922) 18.414 4.812 ( -11.581 -0.000 -0.173) 11.582 4.914 ( -7.601 -0.000 8.174) 11.161 5.345 ( -1.010 -0.000 -1.693) 1.972 5.396 ( -2.598 -0.000 -7.343) 7.789 5.489 ( -7.301 -0.000 11.133) 13.314 5.564 ( 3.582 0.000 -6.018) 7.004 5.720 ( -2.412 -0.000 3.660) 4.384 5.758 ( -0.910 -0.000 -10.266) 10.306 5.927 ( -5.801 -0.000 -15.597) 16.641 5.973 ( 2.426 0.000 7.574) 7.954 6.033 ( -15.936 -0.000 4.157) 16.469 6.229 ( 1.520 0.000 -7.797) 7.944 6.378 ( 10.133 0.000 3.413) 10.692 6.547 ( -6.012 -0.000 10.433) 12.041 6.645 ( 8.166 0.000 11.428) 14.046 6.731 ( -10.611 -0.000 3.790) 11.268 6.820 ( 7.099 0.000 -6.807) 9.835 6.905 ( 0.328 0.000 -3.609) 3.624 7.035 ( -9.344 -0.000 -4.075) 10.194 7.170 ( 1.396 0.000 8.777) 8.887 7.220 ( 2.213 0.000 2.554) 3.380 7.478 ( 0.429 0.000 -5.186) 5.204 7.534 ( -10.480 -0.000 -4.785) 11.521 7.637 ( -1.712 -0.000 -0.609) 1.817 7.790 ( 7.211 0.000 2.391) 7.596 7.814 ( -11.466 -0.000 -7.398) 13.645 7.889 ( 2.872 0.000 1.547) 3.262 8.029 ( 9.169 0.000 6.538) 11.261 8.244 ( 6.918 0.000 4.322) 8.157 8.344 ( -1.589 -0.000 -5.417) 5.645 8.452 ( 2.428 0.000 0.359) 2.455 8.458 ( -1.461 -0.000 3.456) 3.752 8.478 ( -6.982 -0.000 0.215) 6.985 8.661 ( -0.712 -0.000 -1.815) 1.950 8.663 ( -2.419 -0.000 3.040) 3.885 8.848 ( -0.003 -0.000 0.104) 0.104 9.011 ( -30.924 -0.000 -2.771) 31.048 9.957 ( 16.824 0.000 3.848) 17.258 10.033 ( 4.002 0.000 0.335) 4.016 10.035 ( -2.634 -0.000 0.484) 2.679 10.088 ( -4.097 -0.000 -0.894) 4.194 10.408 ( -8.148 -0.000 2.514) 8.527 10.488 ( 4.051 0.000 3.851) 5.589 10.563 ( -5.573 -0.000 -4.517) 7.174 10.734 ( 0.505 0.000 -4.390) 4.419 11.014 ( 4.637 0.000 5.074) 6.873 11.234 ( -4.205 -0.000 -3.284) 5.335 11.847 ( -6.678 -0.000 1.878) 6.937 11.989 ( -1.396 -0.000 -3.111) 3.410 12.411 ( -1.940 -0.000 -0.262) 1.958 12.418 ( 2.146 0.000 -0.463) 2.196 12.548 ( 1.715 0.000 1.537) 2.303 12.641 ( -7.017 -0.000 -1.767) 7.236 13.481 ( 92.335 0.000 2.653) 92.373 13.766 ( -29.189 -0.000 -9.536) 30.707 14.164 ( 6.935 0.000 2.465) 7.360 14.265 ( -4.537 -0.000 3.396) 5.667 14.434 ( -1.716 -0.000 2.854) 3.330 14.455 ( 3.596 0.000 2.081) 4.154 14.602 ( 6.253 0.000 -2.700) 6.811 14.737 ( -4.214 -0.000 -4.502) 6.166 15.207 ( 5.111 0.000 8.372) 9.808 15.443 ( 14.792 0.000 -0.853) 14.817 15.636 ( 8.606 0.000 3.520) 9.298 15.954 ( -16.059 -0.000 -7.685) 17.803 16.432 ( 9.558 0.000 0.281) 9.562 16.454 ( -1.451 -0.000 -0.654) 1.592 19.939 ( 2.961 0.000 -0.595) 3.021 19.966 ( -1.732 -0.000 -1.209) 2.113 20.112 ( 0.259 0.000 2.051) 2.067 20.168 ( 0.372 0.000 -0.252) 0.449 24.529 ( -10.859 -0.000 0.031) 10.859 24.543 ( 53.239 0.000 -0.506) 53.241 24.793 ( 1.170 0.000 1.709) 2.071 24.884 ( -1.072 -0.000 -1.503) 1.846 26.217 ( 2.606 0.000 2.295) 3.473 26.331 ( -0.513 -0.000 -1.735) 1.810 26.711 ( -0.713 -0.000 0.592) 0.927 26.753 ( 0.333 0.000 -0.872) 0.933 27.041 ( 2.663 0.000 2.313) 3.527 27.172 ( -1.711 -0.000 -2.339) 2.898 27.294 ( -1.316 -0.000 0.231) 1.336 27.314 ( 0.743 0.000 -0.386) 0.837 28.147 ( -2.044 -0.000 2.219) 3.017 28.304 ( -0.085 -0.000 -3.809) 3.810 28.817 ( -2.408 -0.000 4.442) 5.052 29.000 ( 0.738 0.000 -2.678) 2.777 29.020 ( 11.638 0.000 3.717) 12.217 29.234 ( -4.092 -0.000 -3.770) 5.564 30.030 ( 9.645 0.000 1.314) 9.734 30.094 ( -51.364 -0.000 -0.997) 51.373 ======================= Grid point 108 (33/117) ======================= q-point: ( 0.10 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.156 ( 5.826 -21.221 28.873) 36.303 1.389 ( 14.557 -27.885 30.936) 44.119 2.154 ( 23.587 -38.749 49.091) 66.841 2.321 ( -7.634 1.359 -22.658) 23.948 2.727 ( -3.683 -5.285 -26.662) 27.429 2.971 ( 1.723 1.611 -0.201) 2.367 3.201 ( -12.931 3.629 -9.358) 16.370 3.650 ( -5.187 6.308 0.658) 8.193 3.837 ( -0.809 -1.741 -6.540) 6.816 3.931 ( 9.125 0.585 5.828) 10.843 4.037 ( -9.347 -4.963 -6.286) 12.309 4.209 ( -2.461 -0.074 -3.249) 4.076 4.405 ( -2.267 5.752 0.700) 6.222 4.554 ( 4.872 5.996 0.247) 7.730 4.636 ( 5.756 1.882 -6.031) 8.547 4.702 ( -1.656 -7.724 -9.425) 12.298 4.759 ( 5.823 3.217 14.053) 15.548 4.979 ( -12.550 -6.155 2.531) 14.205 4.993 ( 15.616 -6.257 0.128) 16.823 5.180 ( -8.482 5.421 3.721) 10.732 5.413 ( -4.786 -1.650 -10.760) 11.892 5.508 ( 0.821 5.225 1.608) 5.529 5.591 ( 4.733 -3.580 -4.589) 7.502 5.681 ( 0.504 3.073 -3.491) 4.678 5.765 ( -2.255 1.054 -2.895) 3.818 5.822 ( -5.093 0.558 -7.641) 9.200 5.955 ( -6.287 -0.568 4.317) 7.647 6.028 ( 6.890 0.996 7.432) 10.183 6.191 ( -4.530 1.395 -7.351) 8.747 6.417 ( -1.564 5.387 8.000) 9.771 6.474 ( 9.858 -3.201 4.468) 11.287 6.585 ( -7.385 6.957 2.952) 10.566 6.757 ( 6.578 -1.595 1.898) 7.030 6.846 ( 0.253 3.720 -2.660) 4.580 6.852 ( 5.083 3.853 -0.183) 6.381 7.018 ( -2.897 -2.605 -0.537) 3.933 7.160 ( 6.008 2.985 6.663) 9.456 7.244 ( 1.432 -0.096 6.721) 6.872 7.344 ( -4.566 7.474 -7.552) 11.564 7.434 ( -5.031 11.234 0.116) 12.310 7.547 ( 5.255 3.927 0.355) 6.570 7.653 ( -13.590 3.852 -8.793) 16.639 7.895 ( -0.302 -0.808 0.506) 1.000 7.911 ( 6.107 -2.535 3.738) 7.596 8.054 ( 7.146 4.256 3.068) 8.865 8.272 ( 1.966 1.312 -1.466) 2.781 8.306 ( -4.393 0.582 -0.387) 4.448 8.339 ( -0.960 1.215 7.441) 7.600 8.467 ( -5.691 1.053 -3.711) 6.875 8.553 ( -1.348 -1.768 2.527) 3.366 8.680 ( 8.187 -3.360 9.418) 12.924 8.775 ( -1.008 -1.544 -0.108) 1.847 8.814 ( 2.929 0.176 5.475) 6.212 9.158 ( -21.310 -20.474 -15.296) 33.275 9.607 ( 0.208 22.528 0.959) 22.550 9.831 ( -0.930 12.334 -8.336) 14.916 10.161 ( 1.600 -4.801 1.860) 5.391 10.263 ( 0.434 -3.279 -2.996) 4.462 10.453 ( -8.160 -4.921 3.131) 10.030 10.529 ( 7.815 -5.923 3.538) 10.425 10.634 ( -1.618 -7.259 -1.381) 7.564 10.804 ( 1.577 -4.238 -6.054) 7.556 11.110 ( 4.747 -5.667 4.952) 8.898 11.252 ( -4.897 -4.438 -3.848) 7.648 11.859 ( -9.066 -5.596 0.147) 10.655 12.007 ( 2.277 -1.643 1.365) 3.123 12.368 ( -0.950 2.156 0.967) 2.547 12.430 ( 2.234 0.107 0.155) 2.242 12.562 ( 2.525 0.232 2.286) 3.414 12.640 ( -1.804 -2.841 -1.722) 3.780 13.489 ( -28.121 7.951 -11.276) 31.324 13.615 ( 43.261 25.273 4.800) 50.331 14.154 ( 3.127 3.138 3.990) 5.962 14.260 ( -1.334 -0.482 -3.044) 3.358 14.384 ( -0.825 2.663 2.975) 4.077 14.428 ( -2.624 2.608 1.815) 4.121 14.626 ( 10.799 3.803 -1.591) 11.559 14.745 ( 2.080 -1.586 -5.615) 6.194 15.106 ( 1.713 8.964 12.286) 15.305 15.347 ( -2.949 5.620 1.526) 6.527 15.725 ( 17.366 5.209 4.868) 18.773 15.782 ( -15.102 3.894 -10.291) 18.685 16.405 ( 6.465 1.142 4.046) 7.712 16.548 ( 1.551 -2.992 -2.837) 4.405 19.933 ( 2.510 0.011 1.703) 3.033 20.048 ( -4.776 -2.404 -5.938) 7.990 20.155 ( -0.880 -4.239 1.179) 4.487 20.228 ( 2.417 -5.593 -1.970) 6.403 24.437 ( -9.407 2.354 -2.650) 10.052 24.636 ( 37.097 16.170 1.958) 40.516 24.824 ( 4.665 -0.212 0.447) 4.692 24.888 ( 2.735 0.053 -1.569) 3.154 26.229 ( 2.657 0.907 2.050) 3.477 26.317 ( -1.650 0.763 -1.717) 2.501 26.709 ( -2.009 0.363 0.634) 2.137 26.731 ( -1.478 -0.654 -0.859) 1.831 27.056 ( 3.145 1.183 2.863) 4.414 27.142 ( 0.087 2.233 -1.878) 2.919 27.228 ( -2.489 6.576 6.170) 9.355 27.286 ( 2.011 1.415 1.348) 2.805 27.677 ( -7.733 10.177 16.137) 20.586 28.330 ( -0.760 5.284 -11.465) 12.647 28.893 ( -1.063 -6.475 2.325) 6.962 28.961 ( -1.858 -3.199 1.510) 3.996 29.201 ( -1.676 -11.968 3.983) 12.724 29.403 ( 6.824 -2.015 1.273) 7.228 30.036 ( 4.700 0.485 3.146) 5.676 30.296 ( -28.084 -25.916 -21.739) 43.965 ======================= Grid point 109 (34/117) ======================= q-point: ( 0.20 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.708 ( 5.576 -28.273 17.707) 33.823 2.084 ( 14.134 -30.974 19.617) 39.294 2.266 ( -5.202 -1.187 -14.657) 15.598 2.727 ( -7.407 2.135 -4.940) 9.155 2.930 ( -3.401 -11.604 -16.595) 20.534 3.091 ( 11.705 -3.454 5.328) 13.316 3.256 ( 15.426 -34.484 23.401) 44.438 3.558 ( -0.633 -0.846 -2.929) 3.114 3.790 ( 0.548 5.057 -6.217) 8.033 3.961 ( 0.692 5.502 4.155) 6.929 4.072 ( -14.561 -1.207 -8.017) 16.666 4.146 ( -3.514 -8.390 -0.988) 9.150 4.388 ( 4.941 0.713 6.871) 8.493 4.449 ( 7.619 6.442 -5.154) 11.230 4.633 ( 4.610 4.880 4.636) 8.158 4.681 ( -3.827 5.869 5.330) 8.804 4.868 ( -6.442 -11.709 -12.325) 18.180 4.945 ( -9.709 -0.950 -5.745) 11.321 5.090 ( -3.240 4.479 -1.175) 5.652 5.201 ( 0.456 -4.703 4.032) 6.211 5.335 ( 6.779 0.146 -5.377) 8.654 5.499 ( 7.791 2.048 6.733) 10.499 5.563 ( -2.804 2.933 4.022) 5.713 5.590 ( -5.992 6.758 -5.854) 10.764 5.725 ( 4.759 1.399 -7.629) 9.100 5.881 ( -1.233 -5.107 -11.064) 12.248 5.965 ( 13.336 8.421 7.521) 17.474 6.000 ( -4.358 -2.507 9.663) 10.893 6.148 ( -5.351 0.522 -8.925) 10.419 6.305 ( -0.742 7.645 -3.702) 8.527 6.421 ( -8.756 1.381 -3.796) 9.643 6.590 ( 5.790 -0.977 3.718) 6.950 6.730 ( 2.266 6.157 1.491) 6.728 6.758 ( 2.955 3.162 -0.477) 4.354 6.821 ( 5.214 2.944 3.731) 7.055 7.005 ( -8.572 8.564 -2.525) 12.377 7.066 ( -0.623 6.635 4.642) 8.122 7.157 ( 2.832 1.065 3.885) 4.924 7.254 ( -3.401 0.371 1.464) 3.721 7.314 ( 4.272 4.151 -2.123) 6.323 7.409 ( -7.454 7.362 -2.674) 10.812 7.529 ( 3.939 4.480 -4.313) 7.361 7.876 ( -4.133 1.894 -0.110) 4.548 7.979 ( 5.728 1.592 3.835) 7.075 7.999 ( 4.526 1.589 5.280) 7.133 8.212 ( -7.616 5.067 1.738) 9.312 8.227 ( -7.730 2.073 -3.318) 8.664 8.350 ( 10.288 2.661 6.424) 12.417 8.438 ( -1.301 -1.051 1.002) 1.950 8.571 ( 0.542 -0.802 2.659) 2.830 8.640 ( -2.535 5.556 3.726) 7.154 8.732 ( 2.465 2.394 3.791) 5.116 9.038 ( 8.302 -9.320 12.039) 17.342 9.136 ( -0.030 16.875 1.965) 16.989 9.297 ( -11.119 4.624 -11.127) 16.396 9.645 ( -9.005 -0.082 -21.241) 23.072 10.244 ( 1.722 -2.573 1.023) 3.261 10.316 ( 1.160 -2.726 -1.260) 3.219 10.476 ( -7.821 -3.147 1.219) 8.518 10.704 ( 5.832 -5.560 1.701) 8.235 10.798 ( 2.750 -8.333 1.423) 8.890 10.882 ( 2.399 -3.282 -4.660) 6.184 11.250 ( 5.598 -4.403 6.158) 9.415 11.317 ( -5.433 -5.087 -4.150) 8.522 11.922 ( -10.953 -6.209 -2.230) 12.786 12.073 ( 4.486 -2.766 2.730) 5.936 12.328 ( -0.262 1.194 1.983) 2.329 12.461 ( 3.842 -1.380 0.356) 4.098 12.575 ( 0.395 -0.680 2.207) 2.343 12.714 ( 2.219 -4.221 -1.506) 5.001 13.138 ( -25.777 9.248 -11.654) 29.763 13.322 ( 22.879 22.446 9.298) 33.373 14.099 ( 0.678 3.286 4.497) 5.611 14.226 ( 1.011 3.637 -0.957) 3.894 14.320 ( -2.469 3.671 2.223) 4.951 14.368 ( -1.637 1.541 -0.843) 2.401 14.611 ( 3.396 1.777 -2.241) 4.440 14.777 ( 4.972 0.927 -4.862) 7.015 14.987 ( -0.570 3.759 9.309) 10.055 15.255 ( -2.560 2.739 -1.137) 3.917 15.517 ( -18.230 7.227 -10.741) 22.359 15.752 ( 19.038 7.613 6.429) 21.488 16.461 ( 7.362 -1.426 5.745) 9.446 16.591 ( -1.179 -1.844 -4.310) 4.834 19.953 ( 4.533 0.384 3.476) 5.725 20.019 ( -5.962 0.707 -4.826) 7.703 20.252 ( -3.177 -6.459 -0.502) 7.216 20.353 ( 2.570 -5.198 -0.826) 5.857 24.342 ( -5.899 2.107 -3.464) 7.158 24.528 ( 19.573 11.560 4.588) 23.190 24.846 ( 1.601 -0.182 0.003) 1.611 24.913 ( 4.705 -0.301 -0.628) 4.756 26.217 ( 0.508 1.257 1.922) 2.352 26.278 ( -2.477 1.821 -1.524) 3.431 26.690 ( -2.265 -0.514 0.780) 2.450 26.772 ( -2.140 -3.557 -1.307) 4.352 27.025 ( -0.392 2.494 1.089) 2.750 27.093 ( 2.587 3.957 1.968) 5.121 27.116 ( -1.666 3.007 5.122) 6.168 27.277 ( 4.142 1.676 0.875) 4.553 27.610 ( -1.752 -1.226 5.157) 5.583 28.203 ( -1.166 5.788 -10.461) 12.013 29.009 ( 1.433 -5.207 4.137) 6.803 29.085 ( -3.619 -9.890 -1.788) 10.682 29.400 ( -1.126 -4.031 3.875) 5.704 29.463 ( 3.467 -6.354 1.215) 7.340 30.050 ( 4.922 0.369 10.068) 11.212 30.496 ( -17.686 -10.596 -20.002) 28.725 ======================= Grid point 110 (35/117) ======================= q-point: ( 0.30 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.226 ( -1.411 -15.846 6.571) 17.212 2.300 ( -1.461 -6.604 -4.661) 8.214 2.560 ( -1.664 -6.114 1.737) 6.571 2.797 ( 6.822 -24.772 7.749) 26.837 3.121 ( 10.977 -0.427 0.473) 10.996 3.261 ( 6.511 -15.985 -10.693) 20.304 3.637 ( 5.159 -2.466 -0.060) 5.719 3.717 ( 0.850 -2.018 -9.309) 9.563 3.801 ( -8.811 3.646 -3.347) 10.106 4.000 ( 10.920 -17.030 13.793) 24.485 4.072 ( -8.385 -3.138 -0.364) 8.961 4.222 ( 2.839 3.732 -2.461) 5.296 4.350 ( 3.824 1.582 -3.315) 5.303 4.404 ( -0.536 8.567 2.388) 8.909 4.552 ( -4.670 -4.022 3.238) 6.962 4.632 ( -1.387 -4.333 6.609) 8.023 4.867 ( 1.159 11.018 3.720) 11.686 4.909 ( -6.224 -1.836 -6.056) 8.876 5.087 ( -5.058 -10.228 -6.118) 12.947 5.219 ( -5.891 1.371 7.140) 9.358 5.349 ( 3.658 7.614 0.139) 8.448 5.437 ( 7.537 -2.082 -8.852) 11.811 5.546 ( -6.754 3.522 -0.112) 7.618 5.586 ( -3.967 5.310 2.416) 7.055 5.648 ( 13.093 0.651 9.431) 16.150 5.780 ( 0.166 3.385 0.764) 3.474 5.890 ( 2.808 10.991 4.724) 12.289 6.021 ( 4.217 0.641 -4.613) 6.282 6.138 ( -1.936 5.222 -7.317) 9.195 6.233 ( 1.445 -10.590 -10.364) 14.888 6.426 ( -6.018 -4.703 -2.525) 8.044 6.521 ( -4.578 5.749 -3.009) 7.941 6.644 ( -1.012 9.530 -0.931) 9.628 6.673 ( -3.408 4.057 -0.851) 5.366 6.779 ( -1.092 7.640 -0.201) 7.720 6.819 ( 3.599 -2.949 3.073) 5.576 6.991 ( -1.821 4.839 -0.569) 5.202 7.095 ( 0.795 6.540 3.944) 7.678 7.176 ( -0.940 1.421 3.405) 3.807 7.302 ( -1.395 -4.100 -4.230) 6.054 7.381 ( 2.623 0.818 3.408) 4.378 7.449 ( 5.603 5.559 -1.437) 8.022 7.765 ( -3.615 5.891 -6.673) 9.607 7.948 ( 8.107 4.429 1.516) 9.361 7.993 ( -3.138 11.246 13.244) 17.656 8.059 ( 1.183 -1.702 6.492) 6.815 8.112 ( -4.702 5.901 -2.337) 7.899 8.360 ( 4.238 1.996 4.866) 6.754 8.445 ( -4.669 -2.270 -0.945) 5.276 8.531 ( 2.535 3.279 2.010) 4.606 8.616 ( -0.078 -1.527 2.708) 3.110 8.701 ( 1.028 2.038 2.026) 3.052 8.868 ( -4.526 5.925 -2.326) 7.810 9.075 ( -2.775 8.240 -4.710) 9.889 9.233 ( 7.765 -1.395 9.984) 12.725 9.626 ( -12.993 -2.603 -18.766) 22.973 10.292 ( 1.106 -1.763 -0.512) 2.143 10.376 ( 2.431 -1.958 -0.528) 3.166 10.486 ( -5.375 -2.183 0.509) 5.824 10.779 ( 5.240 1.656 0.269) 5.502 10.936 ( 0.175 -5.189 0.197) 5.195 11.017 ( 4.831 -7.693 -0.371) 9.092 11.321 ( -0.330 -0.792 1.573) 1.792 11.392 ( 1.732 -4.096 1.330) 4.642 11.942 ( -11.565 -3.291 -4.085) 12.699 12.165 ( 4.212 -3.396 0.759) 5.463 12.328 ( 2.105 -0.208 3.389) 3.995 12.516 ( 1.384 -2.025 -1.078) 2.679 12.589 ( -2.775 -1.223 0.281) 3.045 12.810 ( 4.685 -2.406 -0.125) 5.268 12.848 ( -15.510 5.801 -7.287) 18.092 13.085 ( 15.542 13.429 7.741) 21.950 14.052 ( -0.629 1.857 3.142) 3.703 14.160 ( 2.916 3.608 3.401) 5.753 14.228 ( -2.141 3.895 1.337) 4.641 14.324 ( -0.781 2.452 -0.910) 2.729 14.595 ( -8.144 -1.368 -5.929) 10.166 14.767 ( 3.913 1.960 -2.368) 4.976 14.950 ( 0.736 0.847 4.640) 4.774 15.189 ( -1.104 3.158 -3.500) 4.842 15.286 ( -14.411 4.508 -6.115) 16.291 15.695 ( 14.900 9.151 5.672) 18.382 16.527 ( 5.402 -0.718 4.715) 7.206 16.617 ( -0.240 -1.580 -3.971) 4.281 19.958 ( -5.762 1.066 -4.304) 7.270 19.980 ( 5.598 0.595 4.325) 7.099 20.349 ( -4.644 -5.620 -1.964) 7.550 20.458 ( 2.751 -3.800 0.939) 4.785 24.284 ( -3.099 0.927 -2.799) 4.277 24.440 ( 10.625 7.168 3.153) 13.199 24.855 ( 0.843 -0.090 -0.265) 0.888 24.949 ( 4.078 -0.405 -0.374) 4.115 26.192 ( -0.174 1.319 1.325) 1.878 26.219 ( -2.848 2.289 -1.326) 3.887 26.700 ( -2.113 -1.625 1.047) 2.864 26.822 ( -2.785 -2.900 0.133) 4.023 26.972 ( -0.690 2.346 0.210) 2.454 27.026 ( 1.731 4.079 4.482) 6.303 27.077 ( -1.195 0.771 0.232) 1.441 27.272 ( 5.793 1.797 -1.057) 6.157 27.639 ( 0.278 -1.505 2.840) 3.226 28.097 ( -1.271 3.852 -8.256) 9.198 29.108 ( 1.771 -3.175 5.555) 6.639 29.253 ( -3.430 -8.840 -3.178) 10.000 29.431 ( 2.507 -1.199 3.292) 4.308 29.598 ( 2.627 -3.149 -4.296) 5.939 30.130 ( 0.986 -6.616 13.321) 14.906 30.522 ( -12.444 -3.006 -13.477) 18.588 ======================= Grid point 111 (36/117) ======================= q-point: ( 0.40 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.284 ( -5.795 0.147 -10.180) 11.715 2.426 ( 0.343 -7.871 -0.036) 7.878 2.853 ( 4.369 -13.941 8.006) 16.659 3.233 ( 5.395 -11.208 2.708) 12.730 3.290 ( 9.820 -9.503 0.057) 13.666 3.429 ( 2.036 -0.691 -3.023) 3.709 3.671 ( -3.401 -1.615 -7.147) 8.078 3.791 ( 3.601 2.606 0.372) 4.461 3.901 ( 1.565 -14.287 -2.862) 14.655 3.990 ( -4.390 2.372 -2.842) 5.742 4.071 ( -2.707 5.048 -1.117) 5.836 4.253 ( 6.400 -2.317 0.556) 6.829 4.278 ( 2.706 -2.112 4.998) 6.063 4.385 ( 0.602 1.717 -1.092) 2.122 4.514 ( -3.320 6.733 3.930) 8.473 4.603 ( 2.586 -1.043 3.102) 4.171 4.765 ( -7.205 5.642 2.863) 9.589 4.966 ( -6.095 -5.515 -6.074) 10.220 5.070 ( 3.819 6.779 8.406) 11.454 5.192 ( -7.197 12.063 3.100) 14.385 5.263 ( -3.460 -2.444 8.235) 9.261 5.378 ( 6.316 0.110 -9.214) 11.171 5.419 ( -7.191 3.675 -6.806) 10.561 5.502 ( -3.161 3.368 -3.044) 5.532 5.708 ( -0.002 -3.033 0.225) 3.041 5.801 ( 4.253 -1.041 3.526) 5.622 5.864 ( 10.337 0.341 12.583) 16.288 6.063 ( 1.764 0.199 -5.764) 6.032 6.070 ( 6.696 -3.568 3.267) 8.261 6.309 ( -11.958 7.084 -8.988) 16.552 6.425 ( -1.834 -5.239 -9.282) 10.815 6.491 ( -4.798 3.661 -5.579) 8.219 6.527 ( 5.211 -6.114 4.255) 9.091 6.600 ( 1.338 0.341 -0.817) 1.605 6.685 ( -0.478 1.746 1.121) 2.129 6.879 ( 3.196 -0.267 3.755) 4.938 6.890 ( -1.266 3.836 -0.004) 4.040 7.007 ( 2.326 4.469 -2.233) 5.511 7.128 ( -1.415 3.196 4.539) 5.729 7.281 ( -8.724 6.707 -1.943) 11.174 7.341 ( -0.767 0.987 0.069) 1.251 7.410 ( 8.126 4.526 1.969) 9.508 7.709 ( 2.518 -3.458 -8.941) 9.912 7.816 ( 9.286 7.194 13.262) 17.716 7.894 ( -5.230 4.019 1.901) 6.864 7.990 ( -0.711 1.218 2.020) 2.464 8.064 ( -2.227 2.150 -1.320) 3.366 8.335 ( -3.284 -0.982 5.148) 6.185 8.473 ( -2.238 3.034 0.047) 3.771 8.534 ( 3.676 -4.487 1.848) 6.088 8.618 ( -2.203 -0.444 0.227) 2.259 8.695 ( 1.313 -0.489 2.100) 2.525 8.816 ( -0.839 0.041 -0.972) 1.285 8.944 ( -1.656 3.482 -4.293) 5.770 9.261 ( 6.403 1.522 4.732) 8.106 9.538 ( -10.614 3.342 -12.148) 16.474 10.330 ( 0.907 -1.424 -0.945) 1.935 10.410 ( 2.087 0.050 -0.572) 2.164 10.501 ( -2.895 -1.974 0.561) 3.549 10.739 ( 3.979 4.439 0.846) 6.021 11.022 ( -2.521 -4.242 -0.801) 4.999 11.176 ( 5.184 -4.547 1.186) 6.997 11.306 ( -3.344 0.630 -1.344) 3.658 11.481 ( 6.626 -2.258 4.374) 8.255 11.921 ( -11.307 -2.178 -5.675) 12.837 12.236 ( 4.151 -0.759 0.139) 4.222 12.340 ( 0.113 0.214 2.204) 2.217 12.518 ( -3.472 1.970 -6.031) 7.232 12.590 ( -4.763 -1.657 -1.511) 5.264 12.722 ( 1.357 1.271 4.440) 4.813 12.875 ( 1.819 -1.119 -1.299) 2.499 13.017 ( 11.135 2.569 6.584) 13.188 14.002 ( -1.035 2.820 1.801) 3.503 14.140 ( 3.586 1.089 4.377) 5.762 14.156 ( 0.219 2.844 1.014) 3.028 14.266 ( 1.132 3.490 1.083) 3.826 14.543 ( -17.737 -2.091 -12.704) 21.917 14.776 ( 1.979 -1.147 -0.921) 2.465 14.951 ( 0.388 -0.451 2.803) 2.865 15.137 ( 1.899 0.905 -0.215) 2.115 15.181 ( -5.683 0.683 -1.211) 5.850 15.583 ( 8.170 9.462 1.915) 12.647 16.554 ( 2.698 0.708 3.582) 4.540 16.649 ( 0.694 -1.722 -2.775) 3.339 19.899 ( -5.749 0.888 -4.196) 7.173 20.015 ( 6.838 0.150 5.083) 8.521 20.406 ( -5.143 -3.342 -2.964) 6.812 20.531 ( 2.644 -1.777 1.679) 3.601 24.262 ( -1.829 -0.199 -1.787) 2.565 24.380 ( 5.340 4.045 1.704) 6.912 24.863 ( 0.630 -0.367 0.183) 0.752 24.970 ( 2.118 0.286 -1.011) 2.364 26.163 ( -1.664 1.688 -0.470) 2.416 26.171 ( -0.313 0.690 0.258) 0.800 26.722 ( -1.543 -1.607 1.175) 2.519 26.852 ( -3.034 -2.083 1.782) 4.089 26.927 ( -0.406 2.308 1.155) 2.613 26.967 ( 2.553 2.977 3.379) 5.176 27.058 ( -1.691 0.379 -0.520) 1.810 27.283 ( 4.387 0.214 -4.112) 6.017 27.665 ( 0.656 -0.750 2.683) 2.862 28.032 ( -0.845 1.974 -6.634) 6.972 29.149 ( 0.712 -0.319 6.056) 6.106 29.363 ( -2.281 -4.265 -3.641) 6.054 29.491 ( 1.616 -2.931 0.366) 3.367 29.637 ( 3.919 0.101 -0.541) 3.958 30.286 ( -1.204 -6.815 5.953) 9.129 30.476 ( -6.748 0.033 -6.019) 9.043 ======================= Grid point 112 (37/117) ======================= q-point: (-0.50 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.245 ( -1.410 0.776 -11.931) 12.039 2.563 ( 1.920 -2.733 0.608) 3.394 3.039 ( 1.365 -4.312 3.738) 5.868 3.282 ( -0.849 3.874 1.033) 4.099 3.406 ( -0.064 3.621 1.373) 3.873 3.512 ( 4.492 -3.328 -2.800) 6.253 3.578 ( -1.411 6.594 -5.296) 8.575 3.767 ( 0.283 4.231 -4.401) 6.112 3.951 ( -3.570 2.359 0.784) 4.350 4.023 ( -4.927 -5.179 -1.447) 7.293 4.136 ( -1.471 -6.430 2.524) 7.062 4.212 ( -3.456 2.873 4.461) 6.333 4.333 ( 5.209 1.288 -0.704) 5.412 4.353 ( 5.690 -0.470 -2.957) 6.430 4.492 ( -1.545 -2.169 2.913) 3.947 4.596 ( 0.751 2.897 3.403) 4.532 4.752 ( -6.041 -1.402 4.439) 7.626 4.922 ( 4.688 -1.213 7.007) 8.518 4.982 ( 6.681 1.869 10.969) 12.979 5.120 ( 1.092 -6.681 -4.994) 8.413 5.251 ( -4.105 3.469 -6.054) 8.095 5.352 ( 4.277 1.040 -8.852) 9.886 5.454 ( -5.424 -8.601 -1.349) 10.258 5.510 ( -6.286 -8.075 4.347) 11.119 5.660 ( 2.546 7.001 2.992) 8.028 5.799 ( -3.685 6.008 -1.789) 7.271 5.867 ( 2.220 -3.056 -1.336) 4.006 6.078 ( 3.502 6.904 1.032) 7.810 6.131 ( -1.145 4.927 -3.269) 6.023 6.197 ( 0.636 -4.344 -3.119) 5.386 6.361 ( -5.563 3.697 -5.049) 8.373 6.451 ( -0.280 0.396 -0.034) 0.486 6.644 ( 1.137 1.986 1.032) 2.510 6.694 ( 0.548 -5.080 3.248) 6.054 6.743 ( 8.174 -4.255 1.479) 9.333 6.830 ( -0.973 -1.359 -0.017) 1.671 6.895 ( 4.397 -0.157 2.044) 4.851 6.961 ( 1.061 1.772 0.173) 2.072 7.068 ( -0.447 -1.658 1.465) 2.257 7.132 ( -9.473 0.647 -6.562) 11.542 7.327 ( -5.336 -1.132 4.438) 7.032 7.365 ( 7.975 4.103 1.949) 9.178 7.725 ( 0.708 4.886 0.762) 4.996 7.777 ( -2.270 -0.609 -5.710) 6.174 7.900 ( 0.960 -2.629 11.208) 11.552 7.989 ( 1.382 0.751 -4.588) 4.850 8.027 ( 0.082 -3.283 3.019) 4.461 8.323 ( -1.967 2.365 3.929) 4.990 8.441 ( -1.506 -2.655 0.033) 3.053 8.585 ( 0.231 -0.262 0.801) 0.874 8.639 ( 0.684 -0.912 2.234) 2.507 8.725 ( 2.109 -0.511 3.628) 4.227 8.796 ( -2.076 0.852 -1.020) 2.466 8.891 ( -0.896 1.747 -4.497) 4.907 9.309 ( -0.480 0.446 -4.590) 4.636 9.430 ( 2.666 -2.442 -4.982) 6.156 10.353 ( 0.428 -0.390 -0.350) 0.677 10.402 ( 0.070 1.255 -1.170) 1.717 10.522 ( -1.434 -1.241 0.741) 2.036 10.681 ( 1.957 3.064 0.856) 3.735 11.067 ( -3.348 -2.197 -0.926) 4.111 11.231 ( -0.075 1.119 1.207) 1.648 11.279 ( -1.138 0.044 -0.955) 1.486 11.562 ( 9.496 -0.397 5.250) 10.858 11.886 ( -10.781 -1.407 -6.898) 12.877 12.239 ( 5.096 2.783 0.080) 5.807 12.330 ( -1.775 0.188 1.117) 2.106 12.436 ( -3.025 2.660 -5.958) 7.192 12.597 ( -1.608 -0.372 0.348) 1.687 12.754 ( 0.076 -2.487 3.718) 4.474 12.890 ( -1.106 -0.523 0.370) 1.278 13.085 ( 8.659 -2.295 5.236) 10.376 13.950 ( 3.004 2.775 2.504) 4.796 14.120 ( 2.615 1.845 1.870) 3.707 14.152 ( 3.157 -0.043 2.144) 3.816 14.197 ( -0.629 3.293 -0.163) 3.356 14.495 ( -16.994 -5.079 -13.351) 22.200 14.806 ( 1.815 0.128 0.293) 1.843 14.980 ( 0.608 -1.950 2.964) 3.600 15.141 ( -0.600 -0.237 -2.178) 2.271 15.227 ( 3.282 -6.583 5.634) 9.266 15.441 ( 1.889 7.706 -2.584) 8.345 16.534 ( -0.555 2.097 2.688) 3.454 16.689 ( 0.418 -1.960 -1.697) 2.626 19.855 ( -4.419 0.157 -3.204) 5.461 20.059 ( 6.571 -0.159 4.597) 8.021 20.415 ( -4.640 -0.884 -3.444) 5.846 20.557 ( 2.312 0.731 1.790) 3.014 24.261 ( -2.165 -0.770 -1.365) 2.673 24.352 ( 2.138 1.104 1.174) 2.678 24.876 ( 0.058 -0.671 0.822) 1.063 24.963 ( -0.030 0.990 -1.760) 2.020 26.134 ( -0.603 0.451 -0.442) 0.874 26.170 ( 0.932 -0.426 0.215) 1.048 26.743 ( -0.341 -1.091 0.859) 1.429 26.854 ( -0.148 2.468 5.076) 5.646 26.891 ( -1.694 -1.221 -0.526) 2.153 26.954 ( 1.788 0.113 2.442) 3.029 27.043 ( -0.006 0.459 -0.785) 0.909 27.307 ( -0.465 -1.272 -4.948) 5.130 27.679 ( 0.630 -0.217 2.930) 3.005 28.002 ( 0.073 0.603 -6.255) 6.285 29.149 ( -0.385 0.400 5.632) 5.659 29.401 ( -2.121 -1.481 -2.752) 3.777 29.538 ( -0.235 -1.317 -3.593) 3.834 29.651 ( 4.513 1.560 4.393) 6.488 30.269 ( -4.760 5.627 -3.450) 8.138 30.526 ( 2.810 -5.111 2.113) 6.204 ======================= Grid point 113 (38/117) ======================= q-point: (-0.40 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.240 ( 1.153 -0.589 -7.567) 7.677 2.468 ( 4.877 13.836 -0.544) 14.681 3.053 ( -9.781 7.791 6.536) 14.110 3.132 ( 2.233 6.519 -0.155) 6.893 3.338 ( -1.897 5.873 -1.018) 6.255 3.352 ( -7.064 7.695 5.334) 11.729 3.546 ( 0.434 3.645 -1.052) 3.819 3.618 ( -1.563 5.497 -9.534) 11.115 3.853 ( -0.591 1.764 -2.262) 2.929 3.944 ( -3.650 6.966 -4.035) 8.839 4.200 ( -5.170 -0.140 0.223) 5.177 4.309 ( 7.200 3.196 -0.695) 7.908 4.351 ( -3.025 -11.732 -4.738) 13.009 4.357 ( 2.944 3.490 7.128) 8.466 4.533 ( 2.921 -1.673 4.151) 5.344 4.706 ( 3.325 -8.308 -2.999) 9.438 4.780 ( -2.791 -6.992 1.365) 7.651 4.903 ( 6.973 -0.232 12.766) 14.548 5.150 ( -8.368 -1.419 -4.804) 9.752 5.204 ( 1.573 -1.063 -1.226) 2.260 5.237 ( 0.660 -8.334 9.492) 12.649 5.385 ( -2.737 0.741 -6.206) 6.823 5.500 ( 8.851 0.880 -0.811) 8.931 5.570 ( -1.081 8.413 3.724) 9.264 5.672 ( -2.289 0.482 -2.431) 3.374 5.721 ( 0.424 -5.405 0.339) 5.432 5.824 ( -1.860 0.804 4.938) 5.338 5.969 ( 0.993 -3.407 -1.334) 3.791 6.108 ( 3.349 -6.023 -2.898) 7.476 6.261 ( -5.573 2.444 -8.574) 10.514 6.348 ( -3.837 -6.558 -2.415) 7.973 6.444 ( 6.897 1.345 -1.706) 7.231 6.618 ( -1.094 0.194 0.512) 1.223 6.732 ( -1.031 1.948 0.203) 2.213 6.755 ( -1.531 1.788 -0.876) 2.511 6.865 ( 3.220 -1.631 5.566) 6.634 6.926 ( -1.590 2.283 -0.066) 2.783 6.963 ( 3.997 -3.532 -4.655) 7.079 7.139 ( -5.796 -4.471 -3.014) 7.917 7.195 ( 4.126 -5.782 4.411) 8.361 7.314 ( -3.439 -1.611 4.790) 6.113 7.438 ( 3.286 -8.796 -2.748) 9.784 7.658 ( 1.512 2.737 4.752) 5.688 7.721 ( -5.516 2.873 -6.127) 8.730 7.885 ( -2.464 -0.904 2.891) 3.905 8.096 ( 7.615 -4.680 0.582) 8.957 8.119 ( -3.414 -5.613 7.691) 10.115 8.257 ( 1.267 3.457 2.871) 4.669 8.505 ( -0.413 -2.249 0.934) 2.470 8.584 ( -0.504 -0.347 0.226) 0.652 8.645 ( -1.427 -0.154 3.042) 3.363 8.710 ( 0.353 1.446 3.178) 3.509 8.818 ( 2.412 -3.241 -2.780) 4.904 8.854 ( -0.290 0.802 -4.263) 4.347 9.223 ( -3.649 2.354 -1.119) 4.484 9.671 ( 11.503 -11.795 -8.165) 18.387 10.347 ( -0.853 1.042 -0.131) 1.353 10.370 ( -0.588 1.382 -0.940) 1.772 10.522 ( -1.532 0.681 -0.549) 1.764 10.647 ( -0.541 1.014 1.594) 1.966 11.064 ( -3.857 0.223 -0.424) 3.887 11.177 ( -0.766 3.288 1.929) 3.888 11.246 ( -2.444 2.923 -0.849) 3.903 11.599 ( 8.891 2.991 5.049) 10.653 11.847 ( -7.762 -1.116 -7.116) 10.589 12.210 ( 5.240 3.536 -0.778) 6.369 12.309 ( 0.422 1.414 2.187) 2.638 12.398 ( -0.678 -0.187 -3.073) 3.153 12.567 ( -2.982 2.052 0.096) 3.621 12.800 ( -2.811 -2.747 1.154) 4.096 12.890 ( -4.644 -1.518 0.015) 4.886 13.200 ( 5.098 -4.936 4.435) 8.368 13.943 ( 9.334 1.753 4.500) 10.510 14.116 ( 6.769 1.608 3.787) 7.921 14.132 ( -0.886 0.321 -0.793) 1.232 14.219 ( 0.371 -3.693 -1.349) 3.949 14.507 ( -13.214 -5.617 -10.121) 17.567 14.791 ( 1.880 2.163 0.284) 2.880 15.018 ( 0.344 -1.089 3.820) 3.987 15.159 ( 0.328 -1.655 -2.537) 3.046 15.313 ( -2.825 2.780 -7.283) 8.292 15.448 ( 5.109 -10.679 7.611) 14.074 16.473 ( -3.865 2.664 1.722) 5.000 16.721 ( -0.631 -1.210 -0.899) 1.634 19.838 ( -2.656 -0.795 -1.846) 3.331 20.101 ( 5.084 -0.285 3.215) 6.022 20.384 ( -3.122 1.336 -3.421) 4.820 20.530 ( 1.769 3.510 1.651) 4.263 24.257 ( -3.552 -0.643 -1.906) 4.082 24.369 ( 0.248 -1.993 1.822) 2.712 24.884 ( -1.108 -0.161 0.782) 1.366 24.938 ( -1.453 0.730 -1.582) 2.269 26.137 ( 0.677 -0.680 -0.132) 0.968 26.199 ( 1.893 -1.543 -0.078) 2.443 26.760 ( 1.657 -0.223 0.352) 1.708 26.791 ( 0.647 3.578 3.140) 4.805 26.932 ( -1.805 -3.622 1.027) 4.175 26.980 ( 2.116 -1.447 3.087) 4.012 27.039 ( 0.442 0.169 -1.688) 1.753 27.316 ( -5.359 -1.624 -3.012) 6.358 27.686 ( 0.232 -0.144 3.337) 3.348 28.004 ( 1.533 -0.633 -7.324) 7.509 29.134 ( -1.246 0.937 5.069) 5.303 29.394 ( -2.265 0.883 -0.580) 2.500 29.533 ( -0.630 2.368 -5.598) 6.111 29.635 ( 2.098 1.110 3.610) 4.320 30.084 ( 0.219 11.129 1.800) 11.276 30.636 ( 5.329 -3.142 -2.166) 6.554 ======================= Grid point 114 (39/117) ======================= q-point: (-0.30 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.051 ( 3.453 23.275 3.146) 23.739 2.372 ( 5.463 -3.165 -3.423) 7.182 2.616 ( -5.227 29.600 9.747) 31.599 2.902 ( -14.450 10.298 -0.581) 17.754 3.207 ( -7.332 -1.359 0.520) 7.475 3.290 ( 2.702 5.225 -2.011) 6.217 3.480 ( -1.810 -0.108 -2.117) 2.787 3.577 ( 1.000 1.933 -10.058) 10.290 3.784 ( -3.575 10.640 -2.101) 11.420 3.864 ( 0.096 4.861 2.530) 5.481 4.077 ( -0.489 5.478 -3.038) 6.283 4.223 ( 2.858 3.480 9.474) 10.490 4.280 ( 7.396 2.876 -2.904) 8.450 4.484 ( -5.203 6.032 0.592) 7.987 4.632 ( 3.246 -6.682 1.891) 7.665 4.765 ( 1.130 5.293 2.270) 5.869 4.852 ( 1.376 -12.421 -3.341) 12.936 5.007 ( -3.037 3.576 -2.870) 5.500 5.178 ( -6.265 -1.895 13.706) 15.189 5.194 ( -3.521 -9.738 -1.329) 10.440 5.269 ( 6.883 0.065 7.861) 10.449 5.456 ( -6.387 -1.361 -1.432) 6.685 5.514 ( 2.997 2.480 -5.925) 7.088 5.555 ( 2.490 -2.419 -3.269) 4.768 5.603 ( 2.899 -10.724 3.724) 11.717 5.864 ( 2.347 -0.028 4.507) 5.082 5.910 ( 0.107 -5.473 -7.248) 9.083 6.045 ( -8.389 3.472 -10.651) 13.996 6.136 ( 2.314 -5.127 0.236) 5.630 6.293 ( -4.957 -6.283 -1.670) 8.175 6.455 ( 2.587 -4.271 -3.979) 6.385 6.471 ( 7.340 -0.596 -3.811) 8.292 6.587 ( -3.148 2.458 -2.889) 4.929 6.643 ( -3.034 1.485 -3.696) 5.007 6.789 ( 0.952 -4.238 5.763) 7.217 6.893 ( -6.432 -5.097 3.545) 8.940 6.976 ( 4.201 -4.903 2.446) 6.904 7.083 ( 3.910 -4.424 -1.200) 6.025 7.152 ( -1.239 -1.983 -0.209) 2.347 7.286 ( -0.177 -1.160 -0.963) 1.518 7.400 ( 3.338 -7.477 1.107) 8.263 7.556 ( -1.391 3.445 -5.024) 6.249 7.649 ( 5.625 -3.982 5.128) 8.590 7.756 ( -4.574 -9.018 0.219) 10.114 7.953 ( 0.525 -6.732 7.316) 9.956 8.117 ( -3.596 2.224 6.008) 7.347 8.192 ( -3.140 -0.014 2.334) 3.912 8.272 ( 8.046 -3.848 0.682) 8.945 8.514 ( 0.415 -0.341 1.631) 1.717 8.594 ( -0.249 0.089 2.407) 2.422 8.635 ( -2.797 0.987 -0.173) 2.971 8.702 ( 0.126 -1.430 3.231) 3.535 8.880 ( 3.381 -1.162 1.095) 3.739 8.936 ( 1.951 -6.439 -1.846) 6.977 9.228 ( -2.633 -7.193 -4.418) 8.842 9.921 ( 9.529 -5.766 -11.867) 16.275 10.299 ( -2.167 2.571 -1.637) 3.740 10.356 ( 2.624 0.532 1.648) 3.144 10.468 ( -3.013 3.271 -2.898) 5.308 10.623 ( -1.901 1.088 3.314) 3.972 11.007 ( -4.629 2.919 -0.472) 5.493 11.091 ( -2.053 6.096 0.050) 6.432 11.160 ( -0.814 2.815 2.482) 3.841 11.549 ( 3.408 5.934 2.257) 7.206 11.843 ( 0.409 -1.089 -3.429) 3.621 12.154 ( 3.862 5.201 -1.357) 6.618 12.298 ( 3.446 0.720 3.399) 4.893 12.417 ( 0.634 -0.905 0.933) 1.446 12.491 ( -4.512 2.677 -1.681) 5.509 12.808 ( -1.232 1.131 -0.985) 1.941 12.896 ( -9.349 -3.401 -1.027) 10.001 13.364 ( 1.227 -10.425 2.198) 10.724 14.004 ( 14.165 -0.303 6.481) 15.580 14.143 ( 2.339 -0.217 -0.305) 2.369 14.165 ( 5.640 -2.752 3.546) 7.208 14.296 ( -0.426 -3.894 -1.216) 4.101 14.534 ( -11.681 -5.223 -7.396) 14.779 14.760 ( 2.481 1.987 -1.164) 3.385 15.022 ( -1.930 0.163 3.927) 4.379 15.201 ( 5.105 -0.729 -0.440) 5.175 15.289 ( -6.164 -4.117 -9.227) 11.835 15.703 ( 3.287 -11.414 5.890) 13.258 16.392 ( -5.315 2.469 1.720) 6.108 16.719 ( -2.039 0.737 -0.915) 2.353 19.850 ( -0.999 -1.556 -0.456) 1.904 20.132 ( 2.500 -0.388 1.137) 2.773 20.326 ( -0.790 3.295 -3.067) 4.570 20.444 ( 1.062 6.152 1.362) 6.389 24.244 ( -4.281 -0.704 -2.241) 4.883 24.427 ( -1.649 -4.120 2.693) 5.191 24.865 ( -2.097 0.939 0.014) 2.298 24.922 ( -2.278 -0.147 -0.555) 2.349 26.164 ( 1.388 -1.262 0.464) 1.932 26.248 ( 2.192 -2.036 -0.456) 3.026 26.733 ( 1.025 2.782 1.908) 3.526 26.769 ( 3.229 1.015 -0.602) 3.438 27.006 ( -2.025 -4.908 2.043) 5.689 27.035 ( 4.275 -0.707 1.633) 4.630 27.040 ( -2.830 -2.364 0.117) 3.689 27.303 ( -6.808 -1.069 -0.317) 6.899 27.690 ( -1.617 -0.544 4.603) 4.909 28.046 ( 3.772 -2.523 -9.773) 10.775 29.088 ( -1.612 3.434 3.936) 5.467 29.348 ( 0.478 3.608 1.952) 4.130 29.408 ( -2.581 7.532 -3.441) 8.673 29.657 ( -3.930 -1.472 -3.024) 5.172 29.870 ( 8.222 11.845 8.846) 16.916 30.709 ( 6.219 -0.818 -7.206) 9.554 ======================= Grid point 115 (40/117) ======================= q-point: (-0.20 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.559 ( 3.334 28.066 12.197) 30.783 1.926 ( -5.690 35.883 15.342) 39.438 2.439 ( -3.105 -1.265 -9.916) 10.468 2.732 ( -1.944 4.474 0.975) 4.975 2.988 ( -12.319 34.370 11.104) 38.162 3.198 ( -7.017 16.056 -9.672) 20.014 3.235 ( 2.331 -3.785 -0.356) 4.460 3.551 ( 2.118 -6.253 -2.929) 7.222 3.602 ( -0.712 -3.733 -2.936) 4.802 3.875 ( 6.272 -0.426 1.800) 6.539 4.110 ( 2.688 -0.500 0.976) 2.903 4.260 ( 1.225 -2.933 3.621) 4.818 4.315 ( 8.445 -2.179 4.084) 9.631 4.389 ( -2.198 -1.277 -0.515) 2.593 4.657 ( -1.374 5.655 1.891) 6.119 4.696 ( -1.911 -1.458 1.379) 2.771 4.883 ( 9.498 9.102 -4.225) 13.817 5.025 ( -4.278 5.136 -13.086) 14.694 5.184 ( -4.597 0.181 6.988) 8.366 5.269 ( -2.223 -9.529 -6.183) 11.574 5.293 ( -7.266 0.373 2.288) 7.627 5.462 ( 8.765 -0.751 -2.776) 9.225 5.551 ( -12.441 0.529 -1.408) 12.531 5.602 ( 4.250 -7.283 1.522) 8.569 5.776 ( -5.703 -4.159 -5.426) 8.903 5.836 ( -2.204 -0.622 -15.032) 15.205 5.938 ( 1.435 -5.756 9.044) 10.816 6.107 ( 1.427 -5.969 4.292) 7.489 6.233 ( 0.966 0.577 0.393) 1.192 6.338 ( -6.969 -4.127 -4.090) 9.073 6.460 ( 3.140 4.188 2.111) 5.644 6.523 ( 5.942 -0.411 1.991) 6.280 6.585 ( 3.318 -2.952 -3.172) 5.458 6.704 ( -0.599 -7.427 -1.131) 7.536 6.795 ( -8.703 -2.945 -0.294) 9.193 7.073 ( -0.460 -3.304 7.010) 7.763 7.099 ( 0.618 0.770 -0.922) 1.351 7.123 ( 0.914 -13.461 2.605) 13.741 7.227 ( 0.068 -2.321 0.891) 2.487 7.349 ( 1.386 -6.414 -3.777) 7.571 7.457 ( -2.878 0.267 -6.890) 7.472 7.630 ( 3.018 -9.266 -1.460) 9.854 7.769 ( 6.865 -4.268 8.386) 11.648 7.870 ( -0.564 -3.822 0.284) 3.874 7.994 ( -2.784 2.904 1.682) 4.360 8.154 ( 3.397 -4.587 11.487) 12.826 8.169 ( 1.367 0.648 -0.325) 1.548 8.377 ( 1.375 -2.750 -1.862) 3.594 8.531 ( 3.109 0.299 7.167) 7.818 8.571 ( -0.677 -0.015 -0.884) 1.114 8.631 ( -1.355 -1.271 1.107) 2.163 8.751 ( -2.332 -3.554 1.961) 4.681 8.840 ( 4.064 6.462 4.581) 8.903 9.130 ( -0.300 -14.006 -0.065) 14.010 9.480 ( -2.295 -17.213 -5.925) 18.348 9.957 ( -2.948 3.825 -21.231) 21.773 10.224 ( -1.031 3.922 -1.326) 4.266 10.365 ( 2.929 5.907 2.106) 6.922 10.385 ( 3.509 -0.250 -0.376) 3.538 10.578 ( -1.166 2.751 4.731) 5.595 10.901 ( -5.692 5.508 -0.611) 7.945 10.929 ( -5.262 5.874 -6.345) 10.122 11.132 ( 3.593 2.546 5.188) 6.805 11.431 ( -1.041 6.484 -0.424) 6.581 11.893 ( 7.523 -1.804 2.341) 8.083 12.056 ( 1.874 6.447 0.538) 6.736 12.319 ( 6.027 1.150 5.429) 8.193 12.389 ( -5.277 0.054 0.485) 5.299 12.473 ( 3.795 -0.396 -1.124) 3.977 12.752 ( 0.533 3.569 -0.419) 3.633 12.894 ( -7.710 -1.654 -3.212) 8.515 13.610 ( -1.911 -13.732 -0.373) 13.870 14.113 ( 4.694 -2.339 3.005) 6.045 14.166 ( 13.381 1.098 4.353) 14.114 14.271 ( 1.780 -4.847 2.144) 5.591 14.357 ( -1.155 -2.871 -0.436) 3.125 14.560 ( -10.351 -4.656 -4.969) 12.390 14.752 ( 2.365 0.362 -2.582) 3.520 15.012 ( -1.905 -0.830 4.963) 5.381 15.252 ( 7.245 -0.932 1.590) 7.475 15.384 ( -2.914 -8.138 -6.340) 10.720 15.906 ( -3.570 -8.603 1.380) 9.416 16.328 ( -2.641 1.093 3.420) 4.457 16.663 ( -2.903 3.356 -1.423) 4.660 19.881 ( 0.228 -1.625 0.581) 1.741 20.146 ( -1.086 -0.452 -1.572) 1.964 20.244 ( 1.917 5.342 -2.161) 6.073 20.314 ( 0.908 7.388 0.383) 7.454 24.235 ( -1.801 -0.639 -0.885) 2.105 24.502 ( -4.297 -4.929 3.197) 7.279 24.831 ( -2.295 1.027 0.430) 2.551 24.910 ( -2.474 -0.089 -0.765) 2.592 26.194 ( 1.262 -0.752 1.368) 2.007 26.297 ( 1.582 -1.680 -0.898) 2.476 26.702 ( 1.459 1.084 0.706) 1.950 26.758 ( 3.032 1.993 -1.130) 3.801 27.037 ( -2.422 -0.741 -0.535) 2.589 27.096 ( -1.904 -5.297 2.337) 6.095 27.119 ( 0.761 -4.377 4.739) 6.496 27.283 ( -4.178 -0.588 0.795) 4.294 27.692 ( -4.624 -1.706 7.862) 9.279 28.150 ( 6.009 -5.449 -12.164) 14.621 28.991 ( -0.494 5.285 2.522) 5.876 29.169 ( -1.985 10.867 -0.329) 11.052 29.344 ( 1.970 1.721 -0.510) 2.666 29.502 ( -2.475 12.817 7.731) 15.172 29.848 ( 7.437 -1.992 0.913) 7.754 30.728 ( 3.799 2.318 -13.542) 14.254 ======================= Grid point 116 (41/117) ======================= q-point: (-0.10 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.071 ( 4.349 22.493 26.994) 35.405 1.248 ( 1.247 29.926 28.926) 41.639 2.008 ( -4.564 43.386 46.425) 63.706 2.428 ( -7.192 -2.655 -22.003) 23.300 2.801 ( -4.824 -0.107 -14.015) 14.822 2.967 ( -1.971 5.209 -13.730) 14.817 3.347 ( -1.503 -5.633 -8.469) 10.282 3.653 ( 2.677 -3.695 -1.947) 4.961 3.777 ( 2.755 -11.523 6.538) 13.532 3.872 ( 2.241 3.610 -0.774) 4.320 4.123 ( -0.431 3.134 6.387) 7.127 4.229 ( -3.276 1.292 0.766) 3.604 4.422 ( 1.238 -3.966 0.499) 4.185 4.510 ( 5.937 4.395 -3.419) 8.140 4.548 ( 4.973 -6.084 -1.261) 7.959 4.742 ( -2.546 -3.302 5.825) 7.163 4.753 ( -1.651 8.012 -15.894) 17.875 4.813 ( 7.510 6.711 -6.112) 11.781 5.084 ( -5.203 6.362 4.679) 9.457 5.262 ( -1.808 -2.372 1.688) 3.427 5.421 ( -0.942 0.044 1.396) 1.685 5.501 ( 7.211 -0.970 -5.518) 9.131 5.565 ( -8.924 -6.938 -0.628) 11.321 5.724 ( -6.342 -2.475 -8.113) 10.590 5.765 ( 2.003 0.461 2.359) 3.129 5.893 ( -4.719 -3.560 -11.710) 13.118 5.973 ( -2.949 -1.421 6.053) 6.882 6.118 ( -13.966 -0.588 6.989) 15.628 6.244 ( 0.483 0.788 -5.549) 5.625 6.345 ( 8.515 2.072 0.633) 8.787 6.452 ( -4.397 -4.717 6.726) 9.318 6.621 ( 7.113 -2.405 12.786) 14.828 6.678 ( 5.740 -4.291 -1.843) 7.400 6.793 ( -1.987 -1.996 -0.724) 2.908 6.857 ( -2.237 -5.302 -5.196) 7.753 7.063 ( -5.636 -1.120 -2.148) 6.135 7.136 ( -1.159 -2.544 4.283) 5.115 7.214 ( 3.038 1.281 2.636) 4.221 7.398 ( -1.970 -9.709 -3.537) 10.520 7.486 ( -0.946 -4.651 -0.641) 4.790 7.503 ( -1.051 -9.905 -2.334) 10.231 7.773 ( -0.611 -4.394 -1.666) 4.739 7.851 ( -0.317 2.056 -0.256) 2.096 7.900 ( -0.244 1.446 -1.971) 2.457 7.968 ( 4.864 -2.967 4.349) 7.168 8.190 ( 5.872 -0.711 1.850) 6.198 8.246 ( 9.818 -2.201 13.861) 17.128 8.397 ( -5.786 -1.462 -5.937) 8.418 8.506 ( 8.255 6.853 6.803) 12.704 8.584 ( -5.704 -1.208 -4.517) 7.375 8.630 ( -0.617 -0.049 4.780) 4.820 8.772 ( -0.428 1.571 2.709) 3.161 8.810 ( -1.656 -3.328 0.330) 3.732 9.409 ( -9.896 -5.518 -5.498) 12.594 9.663 ( -12.252 -2.245 -15.130) 19.598 9.852 ( -1.202 -8.111 -10.241) 13.119 10.139 ( 2.019 5.075 1.264) 5.606 10.263 ( 1.765 6.514 0.209) 6.753 10.423 ( 6.433 -0.305 1.924) 6.721 10.508 ( -2.241 3.427 5.034) 6.489 10.709 ( -8.295 8.024 -4.666) 12.449 10.818 ( -3.023 4.615 -7.284) 9.137 11.063 ( 2.774 6.260 2.999) 7.475 11.305 ( -2.957 4.570 -2.025) 5.808 11.934 ( -2.718 5.265 2.144) 6.302 11.986 ( 1.953 -2.207 -1.430) 3.276 12.343 ( 6.377 -1.873 4.990) 8.311 12.415 ( -0.546 -2.079 1.518) 2.631 12.519 ( 6.020 -1.104 2.268) 6.527 12.698 ( -2.576 1.622 -0.998) 3.203 12.931 ( 37.554 0.565 9.188) 38.666 13.813 ( -12.803 -9.699 -4.051) 16.565 14.120 ( 0.749 0.092 0.376) 0.843 14.264 ( 9.412 0.187 8.674) 12.801 14.374 ( 4.691 -4.260 -1.691) 6.558 14.402 ( -1.610 -2.818 2.426) 4.052 14.585 ( -6.712 -3.132 -4.059) 8.446 14.758 ( -1.587 -0.327 -3.188) 3.576 15.066 ( 3.187 -5.150 9.417) 11.196 15.329 ( 8.085 -1.870 2.433) 8.648 15.540 ( 3.778 -6.691 -0.451) 7.697 15.982 ( -11.892 -4.702 -4.014) 13.403 16.339 ( 2.165 -2.141 4.242) 5.221 16.558 ( -2.051 5.476 -1.486) 6.034 19.909 ( 0.897 -0.787 0.822) 1.449 20.103 ( -2.986 5.075 -6.833) 9.020 20.157 ( 0.671 3.968 1.363) 4.248 20.192 ( 3.263 4.826 -0.372) 5.837 24.278 ( 13.215 -1.916 4.697) 14.155 24.552 ( -8.001 -3.536 2.560) 9.114 24.802 ( -1.046 0.815 1.032) 1.681 24.895 ( -2.022 0.056 -1.197) 2.350 26.207 ( 1.001 0.053 2.260) 2.472 26.326 ( 0.473 -0.650 -1.411) 1.624 26.709 ( 2.127 -0.191 0.399) 2.172 26.739 ( 0.271 0.331 -0.871) 0.970 27.035 ( -1.264 -0.280 1.530) 2.004 27.162 ( -2.292 -2.494 -1.217) 3.600 27.236 ( 0.112 -6.696 5.146) 8.446 27.285 ( -1.515 -1.295 0.656) 2.099 27.760 ( -7.180 -12.191 15.653) 21.100 28.305 ( 5.892 -5.871 -12.035) 14.629 28.898 ( -0.227 4.393 2.203) 4.920 28.979 ( -0.779 6.172 1.233) 6.342 29.191 ( 2.867 14.246 4.258) 15.142 29.349 ( 2.010 3.588 0.823) 4.195 29.945 ( 6.895 -2.711 -0.684) 7.441 30.586 ( -11.192 12.638 -21.848) 27.610 ======================= Grid point 118 (42/117) ======================= q-point: ( 0.10 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.993 ( 1.586 0.000 41.666) 41.697 1.167 ( 22.352 0.000 37.771) 43.889 2.006 ( 47.519 0.000 58.404) 75.293 2.255 ( -13.268 -0.000 -27.206) 30.269 2.645 ( -1.923 -0.000 -34.643) 34.696 3.021 ( 6.515 0.000 2.650) 7.033 3.139 ( -16.047 -0.000 -6.681) 17.382 3.722 ( -6.906 -0.000 -13.041) 14.756 3.756 ( -1.532 -0.000 1.652) 2.253 3.803 ( -12.736 -0.000 0.132) 12.736 4.020 ( -7.122 -0.000 -10.643) 12.806 4.298 ( 20.283 0.000 0.479) 20.289 4.555 ( -14.435 -0.000 0.458) 14.442 4.566 ( -0.675 -0.000 -3.739) 3.800 4.588 ( 10.106 0.000 -1.242) 10.182 4.674 ( -4.983 -0.000 -3.289) 5.971 4.771 ( -10.741 -0.000 4.867) 11.793 4.898 ( 12.873 0.000 15.556) 20.192 5.013 ( 11.259 0.000 5.180) 12.394 5.294 ( -3.871 -0.000 -2.013) 4.363 5.361 ( -3.317 -0.000 -13.448) 13.851 5.393 ( -8.308 -0.000 5.183) 9.793 5.642 ( 8.808 0.000 -7.367) 11.483 5.673 ( -5.709 -0.000 7.994) 9.823 5.768 ( 4.144 0.000 -8.976) 9.887 5.824 ( -11.427 -0.000 -10.300) 15.384 5.934 ( 1.838 0.000 3.027) 3.541 6.027 ( 3.341 0.000 -2.186) 3.992 6.259 ( 1.495 0.000 5.825) 6.013 6.497 ( 5.006 0.000 6.411) 8.134 6.499 ( 8.975 0.000 3.026) 9.471 6.669 ( -1.441 -0.000 2.211) 2.639 6.720 ( 3.024 0.000 6.026) 6.742 6.865 ( 0.923 0.000 -1.499) 1.761 6.893 ( -2.395 -0.000 -5.441) 5.945 6.975 ( -2.782 -0.000 -4.476) 5.270 7.247 ( 9.443 0.000 14.813) 17.567 7.248 ( 1.446 0.000 4.452) 4.681 7.422 ( -7.711 -0.000 -4.536) 8.946 7.455 ( -2.778 -0.000 -6.560) 7.124 7.630 ( -15.734 -0.000 -9.073) 18.162 7.635 ( 1.163 0.000 4.719) 4.861 7.899 ( -1.087 -0.000 -0.290) 1.125 7.905 ( 9.656 0.000 1.118) 9.721 8.134 ( 7.014 0.000 4.193) 8.172 8.247 ( -16.358 -0.000 -2.685) 16.577 8.286 ( -7.424 -0.000 -4.087) 8.474 8.338 ( 6.494 0.000 6.035) 8.866 8.462 ( 1.138 0.000 3.491) 3.671 8.546 ( 5.131 0.000 0.691) 5.178 8.630 ( -0.915 -0.000 5.079) 5.160 8.710 ( 5.571 0.000 1.121) 5.683 8.818 ( -6.033 -0.000 5.245) 7.995 8.858 ( 1.115 0.000 2.241) 2.503 9.947 ( -11.422 -0.000 -3.571) 11.967 10.044 ( -2.149 -0.000 -1.456) 2.596 10.045 ( 1.613 0.000 -0.189) 1.624 10.197 ( 17.101 0.000 4.685) 17.731 10.331 ( -4.614 -0.000 5.551) 7.219 10.503 ( -3.553 -0.000 -3.989) 5.342 10.549 ( 5.784 0.000 3.127) 6.575 10.757 ( 3.518 0.000 -4.508) 5.719 11.090 ( 6.813 0.000 6.082) 9.133 11.172 ( -4.915 -0.000 -4.429) 6.616 11.739 ( -10.319 -0.000 -0.006) 10.319 11.994 ( 0.876 0.000 1.345) 1.605 12.389 ( -1.291 -0.000 -1.293) 1.827 12.428 ( -0.203 -0.000 0.481) 0.522 12.594 ( -0.525 -0.000 -0.805) 0.961 12.604 ( 6.292 0.000 2.482) 6.764 13.310 ( -40.769 -0.000 -16.393) 43.941 14.175 ( 13.858 0.000 0.931) 13.889 14.176 ( -7.991 -0.000 -1.498) 8.130 14.242 ( 11.697 0.000 -11.071) 16.106 14.425 ( -4.608 -0.000 2.207) 5.110 14.474 ( 10.548 0.000 -2.344) 10.805 14.696 ( -1.383 -0.000 -5.411) 5.585 14.785 ( 17.554 0.000 0.245) 17.555 15.221 ( -2.201 -0.000 4.363) 4.887 15.539 ( -1.118 -0.000 3.901) 4.058 15.706 ( -20.382 -0.000 -15.267) 25.466 15.829 ( 19.010 0.000 8.127) 20.675 16.442 ( -0.529 -0.000 -1.130) 1.247 16.597 ( 13.186 0.000 -4.954) 14.086 19.945 ( -1.509 -0.000 -1.679) 2.258 19.975 ( 2.706 0.000 -0.550) 2.762 20.119 ( 0.911 0.000 1.782) 2.001 20.170 ( 0.053 0.000 -0.238) 0.244 24.399 ( -8.990 -0.000 -4.356) 9.990 24.826 ( 3.735 0.000 1.925) 4.202 24.870 ( 0.326 0.000 -2.855) 2.874 25.281 ( 50.057 0.000 -30.878) 58.815 26.303 ( 13.352 0.000 -5.763) 14.542 26.311 ( -2.392 -0.000 -1.648) 2.905 26.678 ( -3.884 -0.000 0.856) 3.977 26.747 ( -1.772 -0.000 -1.213) 2.147 27.112 ( 7.555 0.000 2.373) 7.919 27.166 ( 1.808 0.000 -3.085) 3.575 27.277 ( -1.680 -0.000 0.370) 1.721 27.329 ( 1.814 0.000 -0.026) 1.815 28.101 ( -5.541 -0.000 1.247) 5.680 28.162 ( -24.117 -0.000 12.154) 27.007 28.790 ( -2.195 -0.000 3.848) 4.430 29.001 ( -0.360 -0.000 -2.268) 2.296 29.118 ( -2.645 -0.000 3.929) 4.737 29.168 ( -5.381 -0.000 -5.109) 7.420 29.540 ( -21.976 -0.000 18.242) 28.561 30.156 ( 9.388 0.000 5.546) 10.904 ======================= Grid point 119 (43/117) ======================= q-point: ( 0.20 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.249 ( 5.838 -21.118 29.577) 36.809 1.630 ( 21.389 -25.782 27.803) 43.534 2.193 ( -10.604 -2.453 -23.565) 25.957 2.556 ( 23.883 -16.784 13.179) 32.028 2.753 ( 20.408 -17.329 4.561) 27.158 2.911 ( -10.102 8.731 -2.270) 13.544 3.160 ( 5.304 -5.505 -1.341) 7.761 3.569 ( -6.167 6.007 -6.114) 10.559 3.742 ( -13.171 -3.627 -0.952) 13.695 3.925 ( -3.131 -10.130 -5.220) 11.818 3.980 ( -6.508 0.374 -8.948) 11.071 4.207 ( 0.170 12.349 -5.145) 13.379 4.374 ( 2.017 1.758 0.350) 2.698 4.581 ( -8.304 2.212 -3.191) 9.167 4.670 ( 4.531 -3.698 0.426) 5.864 4.753 ( 8.986 -0.216 -0.243) 8.992 4.809 ( -11.289 -7.982 1.507) 13.908 4.868 ( 7.785 8.298 16.179) 19.780 5.088 ( -6.006 3.626 1.393) 7.152 5.155 ( 9.008 -1.588 1.859) 9.334 5.324 ( -5.846 -3.729 -16.152) 17.577 5.522 ( -0.322 4.537 4.548) 6.432 5.584 ( -3.229 -6.482 1.596) 7.415 5.688 ( -3.889 -0.173 -12.487) 13.080 5.741 ( 2.860 2.503 -2.354) 4.471 5.830 ( 8.433 1.484 -3.272) 9.167 5.919 ( 0.407 -0.341 2.744) 2.795 6.082 ( -1.138 -2.870 -3.349) 4.555 6.235 ( 9.797 4.608 11.063) 15.479 6.422 ( 2.546 8.450 -4.123) 9.741 6.506 ( -3.449 7.670 0.060) 8.410 6.610 ( 8.634 -1.125 6.264) 10.726 6.819 ( 1.665 -1.542 -0.554) 2.336 6.834 ( -0.043 2.798 -5.047) 5.771 6.865 ( -1.833 2.103 3.303) 4.323 6.972 ( -4.707 -2.565 -2.745) 6.022 7.216 ( -1.325 4.730 3.734) 6.170 7.259 ( -3.063 7.172 2.437) 8.171 7.324 ( 1.878 4.183 -0.454) 4.608 7.410 ( 5.809 5.131 4.286) 8.856 7.480 ( -11.277 3.095 -6.720) 13.488 7.619 ( 5.398 1.730 3.413) 6.617 7.878 ( -3.035 0.744 -0.286) 3.138 7.947 ( -2.597 -0.445 -3.594) 4.456 8.112 ( -1.400 4.343 -1.502) 4.804 8.186 ( -4.840 0.355 -4.111) 6.360 8.209 ( -5.337 -0.001 2.288) 5.807 8.407 ( 0.760 -2.818 3.219) 4.345 8.455 ( 5.105 2.545 4.232) 7.103 8.574 ( 3.995 -0.559 6.889) 7.983 8.747 ( -1.922 4.334 -0.742) 4.799 8.771 ( 3.396 -0.945 5.597) 6.614 8.882 ( 6.126 -10.015 11.881) 16.703 8.959 ( -9.273 -17.094 -9.298) 21.556 9.591 ( -3.559 22.101 -0.343) 22.389 9.822 ( 0.057 15.245 -5.993) 16.381 10.176 ( -0.345 -6.679 1.009) 6.764 10.282 ( 1.674 -0.275 -3.927) 4.278 10.351 ( -5.050 -3.582 2.336) 6.617 10.612 ( 5.866 -7.204 3.693) 9.997 10.653 ( 3.572 -7.018 1.660) 8.047 10.840 ( 4.323 -4.213 -4.824) 7.728 11.183 ( 3.693 -4.783 4.334) 7.437 11.192 ( -1.563 -4.383 -1.906) 5.029 11.731 ( -11.220 -5.327 -1.013) 12.462 12.028 ( 0.425 -2.890 1.431) 3.253 12.358 ( -0.345 1.714 0.180) 1.757 12.447 ( 0.322 -1.579 -0.027) 1.612 12.588 ( 2.376 0.817 0.133) 2.516 12.670 ( 5.098 -2.294 1.197) 5.717 13.032 ( -36.878 2.212 -16.294) 40.378 13.941 ( 7.110 20.000 -0.330) 21.229 14.157 ( -4.383 2.115 3.780) 6.162 14.308 ( 6.378 1.643 -5.229) 8.410 14.373 ( -2.568 2.562 1.946) 4.117 14.445 ( 9.710 7.522 -1.342) 12.356 14.668 ( 0.471 2.480 -2.776) 3.753 14.867 ( 13.478 2.056 -2.138) 13.800 15.125 ( -0.039 9.591 11.464) 14.947 15.296 ( -5.896 6.790 4.929) 10.254 15.522 ( -18.179 5.561 -15.913) 24.792 15.986 ( 17.723 1.953 6.742) 19.062 16.456 ( 1.343 -1.842 0.610) 2.360 16.604 ( 6.495 2.630 -0.680) 7.040 19.956 ( -0.615 -1.660 -0.802) 1.943 20.002 ( -0.393 -0.112 -1.039) 1.117 20.145 ( -0.644 -2.482 0.728) 2.665 20.247 ( 0.978 -6.266 -1.331) 6.480 24.337 ( -5.890 1.221 -4.645) 7.600 24.844 ( 5.488 2.067 1.409) 6.031 24.864 ( 1.219 0.967 -3.063) 3.436 25.171 ( 29.516 24.125 -8.243) 39.002 26.275 ( -0.094 3.114 -0.975) 3.264 26.301 ( 4.464 3.794 -1.558) 6.063 26.669 ( -4.096 -0.468 1.286) 4.319 26.707 ( -2.198 -0.611 -1.632) 2.805 27.072 ( -0.640 4.212 3.420) 5.463 27.179 ( 1.094 3.633 4.014) 5.524 27.208 ( 3.235 4.091 2.334) 5.714 27.327 ( 3.982 1.020 2.795) 4.971 27.607 ( -4.754 4.922 11.865) 13.697 28.267 ( -8.242 1.773 -8.844) 12.218 28.874 ( -1.974 -7.929 1.824) 8.372 28.948 ( -0.375 -2.501 3.024) 3.942 29.177 ( -2.032 -10.764 1.987) 11.133 29.491 ( 4.882 1.116 7.523) 9.037 29.841 ( -24.391 -35.351 -18.769) 46.871 30.187 ( 4.506 0.744 5.080) 6.831 ======================= Grid point 120 (44/117) ======================= q-point: ( 0.30 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.776 ( 2.771 -26.442 19.654) 33.063 2.202 ( -3.509 -3.783 -14.926) 15.793 2.308 ( 19.618 -27.622 18.759) 38.727 2.616 ( -7.855 6.282 -2.668) 10.406 2.923 ( 5.090 -16.017 -20.366) 26.405 3.257 ( 12.763 1.862 6.783) 14.573 3.522 ( 7.426 -16.931 4.530) 19.034 3.578 ( 17.602 -22.802 13.268) 31.714 3.684 ( -12.799 0.183 -4.455) 13.553 3.831 ( -15.863 4.778 -10.647) 19.693 4.057 ( 4.640 2.471 -0.250) 5.263 4.132 ( 2.482 -5.930 1.320) 6.562 4.410 ( -1.651 -4.198 -0.885) 4.597 4.493 ( -3.461 1.023 -4.355) 5.656 4.636 ( -3.527 11.645 4.774) 13.070 4.667 ( 0.673 8.130 0.470) 8.171 4.830 ( -3.296 -7.164 7.798) 11.091 4.852 ( 0.272 1.454 -6.511) 6.677 5.046 ( -1.978 -0.764 2.078) 2.969 5.217 ( 2.709 2.928 -0.025) 3.989 5.418 ( 4.280 -6.460 -13.077) 15.201 5.466 ( -4.053 2.038 4.248) 6.215 5.538 ( -0.311 -0.183 1.175) 1.229 5.661 ( 7.227 7.854 4.047) 11.415 5.777 ( 3.905 3.616 -1.728) 5.596 5.900 ( 3.918 -11.881 -9.738) 15.853 5.939 ( -2.856 1.798 4.302) 5.468 6.082 ( -1.533 4.845 -1.554) 5.314 6.137 ( 7.703 7.000 8.900) 13.695 6.276 ( -3.103 10.206 -5.667) 12.079 6.329 ( -3.843 0.825 -9.207) 10.011 6.637 ( -0.556 6.752 -1.254) 6.890 6.740 ( -0.493 4.398 1.950) 4.836 6.770 ( 0.378 -1.358 1.314) 1.927 6.875 ( -3.905 3.900 1.057) 5.619 6.895 ( -0.300 9.846 -2.370) 10.131 7.061 ( -1.288 3.577 0.482) 3.832 7.163 ( -4.769 2.249 4.751) 7.098 7.212 ( 0.568 3.220 -2.070) 3.870 7.300 ( -3.625 5.677 0.068) 6.736 7.438 ( 8.837 1.818 5.869) 10.763 7.605 ( 6.117 5.584 -4.776) 9.561 7.827 ( -3.301 3.089 -0.648) 4.567 7.953 ( -8.546 -5.166 3.175) 10.479 8.007 ( -4.477 3.109 -3.815) 6.653 8.136 ( -2.403 4.007 -0.336) 4.684 8.193 ( 1.650 0.943 0.446) 1.952 8.407 ( -0.192 -0.365 5.892) 5.906 8.497 ( 5.588 4.336 2.142) 7.390 8.591 ( 1.476 0.068 5.393) 5.591 8.620 ( 1.722 3.034 2.434) 4.253 8.762 ( 2.000 2.277 4.309) 5.268 9.099 ( -1.149 10.468 5.994) 12.117 9.135 ( -4.780 4.679 -3.823) 7.705 9.192 ( 1.569 -7.420 4.980) 9.073 9.543 ( -6.160 8.195 -17.195) 20.020 10.274 ( 2.707 -1.312 1.116) 3.208 10.310 ( -4.389 -5.409 -3.524) 7.807 10.404 ( -0.396 -2.911 1.028) 3.112 10.755 ( 3.825 -4.317 0.168) 5.770 10.854 ( 4.602 -9.534 2.996) 11.002 10.924 ( 4.053 -2.206 -2.399) 5.201 11.252 ( -3.827 -3.998 -2.725) 6.169 11.334 ( 6.457 -5.442 6.974) 10.952 11.774 ( -12.324 -5.752 -3.022) 13.932 12.103 ( 0.525 -4.235 -0.026) 4.268 12.342 ( 1.785 0.043 2.071) 2.734 12.483 ( -0.051 -1.826 0.129) 1.831 12.572 ( -3.136 1.321 -4.459) 5.609 12.741 ( -2.753 -2.544 -3.346) 5.024 12.825 ( -12.858 -0.093 -3.835) 13.418 13.566 ( 12.961 22.619 5.277) 26.598 14.094 ( -3.397 1.545 2.837) 4.688 14.254 ( -0.612 4.692 4.641) 6.628 14.306 ( 2.466 4.426 -2.618) 5.703 14.367 ( 3.455 4.134 -1.123) 5.504 14.597 ( -1.668 4.205 -0.855) 4.604 14.854 ( 4.066 5.020 -6.723) 9.323 14.989 ( -0.094 3.243 9.084) 9.646 15.217 ( -4.293 0.950 -0.284) 4.406 15.298 ( -12.562 5.987 -10.735) 17.575 15.972 ( 14.279 8.738 5.826) 17.725 16.512 ( 0.655 -2.474 -0.478) 2.604 16.616 ( 5.191 -0.126 1.147) 5.318 19.944 ( -4.709 0.907 -3.573) 5.981 20.021 ( 5.074 -0.262 3.915) 6.414 20.210 ( -3.405 -5.155 -1.214) 6.296 20.375 ( 1.055 -5.867 -0.551) 5.986 24.285 ( -2.657 1.121 -3.466) 4.509 24.731 ( 11.519 13.228 0.182) 17.541 24.867 ( 2.377 0.424 -0.279) 2.431 25.005 ( 9.391 4.864 0.856) 10.610 26.217 ( -1.486 1.973 0.246) 2.482 26.249 ( -1.240 2.596 0.038) 2.877 26.659 ( -2.682 -1.141 0.933) 3.060 26.744 ( -1.975 -3.157 -2.521) 4.497 27.002 ( -2.799 1.976 2.884) 4.479 27.079 ( -2.117 4.003 5.778) 7.341 27.176 ( 7.047 4.584 0.843) 8.449 27.335 ( 4.832 1.158 1.282) 5.132 27.610 ( 1.443 -2.060 1.721) 3.047 28.154 ( -5.614 3.850 -8.308) 10.741 29.033 ( 1.355 -6.788 3.802) 7.897 29.050 ( -1.149 -8.472 -0.164) 8.551 29.381 ( -1.758 -8.193 1.683) 8.546 29.521 ( 4.598 -3.102 3.687) 6.660 30.071 ( -3.720 -2.194 4.195) 6.021 30.274 ( -13.542 -11.524 -12.827) 21.925 ======================= Grid point 121 (45/117) ======================= q-point: ( 0.40 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.172 ( -7.498 -10.764 5.269) 14.137 2.291 ( 1.513 -6.201 -5.833) 8.646 2.598 ( 7.139 -11.209 4.506) 14.032 2.946 ( 15.134 -23.003 10.421) 29.441 3.231 ( 7.303 -5.466 -3.154) 9.652 3.379 ( 12.339 -9.852 -5.525) 16.728 3.609 ( -7.758 -1.472 -2.928) 8.422 3.662 ( -12.225 -0.878 -11.975) 17.135 3.756 ( 5.151 -8.672 -7.210) 12.398 4.002 ( -3.309 0.787 2.280) 4.095 4.117 ( 4.095 -9.999 9.065) 14.104 4.221 ( -2.070 1.115 -4.515) 5.090 4.375 ( -1.933 9.481 2.482) 9.989 4.394 ( 2.521 5.437 -0.623) 6.026 4.547 ( 2.735 -6.045 1.583) 6.821 4.607 ( -4.418 -0.368 5.156) 6.800 4.781 ( -8.148 1.695 -8.793) 12.107 4.951 ( 3.995 5.260 10.716) 12.588 5.037 ( 1.737 -11.079 7.294) 13.378 5.184 ( -1.225 3.926 1.374) 4.336 5.410 ( 5.565 3.377 -0.659) 6.543 5.431 ( -4.321 3.409 -5.055) 7.473 5.504 ( -2.372 9.916 1.507) 10.307 5.580 ( 2.308 2.165 -1.803) 3.642 5.759 ( 2.618 9.500 -0.550) 9.869 5.807 ( 5.253 -3.728 1.660) 6.651 5.970 ( 8.651 4.572 7.463) 12.306 6.079 ( 3.027 3.635 0.951) 4.825 6.114 ( 1.695 2.302 1.998) 3.488 6.198 ( -5.515 -13.236 -3.904) 14.861 6.358 ( -6.057 -5.472 -7.657) 11.191 6.430 ( -6.408 8.530 -13.720) 17.380 6.598 ( -4.506 10.531 -4.403) 12.272 6.650 ( -1.398 4.208 -1.758) 4.770 6.801 ( 2.900 6.253 6.134) 9.227 6.849 ( 1.428 -2.964 2.735) 4.278 6.946 ( -4.081 3.896 -0.991) 5.729 7.108 ( 0.810 1.454 3.705) 4.061 7.173 ( -0.929 5.190 0.356) 5.284 7.296 ( 1.191 -2.776 1.253) 3.270 7.407 ( 0.533 4.970 0.511) 5.024 7.531 ( 6.501 3.565 -0.697) 7.447 7.737 ( 0.021 3.560 -6.766) 7.646 7.896 ( -7.416 4.637 4.527) 9.848 7.997 ( -3.008 0.378 -3.733) 4.809 8.060 ( -1.232 -0.248 4.232) 4.415 8.147 ( 6.651 9.371 7.291) 13.609 8.344 ( -4.781 4.544 0.051) 6.596 8.464 ( 5.424 -2.754 7.061) 9.320 8.570 ( 1.338 3.994 1.346) 4.422 8.627 ( -0.253 7.758 2.038) 8.025 8.692 ( 0.208 -0.498 0.645) 0.841 8.825 ( -1.170 2.143 -1.019) 2.645 9.058 ( 0.379 7.381 -1.720) 7.588 9.312 ( 3.746 -1.161 8.788) 9.624 9.452 ( -13.179 -2.661 -17.405) 21.993 10.306 ( 0.786 -1.604 -1.573) 2.379 10.397 ( -0.184 -4.093 -0.005) 4.097 10.443 ( -0.050 -1.014 0.187) 1.033 10.816 ( 1.632 0.178 -2.381) 2.893 10.957 ( 2.454 -1.694 2.980) 4.216 11.086 ( 5.751 -8.197 0.544) 10.028 11.280 ( -3.218 -1.205 -2.110) 4.032 11.471 ( 7.586 -3.893 7.733) 11.511 11.786 ( -12.701 -3.686 -5.635) 14.376 12.192 ( 0.706 -4.289 -1.277) 4.530 12.364 ( 1.983 0.251 1.832) 2.711 12.500 ( -7.556 0.186 -8.189) 11.144 12.519 ( -2.879 -2.310 -0.298) 3.703 12.727 ( -2.441 -0.396 1.575) 2.932 12.867 ( 4.209 -2.292 1.272) 4.959 13.270 ( 11.614 15.113 6.322) 20.081 14.064 ( 0.820 1.063 3.870) 4.097 14.159 ( -3.692 3.166 4.101) 6.362 14.236 ( 2.180 3.932 -1.543) 4.753 14.319 ( 0.764 1.922 -2.155) 2.987 14.480 ( -7.788 5.143 -3.844) 10.093 14.764 ( -3.332 1.931 -7.437) 8.375 14.962 ( 0.635 0.960 4.893) 5.027 15.163 ( -4.670 1.748 -1.618) 5.242 15.180 ( -0.514 1.741 -1.792) 2.551 15.848 ( 8.720 11.164 2.675) 14.416 16.556 ( 0.609 -1.779 -1.171) 2.215 16.651 ( 4.536 0.176 1.809) 4.887 19.889 ( -4.238 1.427 -3.042) 5.409 20.058 ( 5.842 0.061 4.518) 7.385 20.288 ( -4.723 -5.156 -2.372) 7.383 20.483 ( 1.118 -4.342 0.368) 4.499 24.258 ( -0.777 0.599 -1.898) 2.136 24.558 ( 7.762 10.052 0.835) 12.728 24.871 ( 1.841 0.464 -0.124) 1.902 25.000 ( 3.812 1.106 -0.026) 3.970 26.175 ( -2.933 1.202 -0.978) 3.317 26.194 ( -0.845 1.953 0.925) 2.320 26.677 ( -1.706 -1.897 0.897) 2.705 26.786 ( -2.645 -2.614 -1.356) 3.958 26.957 ( -1.650 1.459 1.042) 2.436 27.012 ( -2.350 1.665 6.620) 7.219 27.118 ( 4.962 4.900 0.335) 6.982 27.339 ( 5.288 1.684 -2.395) 6.045 27.655 ( 2.075 -1.138 1.329) 2.714 28.060 ( -3.734 2.403 -6.852) 8.165 29.136 ( 1.999 -2.492 5.750) 6.578 29.221 ( -1.368 -8.580 -1.201) 8.771 29.459 ( 1.861 -2.242 0.988) 3.077 29.640 ( 4.268 -3.000 -3.092) 6.065 30.121 ( -3.754 -6.924 9.580) 12.402 30.362 ( -11.399 -6.051 -10.142) 16.414 ======================= Grid point 122 (46/117) ======================= q-point: ( 0.50 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.236 ( -0.531 -2.220 -8.549) 8.848 2.451 ( 3.269 -7.938 -0.052) 8.585 2.922 ( 5.758 -11.796 8.649) 15.720 3.299 ( 4.254 -3.564 0.522) 5.574 3.410 ( 9.274 -4.323 -1.689) 10.370 3.456 ( 2.081 -1.858 -2.391) 3.674 3.626 ( -1.718 -8.877 -7.207) 11.563 3.794 ( -3.462 4.592 1.291) 5.894 3.865 ( -3.984 -9.776 -7.069) 12.705 3.961 ( -3.156 2.452 0.629) 4.046 4.057 ( 1.304 1.950 -3.442) 4.165 4.255 ( -2.741 2.532 7.633) 8.496 4.320 ( 0.146 -5.544 -2.602) 6.126 4.390 ( 2.046 -2.892 3.432) 4.932 4.484 ( -2.073 5.712 1.708) 6.312 4.648 ( -8.466 6.180 -2.899) 10.875 4.736 ( 11.502 -6.725 0.029) 13.324 4.904 ( -1.856 1.681 4.824) 5.436 5.084 ( -3.972 4.146 6.586) 8.737 5.125 ( -1.750 7.131 6.172) 9.592 5.215 ( -6.231 -3.612 8.320) 11.004 5.367 ( 1.159 4.742 -3.495) 6.003 5.446 ( 2.771 5.425 -10.414) 12.065 5.462 ( -0.193 6.157 -3.541) 7.105 5.754 ( 7.372 -4.887 4.325) 9.845 5.838 ( 0.458 3.601 -0.972) 3.758 5.955 ( 0.382 9.538 3.695) 10.236 6.084 ( 4.796 -2.809 -2.873) 6.256 6.155 ( 0.886 -4.266 4.368) 6.169 6.174 ( -3.880 -0.529 -1.810) 4.314 6.397 ( -1.545 -2.254 -9.351) 9.742 6.411 ( -5.495 5.163 -5.041) 9.070 6.547 ( -0.341 -9.824 1.713) 9.979 6.630 ( 1.287 -4.854 -2.121) 5.451 6.744 ( 6.986 1.623 4.010) 8.217 6.856 ( -2.912 3.603 -0.536) 4.663 6.914 ( 2.033 -1.193 1.898) 3.026 7.011 ( -1.950 3.638 -4.886) 6.396 7.124 ( 0.381 6.007 1.824) 6.289 7.198 ( -2.870 8.141 4.546) 9.756 7.313 ( -2.945 2.220 -1.359) 3.931 7.521 ( 7.853 5.183 -0.236) 9.412 7.725 ( 0.643 -2.938 -6.020) 6.729 7.811 ( -5.752 -1.205 8.386) 10.240 7.908 ( -0.229 11.238 7.974) 13.781 8.000 ( 2.328 0.065 -5.474) 5.949 8.047 ( 1.438 3.410 1.598) 4.032 8.298 ( -3.236 -1.117 3.932) 5.214 8.440 ( -2.538 2.591 0.173) 3.631 8.576 ( 0.840 -0.743 2.108) 2.388 8.598 ( 0.584 -4.636 2.221) 5.174 8.704 ( -0.343 -0.360 2.330) 2.383 8.820 ( 2.121 1.361 -1.143) 2.767 8.951 ( 3.059 4.056 -3.641) 6.250 9.316 ( 1.198 1.090 -0.652) 1.746 9.399 ( -9.721 -0.322 -8.092) 12.652 10.341 ( 0.878 -1.238 -1.079) 1.863 10.430 ( 1.066 1.319 -0.655) 1.818 10.473 ( -1.390 -3.030 0.911) 3.456 10.777 ( 1.940 4.211 -0.836) 4.711 11.009 ( 0.602 -2.323 1.362) 2.759 11.226 ( 1.902 -2.583 0.725) 3.289 11.271 ( -0.681 -0.193 -0.788) 1.059 11.592 ( 9.810 -2.834 7.489) 12.663 11.770 ( -11.866 -2.786 -7.223) 14.168 12.266 ( 0.311 -2.774 -1.933) 3.395 12.338 ( -0.219 2.184 -0.214) 2.205 12.448 ( -4.832 0.826 -5.524) 7.386 12.571 ( 1.093 -2.395 1.083) 2.847 12.727 ( -0.891 -0.265 3.850) 3.961 12.906 ( 2.405 0.940 0.429) 2.618 13.141 ( 7.346 4.237 4.864) 9.776 14.045 ( 6.371 3.418 8.351) 11.046 14.115 ( -4.651 -1.278 -1.745) 5.130 14.183 ( 0.396 1.982 -0.790) 2.171 14.298 ( 0.481 5.729 2.882) 6.431 14.318 ( -12.450 -1.447 -13.039) 18.087 14.772 ( 0.075 -3.194 -1.889) 3.712 14.959 ( 0.720 -0.258 3.859) 3.934 15.130 ( -2.933 0.162 -1.091) 3.133 15.168 ( 1.930 -1.058 1.193) 2.504 15.659 ( 3.722 11.676 -0.933) 12.290 16.577 ( 1.077 0.868 1.514) 2.051 16.667 ( 1.904 -0.216 -0.605) 2.010 19.842 ( -2.899 0.939 -2.059) 3.678 20.093 ( 4.773 -0.084 3.558) 5.954 20.344 ( -3.947 -3.402 -2.322) 5.705 20.553 ( 0.885 -2.162 0.631) 2.420 24.248 ( -0.266 0.146 -0.725) 0.786 24.437 ( 3.516 5.953 0.232) 6.918 24.874 ( 0.980 0.133 0.440) 1.083 24.991 ( 1.301 1.467 -1.154) 2.275 26.138 ( -1.820 0.706 -0.676) 2.066 26.169 ( -0.365 0.293 0.385) 0.606 26.708 ( -0.854 -1.988 1.141) 2.446 26.815 ( -2.689 -2.156 0.175) 3.451 26.923 ( -0.398 1.587 1.676) 2.342 26.985 ( -0.342 0.679 5.929) 5.977 27.058 ( 1.583 2.830 -0.787) 3.336 27.329 ( 3.758 2.110 -5.380) 6.894 27.679 ( 1.197 -0.320 2.467) 2.761 28.009 ( -1.846 0.845 -6.172) 6.497 29.161 ( 0.406 0.404 6.164) 6.190 29.344 ( -0.281 -4.281 -1.442) 4.526 29.509 ( 1.506 -1.482 -2.611) 3.359 29.684 ( 2.892 -0.308 0.960) 3.063 30.252 ( -3.356 -5.118 -0.825) 6.176 30.406 ( -4.750 -5.916 0.081) 7.587 ======================= Grid point 123 (47/117) ======================= q-point: (-0.40 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.269 ( 6.408 0.486 -10.746) 12.522 2.581 ( 0.485 -2.475 -0.313) 2.542 3.071 ( 2.717 -0.054 4.511) 5.266 3.273 ( -0.507 3.351 0.266) 3.399 3.415 ( 1.678 2.707 -1.068) 3.359 3.481 ( -8.014 8.622 -3.863) 12.389 3.596 ( 4.257 0.621 -1.770) 4.652 3.742 ( -4.212 7.545 -4.824) 9.897 3.927 ( 0.480 0.516 2.415) 2.515 3.978 ( -0.593 -5.409 -1.621) 5.677 4.116 ( -2.554 -4.242 4.245) 6.523 4.172 ( -2.807 4.107 1.015) 5.077 4.373 ( -0.161 -4.612 -5.738) 7.363 4.433 ( 3.309 0.483 1.482) 3.658 4.466 ( 0.526 -4.021 4.941) 6.392 4.604 ( -1.690 -6.227 2.260) 6.837 4.656 ( -3.431 10.246 4.785) 11.817 4.953 ( -2.996 -2.457 4.045) 5.602 5.061 ( 4.036 -6.755 7.846) 11.112 5.199 ( 5.389 6.620 0.130) 8.537 5.217 ( 1.489 -0.646 -1.353) 2.113 5.355 ( -1.733 -11.424 -6.938) 13.478 5.402 ( -2.958 -1.471 -0.672) 3.371 5.467 ( 3.484 -7.200 0.294) 8.004 5.674 ( -2.903 5.837 -2.808) 7.098 5.774 ( 0.577 4.945 -0.244) 4.985 5.914 ( 5.433 -2.343 0.815) 5.973 6.063 ( -3.867 5.856 -7.335) 10.151 6.156 ( 3.877 10.240 5.467) 12.238 6.208 ( -0.462 -2.380 -0.524) 2.481 6.314 ( -1.226 2.299 -0.853) 2.742 6.453 ( 0.896 -4.448 -1.662) 4.832 6.623 ( -1.875 -0.527 -0.348) 1.978 6.710 ( -0.146 -3.032 0.718) 3.119 6.774 ( -2.368 1.748 0.060) 2.944 6.857 ( 2.822 -2.648 3.077) 4.944 6.936 ( -2.928 1.317 -3.653) 4.864 6.946 ( 0.776 -1.483 0.498) 1.746 6.996 ( -4.245 -0.846 -5.595) 7.074 7.133 ( 3.602 0.884 0.217) 3.715 7.285 ( -0.458 -0.911 5.320) 5.417 7.461 ( 6.982 4.737 1.235) 8.527 7.703 ( -3.516 4.284 3.117) 6.359 7.767 ( 0.635 1.595 -5.514) 5.775 7.864 ( -5.468 -0.732 6.680) 8.664 7.992 ( -2.232 -3.456 3.855) 5.638 8.063 ( 4.807 -2.776 -2.706) 6.175 8.306 ( -1.238 0.045 5.622) 5.757 8.448 ( 2.340 -2.333 0.277) 3.316 8.583 ( -0.368 -0.409 1.670) 1.758 8.636 ( -1.406 0.238 1.479) 2.055 8.712 ( -3.401 -0.189 2.283) 4.100 8.814 ( 4.149 0.056 -0.761) 4.219 8.903 ( 3.123 3.297 -4.591) 6.458 9.248 ( -6.971 2.980 -2.728) 8.057 9.484 ( 4.597 -10.567 -6.901) 13.432 10.356 ( 0.075 0.084 -0.594) 0.605 10.397 ( -0.608 1.862 -1.284) 2.342 10.513 ( -0.112 -1.399 1.534) 2.079 10.699 ( 0.720 4.109 0.129) 4.174 11.043 ( -0.192 -0.770 0.091) 0.799 11.219 ( -0.593 1.443 1.322) 2.046 11.281 ( 0.095 1.155 0.080) 1.161 11.686 ( 6.569 0.131 4.099) 7.744 11.755 ( -6.093 -2.779 -5.254) 8.512 12.291 ( 0.739 0.686 -3.329) 3.478 12.305 ( 0.022 0.546 1.006) 1.145 12.417 ( 1.581 0.956 -1.388) 2.311 12.592 ( -0.430 0.955 0.623) 1.219 12.728 ( -3.868 -1.445 3.282) 5.275 12.876 ( -1.111 1.636 0.889) 2.169 13.158 ( 2.324 -1.397 0.328) 2.731 14.040 ( 5.903 0.982 6.534) 8.860 14.123 ( -1.245 -1.034 -0.221) 1.633 14.144 ( -3.613 2.269 -1.906) 4.673 14.204 ( 3.677 0.077 0.494) 3.711 14.339 ( -6.127 -3.727 -6.730) 9.835 14.827 ( 2.453 -0.482 -0.730) 2.604 14.987 ( 0.028 -1.843 3.639) 4.079 15.119 ( -1.831 -0.900 -2.765) 3.436 15.263 ( 0.820 -7.744 3.405) 8.500 15.458 ( 0.858 9.602 -3.177) 10.150 16.530 ( -0.354 3.832 2.792) 4.754 16.690 ( -0.014 -1.325 -1.768) 2.210 19.819 ( -1.024 0.059 -0.714) 1.249 20.119 ( 1.959 -0.262 1.279) 2.354 20.371 ( -1.302 -1.143 -1.210) 2.113 20.575 ( 0.369 0.437 0.477) 0.745 24.243 ( -0.545 0.215 -0.225) 0.628 24.371 ( 0.666 2.130 0.051) 2.233 24.877 ( -0.106 -0.084 0.935) 0.944 24.960 ( -0.111 1.859 -1.865) 2.636 26.128 ( -0.240 -0.343 -0.156) 0.447 26.178 ( 0.221 -1.163 -0.242) 1.208 26.745 ( 0.581 -1.842 1.277) 2.316 26.833 ( -2.699 -0.681 3.155) 4.208 26.891 ( 0.898 1.136 1.044) 1.785 26.980 ( 1.759 0.406 3.105) 3.591 27.041 ( -0.216 -0.625 -0.913) 1.127 27.297 ( -0.336 2.081 -5.592) 5.976 27.687 ( 0.215 0.018 3.496) 3.503 27.997 ( -0.025 -0.352 -6.642) 6.651 29.148 ( -0.406 0.882 5.675) 5.758 29.386 ( 0.022 -0.584 -1.089) 1.236 29.534 ( 0.010 -0.721 -4.183) 4.244 29.687 ( 0.399 1.632 2.407) 2.935 30.235 ( 0.050 4.114 -1.039) 4.244 30.544 ( -0.144 -7.758 0.588) 7.782 ======================= Grid point 124 (48/117) ======================= q-point: (-0.30 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.292 ( 7.618 1.789 -5.945) 9.827 2.518 ( 1.950 9.032 -1.972) 9.448 2.939 ( -8.137 11.492 4.450) 14.768 3.146 ( -4.432 4.437 -1.413) 6.428 3.190 ( -6.598 18.429 0.461) 19.580 3.406 ( 3.751 3.271 4.264) 6.554 3.534 ( -0.037 6.545 -3.249) 7.307 3.643 ( 5.960 0.748 -3.346) 6.876 3.835 ( -2.019 1.827 -1.056) 2.920 3.920 ( 0.473 7.032 -0.916) 7.107 4.143 ( -4.024 -0.392 1.125) 4.197 4.289 ( -5.385 -7.374 -1.520) 9.257 4.365 ( -1.105 -2.309 0.265) 2.573 4.393 ( 2.676 3.253 -1.681) 4.535 4.561 ( 1.156 -3.576 2.626) 4.584 4.700 ( -1.529 -7.421 -3.197) 8.224 4.788 ( 3.330 -6.276 4.556) 8.440 4.996 ( 2.648 -6.006 10.926) 12.746 5.081 ( 0.546 2.537 -4.573) 5.258 5.179 ( -2.548 1.462 -1.762) 3.426 5.283 ( 4.217 -5.530 11.905) 13.788 5.341 ( -3.762 -0.302 -3.533) 5.170 5.551 ( -0.861 7.922 2.874) 8.471 5.588 ( -0.034 2.788 0.381) 2.814 5.640 ( 1.257 1.867 -5.837) 6.256 5.680 ( -3.421 -8.923 0.102) 9.556 5.865 ( 2.636 -1.956 0.170) 3.287 5.999 ( 3.073 -1.290 -5.497) 6.428 6.179 ( 4.649 -2.394 3.884) 6.514 6.194 ( -2.171 0.758 -3.514) 4.200 6.281 ( -2.872 -5.932 -6.116) 8.991 6.526 ( 3.935 0.947 0.857) 4.137 6.607 ( 0.574 0.206 -1.452) 1.575 6.699 ( -2.133 4.667 -4.991) 7.158 6.751 ( -0.415 -1.137 0.716) 1.406 6.842 ( -5.279 1.084 4.978) 7.337 6.948 ( 3.321 -0.759 1.086) 3.575 7.006 ( 1.649 -4.206 -5.967) 7.484 7.057 ( -5.065 -7.873 0.126) 9.362 7.208 ( -0.999 -5.372 -3.593) 6.540 7.334 ( 3.820 -1.377 8.717) 9.617 7.476 ( 3.444 -6.153 -0.698) 7.086 7.636 ( -5.326 4.719 -3.159) 7.786 7.693 ( 1.127 -0.024 0.182) 1.141 7.875 ( 0.848 -3.009 4.592) 5.555 8.063 ( -5.522 -2.685 8.801) 10.731 8.164 ( 3.350 -4.311 -1.361) 5.627 8.289 ( 1.757 1.635 6.428) 6.861 8.498 ( 0.010 -1.265 0.161) 1.275 8.584 ( -0.316 -0.499 0.737) 0.945 8.623 ( -1.281 -0.153 1.905) 2.300 8.690 ( -3.648 0.427 -0.984) 3.803 8.851 ( 1.913 -1.532 -1.713) 2.990 8.889 ( 6.489 -0.965 -2.764) 7.119 9.173 ( -4.398 0.809 2.007) 4.901 9.763 ( 4.259 -12.891 -12.159) 18.225 10.335 ( -0.812 1.786 -0.775) 2.110 10.364 ( -0.395 0.700 -1.342) 1.564 10.526 ( 2.174 0.826 1.987) 3.059 10.635 ( -1.402 2.237 2.035) 3.333 11.031 ( -1.185 1.696 -0.742) 2.198 11.186 ( 1.504 3.188 1.898) 4.004 11.211 ( -2.900 3.844 0.386) 4.831 11.649 ( -4.147 3.108 -3.313) 6.151 11.818 ( 6.555 -2.267 1.775) 7.159 12.256 ( 1.269 3.214 -3.340) 4.806 12.313 ( 1.347 -0.388 3.111) 3.413 12.434 ( 6.489 -0.089 1.488) 6.658 12.532 ( -3.255 3.617 0.582) 4.901 12.744 ( -6.017 -3.105 2.401) 7.184 12.849 ( -1.674 0.325 -0.434) 1.760 13.200 ( -4.673 -4.195 -4.091) 7.495 14.067 ( -1.100 -1.657 0.966) 2.211 14.119 ( 5.822 0.494 4.224) 7.210 14.161 ( 1.688 -2.599 0.958) 3.244 14.265 ( 8.303 -1.257 3.975) 9.291 14.374 ( -7.071 -4.408 -6.490) 10.561 14.824 ( 3.483 2.033 -1.452) 4.287 15.004 ( -3.368 -0.367 2.803) 4.397 15.152 ( -0.441 -3.517 -3.874) 5.251 15.307 ( 2.110 4.988 -3.172) 6.277 15.473 ( -2.012 -11.824 2.595) 12.271 16.444 ( -0.844 4.238 3.319) 5.449 16.705 ( -1.680 -0.588 -2.050) 2.715 19.827 ( 0.862 -0.823 0.732) 1.398 20.127 ( -1.561 -0.432 -1.472) 2.188 20.373 ( 1.893 1.179 0.123) 2.233 20.539 ( -0.398 3.290 0.181) 3.319 24.231 ( -0.300 0.499 0.031) 0.583 24.362 ( -1.510 -1.306 0.255) 2.013 24.872 ( -0.924 0.405 0.792) 1.282 24.924 ( -0.526 1.416 -1.681) 2.260 26.146 ( 0.772 -1.218 0.309) 1.475 26.214 ( 0.512 -2.179 -0.733) 2.355 26.782 ( 0.833 -0.015 1.531) 1.743 26.798 ( 0.908 1.559 3.491) 3.930 26.916 ( -0.669 -2.805 0.409) 2.913 26.992 ( -0.848 -1.119 1.617) 2.141 27.067 ( 4.163 -0.473 -1.316) 4.392 27.248 ( -5.223 0.625 -2.870) 5.993 27.684 ( -0.938 0.295 4.355) 4.465 28.018 ( 1.668 -1.678 -8.157) 8.494 29.126 ( -0.630 1.386 5.261) 5.477 29.381 ( 0.089 0.879 0.423) 0.980 29.516 ( -1.407 3.320 -5.482) 6.561 29.635 ( -1.807 1.829 0.033) 2.571 30.123 ( 5.011 8.779 6.492) 12.014 30.671 ( 0.737 -4.921 -4.698) 6.843 ======================= Grid point 125 (49/117) ======================= q-point: (-0.20 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.111 ( 5.856 22.854 4.576) 24.032 2.415 ( -0.702 1.213 -3.795) 4.045 2.577 ( -2.199 27.241 9.528) 28.943 2.780 ( -2.847 9.972 2.146) 10.590 3.083 ( -10.978 -2.496 -6.515) 13.007 3.279 ( -3.754 8.943 -10.035) 13.956 3.496 ( 4.643 -0.511 1.973) 5.071 3.607 ( 4.971 3.061 -4.907) 7.626 3.763 ( 0.858 18.505 10.337) 21.214 3.898 ( 3.317 -2.036 3.978) 5.565 4.098 ( 3.884 0.672 -5.615) 6.860 4.266 ( 3.284 2.881 5.718) 7.196 4.322 ( -1.982 0.918 -3.385) 4.029 4.402 ( -5.638 3.455 -2.155) 6.954 4.660 ( -1.220 0.260 4.091) 4.277 4.720 ( -4.866 1.594 1.796) 5.426 4.859 ( 0.168 -12.486 -1.985) 12.644 5.069 ( 5.312 2.057 -0.632) 5.732 5.128 ( -4.137 -1.386 5.405) 6.946 5.136 ( 1.223 -2.433 -1.283) 3.010 5.309 ( 0.252 3.552 3.926) 5.301 5.416 ( -0.408 -9.513 7.203) 11.939 5.500 ( -3.434 0.563 -5.585) 6.580 5.605 ( 1.002 -8.102 -0.408) 8.174 5.635 ( 3.524 2.351 -3.863) 5.734 5.821 ( -6.279 -3.392 0.283) 7.143 5.915 ( 2.293 3.060 -12.224) 12.808 6.015 ( 0.519 -1.944 0.434) 2.058 6.131 ( -3.615 -6.211 -6.358) 9.596 6.231 ( -2.421 -3.196 -4.561) 6.072 6.515 ( 2.688 -4.145 -1.316) 5.112 6.534 ( 4.694 -4.601 -3.416) 7.407 6.583 ( 3.038 3.181 4.796) 6.508 6.634 ( 3.323 0.498 -3.490) 4.844 6.754 ( -5.608 2.556 5.675) 8.378 6.855 ( -1.361 -9.641 4.448) 10.704 7.007 ( 0.348 -3.037 1.318) 3.329 7.121 ( -1.777 -6.235 -6.152) 8.938 7.130 ( 3.073 -1.867 2.148) 4.189 7.294 ( 1.577 -2.639 0.162) 3.078 7.423 ( -0.381 -6.817 -0.659) 6.859 7.491 ( -7.689 3.208 -6.448) 10.535 7.704 ( 5.350 -10.200 0.948) 11.557 7.782 ( 5.714 -5.111 6.593) 10.111 7.971 ( -0.262 -3.177 12.626) 13.022 8.047 ( -4.257 -3.447 2.903) 6.199 8.217 ( 4.326 1.282 5.531) 7.137 8.308 ( -2.884 -3.600 -1.298) 4.792 8.515 ( -0.156 -0.930 1.578) 1.838 8.596 ( -1.040 1.278 -1.033) 1.945 8.620 ( 1.065 0.186 1.109) 1.548 8.659 ( -4.968 -2.500 0.848) 5.626 8.922 ( 1.090 -5.640 -0.076) 5.745 8.995 ( 8.314 -0.519 4.006) 9.243 9.184 ( -3.949 -7.626 -4.740) 9.809 9.926 ( -5.794 -3.063 -18.880) 19.985 10.287 ( -0.233 2.692 -0.324) 2.722 10.361 ( -1.531 -0.092 -3.286) 3.626 10.527 ( 11.447 2.454 4.894) 12.689 10.595 ( -3.190 0.627 3.979) 5.139 10.963 ( -2.136 4.020 -1.564) 4.813 11.038 ( -5.082 8.032 -3.319) 10.067 11.190 ( 4.327 1.187 6.004) 7.495 11.533 ( -5.194 5.315 -3.625) 8.268 11.908 ( 9.074 -1.782 3.308) 9.821 12.177 ( -0.758 5.148 -2.895) 5.955 12.334 ( 1.052 -0.877 3.316) 3.588 12.430 ( -0.378 4.352 4.379) 6.185 12.494 ( 7.948 -0.487 1.391) 8.083 12.784 ( -5.355 -4.953 2.280) 7.642 12.817 ( 0.170 2.776 -1.498) 3.159 13.303 ( -10.213 -11.680 -7.108) 17.066 14.088 ( -2.351 -1.260 0.735) 2.767 14.174 ( 1.301 -3.794 -0.083) 4.012 14.241 ( 4.757 -2.962 1.568) 5.820 14.330 ( 5.090 -0.605 7.765) 9.304 14.431 ( 0.038 -3.838 -4.051) 5.581 14.801 ( 2.907 2.235 -3.762) 5.253 14.978 ( -5.007 -0.523 3.414) 6.083 15.231 ( -2.486 -4.168 -5.705) 7.490 15.298 ( 10.715 -1.473 2.581) 11.119 15.673 ( -8.377 -10.938 -1.946) 13.914 16.374 ( 2.171 3.074 5.074) 6.317 16.685 ( -3.033 1.119 -2.767) 4.255 19.859 ( 2.295 -1.358 1.915) 3.283 20.118 ( -4.236 -0.593 -3.587) 5.582 20.347 ( 3.842 3.354 0.611) 5.136 20.443 ( -1.182 5.823 -0.248) 5.947 24.233 ( 2.697 -0.293 1.379) 3.043 24.392 ( -4.001 -3.250 0.020) 5.155 24.850 ( -0.461 1.276 0.408) 1.416 24.901 ( -0.683 0.512 -1.200) 1.473 26.180 ( 0.990 -1.441 1.008) 2.018 26.262 ( 0.116 -2.388 -1.191) 2.671 26.737 ( -0.482 2.179 1.794) 2.863 26.816 ( 3.772 1.020 0.910) 4.012 26.969 ( -2.796 -3.268 1.217) 4.470 27.018 ( -1.168 -2.693 -0.952) 3.086 27.099 ( 5.173 0.235 1.771) 5.473 27.225 ( -5.654 -2.049 0.041) 6.014 27.667 ( -2.432 0.548 5.382) 5.931 28.082 ( 3.103 -3.827 -10.311) 11.427 29.079 ( -0.260 3.549 4.579) 5.799 29.358 ( -1.741 8.789 -0.917) 9.007 29.368 ( -0.523 1.622 -0.867) 1.913 29.610 ( -2.818 1.379 -3.690) 4.844 29.984 ( 8.327 8.651 12.240) 17.146 30.734 ( -1.190 -1.671 -10.720) 10.915 ======================= Grid point 126 (50/117) ======================= q-point: (-0.10 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.626 ( 5.455 28.555 14.886) 32.661 1.942 ( 6.032 34.921 18.314) 39.890 2.356 ( -7.427 0.826 -13.547) 15.472 2.767 ( 2.745 -2.394 0.970) 3.770 2.901 ( 0.897 31.672 8.524) 32.811 3.109 ( -8.004 13.886 -6.918) 17.457 3.183 ( -4.675 5.310 -0.417) 7.087 3.574 ( -1.716 -4.373 1.457) 4.918 3.670 ( 13.798 -4.314 -2.933) 14.751 3.962 ( 3.098 0.585 4.412) 5.422 4.155 ( 3.197 -1.245 2.605) 4.307 4.225 ( -6.431 1.739 -1.951) 6.942 4.327 ( -0.767 -2.585 3.143) 4.141 4.423 ( 1.020 -5.577 -3.916) 6.890 4.576 ( -0.787 0.724 -0.574) 1.214 4.711 ( -0.308 -0.170 5.164) 5.176 4.955 ( -5.608 12.111 -16.737) 21.407 5.043 ( 12.221 5.311 -3.258) 13.718 5.093 ( -11.700 -0.005 0.495) 11.710 5.179 ( -1.736 -3.968 -3.327) 5.462 5.326 ( 2.870 -8.015 3.599) 9.243 5.405 ( -4.356 -1.811 5.322) 7.112 5.607 ( 5.976 5.179 -3.975) 8.851 5.641 ( 0.953 -6.718 -0.590) 6.811 5.694 ( -3.900 -3.622 -7.962) 9.577 5.822 ( 4.128 -5.279 -3.810) 7.709 5.930 ( -2.935 1.067 -1.367) 3.409 6.064 ( -7.083 -1.454 7.716) 10.575 6.227 ( -5.112 -1.109 -10.817) 12.015 6.292 ( 2.371 -7.316 0.653) 7.719 6.483 ( 0.962 2.909 2.429) 3.909 6.568 ( -3.401 1.817 4.582) 5.989 6.662 ( 7.620 -4.946 -2.904) 9.537 6.721 ( 5.220 -5.384 3.368) 8.221 6.744 ( 2.140 -4.189 1.359) 4.897 7.063 ( -1.823 -2.590 3.614) 4.805 7.097 ( -3.147 -6.856 1.014) 7.612 7.124 ( 1.049 -6.161 3.914) 7.375 7.240 ( 2.122 -1.425 1.694) 3.066 7.337 ( -3.162 -3.356 -6.337) 7.837 7.432 ( 0.750 -3.082 -3.279) 4.562 7.589 ( -8.110 -9.697 -7.063) 14.480 7.875 ( 8.731 -3.381 6.896) 11.628 7.901 ( 3.523 -1.935 2.661) 4.820 7.949 ( -2.043 -0.229 3.739) 4.267 8.219 ( 5.783 -7.159 9.258) 13.054 8.234 ( 5.978 -0.160 5.070) 7.840 8.331 ( -6.837 -1.547 -1.574) 7.184 8.505 ( -7.369 -0.397 -5.858) 9.422 8.578 ( -0.393 -0.559 1.647) 1.783 8.637 ( 2.307 -1.000 5.945) 6.455 8.718 ( -1.574 -4.471 2.464) 5.342 8.925 ( 8.110 9.486 8.791) 15.266 9.132 ( 0.404 -14.970 0.790) 14.996 9.420 ( -6.899 -14.733 -9.122) 18.651 9.807 ( -13.847 5.993 -25.638) 29.748 10.229 ( 0.787 3.359 0.767) 3.534 10.320 ( -2.179 2.263 -1.892) 3.667 10.530 ( 2.689 3.163 4.871) 6.400 10.589 ( 8.211 2.825 3.920) 9.527 10.822 ( -5.763 8.564 -2.757) 10.684 10.880 ( -1.549 4.227 -5.320) 6.969 11.184 ( 4.436 3.415 4.911) 7.447 11.388 ( -5.073 5.880 -3.477) 8.509 11.988 ( 6.278 -0.487 3.355) 7.135 12.039 ( -4.788 6.766 -0.818) 8.329 12.345 ( -2.384 -0.718 1.994) 3.190 12.399 ( 5.630 0.365 3.118) 6.446 12.543 ( 5.259 0.196 3.352) 6.239 12.725 ( -3.716 3.773 -2.745) 5.965 12.976 ( 21.064 -11.790 9.837) 26.066 13.475 ( -19.098 -13.256 -9.882) 25.261 14.098 ( -1.553 -1.626 1.435) 2.668 14.248 ( -3.470 -3.440 -1.809) 5.210 14.332 ( 2.963 -3.351 -0.002) 4.473 14.372 ( 2.759 -1.798 7.206) 7.923 14.507 ( 6.154 -2.378 -2.084) 6.919 14.771 ( 0.042 1.443 -6.010) 6.181 14.993 ( -1.588 -3.099 7.765) 8.510 15.285 ( -1.730 -3.464 -1.810) 4.274 15.478 ( 16.907 -6.752 4.380) 18.725 15.775 ( -15.506 -7.299 -7.277) 18.619 16.363 ( 6.461 1.108 6.526) 9.250 16.624 ( -3.030 2.996 -3.396) 5.449 19.903 ( 3.021 -1.146 2.456) 4.058 20.096 ( -5.482 -0.334 -4.899) 7.360 20.274 ( 0.719 6.309 0.810) 6.401 20.323 ( 1.605 5.582 -1.768) 6.071 24.306 ( 12.921 -3.598 4.719) 14.218 24.429 ( -6.943 -3.687 -0.973) 7.921 24.826 ( 1.103 1.230 0.704) 1.796 24.891 ( -0.281 0.313 -1.369) 1.432 26.208 ( 0.756 -0.761 1.858) 2.146 26.301 ( -0.799 -1.768 -1.539) 2.476 26.707 ( -0.548 0.482 0.663) 0.985 26.786 ( 0.677 3.117 -0.895) 3.313 27.013 ( 0.109 -2.270 1.296) 2.616 27.083 ( -0.741 -3.989 -0.908) 4.158 27.134 ( -0.229 -2.734 7.373) 7.867 27.250 ( -0.499 -1.974 0.184) 2.045 27.642 ( -4.064 -0.153 7.551) 8.577 28.198 ( 3.097 -6.322 -11.934) 13.856 28.994 ( 0.543 5.019 3.502) 6.144 29.133 ( -3.567 10.321 -1.965) 11.095 29.379 ( 3.203 -0.274 2.815) 4.273 29.465 ( -3.097 11.413 2.593) 12.107 29.957 ( 8.558 -0.009 7.714) 11.521 30.684 ( -9.101 4.701 -18.983) 21.570 ======================= Grid point 129 (51/117) ======================= q-point: ( 0.20 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.073 ( 7.179 0.000 36.131) 36.837 1.513 ( 28.932 0.000 30.535) 42.065 2.052 ( -15.407 -0.000 -25.633) 29.907 2.563 ( 16.761 0.000 -9.873) 19.453 2.758 ( 41.122 0.000 28.747) 50.174 2.967 ( -10.260 -0.000 -1.608) 10.385 3.078 ( 1.692 0.000 -5.556) 5.808 3.603 ( -16.761 -0.000 2.651) 16.969 3.702 ( 1.470 0.000 -8.027) 8.161 3.711 ( -5.474 -0.000 -3.561) 6.530 3.958 ( -1.443 -0.000 -12.786) 12.867 4.294 ( -18.488 -0.000 -9.214) 20.657 4.455 ( -12.977 -0.000 -2.786) 13.273 4.553 ( -11.164 -0.000 1.004) 11.209 4.612 ( 19.060 0.000 2.550) 19.230 4.631 ( 2.663 0.000 0.076) 2.664 4.856 ( 15.715 0.000 4.393) 16.318 5.018 ( 0.546 0.000 13.234) 13.245 5.031 ( -9.224 -0.000 9.676) 13.368 5.233 ( -0.541 -0.000 -8.624) 8.641 5.344 ( 0.858 0.000 -5.722) 5.786 5.350 ( 2.017 0.000 -3.149) 3.739 5.611 ( -4.917 -0.000 4.234) 6.489 5.681 ( -9.946 -0.000 -3.460) 10.530 5.760 ( 10.802 0.000 -6.822) 12.776 5.844 ( 7.562 0.000 -9.018) 11.769 6.010 ( 8.198 0.000 1.078) 8.268 6.050 ( 1.954 0.000 -0.054) 1.955 6.288 ( 3.677 0.000 9.674) 10.349 6.593 ( 5.223 0.000 1.434) 5.416 6.635 ( 7.012 0.000 1.537) 7.179 6.650 ( 2.344 0.000 -4.372) 4.961 6.734 ( -0.711 -0.000 0.988) 1.217 6.848 ( -2.986 -0.000 -6.235) 6.913 6.863 ( -0.692 -0.000 4.344) 4.399 6.927 ( -4.462 -0.000 -5.059) 6.746 7.254 ( -1.474 -0.000 6.164) 6.338 7.316 ( -9.201 -0.000 -2.558) 9.550 7.352 ( 1.407 0.000 0.537) 1.506 7.452 ( 6.234 0.000 10.493) 12.205 7.481 ( -5.562 -0.000 -7.757) 9.545 7.656 ( 1.110 0.000 3.921) 4.075 7.874 ( -2.455 -0.000 -2.267) 3.342 8.003 ( 6.070 0.000 -2.664) 6.629 8.074 ( -11.924 -0.000 -0.441) 11.932 8.177 ( -9.416 -0.000 -3.416) 10.016 8.205 ( 3.850 0.000 2.509) 4.596 8.351 ( -5.360 -0.000 0.184) 5.363 8.501 ( 5.328 0.000 5.704) 7.805 8.614 ( 5.903 0.000 -0.433) 5.919 8.680 ( 6.092 0.000 6.358) 8.805 8.738 ( -1.124 -0.000 0.827) 1.396 8.809 ( 2.510 0.000 4.602) 5.241 8.880 ( 2.396 0.000 9.654) 9.947 9.786 ( -12.614 -0.000 -5.992) 13.965 10.028 ( -0.367 -0.000 -1.492) 1.537 10.045 ( -1.297 -0.000 -2.364) 2.696 10.305 ( -0.365 -0.000 8.326) 8.334 10.376 ( 10.387 0.000 3.877) 11.087 10.470 ( -1.385 -0.000 -2.409) 2.779 10.647 ( 10.038 0.000 1.977) 10.231 10.806 ( 4.795 0.000 -4.404) 6.511 11.114 ( -3.835 -0.000 -4.183) 5.675 11.184 ( 7.410 0.000 6.269) 9.706 11.605 ( -11.381 -0.000 -0.561) 11.395 11.993 ( -1.177 -0.000 0.100) 1.182 12.379 ( -0.343 -0.000 -1.858) 1.889 12.417 ( -1.572 -0.000 1.006) 1.867 12.620 ( 4.447 0.000 0.387) 4.464 12.684 ( 4.660 0.000 1.802) 4.997 12.813 ( -34.117 -0.000 -16.376) 37.844 14.089 ( -5.367 -0.000 -2.084) 5.757 14.129 ( -9.646 -0.000 1.285) 9.731 14.369 ( -4.927 -0.000 2.113) 5.361 14.383 ( 8.153 0.000 -5.063) 9.597 14.577 ( 4.137 0.000 -8.062) 9.062 14.721 ( 5.724 0.000 -2.959) 6.443 14.986 ( 14.511 0.000 -0.677) 14.527 15.188 ( -2.856 -0.000 2.111) 3.551 15.360 ( -23.126 -0.000 -5.574) 23.789 15.570 ( -2.655 -0.000 -1.655) 3.129 16.058 ( 16.068 0.000 7.268) 17.635 16.436 ( -0.504 -0.000 -0.933) 1.060 16.696 ( 3.701 0.000 -1.231) 3.900 19.929 ( -0.867 -0.000 -1.456) 1.695 20.005 ( 2.212 0.000 0.370) 2.243 20.137 ( 1.535 0.000 1.120) 1.900 20.169 ( -0.188 -0.000 -0.330) 0.380 24.316 ( -3.845 -0.000 -4.611) 6.004 24.877 ( 1.241 0.000 -3.821) 4.018 24.882 ( 4.965 0.000 1.957) 5.336 25.586 ( 7.197 0.000 -19.334) 20.631 26.272 ( -3.649 -0.000 -1.031) 3.791 26.505 ( 16.206 0.000 -21.982) 27.311 26.630 ( -3.868 -0.000 1.412) 4.118 26.699 ( -5.448 -0.000 -1.876) 5.762 27.209 ( 7.424 0.000 1.002) 7.492 27.219 ( 4.215 0.000 -0.531) 4.248 27.259 ( 1.602 0.000 -0.441) 1.661 27.362 ( 3.789 0.000 0.517) 3.824 27.838 ( -24.942 -0.000 28.259) 37.691 28.016 ( -8.347 -0.000 0.269) 8.352 28.774 ( -0.872 -0.000 2.316) 2.475 28.983 ( -2.482 -0.000 -2.114) 3.260 29.011 ( -8.268 -0.000 9.612) 12.679 29.113 ( -2.542 -0.000 -4.931) 5.548 29.561 ( 11.528 0.000 3.378) 12.013 30.252 ( 5.237 0.000 6.435) 8.296 ======================= Grid point 130 (52/117) ======================= q-point: ( 0.30 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.344 ( 6.187 -19.252 26.959) 33.700 1.946 ( 26.558 -21.979 22.593) 41.217 2.041 ( -10.288 -7.312 -20.098) 23.733 2.674 ( 5.976 -2.915 -16.802) 18.070 2.789 ( -4.938 4.847 -4.126) 8.056 3.186 ( 4.184 -11.080 -3.637) 12.390 3.291 ( 40.717 -17.587 31.641) 54.482 3.520 ( -8.303 2.763 0.225) 8.753 3.543 ( -10.326 0.480 -3.120) 10.798 3.826 ( -11.389 0.919 -10.254) 15.352 3.952 ( 3.402 -4.983 -3.484) 6.967 4.173 ( -2.996 -1.296 -7.124) 7.837 4.349 ( -13.473 0.746 -6.952) 15.179 4.490 ( 1.246 6.374 -1.817) 6.744 4.654 ( -8.974 -7.612 6.060) 13.236 4.756 ( 5.370 0.777 3.844) 6.649 4.873 ( 5.319 9.783 3.747) 11.749 4.945 ( 0.092 1.596 9.981) 10.108 5.016 ( -2.428 -1.295 2.240) 3.548 5.255 ( 0.316 -0.451 -7.324) 7.345 5.272 ( 7.183 -2.992 -4.301) 8.891 5.511 ( -1.221 1.156 0.523) 1.761 5.565 ( -0.637 3.731 -2.173) 4.364 5.613 ( -4.104 -10.660 -0.445) 11.431 5.810 ( 5.906 3.233 -5.269) 8.550 5.928 ( 3.038 -2.135 -7.736) 8.581 5.974 ( 10.688 6.565 0.719) 12.564 6.085 ( 2.587 -1.846 3.595) 4.798 6.325 ( 3.830 0.326 3.533) 5.221 6.426 ( -3.650 13.678 1.330) 14.219 6.500 ( 3.329 10.972 -4.435) 12.294 6.706 ( 4.807 -3.300 5.216) 7.823 6.766 ( -5.830 4.819 -5.529) 9.370 6.827 ( -2.316 3.917 0.226) 4.556 6.884 ( 2.722 -2.720 1.986) 4.330 6.906 ( -4.363 -2.865 -4.272) 6.745 7.184 ( -3.069 6.609 4.959) 8.814 7.208 ( -3.090 4.201 1.504) 5.428 7.309 ( -2.954 5.212 -8.052) 10.036 7.382 ( -2.734 5.043 1.438) 5.914 7.549 ( 9.404 0.963 6.676) 11.572 7.691 ( 5.820 -4.644 7.144) 10.318 7.795 ( -9.163 4.872 -7.015) 12.526 7.893 ( -2.691 3.535 -0.797) 4.514 8.016 ( -9.472 2.926 -5.622) 11.397 8.161 ( -1.654 -0.367 -1.426) 2.215 8.219 ( 1.727 0.020 1.584) 2.343 8.353 ( -5.327 -2.908 1.515) 6.255 8.562 ( 6.928 -0.734 3.887) 7.978 8.625 ( 3.135 0.512 4.626) 5.612 8.730 ( 0.852 5.381 1.193) 5.577 8.797 ( -0.051 -1.053 2.733) 2.930 8.854 ( -4.530 -10.081 -5.536) 12.361 8.989 ( 4.956 -10.672 15.819) 19.715 9.538 ( -3.145 16.377 -2.972) 16.939 9.811 ( -1.811 17.827 -2.861) 18.145 10.133 ( -4.956 -7.286 -3.421) 9.453 10.289 ( 1.807 1.284 4.457) 4.978 10.376 ( 5.370 -1.678 -0.549) 5.652 10.664 ( 1.958 -11.338 2.270) 11.728 10.731 ( 8.874 -1.874 1.994) 9.287 10.886 ( 3.153 -3.822 -3.928) 6.323 11.143 ( -2.501 -4.503 -2.454) 5.706 11.274 ( 6.809 -4.239 6.297) 10.197 11.588 ( -11.863 -4.987 -1.232) 12.927 12.020 ( -1.460 -3.466 -1.468) 4.037 12.356 ( -0.252 0.988 -0.090) 1.023 12.439 ( -1.787 -2.313 -0.353) 2.944 12.561 ( -17.649 2.485 -11.369) 21.140 12.676 ( -0.865 -1.610 -0.454) 1.883 12.759 ( 3.342 -2.143 1.976) 4.435 13.955 ( -0.796 11.507 -1.148) 11.592 14.062 ( -10.139 0.249 -1.450) 10.245 14.299 ( -4.703 2.937 2.386) 6.036 14.395 ( 3.019 2.702 -4.714) 6.216 14.555 ( 5.971 5.032 -5.405) 9.497 14.710 ( 6.025 4.993 0.259) 7.829 15.002 ( 6.665 6.245 -5.414) 10.618 15.103 ( -5.897 7.477 6.829) 11.718 15.194 ( -7.433 0.929 0.278) 7.496 15.381 ( -2.664 10.415 -3.909) 11.439 16.162 ( 9.873 2.046 3.907) 10.814 16.462 ( 0.272 -2.768 0.045) 2.782 16.668 ( 3.259 2.465 1.781) 4.457 19.929 ( -1.872 -0.124 -1.766) 2.576 20.027 ( 2.773 -1.237 1.876) 3.569 20.141 ( -0.118 -0.664 0.189) 0.701 20.252 ( -0.090 -6.436 -1.024) 6.518 24.291 ( -1.024 0.749 -3.166) 3.411 24.876 ( 1.412 1.042 -4.754) 5.067 24.910 ( 5.228 0.682 1.862) 5.591 25.382 ( 6.603 19.560 -7.063) 21.819 26.235 ( -3.917 1.359 -0.708) 4.206 26.386 ( 5.124 11.871 -5.588) 14.085 26.621 ( -3.611 -0.801 1.721) 4.079 26.686 ( -0.047 -1.793 -4.504) 4.848 27.066 ( -0.689 7.666 8.752) 11.655 27.164 ( -0.879 4.893 4.060) 6.419 27.299 ( 7.535 2.757 1.476) 8.159 27.385 ( 5.199 0.970 3.531) 6.359 27.587 ( 0.753 -0.095 3.853) 3.927 28.129 ( -12.514 -2.425 -5.788) 14.000 28.856 ( -0.883 -7.725 1.867) 7.997 28.954 ( 0.969 -4.035 3.280) 5.290 29.155 ( -2.004 -10.215 1.519) 10.520 29.428 ( -14.570 -16.781 3.190) 22.451 29.716 ( 5.244 -13.741 -11.056) 18.400 30.234 ( 1.703 3.924 6.007) 7.374 ======================= Grid point 131 (53/117) ======================= q-point: ( 0.40 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.790 ( -2.907 -21.526 18.973) 28.841 2.161 ( -1.045 -8.385 -12.824) 15.358 2.563 ( 0.837 2.757 4.221) 5.110 2.586 ( 21.541 -25.242 14.790) 36.331 3.013 ( 11.268 -15.505 -18.271) 26.480 3.388 ( 4.624 -1.931 4.610) 6.809 3.469 ( -6.898 -9.026 -11.648) 16.271 3.495 ( -14.471 -3.606 -6.935) 16.447 3.688 ( -5.734 2.326 -11.512) 13.070 3.884 ( 18.102 -13.755 17.642) 28.778 4.073 ( -0.921 -1.777 -1.219) 2.344 4.203 ( 4.403 0.775 1.446) 4.699 4.360 ( -1.095 -9.705 -1.712) 9.916 4.426 ( -5.122 -2.177 -5.177) 7.601 4.584 ( -3.260 11.491 1.339) 12.019 4.666 ( -1.538 7.004 11.143) 13.251 4.767 ( -4.169 -1.488 10.735) 11.612 4.955 ( 10.873 3.727 -1.503) 11.592 5.044 ( 0.574 -2.379 5.644) 6.151 5.226 ( -2.656 0.165 -8.479) 8.887 5.425 ( 1.415 -6.489 -7.246) 9.829 5.450 ( 1.046 3.412 6.389) 7.319 5.589 ( 5.668 -0.732 -2.446) 6.216 5.730 ( 4.172 3.313 -0.960) 5.413 5.780 ( -2.053 9.637 -0.089) 9.853 5.850 ( -4.920 -12.655 -0.051) 13.578 6.041 ( 0.356 2.100 -4.370) 4.861 6.053 ( 8.414 8.561 1.846) 12.145 6.194 ( -1.218 4.550 4.755) 6.693 6.270 ( 5.982 8.910 -1.682) 10.862 6.311 ( -0.086 5.243 -3.508) 6.309 6.568 ( -7.800 8.741 -6.049) 13.185 6.730 ( -2.477 4.776 -1.691) 5.639 6.780 ( -1.134 0.943 0.407) 1.530 6.794 ( -1.813 6.359 0.176) 6.614 6.940 ( 1.965 2.234 2.688) 4.010 7.011 ( -7.036 7.691 -1.846) 10.586 7.116 ( 0.008 1.218 2.547) 2.823 7.262 ( 5.944 -1.331 2.899) 6.746 7.280 ( -0.976 4.810 0.863) 4.983 7.512 ( 0.980 6.485 1.699) 6.775 7.632 ( -0.182 3.237 -8.590) 9.181 7.807 ( -0.534 4.325 -0.023) 4.358 7.890 ( -2.151 -4.615 5.409) 7.428 7.923 ( -5.060 -1.935 -2.179) 5.839 8.099 ( -3.785 4.084 -2.394) 6.062 8.223 ( 1.104 0.422 1.103) 1.617 8.375 ( -4.600 -0.267 -1.710) 4.915 8.528 ( 1.330 6.351 6.499) 9.184 8.604 ( 0.012 1.704 2.969) 3.423 8.686 ( 5.136 -0.798 2.191) 5.640 8.802 ( 4.558 0.542 4.212) 6.230 9.044 ( -7.016 -5.658 -7.421) 11.675 9.074 ( -2.512 13.637 4.712) 14.645 9.269 ( 6.662 -0.468 11.622) 13.404 9.452 ( -7.332 13.015 -13.319) 20.013 10.233 ( -4.336 -5.816 -3.978) 8.274 10.319 ( 3.406 -2.225 3.672) 5.480 10.444 ( 4.633 -1.241 0.199) 4.801 10.799 ( 2.782 -1.965 -1.782) 3.844 10.910 ( 4.029 -8.877 3.660) 10.413 10.964 ( 2.944 -4.180 -1.203) 5.252 11.217 ( -1.546 -3.688 -0.910) 4.101 11.419 ( 6.354 -5.771 6.932) 11.033 11.620 ( -12.259 -5.277 -3.065) 13.694 12.099 ( -0.605 -5.018 -2.938) 5.846 12.356 ( -0.687 -0.999 0.330) 1.256 12.425 ( -12.284 -0.500 -8.709) 15.067 12.483 ( -0.012 -1.477 0.258) 1.499 12.710 ( 2.314 -0.823 2.391) 3.427 12.836 ( 3.923 -3.033 2.576) 5.588 13.665 ( 4.290 17.763 1.653) 18.348 14.009 ( -9.519 -1.510 -3.837) 10.374 14.215 ( -4.390 2.954 4.061) 6.671 14.328 ( 0.231 4.482 -5.148) 6.830 14.455 ( 6.292 8.300 -3.910) 11.125 14.596 ( 0.671 8.464 2.180) 8.766 14.841 ( -1.065 7.413 -6.291) 9.781 15.004 ( 1.619 3.259 9.147) 9.844 15.158 ( -3.262 0.496 -0.212) 3.306 15.228 ( -0.824 4.208 -3.922) 5.811 16.090 ( 4.240 8.743 -0.068) 9.717 16.520 ( 1.554 -2.304 0.294) 2.795 16.678 ( 3.838 -0.441 2.588) 4.650 19.899 ( -2.152 1.547 -1.548) 3.069 20.086 ( 4.786 -1.228 3.779) 6.220 20.168 ( -3.211 -3.559 -1.692) 5.083 20.379 ( -0.329 -6.375 -0.911) 6.448 24.273 ( 0.943 0.986 -1.235) 1.840 24.810 ( 2.691 8.334 -5.113) 10.141 24.912 ( 4.602 2.065 1.473) 5.255 25.105 ( 5.348 9.445 0.927) 10.894 26.181 ( -3.368 1.526 -0.653) 3.755 26.246 ( -0.308 4.528 0.028) 4.539 26.629 ( -2.208 -1.761 1.271) 3.097 26.726 ( -0.344 -2.194 -4.098) 4.661 26.975 ( -1.706 2.262 5.594) 6.271 27.064 ( -1.095 4.421 4.676) 6.527 27.255 ( 5.051 5.300 2.159) 7.633 27.399 ( 5.742 1.135 -0.147) 5.855 27.645 ( 3.862 -1.930 -0.771) 4.386 28.060 ( -8.327 1.134 -6.484) 10.614 29.030 ( -0.118 -9.748 1.881) 9.928 29.076 ( 3.111 -5.651 3.351) 7.269 29.359 ( -2.339 -9.683 1.262) 10.041 29.559 ( 0.240 -6.334 1.967) 6.637 29.976 ( -6.997 -9.642 -7.875) 14.281 30.175 ( -4.482 -1.134 1.877) 4.990 ======================= Grid point 132 (54/117) ======================= q-point: ( 0.50 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.081 ( -6.995 -12.137 6.449) 15.421 2.325 ( 4.003 -7.508 -5.482) 10.122 2.711 ( 9.475 -12.190 6.356) 16.696 3.157 ( 16.634 -19.848 9.227) 27.491 3.300 ( 3.881 -5.508 -4.493) 8.099 3.488 ( -4.734 0.651 -7.098) 8.556 3.507 ( -9.381 -7.440 -12.576) 17.364 3.551 ( 9.503 -10.039 -0.693) 13.840 3.779 ( -1.159 -8.890 -9.302) 12.919 3.961 ( -3.903 2.612 -0.141) 4.699 4.108 ( -4.780 0.192 -2.733) 5.509 4.190 ( -1.502 -1.679 0.634) 2.341 4.386 ( 0.960 7.845 6.356) 10.142 4.415 ( 2.291 0.856 -0.618) 2.522 4.515 ( -6.215 1.157 2.658) 6.857 4.564 ( -5.170 -2.495 -0.654) 5.778 4.748 ( 4.462 1.999 4.051) 6.349 4.972 ( 0.019 -1.447 10.552) 10.651 5.132 ( 6.649 0.497 5.647) 8.738 5.181 ( 1.576 7.563 4.841) 9.117 5.348 ( -6.311 6.710 -7.673) 11.989 5.471 ( 0.499 2.320 -3.506) 4.234 5.506 ( 4.314 5.218 5.609) 8.792 5.647 ( 10.603 0.438 3.126) 11.063 5.736 ( -4.612 11.444 -7.022) 14.197 5.854 ( -0.927 -4.943 -6.252) 8.023 6.058 ( 5.479 -0.708 7.372) 9.213 6.071 ( -3.390 -3.389 8.954) 10.156 6.152 ( -6.378 4.085 -3.370) 8.290 6.180 ( 5.464 2.724 -0.756) 6.152 6.284 ( 3.430 -6.664 6.051) 9.633 6.395 ( 1.267 2.787 -16.167) 16.454 6.537 ( -4.993 10.652 -2.373) 12.001 6.628 ( -1.935 3.413 -1.858) 4.341 6.803 ( -2.309 2.312 1.073) 3.440 6.871 ( 0.107 -1.750 1.745) 2.473 6.916 ( -0.269 3.359 0.303) 3.383 7.118 ( -0.417 5.651 -1.959) 5.995 7.166 ( 2.068 0.755 1.768) 2.824 7.318 ( 0.889 0.903 1.216) 1.756 7.397 ( -1.630 6.354 -0.612) 6.588 7.582 ( 1.122 1.796 -0.014) 2.117 7.745 ( 1.311 1.662 -4.371) 4.857 7.811 ( -6.616 4.164 0.991) 7.880 7.971 ( -0.151 0.085 -2.875) 2.880 8.044 ( -1.834 1.136 5.439) 5.851 8.179 ( -0.845 4.491 -1.971) 4.977 8.325 ( 1.278 1.176 4.080) 4.434 8.481 ( -6.073 2.714 1.335) 6.785 8.574 ( 0.163 1.565 0.859) 1.793 8.619 ( 3.669 10.573 9.528) 14.698 8.731 ( 2.086 4.725 0.740) 5.218 8.860 ( 7.378 -0.412 -0.058) 7.389 9.073 ( 1.668 4.767 -0.994) 5.147 9.276 ( -13.264 -1.926 -16.247) 21.063 9.336 ( -0.366 -0.915 5.596) 5.682 10.305 ( -0.149 -3.153 -1.946) 3.708 10.399 ( 1.483 -3.758 3.023) 5.045 10.465 ( 2.173 1.152 -0.796) 2.585 10.824 ( 0.061 0.380 -3.895) 3.914 10.988 ( 2.065 -1.683 4.440) 5.178 11.148 ( 4.153 -7.227 0.511) 8.350 11.257 ( -0.572 -1.170 0.071) 1.304 11.569 ( 5.767 -5.200 5.399) 9.457 11.635 ( -9.273 -3.752 -2.878) 10.409 12.190 ( -0.479 -4.416 -3.224) 5.489 12.345 ( -4.251 -0.236 -3.815) 5.717 12.414 ( -2.713 -1.618 -2.426) 3.983 12.529 ( 2.351 -2.526 1.534) 3.776 12.728 ( 0.713 0.212 3.652) 3.727 12.913 ( 2.994 -2.084 1.507) 3.947 13.371 ( 4.666 14.336 3.471) 15.470 14.001 ( -10.875 -3.678 -7.455) 13.688 14.136 ( -0.918 3.033 6.125) 6.896 14.237 ( -1.582 3.710 -4.620) 6.133 14.320 ( -3.941 5.889 -9.621) 11.948 14.437 ( 4.167 7.759 5.232) 10.244 14.761 ( 5.347 1.938 2.217) 6.104 14.975 ( 0.977 1.057 5.983) 6.154 15.126 ( -1.797 1.000 -0.678) 2.165 15.176 ( -0.638 1.159 -2.059) 2.447 15.903 ( 0.293 11.325 -3.281) 11.794 16.572 ( 2.188 -1.617 0.323) 2.739 16.698 ( 2.446 0.870 1.850) 3.188 19.855 ( -1.041 1.645 -0.651) 2.053 20.115 ( 1.964 0.134 1.526) 2.491 20.242 ( -1.578 -4.989 -0.224) 5.238 20.486 ( -0.440 -4.768 -0.637) 4.830 24.262 ( 1.608 0.952 0.224) 1.882 24.622 ( 2.581 10.475 -2.593) 11.095 24.899 ( 2.588 1.512 0.759) 3.092 25.035 ( 1.696 2.300 -0.212) 2.866 26.140 ( -2.346 0.864 -0.657) 2.585 26.182 ( -1.256 1.707 0.081) 2.121 26.659 ( -1.267 -2.293 1.309) 2.929 26.761 ( -1.205 -1.999 -2.465) 3.394 26.940 ( -0.896 0.869 2.676) 2.952 26.994 ( -1.466 1.982 6.170) 6.644 27.169 ( 2.927 5.794 1.686) 6.707 27.402 ( 5.612 2.218 -4.504) 7.530 27.684 ( 1.941 -0.318 1.324) 2.371 28.002 ( -4.502 0.405 -6.162) 7.642 29.161 ( 1.295 -1.598 6.049) 6.389 29.221 ( 1.279 -8.281 1.310) 8.481 29.479 ( 1.503 -3.894 -1.845) 4.564 29.675 ( 0.670 -2.567 -3.942) 4.751 30.074 ( -3.112 -8.406 5.264) 10.395 30.240 ( -7.508 -7.031 -4.410) 11.192 ======================= Grid point 133 (55/117) ======================= q-point: ( 0.60 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.255 ( 3.983 -6.773 -4.708) 9.160 2.483 ( 0.944 -6.523 -1.152) 6.691 3.003 ( 6.061 -10.390 8.092) 14.497 3.321 ( -0.341 1.531 -4.286) 4.564 3.440 ( -3.620 0.478 -5.676) 6.749 3.513 ( 7.069 -0.426 -3.513) 7.905 3.654 ( 5.361 -14.158 -5.366) 16.062 3.730 ( -6.074 7.454 -0.407) 9.624 3.820 ( -2.557 -11.030 -2.073) 11.511 3.906 ( -3.477 2.141 4.172) 5.838 4.076 ( 1.036 -2.112 -5.064) 5.584 4.226 ( -1.637 2.645 5.456) 6.280 4.328 ( 1.655 2.388 0.606) 2.968 4.418 ( -0.430 -2.433 6.257) 6.727 4.458 ( -0.064 -1.031 -4.408) 4.528 4.541 ( -5.434 -0.418 -2.732) 6.096 4.842 ( 2.778 -1.681 0.080) 3.248 4.890 ( -2.260 5.085 6.922) 8.882 5.026 ( -8.687 8.150 5.172) 12.986 5.148 ( -0.368 -4.864 8.795) 10.057 5.172 ( 7.789 -1.008 5.778) 9.751 5.391 ( 0.078 9.526 -2.903) 9.959 5.457 ( 5.556 6.657 0.885) 8.716 5.509 ( 4.345 2.947 -7.243) 8.945 5.802 ( -5.324 5.937 -0.740) 8.009 5.863 ( 3.162 -1.476 0.302) 3.503 5.907 ( -0.770 5.470 -3.478) 6.528 6.098 ( -1.552 1.329 -3.314) 3.894 6.150 ( -0.738 -5.744 2.347) 6.249 6.204 ( 4.234 -3.739 5.732) 8.048 6.342 ( -4.682 1.791 -6.281) 8.036 6.390 ( 1.648 0.595 -3.773) 4.160 6.581 ( 2.811 -1.680 4.920) 5.911 6.613 ( -1.649 -9.027 -0.714) 9.204 6.791 ( -0.108 -1.894 -0.627) 1.998 6.818 ( -1.770 4.104 -2.857) 5.304 6.931 ( -2.109 -2.664 -4.262) 5.451 7.001 ( 3.885 4.012 0.316) 5.594 7.112 ( -2.429 13.970 -2.078) 14.331 7.217 ( 1.962 4.219 2.858) 5.460 7.288 ( 1.105 -0.031 1.266) 1.680 7.579 ( 0.795 1.584 0.538) 1.853 7.717 ( -1.893 -1.163 4.575) 5.086 7.756 ( -2.885 -0.471 3.130) 4.283 7.886 ( -2.142 8.835 2.374) 9.396 8.012 ( 2.034 -0.015 -4.292) 4.749 8.084 ( 0.552 7.120 -0.271) 7.146 8.252 ( -3.758 -1.988 2.525) 4.945 8.442 ( 3.096 -1.553 3.303) 4.786 8.572 ( 0.200 -0.483 1.237) 1.343 8.618 ( 0.445 -1.673 5.006) 5.297 8.688 ( -2.255 0.786 1.753) 2.962 8.864 ( 4.032 2.497 -1.146) 4.879 9.012 ( 7.774 4.274 -4.466) 9.932 9.227 ( -11.496 -0.206 -7.208) 13.570 9.353 ( -0.660 -3.346 -2.713) 4.357 10.348 ( 0.412 -1.139 -0.955) 1.543 10.432 ( -0.367 1.888 -1.320) 2.333 10.476 ( 1.416 -2.374 2.797) 3.932 10.779 ( -1.336 3.414 -3.429) 5.020 11.037 ( 3.234 -1.182 4.186) 5.420 11.232 ( 0.720 -0.233 1.032) 1.280 11.283 ( 0.800 -1.293 0.431) 1.580 11.621 ( -9.819 -3.109 -7.853) 12.952 11.729 ( 9.696 -3.691 8.897) 13.667 12.247 ( -2.255 -2.231 -3.591) 4.791 12.336 ( 0.542 -0.048 -1.505) 1.600 12.423 ( -0.317 -0.760 -2.442) 2.577 12.588 ( 1.236 -1.353 1.189) 2.184 12.713 ( -1.348 1.065 4.283) 4.615 12.929 ( 1.265 2.341 0.767) 2.769 13.195 ( 0.983 5.241 1.395) 5.512 13.977 ( -12.951 -2.247 -8.617) 15.717 14.133 ( 2.891 -1.506 4.639) 5.670 14.173 ( -0.735 2.445 -2.504) 3.576 14.206 ( -4.492 1.111 -5.787) 7.410 14.362 ( 8.821 4.726 6.434) 11.898 14.811 ( 5.844 -2.177 3.310) 7.061 14.974 ( 1.144 0.007 4.961) 5.091 15.103 ( -1.382 0.280 -1.358) 1.958 15.169 ( -1.760 -1.712 -0.712) 2.556 15.668 ( -1.883 11.514 -5.118) 12.740 16.590 ( 1.027 1.464 1.837) 2.563 16.685 ( 0.963 0.803 -0.454) 1.333 19.828 ( 0.747 0.915 0.574) 1.313 20.114 ( -2.018 -0.145 -1.463) 2.496 20.327 ( 1.719 -3.435 1.717) 4.208 20.553 ( -0.889 -2.432 -0.715) 2.686 24.255 ( 1.410 0.810 0.920) 1.868 24.462 ( 0.376 6.684 -1.750) 6.919 24.886 ( 0.985 0.920 0.981) 1.667 24.999 ( 0.185 2.043 -1.542) 2.566 26.121 ( -0.797 -0.011 -0.252) 0.836 26.161 ( -0.937 -0.171 -0.387) 1.028 26.703 ( -0.049 -2.545 1.659) 3.039 26.789 ( -1.513 -1.792 -0.671) 2.440 26.922 ( 0.060 1.087 2.090) 2.357 26.978 ( -1.109 -0.976 5.801) 5.986 27.077 ( 1.041 4.586 0.330) 4.714 27.370 ( 3.613 3.859 -6.805) 8.617 27.691 ( 0.090 0.110 3.316) 3.319 27.983 ( -1.410 -0.461 -6.302) 6.474 29.167 ( -0.112 0.880 6.232) 6.295 29.357 ( 2.387 -3.979 1.253) 4.806 29.525 ( 1.498 -0.150 -4.917) 5.142 29.688 ( -2.833 -0.760 -0.681) 3.011 30.241 ( 2.589 -4.797 -1.509) 5.656 30.346 ( -5.485 -9.694 2.075) 11.330 ======================= Grid point 134 (56/117) ======================= q-point: (-0.30 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.368 ( 9.703 -0.345 -7.848) 12.485 2.555 ( -5.159 -1.840 -3.413) 6.453 3.096 ( 0.023 6.864 6.184) 9.239 3.266 ( -0.712 2.437 0.677) 2.628 3.390 ( -3.084 9.064 -7.234) 12.000 3.451 ( 2.592 -0.123 1.069) 2.806 3.621 ( -2.263 -1.830 -5.143) 5.909 3.681 ( -1.441 6.845 -5.384) 8.827 3.967 ( 4.639 2.377 5.899) 7.873 4.001 ( 2.403 -4.055 3.871) 6.100 4.091 ( -0.037 -0.917 1.111) 1.441 4.149 ( -0.676 4.218 1.984) 4.710 4.316 ( -5.677 -3.420 -7.368) 9.910 4.449 ( -4.455 -2.210 1.754) 5.273 4.478 ( 4.003 -4.712 6.060) 8.657 4.575 ( -2.329 2.124 -0.427) 3.181 4.697 ( 5.789 -0.487 6.203) 8.499 4.877 ( -8.261 -1.969 1.240) 8.583 5.072 ( -2.244 -12.329 -2.060) 12.699 5.195 ( -1.976 3.613 -2.000) 4.578 5.246 ( 1.459 0.949 8.594) 8.769 5.362 ( 3.523 3.050 -0.171) 4.663 5.432 ( 3.652 -6.578 -1.253) 7.627 5.549 ( 8.208 -6.710 3.337) 11.115 5.628 ( -2.509 4.576 -3.087) 6.064 5.768 ( -1.652 3.460 -2.037) 4.341 5.981 ( 3.944 -0.777 -5.964) 7.192 6.022 ( -1.033 2.413 -4.793) 5.465 6.135 ( -6.643 8.090 2.411) 10.742 6.245 ( 5.274 0.662 4.017) 6.663 6.320 ( 2.538 5.844 3.388) 7.216 6.469 ( 1.092 -9.285 -3.495) 9.981 6.615 ( -0.269 -0.811 1.149) 1.432 6.679 ( -4.347 -2.488 -0.970) 5.101 6.729 ( -3.730 -0.330 -2.797) 4.674 6.848 ( -4.689 3.770 -3.193) 6.811 6.869 ( -2.132 -1.692 1.995) 3.374 6.951 ( -0.170 -1.289 -3.671) 3.895 7.034 ( 6.973 1.761 -0.847) 7.242 7.132 ( -2.462 0.227 -4.269) 4.933 7.334 ( 5.512 -0.877 7.402) 9.270 7.531 ( 4.038 4.009 1.468) 5.876 7.639 ( -7.679 4.007 2.323) 8.968 7.774 ( -0.464 4.773 -5.722) 7.466 7.831 ( 2.117 -3.777 8.532) 9.568 7.963 ( -2.857 -2.881 6.283) 7.480 8.090 ( -0.321 -3.579 -5.589) 6.645 8.312 ( 1.823 -1.622 6.313) 6.768 8.487 ( 2.847 -0.588 1.354) 3.207 8.576 ( -0.646 0.227 1.483) 1.633 8.622 ( -0.610 -0.045 1.902) 1.998 8.668 ( -3.688 -0.109 0.212) 3.695 8.854 ( 1.497 0.525 -0.892) 1.820 8.969 ( 8.382 4.475 -3.743) 10.212 9.152 ( -8.248 0.697 -0.299) 8.283 9.515 ( 1.301 -12.554 -9.280) 15.666 10.353 ( -0.350 0.554 -0.862) 1.082 10.390 ( -0.262 1.890 -1.364) 2.345 10.521 ( 0.976 -1.427 2.841) 3.325 10.695 ( -1.325 3.725 -1.595) 4.263 11.063 ( 3.085 0.867 2.348) 3.972 11.231 ( 2.284 0.785 3.392) 4.164 11.266 ( -2.430 2.745 -1.213) 3.861 11.609 ( -8.652 -1.522 -8.315) 12.096 11.846 ( 10.232 -1.755 8.016) 13.116 12.259 ( -2.551 -0.866 -3.451) 4.378 12.347 ( 4.303 0.678 0.587) 4.395 12.450 ( 1.901 -1.895 -1.049) 2.882 12.575 ( -1.548 2.405 1.677) 3.316 12.688 ( -2.209 0.313 3.625) 4.257 12.870 ( 0.170 2.814 1.155) 3.047 13.138 ( -5.423 0.628 -5.046) 7.435 13.971 ( -6.598 -3.774 -3.994) 8.586 14.138 ( 0.353 0.220 0.015) 0.416 14.163 ( 0.263 -0.198 1.608) 1.642 14.228 ( -4.129 -3.961 -2.961) 6.443 14.371 ( 15.024 1.493 8.038) 17.104 14.866 ( 3.205 0.103 -0.509) 3.247 14.983 ( -1.498 -0.032 3.794) 4.079 15.102 ( -0.525 -1.170 -2.685) 2.975 15.248 ( -2.965 -7.917 0.902) 8.502 15.454 ( -0.955 8.470 -4.513) 9.645 16.530 ( 0.092 4.257 3.142) 5.291 16.687 ( -0.266 -0.326 -2.064) 2.107 19.830 ( 2.671 0.006 1.945) 3.304 20.097 ( -4.795 -0.394 -3.619) 6.020 20.392 ( 3.950 -1.198 2.666) 4.913 20.567 ( -1.637 0.269 -1.009) 1.941 24.248 ( 1.300 0.756 1.122) 1.876 24.367 ( -1.186 2.711 -1.271) 3.220 24.875 ( -0.211 0.535 1.052) 1.199 24.959 ( 0.125 2.018 -1.966) 2.820 26.129 ( 0.302 -0.861 0.190) 0.932 26.175 ( -0.605 -1.608 -0.855) 1.919 26.758 ( 1.256 -2.516 2.180) 3.558 26.805 ( -1.906 -0.709 1.745) 2.680 26.905 ( 1.038 0.700 2.033) 2.388 26.992 ( -0.454 1.129 3.144) 3.371 27.039 ( 0.002 -2.123 -0.777) 2.261 27.294 ( 0.743 4.837 -6.361) 8.025 27.687 ( -0.797 0.280 4.196) 4.280 27.994 ( 0.473 -1.208 -7.006) 7.125 29.148 ( -0.328 1.022 5.795) 5.894 29.400 ( 2.198 0.474 0.123) 2.252 29.532 ( 0.194 -0.262 -3.771) 3.785 29.662 ( -4.039 1.486 -1.058) 4.432 30.270 ( 4.890 3.016 2.975) 6.470 30.524 ( -2.973 -9.354 -1.687) 9.959 ======================= Grid point 135 (57/117) ======================= q-point: (-0.20 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.391 ( 7.460 3.323 -4.083) 9.131 2.485 ( -6.666 5.015 -4.017) 9.258 2.860 ( -6.517 13.169 4.956) 15.507 3.073 ( 0.689 10.642 -2.961) 11.067 3.189 ( 0.898 16.617 1.086) 16.677 3.417 ( -0.801 5.300 -0.497) 5.383 3.583 ( 7.313 4.783 -0.474) 8.752 3.732 ( 7.098 -2.675 0.853) 7.633 3.806 ( -1.809 4.054 -1.461) 4.673 3.958 ( 5.828 7.202 0.053) 9.264 4.103 ( -2.874 -1.712 3.224) 4.646 4.238 ( -2.660 -7.569 -0.668) 8.051 4.299 ( -7.332 -0.787 -3.637) 8.222 4.398 ( -1.123 0.758 -6.755) 6.889 4.565 ( -1.109 -7.179 7.539) 10.469 4.685 ( -1.987 -3.761 -0.119) 4.256 4.838 ( 3.701 -2.947 4.702) 6.670 5.000 ( -0.893 -10.375 1.539) 10.526 5.094 ( -2.213 4.786 -0.244) 5.278 5.166 ( 1.516 -1.987 -0.970) 2.681 5.291 ( -0.664 2.584 6.574) 7.095 5.369 ( 4.541 -7.624 5.341) 10.357 5.528 ( -1.895 0.093 -5.107) 5.448 5.571 ( -1.348 10.849 0.848) 10.965 5.655 ( -0.213 -4.687 -1.676) 4.982 5.662 ( 1.308 0.559 4.412) 4.635 5.867 ( -1.618 -0.423 -1.792) 2.451 6.009 ( -1.097 -1.345 -5.726) 5.983 6.116 ( -6.662 -0.226 -8.330) 10.669 6.226 ( 5.608 4.976 -1.168) 7.588 6.366 ( 10.552 -11.468 3.736) 16.026 6.530 ( -2.244 2.417 -0.909) 3.421 6.616 ( -1.609 -0.454 0.300) 1.698 6.684 ( -0.381 2.322 -8.074) 8.410 6.741 ( -0.856 -2.439 1.305) 2.896 6.789 ( -2.652 1.156 3.934) 4.883 6.939 ( -6.054 -7.324 0.213) 9.505 6.982 ( 1.063 -2.554 -2.257) 3.570 7.081 ( 4.860 -3.734 -1.894) 6.415 7.207 ( 1.766 -6.528 -2.776) 7.310 7.370 ( 0.977 1.314 6.158) 6.372 7.533 ( 1.905 -0.960 1.749) 2.758 7.557 ( -3.110 -1.512 0.816) 3.553 7.703 ( 0.381 -1.736 -5.661) 5.934 7.910 ( 3.642 -3.423 6.811) 8.448 8.017 ( -2.980 -1.046 10.271) 10.746 8.162 ( -3.580 -4.793 -6.521) 8.849 8.313 ( 2.373 2.624 10.554) 11.131 8.496 ( -1.463 -0.590 0.077) 1.579 8.577 ( -1.054 -0.747 -0.752) 1.495 8.630 ( 1.420 0.043 1.993) 2.447 8.642 ( -2.171 0.807 -1.087) 2.558 8.857 ( -0.656 -1.168 -2.047) 2.446 8.975 ( 6.160 -1.333 -5.325) 8.251 9.128 ( -2.313 -1.221 7.303) 7.757 9.756 ( -3.599 -10.399 -14.495) 18.199 10.326 ( -0.515 1.706 -0.780) 1.945 10.365 ( 0.934 0.728 -1.631) 2.016 10.553 ( 0.317 -1.421 3.511) 3.801 10.635 ( 2.247 2.144 1.206) 3.332 11.037 ( 2.067 3.529 0.541) 4.125 11.153 ( -4.348 6.282 -2.514) 8.043 11.239 ( 4.706 0.718 5.382) 7.185 11.556 ( -8.076 1.576 -7.234) 10.956 11.941 ( 10.138 -1.436 6.669) 12.220 12.231 ( -3.655 2.061 -5.132) 6.629 12.348 ( 1.291 1.297 2.271) 2.916 12.508 ( 1.281 3.562 2.113) 4.335 12.534 ( 8.819 -3.215 3.785) 10.121 12.674 ( -5.071 -1.260 3.187) 6.120 12.849 ( 1.753 0.148 0.068) 1.760 13.090 ( -11.839 -2.257 -9.833) 15.555 14.026 ( -0.834 -3.638 0.630) 3.785 14.135 ( -3.599 0.047 -1.304) 3.828 14.184 ( -0.439 -3.106 1.531) 3.490 14.279 ( -2.770 -3.736 -0.870) 4.731 14.475 ( 17.810 -0.248 8.218) 19.616 14.849 ( -1.319 2.143 -4.596) 5.240 14.949 ( -4.175 0.768 3.028) 5.214 15.146 ( -0.321 -3.353 -4.165) 5.357 15.359 ( 5.978 1.859 0.139) 6.262 15.407 ( -7.655 -10.257 -1.658) 12.906 16.459 ( 2.598 3.510 4.794) 6.484 16.680 ( -1.940 0.355 -3.227) 3.782 19.860 ( 4.154 -0.707 3.127) 5.247 20.071 ( -6.246 -0.626 -4.809) 7.907 20.419 ( 4.644 1.242 2.576) 5.454 20.520 ( -2.507 3.163 -1.312) 4.244 24.250 ( 3.056 0.063 1.733) 3.514 24.335 ( -2.602 -0.406 -1.298) 2.936 24.863 ( -0.628 0.538 0.646) 1.050 24.926 ( 1.019 1.597 -1.576) 2.464 26.156 ( 0.674 -1.467 0.709) 1.763 26.210 ( -0.922 -2.398 -1.274) 2.868 26.770 ( -2.124 1.449 2.712) 3.737 26.831 ( 3.210 -1.672 2.983) 4.691 26.918 ( 0.779 -1.183 1.067) 1.773 26.971 ( -2.425 -0.657 -0.082) 2.514 27.114 ( 1.800 -4.069 -0.286) 4.458 27.197 ( -1.190 4.403 -3.535) 5.771 27.672 ( -1.334 0.742 4.493) 4.745 28.032 ( 1.412 -2.410 -8.181) 8.644 29.127 ( 0.105 1.400 5.632) 5.804 29.392 ( 1.218 1.165 -0.023) 1.685 29.490 ( -2.090 5.221 -3.443) 6.594 29.609 ( -1.587 0.707 -2.552) 3.087 30.199 ( 5.793 7.569 9.457) 13.427 30.647 ( -3.920 -5.331 -7.072) 9.685 ======================= Grid point 136 (58/117) ======================= q-point: (-0.10 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.190 ( 5.471 22.673 7.599) 24.530 2.350 ( -6.337 3.844 -5.978) 9.522 2.576 ( 0.050 17.829 7.713) 19.426 2.784 ( -1.955 13.456 3.720) 14.097 3.006 ( 3.562 -0.907 -4.347) 5.693 3.236 ( -0.575 13.917 -13.025) 19.070 3.562 ( 5.692 1.347 1.231) 5.977 3.679 ( 6.053 0.588 -4.875) 7.794 3.827 ( 6.511 14.776 13.922) 21.320 3.912 ( -1.128 0.848 3.006) 3.321 4.160 ( 6.172 -4.225 -3.001) 8.059 4.210 ( -11.700 3.367 -5.035) 13.175 4.313 ( 2.862 1.867 -0.267) 3.427 4.387 ( 1.573 -4.016 2.106) 4.800 4.612 ( -4.729 10.690 5.994) 13.137 4.671 ( -4.944 -1.161 1.405) 5.269 4.855 ( -0.452 -13.806 1.159) 13.862 5.017 ( -9.300 -0.318 -1.172) 9.379 5.100 ( 2.702 2.456 -7.029) 7.921 5.256 ( 6.242 -3.196 2.813) 7.556 5.335 ( 4.047 5.153 -4.199) 7.783 5.373 ( -6.905 -2.103 5.002) 8.782 5.496 ( 7.028 0.472 6.185) 9.374 5.585 ( -0.974 -7.994 -2.038) 8.307 5.687 ( -5.349 -0.968 1.442) 5.624 5.744 ( 1.780 -4.300 -1.156) 4.795 5.921 ( -5.582 -6.872 -0.451) 8.864 5.985 ( 1.635 1.690 -7.399) 7.764 6.138 ( 3.530 -3.274 -9.669) 10.802 6.215 ( 0.480 -1.124 -8.146) 8.237 6.493 ( -3.839 1.592 0.258) 4.164 6.550 ( -1.021 -2.669 -0.830) 2.976 6.644 ( 0.947 -5.172 1.195) 5.392 6.700 ( 1.050 2.246 5.327) 5.876 6.729 ( 6.799 -1.796 1.774) 7.252 6.828 ( -3.599 -8.323 -0.250) 9.071 6.998 ( -0.843 -2.650 0.799) 2.894 7.098 ( -1.166 -7.577 -1.420) 7.796 7.169 ( 2.455 -2.635 0.863) 3.703 7.325 ( 2.135 -0.942 0.012) 2.334 7.368 ( -5.440 -2.130 -2.608) 6.398 7.427 ( -1.420 0.055 -2.563) 2.930 7.805 ( 7.365 -8.672 2.687) 11.690 7.819 ( 1.182 -9.174 -1.976) 9.458 7.977 ( 2.552 0.668 15.499) 15.722 8.046 ( 0.477 -7.230 8.107) 10.874 8.215 ( -8.847 -4.457 -5.928) 11.545 8.290 ( 5.140 1.269 7.289) 9.009 8.503 ( -2.260 1.892 -2.105) 3.622 8.543 ( -5.072 -1.853 -1.669) 5.652 8.622 ( -1.077 0.747 3.156) 3.418 8.665 ( 3.848 -1.921 2.976) 5.230 8.914 ( -2.172 -6.353 -1.757) 6.941 9.111 ( 6.806 -5.839 -1.342) 9.068 9.131 ( -1.579 -1.430 4.082) 4.604 9.795 ( -11.872 0.840 -20.045) 23.312 10.285 ( 0.100 2.258 -0.165) 2.266 10.354 ( 0.936 1.513 -1.516) 2.337 10.549 ( -4.690 0.730 2.609) 5.417 10.677 ( 10.877 -1.146 3.299) 11.424 10.948 ( -0.956 6.243 -1.290) 6.446 10.988 ( -1.170 7.612 -2.749) 8.177 11.261 ( 6.055 1.086 6.718) 9.109 11.449 ( -6.946 4.122 -5.457) 9.748 12.017 ( 4.377 -0.496 4.321) 6.171 12.130 ( -3.345 5.209 -4.307) 7.542 12.325 ( -1.570 0.443 2.799) 3.240 12.468 ( 5.196 2.636 1.819) 6.104 12.598 ( 3.633 2.149 5.052) 6.584 12.752 ( 2.541 -4.059 0.776) 4.851 12.870 ( 8.372 -4.326 4.351) 10.379 13.119 ( -17.176 -9.885 -11.611) 22.968 14.063 ( -1.081 -0.739 2.484) 2.808 14.151 ( -2.253 -4.096 -1.027) 4.786 14.255 ( -1.604 -4.291 1.379) 4.784 14.333 ( -0.863 -2.714 0.819) 2.963 14.567 ( 12.705 1.162 3.440) 13.213 14.781 ( -5.359 1.020 -6.807) 8.724 14.942 ( -0.582 -1.256 5.360) 5.536 15.206 ( -1.275 -3.366 -4.006) 5.386 15.442 ( 3.073 -5.701 1.559) 6.662 15.541 ( -2.993 -7.918 -3.030) 8.991 16.440 ( 6.860 1.742 6.554) 9.646 16.645 ( -2.938 1.537 -4.470) 5.566 19.907 ( 4.882 -0.998 3.786) 6.258 20.044 ( -6.596 -0.849 -5.151) 8.412 20.389 ( 0.316 4.841 0.690) 4.900 20.426 ( 0.453 4.360 -0.622) 4.427 24.306 ( 7.211 -2.888 3.077) 8.355 24.340 ( -2.818 -2.011 -1.734) 3.872 24.849 ( 0.154 0.614 0.261) 0.685 24.909 ( 2.183 1.041 -1.083) 2.650 26.189 ( 0.411 -1.454 1.376) 2.043 26.250 ( -1.766 -2.443 -1.559) 3.394 26.724 ( -1.774 1.689 1.532) 2.889 26.843 ( -0.141 2.187 1.390) 2.595 26.962 ( 1.627 -2.855 1.097) 3.465 27.006 ( -0.360 -3.655 -0.679) 3.734 27.121 ( -3.539 1.402 1.948) 4.276 27.205 ( 4.170 -3.060 -0.370) 5.185 27.645 ( -1.580 1.287 4.569) 5.003 28.103 ( 1.296 -4.345 -9.634) 10.648 29.087 ( 0.917 3.474 5.212) 6.331 29.305 ( -4.374 9.087 -4.386) 10.997 29.395 ( 2.647 0.900 3.626) 4.578 29.587 ( -0.335 2.626 -4.464) 5.190 30.080 ( 5.431 7.226 13.846) 16.535 30.665 ( -8.405 -0.191 -13.141) 15.600 ======================= Grid point 140 (59/117) ======================= q-point: ( 0.30 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.209 ( 10.515 0.000 26.832) 28.819 1.859 ( -0.546 -0.000 -10.155) 10.169 1.923 ( 22.615 0.000 16.991) 28.286 2.672 ( 10.889 0.000 -24.217) 26.552 2.842 ( -7.186 -0.000 6.827) 9.912 3.057 ( -2.433 -0.000 -16.684) 16.861 3.342 ( -25.716 -0.000 3.067) 25.899 3.409 ( 40.071 0.000 32.368) 51.511 3.644 ( 2.916 0.000 -1.846) 3.451 3.746 ( 2.543 0.000 1.161) 2.795 3.961 ( 3.558 0.000 -13.291) 13.759 4.051 ( -18.844 -0.000 -8.254) 20.572 4.357 ( -17.477 -0.000 -2.458) 17.649 4.358 ( -1.094 -0.000 -6.171) 6.268 4.697 ( 7.597 0.000 2.821) 8.104 4.866 ( 8.395 0.000 2.226) 8.685 4.884 ( -12.699 -0.000 10.573) 16.524 4.903 ( -4.609 -0.000 5.132) 6.898 5.031 ( 10.972 0.000 7.201) 13.124 5.297 ( 2.541 0.000 -5.519) 6.076 5.362 ( -2.634 -0.000 -4.122) 4.892 5.384 ( 10.620 0.000 -6.252) 12.323 5.555 ( -4.856 -0.000 4.590) 6.682 5.611 ( 0.715 0.000 0.496) 0.870 5.887 ( 10.436 0.000 -7.568) 12.891 5.892 ( 0.963 0.000 -10.979) 11.022 6.088 ( 2.896 0.000 7.826) 8.344 6.101 ( 5.424 0.000 1.493) 5.626 6.358 ( 6.216 0.000 -0.343) 6.226 6.599 ( -4.237 -0.000 -2.047) 4.705 6.604 ( -2.771 -0.000 5.723) 6.359 6.710 ( -1.481 -0.000 -5.360) 5.561 6.721 ( -0.943 -0.000 -5.584) 5.663 6.843 ( 3.369 0.000 -4.461) 5.590 6.865 ( 0.490 0.000 10.289) 10.301 6.883 ( -1.645 -0.000 -7.277) 7.461 7.228 ( -3.384 -0.000 7.965) 8.654 7.244 ( 0.075 0.000 1.637) 1.638 7.314 ( -4.962 -0.000 -6.495) 8.173 7.460 ( 1.214 0.000 -5.176) 5.316 7.555 ( 4.927 0.000 12.861) 13.772 7.662 ( -0.131 -0.000 1.643) 1.649 7.842 ( -2.401 -0.000 -3.469) 4.219 7.954 ( -7.250 -0.000 0.939) 7.310 8.059 ( 3.702 0.000 -3.910) 5.385 8.064 ( -8.067 -0.000 -1.206) 8.156 8.215 ( -3.089 -0.000 -2.853) 4.205 8.285 ( -2.377 -0.000 3.795) 4.478 8.538 ( -1.351 -0.000 -0.042) 1.352 8.683 ( 4.733 0.000 -0.931) 4.824 8.717 ( -1.719 -0.000 -0.834) 1.911 8.745 ( 4.098 0.000 2.511) 4.807 8.841 ( 1.615 0.000 4.864) 5.125 8.925 ( 1.351 0.000 16.068) 16.125 9.666 ( -4.887 -0.000 -2.845) 5.655 10.015 ( -2.975 -0.000 -4.185) 5.135 10.032 ( 1.106 0.000 -1.065) 1.536 10.327 ( 2.338 0.000 10.420) 10.679 10.456 ( 2.969 0.000 1.668) 3.406 10.467 ( 1.198 0.000 -0.632) 1.355 10.778 ( 9.595 0.000 -0.740) 9.623 10.863 ( 4.658 0.000 -3.765) 5.989 11.077 ( -1.385 -0.000 -2.336) 2.716 11.276 ( 6.529 0.000 4.894) 8.159 11.461 ( -11.648 -0.000 -0.156) 11.649 11.970 ( -2.150 -0.000 -2.975) 3.670 12.374 ( -0.208 -0.000 -2.056) 2.066 12.377 ( -7.373 -0.000 -2.804) 7.888 12.462 ( -13.742 -0.000 -6.064) 15.021 12.689 ( 5.791 0.000 1.823) 6.071 12.771 ( 5.082 0.000 2.819) 5.811 13.994 ( -11.332 -0.000 -3.462) 11.849 14.048 ( -1.093 -0.000 -1.793) 2.100 14.307 ( -5.348 -0.000 2.077) 5.737 14.435 ( 1.111 0.000 -5.735) 5.842 14.612 ( 2.439 0.000 -5.447) 5.968 14.784 ( 3.643 0.000 -3.611) 5.129 15.088 ( -17.687 -0.000 -7.838) 19.346 15.109 ( 3.030 0.000 -3.206) 4.411 15.181 ( 4.009 0.000 1.565) 4.304 15.564 ( 1.058 0.000 6.507) 6.593 16.216 ( 8.520 0.000 3.263) 9.123 16.430 ( -0.161 -0.000 0.135) 0.210 16.705 ( -1.625 -0.000 1.918) 2.513 19.924 ( 0.379 0.000 -0.340) 0.509 20.030 ( 1.797 0.000 0.794) 1.965 20.153 ( 0.817 0.000 0.302) 0.871 20.165 ( -0.332 -0.000 -0.573) 0.662 24.299 ( 1.249 0.000 -1.690) 2.102 24.892 ( 1.712 0.000 -5.564) 5.821 24.947 ( 5.237 0.000 2.206) 5.683 25.558 ( -7.106 -0.000 -8.580) 11.140 26.224 ( -3.864 -0.000 -0.203) 3.869 26.551 ( -6.947 -0.000 -13.007) 14.746 26.588 ( -2.988 -0.000 1.678) 3.427 26.679 ( 4.232 0.000 -9.595) 10.487 27.202 ( -3.106 -0.000 8.076) 8.653 27.281 ( 4.084 0.000 -0.684) 4.141 27.354 ( 8.019 0.000 -0.464) 8.032 27.432 ( 7.656 0.000 1.041) 7.727 27.656 ( -7.270 -0.000 15.647) 17.253 27.900 ( -10.253 -0.000 -0.375) 10.260 28.769 ( -0.159 -0.000 1.536) 1.545 28.944 ( -3.206 -0.000 -2.237) 3.909 28.951 ( -3.337 -0.000 6.961) 7.720 29.096 ( 0.034 0.000 -4.039) 4.039 29.713 ( 12.144 0.000 2.037) 12.314 30.291 ( 0.498 0.000 4.677) 4.704 ======================= Grid point 141 (60/117) ======================= q-point: ( 0.40 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.433 ( 5.376 -14.255 21.762) 26.565 1.943 ( -2.573 -10.359 -12.217) 16.223 2.298 ( 27.025 -17.604 18.420) 37.142 2.665 ( -3.886 7.452 9.695) 12.831 2.856 ( 14.521 -8.525 -20.314) 26.385 3.146 ( -4.419 -10.202 -18.042) 21.193 3.248 ( -25.015 -5.974 -1.480) 25.761 3.503 ( -2.650 0.366 -3.675) 4.545 3.695 ( -4.955 3.199 -8.390) 10.256 3.866 ( 30.185 -4.421 24.007) 38.821 3.980 ( -3.364 -4.411 -0.680) 5.589 4.094 ( -7.315 -8.091 -12.104) 16.294 4.225 ( 2.103 -2.760 4.036) 5.322 4.475 ( -3.091 -2.627 -4.673) 6.188 4.654 ( 5.715 4.107 5.806) 9.124 4.726 ( -6.932 4.411 7.821) 11.344 4.830 ( -10.726 -0.880 8.796) 13.900 4.958 ( 1.898 8.306 9.874) 13.042 5.104 ( 14.371 -3.460 -0.734) 14.800 5.236 ( -2.341 -0.738 -5.982) 6.466 5.357 ( 1.215 6.832 -5.925) 9.125 5.522 ( 6.937 -7.088 -5.264) 11.228 5.563 ( -3.075 -6.067 7.034) 9.784 5.608 ( 5.352 1.269 0.322) 5.510 5.834 ( -1.323 4.431 -11.757) 12.634 5.965 ( 5.258 2.471 -3.518) 6.792 6.086 ( 4.238 3.084 0.999) 5.336 6.134 ( 4.632 -2.598 5.148) 7.397 6.365 ( 1.417 6.941 -2.799) 7.618 6.378 ( -1.009 7.422 -0.292) 7.496 6.531 ( 1.421 9.769 3.517) 10.480 6.647 ( -8.530 3.504 -5.622) 10.801 6.754 ( -0.576 1.529 1.049) 1.941 6.818 ( 0.912 2.315 -1.556) 2.934 6.878 ( 0.046 -2.077 -4.941) 5.360 6.894 ( -0.528 -0.213 2.934) 2.988 7.139 ( -5.313 6.908 4.833) 9.965 7.199 ( -0.768 5.468 -0.616) 5.556 7.292 ( 3.664 -0.056 1.414) 3.928 7.380 ( 0.712 6.253 -0.454) 6.310 7.596 ( -2.513 -2.060 -3.719) 4.938 7.675 ( -5.738 4.880 -1.982) 7.789 7.789 ( 5.451 -2.073 4.451) 7.337 7.886 ( 0.708 3.214 3.311) 4.669 7.911 ( -5.692 4.089 -3.010) 7.628 8.119 ( -4.441 0.146 -4.198) 6.113 8.204 ( -3.587 -1.432 -2.909) 4.835 8.325 ( 1.085 -2.539 6.207) 6.793 8.591 ( -1.923 -2.671 -1.547) 3.637 8.656 ( 1.473 1.990 0.400) 2.508 8.754 ( -5.272 -7.380 -7.625) 11.849 8.779 ( 5.144 5.511 6.090) 9.691 8.841 ( 1.346 0.321 4.173) 4.397 9.000 ( -5.329 -9.919 9.848) 14.959 9.545 ( 4.766 10.646 0.758) 11.689 9.767 ( -4.814 19.813 -1.570) 20.450 10.097 ( 0.046 -5.195 -1.997) 5.566 10.327 ( 3.142 0.555 7.298) 7.965 10.444 ( 5.314 -1.802 -0.128) 5.613 10.672 ( -0.870 -11.157 -0.213) 11.193 10.851 ( 9.516 -1.638 1.569) 9.782 10.901 ( -0.321 -2.356 -3.900) 4.567 11.127 ( -0.024 -4.397 -0.413) 4.416 11.352 ( 3.525 -4.188 2.089) 5.859 11.447 ( -8.897 -4.589 1.654) 10.147 11.997 ( -1.726 -4.027 -4.487) 6.271 12.326 ( -6.494 -0.301 -3.936) 7.600 12.361 ( -2.661 0.273 -1.752) 3.198 12.446 ( -0.509 -2.197 1.121) 2.519 12.725 ( 4.396 -0.173 2.435) 5.028 12.815 ( 3.807 -1.567 2.886) 5.027 13.925 ( -10.560 -0.198 -5.601) 11.954 13.955 ( 0.837 9.649 -1.895) 9.869 14.238 ( -5.082 2.682 2.534) 6.280 14.401 ( -0.883 3.092 -6.448) 7.205 14.575 ( -4.415 3.852 -10.794) 12.282 14.758 ( 1.894 4.523 -3.028) 5.763 14.956 ( -3.008 4.384 -0.305) 5.326 15.109 ( 0.883 0.968 -0.064) 1.312 15.172 ( 2.376 3.840 1.857) 4.883 15.401 ( 4.390 13.100 6.174) 15.133 16.225 ( 0.276 3.972 -2.516) 4.710 16.477 ( 2.251 -3.567 2.960) 5.153 16.687 ( -0.210 0.018 2.597) 2.605 19.919 ( 0.347 1.054 0.117) 1.116 20.059 ( 1.903 -2.291 1.802) 3.481 20.140 ( -0.170 0.546 -0.510) 0.766 20.245 ( -0.859 -6.258 -1.193) 6.428 24.304 ( 3.049 0.815 0.367) 3.177 24.888 ( 1.053 1.437 -6.945) 7.170 24.973 ( 4.664 0.755 2.163) 5.197 25.376 ( -5.057 12.347 -3.885) 13.896 26.189 ( -3.328 1.227 0.016) 3.547 26.383 ( -3.981 9.128 -5.766) 11.507 26.586 ( -2.373 -1.206 1.705) 3.161 26.702 ( 2.530 -0.585 -7.524) 7.959 27.073 ( 0.563 8.526 11.901) 14.651 27.170 ( 1.138 6.583 1.661) 6.884 27.361 ( 1.972 2.928 5.592) 6.613 27.471 ( 8.716 1.750 0.755) 8.922 27.628 ( 5.037 -2.080 -2.239) 5.892 27.968 ( -12.448 -4.777 -4.309) 14.012 28.855 ( 0.370 -7.789 2.550) 8.204 28.974 ( 1.741 -5.994 2.825) 6.852 29.118 ( -4.866 -10.909 2.666) 12.239 29.277 ( -8.088 -17.313 -4.815) 19.706 29.815 ( 9.676 -3.700 -1.154) 10.424 30.234 ( -2.097 4.998 3.673) 6.547 ======================= Grid point 142 (61/117) ======================= q-point: ( 0.50 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.744 ( -5.969 -15.745 16.723) 23.731 2.168 ( 3.613 -11.252 -8.704) 14.677 2.588 ( 2.464 -5.567 8.883) 10.769 2.879 ( 22.344 -19.415 12.809) 32.253 3.155 ( 11.355 -12.683 -15.048) 22.721 3.225 ( -17.587 -7.518 -8.661) 20.996 3.353 ( -7.350 -10.664 -10.446) 16.639 3.519 ( 4.392 -3.352 1.819) 5.817 3.636 ( -0.513 -0.887 -14.899) 14.934 3.995 ( -1.500 -5.665 2.237) 6.272 4.023 ( -3.838 -0.557 -4.999) 6.327 4.152 ( -9.265 -1.860 -6.041) 11.215 4.374 ( -3.259 5.084 -2.705) 6.617 4.461 ( 9.593 -5.521 11.594) 16.029 4.605 ( 4.053 7.894 7.773) 11.797 4.654 ( -1.256 5.488 12.907) 14.081 4.753 ( 2.615 -0.834 10.737) 11.082 4.967 ( -8.405 -8.075 8.842) 14.630 5.114 ( 7.129 9.196 -8.708) 14.533 5.217 ( 5.033 -6.410 -3.008) 8.687 5.440 ( 3.106 -8.677 -4.389) 10.208 5.503 ( 4.914 10.323 9.798) 15.057 5.596 ( -4.782 3.507 -6.987) 9.164 5.731 ( -1.242 1.489 -5.285) 5.630 5.790 ( 2.426 -10.091 2.752) 10.737 5.850 ( 4.526 6.447 0.512) 7.894 5.992 ( -4.835 10.008 -1.782) 11.257 6.136 ( -1.838 6.431 -2.851) 7.271 6.202 ( 5.542 1.361 5.064) 7.629 6.321 ( 4.379 8.479 -0.345) 9.549 6.385 ( 9.835 4.732 9.506) 14.473 6.483 ( -4.150 5.252 -9.965) 12.004 6.685 ( -3.256 4.606 -2.418) 6.137 6.734 ( -4.265 9.440 0.847) 10.393 6.820 ( 2.561 1.855 -0.020) 3.162 6.914 ( -5.686 6.066 2.441) 8.665 6.945 ( -2.476 0.364 -3.888) 4.624 7.151 ( 3.839 -0.037 3.327) 5.080 7.258 ( -2.669 6.591 -2.251) 7.459 7.336 ( 4.490 -0.117 2.341) 5.065 7.482 ( -3.397 6.350 -3.807) 8.146 7.611 ( -3.064 -0.589 -6.573) 7.276 7.801 ( -8.554 2.344 -3.097) 9.395 7.815 ( 2.378 3.668 1.986) 4.801 7.956 ( 3.633 -4.462 3.336) 6.651 8.054 ( -2.738 2.081 0.185) 3.444 8.210 ( -0.773 -0.164 -1.775) 1.943 8.344 ( -0.580 1.271 1.085) 1.769 8.525 ( -3.000 5.740 4.623) 7.958 8.601 ( -0.549 2.080 1.556) 2.655 8.729 ( 1.877 2.061 3.127) 4.189 8.867 ( 4.518 -2.467 -0.326) 5.158 8.938 ( -8.573 -10.552 -7.230) 15.399 9.068 ( 0.565 6.806 5.450) 8.738 9.308 ( -6.736 14.058 -1.566) 15.667 9.396 ( 5.597 9.442 0.027) 10.976 10.214 ( 1.434 -5.726 -0.038) 5.903 10.365 ( 3.480 -1.811 5.375) 6.655 10.494 ( 3.057 0.051 -0.987) 3.213 10.808 ( -1.226 -2.833 -4.471) 5.433 10.941 ( 0.451 -3.372 2.634) 4.302 11.014 ( 5.113 -8.511 1.626) 10.061 11.208 ( -0.102 -3.541 0.573) 3.588 11.445 ( -8.350 -5.870 -5.704) 11.693 11.533 ( 4.258 -5.597 8.967) 11.396 12.087 ( -1.021 -5.607 -5.186) 7.705 12.309 ( -1.713 -0.561 -2.783) 3.316 12.360 ( -2.136 -1.594 -0.532) 2.718 12.503 ( 3.388 -2.420 3.145) 5.218 12.744 ( 1.961 0.373 2.928) 3.543 12.879 ( 2.491 -2.780 2.829) 4.684 13.698 ( 0.892 15.960 -0.327) 15.988 13.877 ( -10.161 -1.653 -8.903) 13.610 14.168 ( -3.362 1.984 3.142) 5.010 14.303 ( -4.327 5.124 -8.426) 10.769 14.408 ( -8.636 6.582 -13.201) 17.093 14.650 ( 7.134 8.518 4.154) 11.862 14.893 ( 6.728 4.106 4.135) 8.901 15.045 ( 4.000 6.109 9.728) 12.164 15.127 ( -2.164 -0.025 -0.911) 2.348 15.236 ( 2.427 6.242 -0.076) 6.698 16.081 ( -4.662 8.419 -7.065) 11.939 16.554 ( 3.397 -2.255 3.541) 5.401 16.708 ( 0.692 -1.036 1.935) 2.301 19.890 ( 0.852 1.965 0.784) 2.281 20.121 ( -2.968 0.145 -2.244) 3.724 20.146 ( 3.355 -4.385 3.401) 6.485 20.368 ( -1.227 -6.579 -1.595) 6.880 24.303 ( 3.687 1.444 1.994) 4.433 24.812 ( -1.300 7.050 -8.325) 10.986 24.967 ( 3.634 2.688 1.969) 4.930 25.131 ( -0.782 8.158 0.582) 8.216 26.146 ( -1.981 1.227 -0.121) 2.334 26.230 ( -2.156 4.520 -1.694) 5.287 26.607 ( -1.433 -2.115 1.589) 3.008 26.726 ( 0.606 -1.075 -4.930) 5.082 26.975 ( 0.926 3.172 7.088) 7.820 27.056 ( -0.815 4.887 4.242) 6.522 27.294 ( 1.119 5.069 3.306) 6.154 27.482 ( 7.975 2.205 -2.809) 8.738 27.686 ( 1.797 -0.865 -0.210) 2.006 27.957 ( -6.703 -1.535 -6.181) 9.246 29.043 ( 1.700 -9.891 4.054) 10.824 29.118 ( 3.081 -5.332 3.445) 7.057 29.319 ( -4.332 -11.682 1.167) 12.513 29.522 ( -4.971 -12.241 -5.686) 14.383 29.957 ( 3.847 -4.869 -1.259) 6.332 30.123 ( -4.293 1.747 1.827) 4.982 ======================= Grid point 143 (62/117) ======================= q-point: ( 0.60 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.018 ( -4.150 -16.312 8.263) 18.751 2.368 ( 3.237 -6.580 -4.945) 8.844 2.815 ( 5.806 -11.906 6.540) 14.772 3.267 ( -7.686 -7.876 -2.425) 11.269 3.316 ( 5.066 -14.400 0.000) 15.265 3.408 ( -4.074 -0.964 -8.415) 9.399 3.488 ( 8.561 -14.133 -3.153) 16.821 3.693 ( 2.556 -1.398 -12.299) 12.640 3.723 ( 2.159 -11.914 -0.811) 12.135 3.895 ( -7.171 8.983 -3.274) 11.951 4.057 ( -0.671 -0.189 -5.992) 6.032 4.207 ( 3.526 -8.116 5.918) 10.645 4.323 ( -8.173 -3.702 -10.582) 13.874 4.465 ( -1.702 10.152 8.834) 13.565 4.469 ( -0.070 1.149 12.589) 12.642 4.538 ( 4.717 4.774 1.856) 6.963 4.819 ( 4.199 0.060 6.258) 7.537 4.961 ( -3.016 2.827 4.863) 6.383 5.138 ( -2.843 -6.096 -2.108) 7.049 5.210 ( -1.296 16.094 4.152) 16.672 5.323 ( 3.975 6.441 4.874) 9.003 5.490 ( 2.628 0.211 -8.128) 8.545 5.572 ( 6.314 5.798 5.540) 10.207 5.649 ( -7.914 4.997 -4.079) 10.209 5.771 ( -1.375 0.597 -3.842) 4.124 5.814 ( 4.775 -2.685 -0.835) 5.541 5.971 ( -14.745 -2.485 -6.392) 16.261 6.090 ( 2.853 6.161 8.249) 10.683 6.128 ( 3.872 -1.224 8.452) 9.377 6.269 ( 8.098 7.040 1.065) 10.784 6.374 ( 4.022 -2.566 -6.379) 7.966 6.435 ( 5.600 -0.083 3.391) 6.547 6.490 ( -0.717 7.851 1.361) 8.000 6.610 ( 0.685 2.329 0.682) 2.522 6.777 ( -1.303 1.424 -3.339) 3.857 6.850 ( -2.582 -0.252 -1.973) 3.260 6.912 ( -1.226 2.377 -2.017) 3.350 7.108 ( -0.538 4.884 -0.341) 4.925 7.226 ( 6.334 -2.240 0.593) 6.745 7.293 ( -5.297 2.839 -4.295) 7.387 7.369 ( -2.721 8.133 -0.041) 8.576 7.564 ( -2.861 2.053 2.354) 4.236 7.717 ( -8.462 0.177 -5.907) 10.321 7.774 ( 3.139 2.111 1.666) 4.134 7.977 ( 0.458 0.335 -2.216) 2.288 8.031 ( 1.128 2.216 2.616) 3.609 8.197 ( 3.704 2.543 1.429) 4.715 8.317 ( -5.711 5.851 1.769) 8.365 8.402 ( -2.465 0.101 1.659) 2.973 8.580 ( 0.517 0.198 1.121) 1.250 8.681 ( 2.819 4.533 7.720) 9.386 8.750 ( 2.285 10.430 3.796) 11.332 8.955 ( 4.885 4.138 -1.510) 6.578 9.048 ( -9.388 -6.626 -6.528) 13.216 9.153 ( 0.259 1.608 -7.881) 8.048 9.333 ( 0.633 1.917 0.651) 2.121 10.312 ( 1.249 -3.060 0.139) 3.308 10.432 ( 2.885 -2.096 4.268) 5.562 10.481 ( 0.471 1.542 -1.112) 1.959 10.807 ( -2.505 1.051 -5.691) 6.306 11.015 ( 1.779 -3.303 5.662) 6.792 11.190 ( 2.619 -5.773 0.762) 6.385 11.258 ( 0.311 -1.465 1.554) 2.158 11.485 ( -9.464 -4.526 -6.948) 12.583 11.692 ( 8.158 -5.825 9.711) 13.956 12.175 ( -1.565 -4.030 -4.944) 6.568 12.323 ( 1.872 -0.942 -2.044) 2.928 12.381 ( -3.386 -2.017 -2.559) 4.699 12.577 ( 5.369 -1.779 4.728) 7.372 12.735 ( -0.151 1.159 3.347) 3.545 12.942 ( 1.501 -1.758 1.912) 3.000 13.391 ( -2.145 14.063 -0.493) 14.235 13.853 ( -9.448 -2.319 -9.680) 13.724 14.126 ( -1.306 0.665 2.869) 3.222 14.170 ( -8.206 2.355 -11.108) 14.010 14.263 ( -1.436 5.056 -5.147) 7.356 14.548 ( 9.814 6.896 8.999) 14.995 14.872 ( 9.652 3.094 6.569) 12.079 14.995 ( 1.183 1.389 7.081) 7.312 15.114 ( -0.468 0.726 -0.553) 1.026 15.159 ( -0.428 2.399 -1.377) 2.799 15.856 ( -6.882 10.343 -9.213) 15.467 16.607 ( 2.893 -0.723 2.649) 3.989 16.712 ( -0.242 0.860 0.692) 1.130 19.863 ( 2.330 1.657 1.771) 3.363 20.092 ( -4.589 0.227 -3.361) 5.692 20.264 ( 3.895 -4.834 3.796) 7.276 20.472 ( -1.666 -4.898 -1.807) 5.480 24.295 ( 3.311 1.703 2.654) 4.573 24.618 ( -2.612 9.527 -5.631) 11.371 24.930 ( 2.064 2.555 1.651) 3.676 25.040 ( -0.741 2.475 -0.732) 2.685 26.121 ( -0.409 0.522 -0.116) 0.673 26.163 ( -1.610 1.380 -0.970) 2.332 26.650 ( -0.312 -2.724 1.733) 3.244 26.750 ( -0.420 -1.465 -2.953) 3.323 26.943 ( 0.947 1.190 3.770) 4.065 26.982 ( -1.252 2.128 5.664) 6.179 27.189 ( 0.071 5.888 1.941) 6.201 27.470 ( 5.762 3.588 -6.359) 9.301 27.691 ( -1.540 -0.053 2.999) 3.372 27.955 ( -1.746 -1.140 -6.353) 6.686 29.175 ( 0.061 -0.813 6.281) 6.334 29.252 ( 3.408 -8.228 4.140) 9.821 29.490 ( 0.260 -6.502 -3.694) 7.483 29.642 ( -4.267 -1.636 -7.756) 9.002 30.056 ( -3.385 -9.589 7.228) 12.476 30.190 ( 2.229 -6.164 -3.484) 7.423 ======================= Grid point 144 (63/117) ======================= q-point: (-0.30 -0.70 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.313 ( 5.082 -11.646 -0.656) 12.723 2.458 ( -4.767 -3.476 -3.608) 6.915 3.071 ( 3.670 -10.872 6.075) 12.984 3.287 ( -4.670 2.135 -2.172) 5.575 3.393 ( -2.235 -1.199 -5.683) 6.223 3.566 ( 1.020 4.002 -3.470) 5.394 3.631 ( -8.006 2.293 -10.265) 13.219 3.696 ( 2.415 -3.817 -6.777) 8.145 3.792 ( -2.524 -11.824 2.696) 12.388 3.962 ( 10.243 -5.117 11.533) 16.251 4.073 ( 0.040 -2.961 -4.514) 5.399 4.226 ( 0.434 0.948 1.978) 2.236 4.353 ( 0.174 5.143 -2.643) 5.785 4.379 ( -0.776 0.957 1.820) 2.198 4.491 ( 2.645 1.495 0.474) 3.075 4.541 ( 5.408 -3.134 4.583) 7.751 4.779 ( -13.334 -1.353 -2.510) 13.635 4.855 ( -2.844 -0.280 4.242) 5.114 4.979 ( 3.422 16.253 8.236) 18.540 5.154 ( 1.665 -0.234 2.190) 2.761 5.300 ( 6.781 -9.199 8.685) 14.354 5.385 ( -0.389 10.012 -1.241) 10.096 5.537 ( 5.350 5.906 -0.998) 8.031 5.546 ( 1.574 1.853 -0.829) 2.569 5.715 ( -7.434 3.189 -0.336) 8.096 5.816 ( -2.655 4.834 -3.676) 6.629 5.939 ( -0.081 -4.020 -4.160) 5.786 6.084 ( -0.901 4.363 -4.048) 6.019 6.133 ( -2.565 -4.628 3.601) 6.401 6.244 ( -2.149 -0.672 1.114) 2.512 6.310 ( 5.642 -0.480 -3.131) 6.471 6.439 ( 4.522 1.066 0.938) 4.740 6.538 ( -3.236 -1.678 2.067) 4.191 6.671 ( 4.988 -3.202 3.020) 6.653 6.745 ( -4.509 3.792 -3.934) 7.085 6.825 ( 0.628 -1.962 -1.434) 2.510 6.899 ( -0.993 -0.441 -5.616) 5.720 7.007 ( -4.407 8.499 -6.906) 11.805 7.118 ( 4.364 5.617 3.319) 7.849 7.198 ( -2.952 5.646 0.400) 6.384 7.364 ( 7.637 -1.856 3.773) 8.717 7.547 ( -4.177 -3.127 2.807) 5.925 7.656 ( -9.274 1.044 1.033) 9.390 7.760 ( 3.585 1.421 4.907) 6.241 7.906 ( 4.450 6.017 2.819) 7.997 8.033 ( -6.972 8.803 -0.828) 11.260 8.040 ( 2.109 0.729 -2.800) 3.580 8.239 ( 1.042 -5.078 0.420) 5.201 8.504 ( 5.846 -3.007 3.692) 7.540 8.585 ( 0.744 0.195 1.722) 1.886 8.609 ( -1.771 2.404 4.869) 5.712 8.661 ( -1.915 1.440 1.250) 2.703 8.889 ( 0.036 2.668 -1.554) 3.088 9.077 ( -10.953 -2.685 -5.432) 12.517 9.144 ( 12.890 5.338 -3.465) 14.375 9.335 ( -1.716 -4.568 -5.332) 7.227 10.351 ( 0.193 -0.740 -0.390) 0.858 10.423 ( -0.902 1.841 -1.716) 2.673 10.504 ( 2.606 -1.338 4.281) 5.187 10.742 ( -3.891 2.865 -5.087) 7.016 11.084 ( 3.510 -1.579 5.869) 7.018 11.259 ( 3.308 -0.126 2.342) 4.055 11.274 ( -2.315 -0.301 -0.082) 2.336 11.507 ( -7.478 -3.367 -7.497) 11.111 11.847 ( 8.013 -4.279 8.866) 12.693 12.218 ( -1.952 -1.920 -4.647) 5.394 12.363 ( 3.387 -1.140 -1.898) 4.046 12.395 ( -3.870 -2.207 -2.908) 5.320 12.619 ( 4.300 1.150 5.054) 6.735 12.707 ( -0.242 1.418 3.269) 3.571 12.944 ( 1.487 2.731 1.446) 3.429 13.157 ( -7.040 6.400 -3.675) 10.200 13.864 ( -3.091 -3.626 -3.703) 6.034 14.109 ( -8.850 -1.981 -9.252) 12.955 14.143 ( -0.287 -1.312 0.558) 1.454 14.181 ( 0.737 2.661 -1.547) 3.165 14.523 ( 13.795 3.385 11.947) 18.560 14.890 ( 4.968 0.735 2.505) 5.612 14.985 ( -1.082 0.437 4.054) 4.219 15.096 ( 0.470 0.752 -1.105) 1.417 15.144 ( -0.083 -1.454 1.563) 2.136 15.609 ( -6.636 9.570 -9.011) 14.725 16.599 ( -0.337 2.569 2.416) 3.543 16.693 ( 0.687 0.712 -0.805) 1.276 19.860 ( 4.161 0.790 2.945) 5.158 20.056 ( -6.230 -0.071 -4.566) 7.725 20.375 ( 4.814 -3.429 3.984) 7.127 20.532 ( -2.424 -2.463 -2.102) 4.045 24.281 ( 2.547 1.522 2.447) 3.846 24.443 ( -2.923 6.162 -3.408) 7.624 24.898 ( 0.613 1.658 1.457) 2.291 24.994 ( -0.769 1.798 -1.940) 2.755 26.120 ( 0.591 -0.228 0.145) 0.650 26.148 ( -0.926 -0.485 -0.962) 1.420 26.710 ( 0.920 -3.076 2.183) 3.882 26.775 ( -0.742 -1.409 -1.149) 1.964 26.926 ( 0.342 1.123 2.699) 2.943 26.971 ( -0.671 -1.317 5.161) 5.369 27.079 ( -0.741 4.832 0.309) 4.898 27.405 ( 2.573 5.272 -7.271) 9.342 27.684 ( -1.452 -0.115 4.080) 4.332 27.971 ( 0.282 -1.136 -6.408) 6.514 29.167 ( -0.674 0.934 6.113) 6.220 29.404 ( 4.735 -3.720 4.061) 7.263 29.538 ( 1.142 1.485 -6.545) 6.808 29.622 ( -6.764 -2.105 -2.777) 7.609 30.272 ( -6.635 -12.329 1.330) 14.064 30.313 ( 8.411 -3.278 0.313) 9.032 ======================= Grid point 145 (64/117) ======================= q-point: (-0.20 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.443 ( -7.473 -0.735 -7.053) 10.302 2.479 ( 4.299 -0.671 -4.581) 6.318 3.073 ( -3.661 11.733 5.363) 13.410 3.275 ( 1.724 -2.789 2.810) 4.319 3.390 ( 2.882 10.774 -6.034) 12.681 3.459 ( -2.125 -1.661 2.227) 3.498 3.574 ( -1.029 -4.716 -8.741) 9.985 3.706 ( 4.049 2.479 -7.015) 8.470 3.986 ( -1.183 -1.272 4.417) 4.746 4.045 ( 3.280 1.591 8.739) 9.469 4.137 ( 4.273 -1.968 -0.395) 4.721 4.168 ( 3.819 6.443 4.661) 8.822 4.258 ( -1.985 -0.506 -4.794) 5.214 4.406 ( -0.991 3.501 -0.663) 3.698 4.501 ( -6.494 6.064 1.051) 8.947 4.544 ( 2.821 -10.941 3.223) 11.749 4.753 ( -2.750 -5.137 2.182) 6.222 4.806 ( 2.571 -3.051 4.786) 6.231 5.021 ( -5.036 -9.605 -0.071) 10.845 5.195 ( 1.189 5.164 -1.727) 5.574 5.261 ( 0.329 -4.734 1.634) 5.019 5.399 ( -2.154 5.543 3.212) 6.759 5.441 ( 2.601 0.911 -5.283) 5.959 5.590 ( -4.425 1.651 1.935) 5.105 5.648 ( 5.724 -6.465 5.001) 9.978 5.765 ( 2.262 3.089 3.112) 4.934 5.981 ( -3.046 3.534 -9.349) 10.449 6.019 ( -2.844 -3.461 -9.897) 10.863 6.068 ( 1.298 7.434 2.161) 7.849 6.290 ( -0.033 -3.211 0.438) 3.241 6.388 ( 6.552 6.787 8.391) 12.626 6.468 ( 0.367 -7.867 -1.939) 8.111 6.587 ( -4.247 -1.629 -2.289) 5.092 6.621 ( -3.663 -0.259 -3.647) 5.175 6.715 ( 1.697 -0.920 0.327) 1.958 6.816 ( -0.589 3.993 0.815) 4.118 6.845 ( -1.199 -0.034 -0.209) 1.217 6.955 ( 0.688 -2.309 -2.949) 3.808 7.088 ( -1.753 1.112 -2.246) 3.058 7.131 ( 6.981 0.104 -1.987) 7.259 7.382 ( 0.197 -0.368 6.891) 6.903 7.498 ( -11.017 2.132 -0.210) 11.223 7.604 ( 5.169 3.134 3.240) 6.858 7.765 ( 1.106 4.036 -5.579) 6.974 7.897 ( 2.437 -3.726 12.627) 13.388 7.935 ( 0.271 -0.389 2.057) 2.111 8.061 ( -2.971 -3.151 -5.242) 6.800 8.346 ( 1.818 -2.838 3.878) 5.138 8.501 ( -0.025 2.529 4.426) 5.097 8.569 ( -2.362 0.669 -1.418) 2.835 8.630 ( 2.832 -1.863 1.154) 3.581 8.639 ( -0.841 0.401 1.713) 1.950 8.851 ( -1.293 0.916 -1.329) 2.068 9.033 ( -6.356 1.520 -5.017) 8.239 9.107 ( 9.145 2.859 2.415) 9.881 9.502 ( -2.047 -12.005 -9.848) 15.662 10.349 ( -0.212 0.807 -0.772) 1.137 10.390 ( 0.461 1.178 -1.331) 1.836 10.537 ( 0.959 -0.672 3.438) 3.632 10.671 ( -1.798 1.718 -2.429) 3.476 11.111 ( 3.415 1.526 3.928) 5.424 11.221 ( -3.655 3.391 -1.649) 5.251 11.278 ( 3.965 0.314 3.773) 5.482 11.510 ( -6.220 -1.134 -7.240) 9.612 11.960 ( 6.751 -2.468 7.282) 10.232 12.226 ( -2.700 -0.220 -5.450) 6.086 12.369 ( -2.142 0.299 -0.825) 2.315 12.461 ( 1.705 -4.961 -1.047) 5.349 12.597 ( 4.961 3.286 5.467) 8.081 12.682 ( 0.224 1.508 2.985) 3.352 12.887 ( 2.650 3.041 2.049) 4.525 13.032 ( -9.415 2.167 -7.663) 12.331 13.951 ( 3.111 -4.687 2.368) 6.103 14.091 ( -8.903 -1.578 -6.281) 11.009 14.143 ( 0.056 -0.139 0.613) 0.631 14.200 ( -0.349 -3.028 -1.037) 3.220 14.588 ( 16.242 0.391 11.273) 19.774 14.868 ( -5.121 2.199 -5.151) 7.590 14.957 ( -1.371 1.245 3.197) 3.695 15.099 ( 0.327 -0.968 -2.419) 2.626 15.216 ( -1.450 -5.403 2.317) 6.055 15.434 ( -1.315 4.291 -5.011) 6.726 16.535 ( 0.177 3.082 3.278) 4.503 16.683 ( -0.003 0.772 -2.203) 2.335 19.884 ( 5.637 0.005 4.034) 6.932 20.017 ( -7.074 -0.402 -5.255) 8.822 20.451 ( 4.749 -1.093 3.541) 6.023 20.535 ( -3.187 0.270 -2.337) 3.961 24.274 ( 2.407 0.718 1.995) 3.208 24.342 ( -2.445 2.527 -2.145) 4.119 24.874 ( -0.089 0.978 1.004) 1.405 24.960 ( 0.330 1.394 -1.918) 2.394 26.136 ( 0.736 -0.937 0.475) 1.282 26.164 ( -0.865 -1.548 -1.131) 2.104 26.764 ( -0.946 -0.959 2.015) 2.423 26.803 ( 1.705 -2.439 2.012) 3.592 26.917 ( 0.547 0.085 2.221) 2.289 26.974 ( -2.495 1.972 2.507) 4.050 27.040 ( 0.209 -2.566 -0.717) 2.672 27.303 ( 1.267 5.640 -6.131) 8.426 27.677 ( -1.006 0.287 4.056) 4.189 27.998 ( 0.843 -1.534 -6.813) 7.034 29.148 ( -0.274 0.769 5.817) 5.874 29.432 ( 2.229 1.987 -0.865) 3.109 29.535 ( 0.750 0.096 -0.924) 1.194 29.606 ( -3.956 0.137 -2.864) 4.886 30.337 ( 4.246 2.275 4.525) 6.609 30.478 ( -3.155 -8.684 -3.315) 9.816 ======================= Grid point 146 (65/117) ======================= q-point: (-0.10 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.381 ( -8.330 1.769 -7.792) 11.543 2.435 ( -0.176 5.031 -1.938) 5.394 2.814 ( -0.047 14.645 6.120) 15.872 3.147 ( 8.900 10.936 -1.438) 14.173 3.206 ( 2.557 16.089 2.662) 16.507 3.414 ( 0.749 2.992 -2.595) 4.030 3.676 ( 5.638 4.065 0.236) 6.954 3.753 ( -0.423 -7.275 -4.202) 8.413 3.845 ( 6.038 10.813 1.502) 12.475 4.035 ( 2.188 5.594 -6.762) 9.045 4.084 ( 1.223 -4.581 5.927) 7.591 4.188 ( -3.171 0.336 -1.254) 3.426 4.259 ( 1.072 -2.386 2.930) 3.928 4.378 ( -0.427 -2.723 -6.748) 7.289 4.548 ( -2.434 -8.024 7.224) 11.068 4.636 ( -5.384 -1.151 2.281) 5.959 4.845 ( -4.733 -1.979 3.302) 6.100 5.001 ( 2.236 -10.072 4.427) 11.227 5.042 ( -3.734 8.357 -4.006) 9.991 5.217 ( 4.475 -12.800 -1.373) 13.629 5.296 ( -1.109 2.761 10.009) 10.442 5.364 ( -4.403 -2.190 -4.857) 6.912 5.493 ( -3.342 -7.330 -8.335) 11.592 5.545 ( -3.330 5.583 -0.513) 6.521 5.681 ( 5.305 3.448 3.242) 7.109 5.732 ( 8.281 3.149 11.344) 14.393 5.811 ( -6.622 2.251 0.310) 7.001 5.997 ( 2.239 1.750 -1.288) 3.120 6.068 ( -0.417 -2.740 -10.133) 10.505 6.334 ( 9.959 3.499 -5.241) 11.785 6.451 ( 1.384 -9.655 3.087) 10.231 6.486 ( -4.563 0.797 -2.754) 5.389 6.557 ( -4.771 2.341 -0.757) 5.368 6.640 ( -6.048 -4.088 -6.579) 9.827 6.714 ( -2.815 0.968 -0.455) 3.011 6.820 ( 5.200 -0.320 4.158) 6.666 6.897 ( -0.735 -5.481 1.220) 5.663 6.988 ( 0.584 -2.665 -2.043) 3.408 7.129 ( 1.857 -3.314 1.377) 4.041 7.258 ( 7.212 -7.305 -3.831) 10.957 7.375 ( -0.503 2.031 5.283) 5.683 7.427 ( -10.588 -1.101 0.421) 10.654 7.658 ( 9.493 -4.095 4.630) 11.328 7.707 ( 2.639 -1.838 -6.215) 6.997 7.947 ( -0.822 -1.226 10.402) 10.506 7.993 ( -1.422 -4.237 2.784) 5.265 8.101 ( -4.062 -2.406 -4.101) 6.253 8.350 ( 0.954 2.008 8.781) 9.058 8.480 ( -0.080 -0.613 2.687) 2.757 8.534 ( -3.760 1.910 -4.512) 6.177 8.634 ( -0.341 -0.085 1.250) 1.298 8.666 ( 3.064 -0.221 2.262) 3.815 8.836 ( -2.032 -0.662 -2.161) 3.039 8.984 ( -2.944 -1.686 -6.506) 7.337 9.169 ( 6.880 -2.340 8.722) 11.353 9.667 ( -8.507 -6.621 -14.167) 17.802 10.323 ( 0.207 1.632 -0.870) 1.861 10.384 ( 2.112 0.522 -1.048) 2.415 10.536 ( -2.641 0.507 1.930) 3.309 10.684 ( 4.621 -2.481 1.146) 5.368 11.056 ( -1.335 5.016 0.108) 5.191 11.121 ( 1.805 5.502 -0.909) 5.862 11.304 ( 4.093 -0.205 5.067) 6.517 11.466 ( -4.529 1.844 -5.098) 7.064 12.018 ( -1.263 -0.427 2.087) 2.477 12.193 ( 0.606 1.891 -3.863) 4.343 12.340 ( -1.059 1.339 2.864) 3.334 12.543 ( 0.860 0.623 -3.633) 3.785 12.618 ( 0.637 -2.663 4.782) 5.510 12.668 ( 6.600 -1.874 5.785) 8.975 12.896 ( 5.544 -1.693 2.486) 6.307 12.930 ( -9.907 1.875 -9.073) 13.564 14.056 ( -4.240 0.053 -0.880) 4.331 14.063 ( 2.910 -4.215 3.250) 6.066 14.171 ( -1.321 -2.891 1.350) 3.453 14.265 ( -0.420 -3.635 -0.512) 3.695 14.676 ( 11.213 1.660 5.245) 12.490 14.750 ( -11.366 1.935 -7.493) 13.751 14.940 ( 0.864 0.482 3.018) 3.176 15.135 ( -0.771 -2.827 -3.903) 4.881 15.280 ( -9.868 -4.307 -2.638) 11.085 15.469 ( 9.548 -5.041 2.278) 11.034 16.506 ( 4.093 1.217 5.118) 6.666 16.657 ( -1.279 1.399 -3.886) 4.324 19.928 ( 6.280 -0.459 4.676) 7.843 19.983 ( -7.033 -0.795 -5.259) 8.818 20.460 ( -1.567 2.707 -0.292) 3.142 20.494 ( 1.434 1.978 0.441) 2.483 24.287 ( -0.564 -0.510 -0.396) 0.858 24.317 ( 3.056 -1.059 0.676) 3.304 24.859 ( -0.003 0.553 0.306) 0.632 24.944 ( 2.067 0.929 -1.208) 2.568 26.163 ( 0.472 -1.391 0.993) 1.773 26.191 ( -1.834 -2.078 -1.415) 3.112 26.744 ( -2.180 1.371 1.823) 3.155 26.866 ( 1.128 -0.437 4.209) 4.379 26.933 ( 1.146 -1.213 1.394) 2.175 26.941 ( -1.327 -1.801 -0.746) 2.359 27.092 ( -3.365 -1.905 -0.245) 3.875 27.228 ( 4.754 2.274 -3.574) 6.368 27.662 ( -0.592 0.898 3.678) 3.832 28.039 ( 0.497 -2.529 -7.488) 7.919 29.136 ( 0.611 1.002 5.908) 6.023 29.394 ( -1.376 2.839 -3.716) 4.874 29.474 ( 0.313 4.882 1.277) 5.056 29.604 ( 1.309 -0.312 -2.815) 3.120 30.265 ( 3.380 7.413 9.715) 12.679 30.571 ( -7.058 -3.937 -8.317) 11.597 ======================= Grid point 151 (66/117) ======================= q-point: ( 0.40 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.362 ( 11.651 0.000 18.889) 22.194 1.823 ( 3.697 0.000 -5.927) 6.986 2.309 ( 29.373 0.000 20.428) 35.778 2.745 ( -5.475 -0.000 12.868) 13.984 2.845 ( 13.849 0.000 -17.044) 21.961 2.993 ( -29.527 -0.000 3.948) 29.790 3.025 ( -0.130 -0.000 -21.716) 21.717 3.409 ( -14.418 -0.000 -18.239) 23.249 3.731 ( -3.445 -0.000 -8.324) 9.009 3.834 ( -14.752 -0.000 -7.177) 16.406 3.989 ( 3.567 0.000 6.889) 7.757 4.011 ( 3.399 0.000 -0.818) 3.496 4.271 ( 24.980 0.000 22.112) 33.361 4.377 ( 2.597 0.000 -11.640) 11.926 4.687 ( -16.182 -0.000 16.129) 22.847 4.750 ( -3.422 -0.000 20.653) 20.935 4.852 ( 10.649 0.000 0.229) 10.652 5.070 ( 7.018 0.000 -10.446) 12.584 5.132 ( 4.954 0.000 8.585) 9.912 5.285 ( -7.221 -0.000 0.005) 7.221 5.297 ( 2.137 0.000 -7.323) 7.629 5.456 ( -4.245 -0.000 -5.861) 7.237 5.578 ( 11.808 0.000 3.074) 12.202 5.690 ( 9.732 0.000 2.824) 10.133 5.872 ( -1.453 -0.000 -9.929) 10.035 6.004 ( 9.452 0.000 -8.354) 12.614 6.114 ( 0.673 0.000 9.729) 9.752 6.129 ( -0.937 -0.000 0.072) 0.940 6.414 ( 2.051 0.000 1.539) 2.564 6.516 ( -8.084 -0.000 -7.634) 11.118 6.579 ( -3.642 -0.000 1.840) 4.080 6.671 ( -1.391 -0.000 -5.140) 5.325 6.701 ( -1.704 -0.000 -5.674) 5.924 6.863 ( 0.527 0.000 -6.048) 6.071 6.868 ( 0.451 0.000 4.871) 4.892 6.926 ( 7.551 0.000 1.626) 7.724 7.173 ( -5.922 -0.000 9.072) 10.833 7.233 ( -7.106 -0.000 -5.304) 8.867 7.324 ( 9.678 0.000 4.324) 10.600 7.483 ( 2.998 0.000 -3.094) 4.308 7.536 ( -8.523 -0.000 -0.497) 8.537 7.676 ( 1.855 0.000 2.388) 3.024 7.806 ( -3.008 -0.000 -3.517) 4.628 7.901 ( -2.161 -0.000 1.656) 2.722 8.001 ( -0.891 -0.000 4.307) 4.399 8.068 ( -2.249 -0.000 -5.024) 5.505 8.169 ( -3.037 -0.000 -2.438) 3.894 8.300 ( 4.098 0.000 5.766) 7.074 8.492 ( -4.019 -0.000 -3.878) 5.585 8.686 ( -2.024 -0.000 -2.248) 3.025 8.734 ( 2.306 0.000 -2.074) 3.102 8.746 ( -7.024 -0.000 1.639) 7.213 8.857 ( 0.545 0.000 5.401) 5.428 8.923 ( -0.830 -0.000 8.346) 8.387 9.671 ( 4.261 0.000 4.552) 6.235 9.972 ( -3.174 -0.000 -5.143) 6.044 10.053 ( 2.514 0.000 0.347) 2.538 10.369 ( 2.691 0.000 12.964) 13.240 10.465 ( -1.081 -0.000 -2.265) 2.510 10.496 ( 3.203 0.000 1.502) 3.537 10.849 ( 1.841 0.000 -4.985) 5.315 10.912 ( 3.614 0.000 -2.772) 4.555 11.087 ( 3.047 0.000 0.988) 3.203 11.284 ( -9.025 -0.000 -4.911) 10.274 11.394 ( 4.834 0.000 8.232) 9.547 11.939 ( -2.421 -0.000 -5.905) 6.382 12.298 ( -0.366 -0.000 0.504) 0.623 12.371 ( -0.011 -0.000 -1.977) 1.977 12.409 ( 0.198 0.000 3.625) 3.631 12.750 ( 3.425 0.000 2.424) 4.196 12.822 ( 2.732 0.000 2.858) 3.954 13.857 ( -10.018 -0.000 -9.123) 13.549 14.059 ( 2.978 0.000 -1.290) 3.245 14.242 ( -5.250 -0.000 2.295) 5.730 14.421 ( -2.136 -0.000 -7.442) 7.742 14.553 ( -12.268 -0.000 -16.778) 20.785 14.804 ( 2.167 0.000 -1.636) 2.715 14.991 ( 1.392 0.000 4.110) 4.339 15.097 ( -1.987 -0.000 -2.861) 3.483 15.242 ( 3.170 0.000 -1.838) 3.665 15.604 ( 4.506 0.000 9.897) 10.875 16.260 ( -1.344 -0.000 -3.354) 3.614 16.445 ( 2.678 0.000 3.392) 4.322 16.671 ( -3.846 -0.000 2.557) 4.619 19.939 ( 1.829 0.000 1.349) 2.272 20.049 ( 1.054 0.000 1.002) 1.454 20.154 ( -0.729 -0.000 -0.770) 1.060 20.160 ( -0.502 -0.000 -0.893) 1.025 24.338 ( 4.790 0.000 2.467) 5.388 24.906 ( 1.059 0.000 -8.390) 8.456 25.008 ( 4.132 0.000 2.919) 5.059 25.437 ( -10.990 -0.000 -4.704) 11.954 26.183 ( -2.620 -0.000 0.608) 2.690 26.431 ( -9.563 -0.000 -8.320) 12.675 26.560 ( -1.888 -0.000 1.569) 2.455 26.714 ( 2.203 0.000 -9.232) 9.491 27.182 ( -1.156 -0.000 9.401) 9.472 27.314 ( 1.614 0.000 -1.285) 2.063 27.406 ( 0.278 0.000 9.173) 9.178 27.544 ( 10.093 0.000 0.613) 10.112 27.661 ( 5.602 0.000 -2.342) 6.072 27.768 ( -11.013 -0.000 -0.598) 11.030 28.771 ( 0.143 0.000 1.603) 1.609 28.909 ( -2.015 -0.000 -2.258) 3.026 28.926 ( -1.772 -0.000 5.401) 5.684 29.100 ( 0.866 0.000 -3.378) 3.488 29.857 ( 11.012 0.000 4.306) 11.824 30.275 ( -3.314 -0.000 1.566) 3.665 ======================= Grid point 152 (67/117) ======================= q-point: ( 0.50 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.509 ( 4.592 -7.003 16.929) 18.887 1.973 ( 8.281 -9.911 -3.153) 13.294 2.505 ( -3.062 -2.193 14.949) 15.416 2.740 ( 18.798 -9.099 15.334) 25.909 2.905 ( -24.575 -6.709 -3.117) 25.664 3.059 ( 18.033 -10.589 -14.651) 25.534 3.107 ( -1.088 -8.033 -18.883) 20.550 3.421 ( -7.534 -7.061 -13.263) 16.808 3.663 ( -0.446 2.106 -9.319) 9.565 3.830 ( -13.798 -5.858 -13.273) 20.022 3.913 ( -13.231 -1.755 -3.388) 13.770 4.061 ( -1.092 -2.636 6.929) 7.493 4.395 ( -7.325 -1.613 -8.840) 11.593 4.530 ( 25.727 0.845 22.840) 34.413 4.643 ( -5.927 -3.018 15.860) 17.198 4.685 ( 2.335 3.791 11.507) 12.338 4.842 ( 7.526 2.580 7.353) 10.833 4.984 ( 3.310 11.476 7.143) 13.916 5.165 ( -4.854 0.006 -3.059) 5.738 5.242 ( -1.118 -8.124 -3.174) 8.794 5.389 ( 11.682 7.842 -6.428) 15.470 5.479 ( -6.617 -9.259 1.455) 11.473 5.658 ( 10.834 -4.162 -4.580) 12.477 5.705 ( 7.793 4.454 6.384) 11.015 5.806 ( 0.173 4.997 -8.331) 9.717 6.031 ( 4.488 4.807 0.815) 6.627 6.077 ( -4.317 3.958 1.222) 5.983 6.192 ( 4.237 -4.892 1.969) 6.765 6.308 ( -5.270 10.727 -9.065) 15.000 6.425 ( 0.527 -0.444 -1.028) 1.237 6.544 ( -3.626 3.748 -1.889) 5.546 6.564 ( 1.447 6.707 1.839) 7.104 6.755 ( 0.020 1.350 -2.431) 2.781 6.798 ( -1.796 1.872 -1.876) 3.201 6.867 ( -1.080 0.243 1.895) 2.194 6.932 ( 5.087 4.555 0.696) 6.863 7.068 ( -5.781 7.546 0.948) 9.554 7.178 ( -1.958 1.015 2.538) 3.363 7.371 ( 3.224 3.164 -0.475) 4.542 7.383 ( 2.467 4.369 -0.955) 5.108 7.510 ( -8.135 -1.774 -8.188) 11.678 7.622 ( -3.817 7.933 -2.106) 9.051 7.841 ( 1.728 -3.083 1.878) 4.002 7.859 ( 0.911 1.596 1.047) 2.115 7.930 ( 3.934 3.904 4.907) 7.402 8.060 ( -4.264 0.333 -2.660) 5.037 8.174 ( -0.878 -2.050 -1.089) 2.481 8.362 ( 3.145 -0.572 6.283) 7.050 8.548 ( -3.447 -4.249 -3.875) 6.704 8.658 ( -1.453 1.436 0.389) 2.079 8.669 ( -7.985 -3.351 -7.944) 11.751 8.814 ( -1.755 4.123 3.179) 5.494 8.877 ( 3.669 -0.825 3.830) 5.368 8.919 ( -4.874 -8.899 3.472) 10.724 9.621 ( 4.563 8.337 2.990) 9.963 9.716 ( -1.560 20.220 -0.830) 20.297 10.125 ( 3.888 -4.723 2.025) 6.444 10.369 ( 2.538 0.173 8.791) 9.151 10.499 ( 3.338 -2.046 -0.454) 3.941 10.646 ( -2.844 -9.842 -2.135) 10.465 10.868 ( -3.825 -3.007 -3.523) 6.007 10.958 ( 6.607 -1.994 1.013) 6.976 11.140 ( 1.936 -3.006 1.244) 3.786 11.275 ( -9.627 -4.883 -5.687) 12.201 11.476 ( 7.395 -3.806 8.376) 11.804 11.968 ( -2.414 -4.565 -7.022) 8.717 12.311 ( 3.004 -0.171 1.475) 3.351 12.345 ( -0.445 1.234 -0.563) 1.428 12.474 ( 6.022 -3.266 6.326) 9.324 12.763 ( 1.107 0.309 2.305) 2.575 12.849 ( 1.431 -1.489 3.088) 3.715 13.793 ( -9.645 0.190 -14.228) 17.190 13.978 ( 2.382 10.354 0.159) 10.626 14.184 ( -3.629 1.830 2.440) 4.740 14.356 ( -8.190 3.726 -12.305) 15.244 14.445 ( -8.201 2.821 -13.124) 15.731 14.801 ( 4.667 2.724 1.875) 5.720 14.975 ( 3.072 3.005 5.740) 7.170 15.093 ( -2.088 -0.797 -2.845) 3.618 15.200 ( 0.512 4.894 -1.696) 5.205 15.489 ( 8.929 12.739 11.768) 19.506 16.178 ( -6.714 5.609 -7.846) 11.751 16.515 ( 3.106 -3.784 5.007) 7.003 16.671 ( -2.408 -2.059 2.112) 3.807 19.936 ( 2.273 1.498 2.012) 3.385 20.072 ( -0.139 -2.011 1.055) 2.275 20.136 ( -0.282 0.250 -0.729) 0.820 20.230 ( -1.250 -6.029 -1.606) 6.363 24.360 ( 5.500 1.179 4.234) 7.040 24.885 ( -0.905 2.388 -10.564) 10.869 25.022 ( 2.679 1.052 2.982) 4.144 25.283 ( -8.890 7.898 -2.344) 12.120 26.160 ( -1.223 1.021 0.686) 1.734 26.312 ( -5.970 5.245 -5.462) 9.643 26.565 ( -1.181 -1.383 1.486) 2.348 26.721 ( 1.278 -0.061 -6.818) 6.937 27.094 ( 1.404 6.990 10.369) 12.584 27.188 ( 1.380 8.664 1.174) 8.851 27.370 ( -0.683 2.671 6.045) 6.644 27.589 ( 10.148 2.396 -1.337) 10.512 27.668 ( -1.079 -0.932 -0.775) 1.623 27.846 ( -4.511 -6.084 -5.843) 9.566 28.868 ( 1.288 -8.556 3.753) 9.431 29.000 ( 2.288 -8.145 1.990) 8.691 29.044 ( -6.546 -11.029 2.082) 12.993 29.219 ( -1.772 -11.780 -5.822) 13.259 29.940 ( 10.466 -1.704 3.557) 11.185 30.192 ( -4.761 5.350 0.385) 7.172 ======================= Grid point 153 (68/117) ======================= q-point: (-0.40 -0.60 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.683 ( -5.464 -12.490 14.286) 19.747 2.234 ( 7.679 -10.091 -4.494) 13.454 2.613 ( -0.427 -10.825 10.691) 15.220 2.924 ( -20.867 -14.203 0.013) 25.242 3.154 ( 12.472 -10.584 -0.285) 16.360 3.281 ( 1.740 -10.877 -9.644) 14.640 3.340 ( 14.012 -6.927 -6.951) 17.107 3.504 ( -4.239 -6.102 -9.063) 11.719 3.671 ( 3.625 -2.677 -13.510) 14.242 3.915 ( -6.557 -10.504 -11.581) 16.954 3.983 ( -1.587 -8.317 -0.336) 8.473 4.070 ( -3.326 0.360 5.647) 6.564 4.303 ( -9.512 5.199 -1.891) 11.004 4.494 ( -5.193 0.050 5.952) 7.899 4.599 ( -3.432 7.994 10.793) 13.862 4.671 ( 1.321 2.717 7.234) 7.840 4.883 ( 6.991 -0.352 8.373) 10.913 4.894 ( 4.632 -1.009 15.914) 16.605 5.164 ( 0.712 10.563 -7.772) 13.133 5.263 ( 4.813 -7.465 -4.978) 10.182 5.459 ( -7.893 -4.513 -5.228) 10.488 5.557 ( 7.622 -0.171 -3.744) 8.494 5.589 ( 5.193 10.822 12.944) 17.653 5.723 ( -0.929 3.064 2.211) 3.891 5.821 ( 1.087 -5.354 -5.044) 7.436 5.871 ( 0.184 10.569 -1.591) 10.690 5.942 ( -1.904 7.837 0.563) 8.085 6.087 ( -4.641 3.365 -1.739) 5.990 6.286 ( 6.802 1.090 5.890) 9.063 6.390 ( 3.008 4.881 0.884) 5.801 6.446 ( 1.759 3.558 -6.010) 7.202 6.505 ( 5.557 2.698 4.963) 7.924 6.678 ( -2.517 7.900 2.909) 8.787 6.686 ( 3.476 6.423 -0.489) 7.320 6.840 ( 0.154 3.763 -3.594) 5.206 6.879 ( -0.103 2.607 4.422) 5.134 6.903 ( -3.016 2.132 -4.783) 6.043 7.166 ( -3.496 1.323 1.726) 4.118 7.241 ( 2.079 3.880 -3.229) 5.459 7.350 ( -2.177 5.237 -4.348) 7.147 7.459 ( 0.242 4.275 -1.533) 4.548 7.529 ( -9.341 -4.555 -11.711) 15.657 7.717 ( -3.450 7.400 3.057) 8.718 7.872 ( 6.147 4.083 2.665) 7.846 7.979 ( 0.821 -1.049 -2.636) 2.954 8.042 ( 0.645 -1.707 4.519) 4.873 8.230 ( 1.866 -3.064 2.373) 4.302 8.340 ( -0.184 2.977 1.686) 3.427 8.476 ( -4.015 6.544 3.146) 8.297 8.595 ( -0.686 2.025 0.867) 2.307 8.737 ( -1.495 0.563 0.305) 1.627 8.789 ( -10.035 -8.770 -9.723) 16.497 8.944 ( 3.801 0.141 2.211) 4.399 9.068 ( -1.605 -7.993 -0.575) 8.173 9.235 ( -1.418 22.375 3.306) 22.663 9.491 ( 7.788 9.973 -1.144) 12.706 10.251 ( 3.480 -4.587 3.232) 6.603 10.413 ( 3.701 -2.162 7.234) 8.408 10.510 ( -0.505 1.502 -2.557) 3.008 10.767 ( -4.379 -4.062 -6.579) 8.886 10.937 ( -1.054 -5.173 3.668) 6.428 11.072 ( 3.338 -6.329 2.343) 7.529 11.213 ( 0.629 -3.364 1.252) 3.645 11.327 ( -7.935 -5.659 -5.821) 11.352 11.625 ( 7.988 -5.941 8.864) 13.329 12.061 ( -2.519 -6.022 -7.297) 9.791 12.328 ( -2.863 -0.573 -1.240) 3.172 12.339 ( 4.892 0.007 -0.640) 4.933 12.587 ( 10.530 -2.242 9.378) 14.277 12.752 ( -1.312 0.788 1.920) 2.456 12.901 ( 0.839 -2.816 3.717) 4.739 13.638 ( -10.896 11.692 -15.812) 22.482 13.807 ( 0.614 3.471 0.387) 3.546 14.141 ( -1.549 1.452 2.766) 3.487 14.189 ( -9.906 5.350 -14.238) 18.152 14.349 ( -0.799 4.278 -6.128) 7.516 14.735 ( 5.319 6.861 5.926) 10.511 14.950 ( 1.845 0.768 5.161) 5.534 15.073 ( -2.690 3.720 -2.355) 5.159 15.110 ( 0.606 1.419 -0.769) 1.725 15.324 ( 11.936 10.417 11.998) 19.873 15.980 ( -10.301 8.464 -11.893) 17.866 16.598 ( 2.856 -2.358 4.714) 5.995 16.700 ( -1.886 -1.495 0.996) 2.605 19.918 ( 3.332 1.945 2.675) 4.695 20.070 ( -4.547 0.561 -3.064) 5.512 20.193 ( 3.287 -4.683 3.442) 6.677 20.348 ( -1.734 -6.449 -2.435) 7.108 24.361 ( 5.075 2.190 5.003) 7.455 24.764 ( -5.511 7.756 -11.354) 14.813 24.998 ( 0.994 2.614 2.444) 3.714 25.100 ( -3.821 5.280 0.394) 6.529 26.137 ( 0.627 0.981 0.418) 1.237 26.197 ( -2.577 3.354 -2.437) 4.881 26.598 ( -0.161 -2.389 1.501) 2.827 26.729 ( 0.273 -0.489 -4.487) 4.522 27.002 ( 2.283 3.859 7.108) 8.404 27.050 ( -0.375 5.529 3.636) 6.628 27.294 ( -1.280 4.881 2.882) 5.811 27.580 ( 7.506 3.876 -4.846) 9.739 27.661 ( -5.665 -0.998 2.614) 6.318 27.915 ( 0.834 -2.467 -6.654) 7.145 29.075 ( 2.803 -10.116 6.193) 12.188 29.144 ( -0.356 -4.753 4.177) 6.338 29.268 ( -2.446 -13.591 -0.587) 13.822 29.462 ( -3.307 -13.492 -8.570) 16.322 29.995 ( -2.232 3.863 3.829) 5.879 30.117 ( 6.959 -3.597 -1.185) 7.922 ======================= Grid point 154 (69/117) ======================= q-point: (-0.30 -0.60 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.990 ( -1.432 -20.029 8.006) 21.617 2.386 ( -0.111 -2.598 -4.507) 5.203 2.845 ( -1.958 -12.941 4.999) 14.010 3.157 ( -7.620 -14.201 2.896) 16.374 3.342 ( 0.264 -8.754 -1.454) 8.878 3.385 ( 0.786 -3.411 -7.645) 8.409 3.542 ( -7.213 -8.915 -7.469) 13.686 3.637 ( 2.210 -2.451 -14.286) 14.662 3.765 ( -1.943 -2.180 1.283) 3.190 3.907 ( 10.162 1.903 2.346) 10.602 4.079 ( 4.219 -1.874 -6.174) 7.709 4.191 ( -9.135 -2.625 -8.294) 12.614 4.246 ( -1.456 -7.723 1.705) 8.041 4.470 ( 0.082 -0.421 11.208) 11.216 4.531 ( 11.646 -1.412 9.808) 15.291 4.585 ( -0.073 4.823 3.482) 5.948 4.836 ( -3.060 11.717 2.601) 12.386 4.951 ( 5.139 6.335 -1.565) 8.306 5.092 ( -4.287 -12.936 7.355) 15.486 5.203 ( 0.645 11.647 0.431) 11.673 5.387 ( 1.590 11.910 5.611) 13.261 5.458 ( -4.012 -1.659 -3.867) 5.814 5.606 ( 1.608 0.167 -2.789) 3.223 5.623 ( -2.373 7.804 6.757) 10.592 5.716 ( -5.139 1.840 -3.249) 6.352 5.783 ( -9.595 1.407 -8.835) 13.118 5.902 ( 6.512 -2.681 -1.583) 7.217 6.089 ( -2.387 0.494 1.203) 2.718 6.218 ( 6.344 8.970 13.672) 17.539 6.313 ( -5.330 5.875 -4.599) 9.169 6.406 ( 9.730 4.303 -3.090) 11.079 6.470 ( -3.458 3.172 2.413) 5.276 6.541 ( 8.671 -0.578 2.831) 9.140 6.685 ( 9.162 1.103 4.205) 10.141 6.773 ( 0.928 2.522 -4.336) 5.101 6.816 ( -1.737 1.835 -0.404) 2.559 6.884 ( -2.924 -0.510 -4.393) 5.302 7.093 ( -2.205 3.221 -3.477) 5.228 7.194 ( -7.531 3.666 -4.647) 9.579 7.314 ( 6.663 -5.753 2.887) 9.265 7.336 ( -2.197 8.700 0.466) 8.985 7.538 ( -1.784 2.028 -5.559) 6.180 7.586 ( -9.837 -0.059 0.254) 9.841 7.848 ( 8.177 2.891 2.435) 9.009 7.974 ( -0.850 0.832 -1.131) 1.641 8.068 ( 2.581 0.290 1.981) 3.267 8.208 ( -9.152 9.150 1.910) 13.081 8.248 ( 3.585 5.090 2.854) 6.848 8.430 ( 5.018 -5.026 4.284) 8.294 8.579 ( -1.025 -0.360 0.021) 1.086 8.691 ( -0.817 2.540 0.883) 2.811 8.775 ( -1.909 11.584 2.669) 12.039 8.899 ( -6.447 -5.157 -6.205) 10.328 8.965 ( -3.945 3.842 -0.374) 5.519 9.217 ( 6.128 -3.466 -0.206) 7.044 9.380 ( 8.426 6.273 -4.898) 11.591 10.328 ( 0.953 -1.984 1.454) 2.638 10.447 ( -1.719 1.564 -1.649) 2.850 10.499 ( 3.109 -1.592 5.355) 6.394 10.756 ( -4.744 1.256 -7.327) 8.819 11.040 ( 1.513 -4.582 6.920) 8.436 11.200 ( -1.658 -5.033 0.302) 5.308 11.271 ( 1.541 -1.782 1.758) 2.940 11.385 ( -5.320 -4.662 -5.105) 8.723 11.795 ( 7.260 -5.836 8.411) 12.550 12.144 ( -2.940 -4.158 -6.778) 8.478 12.325 ( -4.533 -1.515 -3.163) 5.731 12.371 ( 4.456 -0.443 -1.868) 4.852 12.678 ( 9.770 0.278 8.886) 13.210 12.724 ( -1.591 0.756 1.746) 2.480 12.959 ( 1.532 -1.772 4.026) 4.658 13.305 ( -10.544 12.959 -8.149) 18.588 13.804 ( 2.257 -1.661 -1.569) 3.212 14.046 ( -8.517 2.089 -10.970) 14.044 14.127 ( -0.022 0.053 0.525) 0.529 14.261 ( 1.028 4.479 -3.371) 5.700 14.659 ( 6.657 3.936 9.515) 12.262 14.957 ( 3.723 1.595 2.911) 4.988 14.976 ( -6.296 1.787 -1.926) 6.822 15.107 ( 0.708 0.130 -1.599) 1.754 15.238 ( 12.339 6.742 12.209) 18.622 15.731 ( -11.595 9.110 -13.390) 19.918 16.627 ( -1.133 0.615 2.558) 2.864 16.706 ( 0.272 -0.078 0.531) 0.602 19.911 ( 4.988 1.374 3.528) 6.262 20.022 ( -6.001 0.727 -4.301) 7.419 20.320 ( 4.363 -5.234 4.155) 7.981 20.444 ( -2.581 -4.684 -2.984) 6.124 24.343 ( 3.877 2.591 4.541) 6.509 24.555 ( -6.717 8.103 -7.392) 12.861 24.946 ( 0.174 2.743 2.053) 3.431 25.019 ( -2.352 1.950 -1.225) 3.292 26.130 ( 1.696 0.605 0.216) 1.813 26.146 ( -0.805 0.904 -1.218) 1.717 26.655 ( 0.992 -3.080 1.722) 3.666 26.744 ( -0.184 -1.230 -2.715) 2.987 26.965 ( 1.968 2.144 3.705) 4.711 26.972 ( -0.826 1.957 5.271) 5.683 27.177 ( -2.109 5.727 1.278) 6.236 27.517 ( 1.380 4.954 -6.409) 8.217 27.661 ( -2.039 -1.157 3.665) 4.351 27.952 ( 1.599 -1.066 -6.160) 6.453 29.170 ( -1.597 -0.609 5.907) 6.149 29.305 ( 4.227 -8.886 6.223) 11.643 29.468 ( -3.350 -8.185 -3.170) 9.395 29.604 ( 0.143 0.330 -10.273) 10.279 29.980 ( -8.286 -9.800 4.991) 13.770 30.289 ( 11.834 -5.418 -0.992) 13.053 ======================= Grid point 155 (70/117) ======================= q-point: (-0.20 -0.60 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.357 ( -2.320 -7.037 -2.812) 7.925 2.384 ( -1.725 -8.137 -2.099) 8.578 3.097 ( 0.279 -12.555 2.589) 12.822 3.226 ( -4.829 5.184 5.137) 8.751 3.360 ( -3.409 -3.008 -4.102) 6.123 3.537 ( -4.534 -0.187 -9.241) 10.295 3.553 ( -1.937 0.674 -3.183) 3.787 3.707 ( -2.231 -7.199 -1.386) 7.663 3.795 ( 4.052 -7.493 -3.673) 9.276 4.033 ( -0.538 -5.409 -4.587) 7.113 4.136 ( 8.954 0.485 8.765) 12.539 4.230 ( 0.306 -1.921 0.138) 1.950 4.314 ( -1.499 -3.981 -3.585) 5.563 4.447 ( 6.870 6.832 2.421) 9.986 4.522 ( -1.942 7.502 0.511) 7.766 4.585 ( -7.618 -5.758 1.723) 9.704 4.638 ( 5.337 9.408 6.284) 12.509 4.873 ( 4.427 -2.267 1.556) 5.212 5.051 ( 5.746 13.818 7.088) 16.558 5.193 ( 4.407 1.181 -0.917) 4.653 5.302 ( -5.560 -4.602 5.311) 8.961 5.380 ( -1.145 5.163 -1.509) 5.499 5.535 ( -2.238 -3.208 3.657) 5.355 5.561 ( -0.516 4.273 1.554) 4.576 5.664 ( -2.365 3.855 -1.539) 4.777 5.776 ( -3.190 -4.422 -4.355) 6.978 5.967 ( 3.936 3.952 -0.292) 5.585 6.020 ( -8.926 -2.250 -0.836) 9.243 6.121 ( 1.516 1.502 -3.255) 3.892 6.188 ( -2.444 2.608 -6.588) 7.495 6.402 ( -0.340 -0.649 1.115) 1.335 6.461 ( 4.616 -2.126 3.349) 6.087 6.569 ( 4.703 2.594 1.524) 5.583 6.673 ( -2.326 4.155 -4.322) 6.430 6.740 ( 3.976 1.140 1.610) 4.438 6.823 ( -0.938 -1.579 -0.086) 1.839 6.890 ( -0.119 -0.257 -3.790) 3.801 6.962 ( -0.745 4.252 -5.842) 7.264 7.138 ( -2.000 8.261 1.875) 8.704 7.200 ( 2.818 -1.905 5.864) 6.779 7.411 ( -1.132 5.540 -0.170) 5.657 7.513 ( -8.369 3.473 -4.279) 10.021 7.555 ( 1.845 -9.326 5.805) 11.139 7.838 ( 7.778 3.256 6.434) 10.607 7.914 ( -6.798 6.993 -0.102) 9.753 7.961 ( -1.338 -0.869 -1.668) 2.308 8.081 ( 4.515 5.549 2.917) 7.726 8.258 ( 1.484 -4.433 -1.127) 4.809 8.550 ( -3.977 0.302 0.102) 3.989 8.581 ( 4.352 -1.062 3.789) 5.867 8.613 ( 0.606 1.879 2.422) 3.125 8.653 ( 0.879 1.683 2.793) 3.377 8.872 ( -2.467 2.548 -1.485) 3.845 8.948 ( -8.500 -3.275 -3.020) 9.596 9.304 ( -2.130 -3.222 -6.031) 7.162 9.322 ( 15.225 5.277 -3.768) 16.548 10.352 ( -0.018 -0.386 0.203) 0.436 10.407 ( -1.491 0.885 -1.938) 2.601 10.539 ( 2.074 -0.365 4.546) 5.010 10.687 ( -4.054 1.964 -5.114) 6.815 11.121 ( 1.227 -2.101 6.145) 6.609 11.232 ( -3.600 -0.351 -1.382) 3.872 11.301 ( 1.461 -0.267 1.459) 2.082 11.440 ( -1.378 -3.072 -3.600) 4.929 11.933 ( 4.648 -3.992 6.295) 8.784 12.182 ( -3.554 -2.164 -6.556) 7.765 12.328 ( -3.692 -1.719 -1.746) 4.431 12.411 ( 2.270 -1.621 -2.961) 4.068 12.674 ( -1.014 1.593 1.882) 2.666 12.728 ( 6.594 2.044 6.210) 9.286 12.979 ( 4.521 2.037 4.397) 6.627 13.045 ( -8.952 6.505 -4.873) 12.091 13.893 ( 6.797 -4.158 3.111) 8.553 13.989 ( -8.678 -1.863 -9.350) 12.892 14.138 ( -0.369 -0.981 -0.203) 1.068 14.194 ( 1.437 2.674 -1.476) 3.376 14.677 ( 9.157 0.008 9.689) 13.332 14.870 ( -9.742 2.825 -7.437) 12.578 14.971 ( 1.405 0.327 3.933) 4.189 15.110 ( 2.009 0.304 -1.421) 2.480 15.214 ( 9.257 3.221 10.629) 14.458 15.503 ( -8.876 6.264 -11.207) 15.608 16.578 ( -3.298 2.107 1.555) 4.212 16.706 ( 1.409 0.931 -0.217) 1.703 19.930 ( 6.468 0.569 4.434) 7.863 19.970 ( -6.706 0.281 -4.887) 8.303 20.436 ( 4.301 -3.455 3.718) 6.653 20.493 ( -3.274 -2.333 -3.152) 5.108 24.316 ( 2.534 2.124 3.181) 4.588 24.390 ( -4.897 4.611 -4.003) 7.827 24.902 ( -0.135 1.818 1.526) 2.377 24.979 ( -1.396 0.969 -2.080) 2.686 26.130 ( 0.360 -0.103 -0.289) 0.473 26.145 ( 1.162 -0.243 -0.316) 1.228 26.726 ( 1.358 -2.949 1.999) 3.813 26.770 ( 0.146 -1.590 -0.678) 1.735 26.932 ( 0.359 1.315 2.834) 3.144 26.969 ( -0.360 -0.528 4.534) 4.579 27.063 ( -1.619 4.106 -0.563) 4.450 27.413 ( -0.729 5.370 -6.004) 8.088 27.672 ( -0.630 -0.449 3.470) 3.555 27.978 ( 1.331 -0.937 -6.189) 6.399 29.160 ( -1.159 0.538 5.738) 5.879 29.470 ( 4.145 -3.317 5.261) 7.474 29.523 ( -3.802 0.365 -3.635) 5.273 29.560 ( -0.250 -0.959 -5.623) 5.710 30.188 ( -6.747 -12.957 -0.213) 14.610 30.431 ( 10.070 -1.725 0.896) 10.255 ======================= Grid point 156 (71/117) ======================= q-point: (-0.10 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.318 ( -8.558 -0.736 -10.923) 13.896 2.534 ( 3.139 1.565 -0.491) 3.541 3.040 ( -1.807 8.380 3.895) 9.416 3.287 ( -0.125 -4.742 2.585) 5.402 3.418 ( -1.640 0.912 0.773) 2.030 3.449 ( 4.706 6.317 -2.357) 8.222 3.580 ( 1.607 -6.723 -8.607) 11.039 3.749 ( 3.182 -0.319 -6.061) 6.853 3.980 ( -0.909 -2.781 2.619) 3.927 4.061 ( -1.205 3.277 3.541) 4.973 4.159 ( -1.127 2.113 2.717) 3.622 4.208 ( 2.103 2.642 4.079) 5.296 4.275 ( 4.171 -1.812 -1.170) 4.696 4.377 ( -7.500 6.209 -6.522) 11.719 4.465 ( 4.726 -0.864 4.732) 6.743 4.580 ( 1.635 -5.205 3.096) 6.273 4.729 ( 2.433 1.141 4.512) 5.252 4.885 ( 6.575 -3.323 9.882) 12.326 4.955 ( -5.792 -7.381 1.719) 9.539 5.167 ( -5.176 7.248 -5.812) 10.635 5.279 ( 2.103 -4.166 -4.082) 6.200 5.341 ( -4.027 -0.016 -5.782) 7.046 5.480 ( 1.789 6.072 1.743) 6.566 5.541 ( -2.268 3.485 5.221) 6.674 5.679 ( -2.382 -6.319 4.262) 7.985 5.805 ( 2.532 -0.182 4.440) 5.114 5.888 ( -5.933 3.409 -6.850) 9.682 6.030 ( 3.719 -0.658 -5.790) 6.913 6.116 ( 3.911 2.054 -2.415) 5.034 6.236 ( -5.711 -6.797 -4.810) 10.097 6.439 ( -4.755 -3.349 0.733) 5.861 6.459 ( -0.324 -0.128 0.026) 0.349 6.579 ( 6.223 2.484 1.113) 6.792 6.626 ( 5.099 2.509 -0.001) 5.683 6.728 ( -1.163 2.365 0.336) 2.657 6.832 ( 3.691 0.817 4.167) 5.626 6.842 ( -0.121 0.035 0.085) 0.151 6.956 ( -0.023 -1.395 -2.770) 3.101 7.070 ( -0.742 -1.971 1.182) 2.415 7.217 ( 4.510 2.337 -6.505) 8.253 7.322 ( -7.463 -2.713 1.244) 8.037 7.392 ( -5.720 2.171 7.530) 9.702 7.682 ( 5.723 -1.447 -0.182) 5.906 7.795 ( 2.810 5.074 -4.685) 7.456 7.870 ( -2.347 -2.864 8.368) 9.151 7.987 ( 2.555 0.668 4.573) 5.280 8.025 ( -1.471 -1.040 -2.823) 3.348 8.346 ( -1.734 -2.911 2.619) 4.282 8.482 ( -4.223 1.726 1.126) 4.699 8.562 ( 2.730 1.428 0.441) 3.112 8.634 ( -0.375 0.749 2.192) 2.346 8.680 ( 4.167 -1.062 2.469) 4.958 8.829 ( -2.269 0.411 -0.882) 2.469 8.940 ( -6.412 -1.043 -3.158) 7.223 9.238 ( 10.087 5.471 -1.490) 11.571 9.456 ( -3.897 -8.974 -8.207) 12.770 10.348 ( 0.240 0.717 -0.471) 0.890 10.397 ( 0.716 -0.089 -1.230) 1.426 10.539 ( -1.015 0.783 1.922) 2.310 10.661 ( 0.671 -1.169 -0.677) 1.509 11.115 ( -3.438 2.405 0.814) 4.274 11.209 ( 2.126 1.634 0.630) 2.754 11.307 ( -0.994 -0.406 0.508) 1.188 11.475 ( 2.737 -0.097 -0.522) 2.788 11.991 ( -3.781 -0.783 -0.238) 3.869 12.197 ( 0.486 -1.507 -2.961) 3.358 12.344 ( -1.085 -0.694 1.767) 2.187 12.466 ( -0.869 -3.855 -4.941) 6.327 12.636 ( -2.629 1.065 -0.478) 2.877 12.713 ( 5.302 2.855 6.310) 8.722 12.910 ( -2.007 2.786 -0.601) 3.486 12.977 ( 5.328 2.178 2.388) 6.231 13.974 ( -5.110 -2.545 -3.417) 6.653 14.040 ( 6.645 -4.120 4.598) 9.071 14.142 ( -0.155 0.144 0.570) 0.608 14.198 ( 0.047 -2.517 -0.949) 2.691 14.715 ( -13.696 2.860 -9.132) 16.707 14.754 ( 5.637 0.353 3.568) 6.680 14.966 ( 1.303 1.244 3.044) 3.537 15.118 ( 3.057 0.442 0.119) 3.091 15.210 ( -0.436 1.036 3.107) 3.304 15.426 ( 0.648 -2.470 -3.732) 4.522 16.537 ( -0.241 0.549 2.989) 3.049 16.684 ( 0.439 1.744 -1.966) 2.665 19.927 ( -6.611 -0.284 -4.855) 8.207 19.968 ( 7.144 0.054 5.051) 8.749 20.473 ( -3.658 0.446 -2.287) 4.337 20.519 ( 3.024 -0.874 1.924) 3.689 24.290 ( -1.485 1.405 -0.619) 2.136 24.324 ( 1.364 0.385 0.445) 1.486 24.875 ( 0.071 1.030 0.867) 1.348 24.963 ( 0.236 0.246 -1.797) 1.829 26.141 ( -0.247 -1.007 -0.141) 1.046 26.159 ( 0.507 -0.540 -0.248) 0.781 26.751 ( -1.076 0.346 1.046) 1.540 26.833 ( 2.326 -3.609 3.570) 5.584 26.918 ( -1.180 0.631 1.067) 1.711 26.945 ( -1.467 1.485 2.397) 3.178 27.042 ( 0.249 -1.594 -0.788) 1.795 27.311 ( 0.465 4.178 -5.275) 6.745 27.672 ( -0.105 0.244 3.280) 3.290 28.003 ( 0.593 -1.284 -6.366) 6.521 29.149 ( -0.301 0.228 5.718) 5.731 29.433 ( -1.836 2.424 -3.673) 4.769 29.544 ( -0.180 1.953 -0.449) 2.012 29.593 ( 3.078 -2.297 0.968) 3.961 30.336 ( -4.498 -4.480 -1.332) 6.487 30.481 ( 3.503 0.256 1.118) 3.686 ======================= Grid point 162 (72/117) ======================= q-point: (-0.50 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.525 ( 13.113 0.000 14.449) 19.512 1.946 ( 15.486 0.000 3.137) 15.801 2.456 ( -23.109 -0.000 11.375) 25.757 2.599 ( -21.394 -0.000 11.161) 24.130 2.830 ( 18.403 0.000 9.963) 20.926 3.025 ( 11.629 0.000 -9.093) 14.762 3.037 ( 4.243 0.000 -19.637) 20.090 3.230 ( -6.348 -0.000 -19.650) 20.650 3.661 ( -13.161 -0.000 -14.707) 19.736 3.670 ( -4.889 -0.000 -18.429) 19.067 3.857 ( -10.878 -0.000 1.349) 10.961 4.010 ( -3.291 -0.000 6.205) 7.023 4.395 ( 2.481 0.000 -6.899) 7.331 4.533 ( -10.338 -0.000 17.167) 20.039 4.742 ( -1.972 -0.000 20.461) 20.556 4.754 ( 35.955 0.000 29.297) 46.379 4.989 ( 8.109 0.000 1.520) 8.250 5.016 ( -10.319 -0.000 -17.297) 20.141 5.147 ( -2.452 -0.000 2.527) 3.521 5.229 ( -13.827 -0.000 -3.830) 14.348 5.286 ( 9.317 0.000 10.160) 13.786 5.526 ( 15.690 0.000 -4.630) 16.359 5.675 ( 1.927 0.000 -7.509) 7.752 5.814 ( 9.012 0.000 6.934) 11.371 5.890 ( 5.511 0.000 1.245) 5.650 6.072 ( -2.429 -0.000 -3.547) 4.299 6.125 ( 5.742 0.000 -8.461) 10.225 6.133 ( 1.151 0.000 10.505) 10.568 6.390 ( -11.184 -0.000 -14.198) 18.074 6.396 ( -4.950 -0.000 -1.757) 5.253 6.519 ( -4.230 -0.000 -10.219) 11.060 6.655 ( -5.992 -0.000 -4.083) 7.251 6.684 ( 4.071 0.000 5.112) 6.535 6.868 ( -1.264 -0.000 4.028) 4.221 6.912 ( 7.267 0.000 -0.918) 7.325 7.012 ( 4.760 0.000 -4.196) 6.346 7.096 ( -7.779 -0.000 7.270) 10.648 7.164 ( -1.374 -0.000 -0.116) 1.379 7.386 ( -13.715 -0.000 -6.013) 14.975 7.446 ( 9.179 0.000 2.962) 9.645 7.528 ( 3.923 0.000 -0.439) 3.948 7.695 ( 1.015 0.000 1.332) 1.674 7.769 ( -1.912 -0.000 -3.442) 3.938 7.899 ( 2.238 0.000 2.064) 3.044 8.021 ( -4.098 -0.000 -4.493) 6.081 8.064 ( 9.505 0.000 13.232) 16.293 8.123 ( -3.739 -0.000 -8.133) 8.951 8.370 ( 3.528 0.000 3.212) 4.771 8.454 ( -2.242 -0.000 1.543) 2.722 8.594 ( -13.304 -0.000 -1.409) 13.379 8.660 ( -1.787 -0.000 -3.327) 3.777 8.738 ( -1.134 -0.000 -2.847) 3.064 8.866 ( 0.312 0.000 5.335) 5.345 8.934 ( 0.860 0.000 3.946) 4.039 9.739 ( 5.349 0.000 6.405) 8.345 9.932 ( -2.602 -0.000 -5.306) 5.909 10.095 ( 3.856 0.000 3.249) 5.042 10.381 ( -4.120 -0.000 9.168) 10.051 10.455 ( 1.721 0.000 -0.933) 1.957 10.540 ( 3.458 0.000 3.180) 4.697 10.826 ( -4.236 -0.000 -6.370) 7.650 10.943 ( 1.634 0.000 -2.223) 2.759 11.140 ( 4.804 0.000 2.218) 5.292 11.162 ( -8.783 -0.000 -4.471) 9.855 11.491 ( 8.654 0.000 7.622) 11.532 11.899 ( -3.277 -0.000 -8.316) 8.939 12.321 ( 0.807 0.000 1.419) 1.632 12.372 ( 0.301 0.000 -1.621) 1.649 12.503 ( 16.282 0.000 13.594) 21.211 12.767 ( -1.008 -0.000 1.694) 1.972 12.840 ( -0.001 -0.000 3.195) 3.195 13.735 ( -8.553 -0.000 -18.735) 20.595 14.112 ( 5.268 0.000 -0.646) 5.308 14.187 ( -3.695 -0.000 2.872) 4.680 14.303 ( -16.322 -0.000 -18.560) 24.716 14.434 ( -1.793 -0.000 -7.648) 7.855 14.846 ( 3.791 0.000 2.397) 4.485 15.043 ( 4.393 0.000 6.033) 7.463 15.070 ( -2.072 -0.000 -3.976) 4.484 15.241 ( -2.852 -0.000 -3.491) 4.508 15.689 ( 7.997 0.000 12.430) 14.780 16.197 ( -7.472 -0.000 -7.703) 10.731 16.488 ( 3.197 0.000 5.136) 6.050 16.620 ( -4.579 -0.000 1.814) 4.925 19.969 ( 2.603 0.000 2.829) 3.845 20.056 ( -0.208 -0.000 1.011) 1.033 20.135 ( -2.061 -0.000 -1.718) 2.683 20.152 ( -0.657 -0.000 -1.184) 1.354 24.412 ( 6.422 0.000 6.142) 8.886 24.898 ( -1.406 -0.000 -12.936) 13.013 25.047 ( 1.507 0.000 4.240) 4.500 25.293 ( -11.588 -0.000 -3.574) 12.127 26.167 ( 0.000 0.000 1.222) 1.222 26.320 ( -7.487 -0.000 -6.741) 10.074 26.545 ( -0.632 -0.000 1.175) 1.334 26.726 ( 0.902 0.000 -6.586) 6.648 27.185 ( 0.492 0.000 7.743) 7.758 27.324 ( 0.286 0.000 -1.339) 1.369 27.400 ( -1.794 -0.000 9.139) 9.314 27.608 ( -8.890 -0.000 -0.921) 8.938 27.699 ( 8.892 0.000 0.440) 8.903 27.747 ( 7.961 0.000 -5.172) 9.494 28.775 ( 0.419 0.000 2.100) 2.141 28.893 ( -0.259 -0.000 -2.434) 2.447 28.911 ( -1.350 -0.000 4.479) 4.678 29.111 ( 1.217 0.000 -2.859) 3.108 29.993 ( 10.583 0.000 7.391) 12.908 30.217 ( -5.885 -0.000 -1.834) 6.164 ======================= Grid point 163 (73/117) ======================= q-point: (-0.40 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.558 ( 0.237 1.636 14.048) 14.145 2.127 ( 15.798 -6.809 1.682) 17.285 2.394 ( -11.897 -10.112 10.811) 18.991 2.513 ( -32.235 -8.792 1.590) 33.451 3.079 ( 15.551 -5.316 1.916) 16.546 3.105 ( 11.144 -8.916 -7.820) 16.274 3.221 ( -0.006 -14.600 -3.812) 15.089 3.386 ( 11.313 -7.847 -15.698) 20.880 3.593 ( -10.839 -2.163 -21.248) 23.951 3.670 ( -10.358 -6.600 -17.752) 21.587 3.798 ( -1.340 -2.561 9.910) 10.323 4.033 ( -2.814 -2.500 7.814) 8.673 4.280 ( -7.524 5.958 0.213) 9.600 4.594 ( -4.133 -1.668 11.134) 11.993 4.641 ( -1.581 5.503 10.989) 12.391 4.804 ( -1.220 9.578 7.303) 12.106 4.915 ( 5.166 4.519 3.160) 7.557 5.060 ( 4.045 2.226 1.868) 4.981 5.122 ( 2.726 -6.256 -1.407) 6.968 5.228 ( 1.185 -3.499 7.902) 8.723 5.395 ( 2.188 -1.704 1.364) 3.091 5.599 ( 12.409 3.166 -5.006) 13.750 5.713 ( 0.288 -3.608 -5.968) 6.980 5.795 ( 5.643 4.241 8.089) 10.736 5.857 ( 6.227 5.561 2.693) 8.773 6.000 ( -4.959 3.980 0.202) 6.362 6.082 ( 1.752 6.723 9.204) 11.532 6.211 ( -3.963 8.131 -10.059) 13.528 6.240 ( -3.438 -3.387 -11.875) 12.818 6.378 ( -4.746 -3.277 -12.892) 14.123 6.487 ( -2.744 0.156 -1.570) 3.165 6.613 ( 0.585 3.301 5.440) 6.390 6.713 ( -1.772 -1.098 0.546) 2.155 6.827 ( -0.171 4.069 3.255) 5.214 6.884 ( 7.883 5.609 0.144) 9.676 6.987 ( 1.945 4.547 5.490) 7.388 7.012 ( -1.910 4.009 -3.936) 5.934 7.167 ( 0.450 0.942 2.197) 2.432 7.309 ( -7.674 -0.177 -8.847) 11.713 7.426 ( -0.115 6.232 -0.291) 6.240 7.466 ( 2.384 3.957 -2.823) 5.414 7.592 ( 0.255 8.399 -2.053) 8.650 7.842 ( -0.076 1.131 1.537) 1.909 7.919 ( 5.757 -3.523 2.324) 7.139 7.978 ( 0.407 2.134 -1.511) 2.647 8.047 ( 5.213 3.592 8.450) 10.559 8.154 ( -2.804 -3.525 -2.275) 5.046 8.383 ( -2.106 0.496 -1.024) 2.393 8.509 ( -6.257 -7.625 -3.304) 10.402 8.539 ( -5.171 1.444 -0.471) 5.390 8.658 ( 1.152 1.839 1.912) 2.892 8.771 ( -3.078 -1.512 -1.241) 3.647 8.895 ( -0.125 -2.748 2.831) 3.947 8.936 ( 4.420 -4.129 3.346) 6.912 9.627 ( -1.579 16.200 2.099) 16.412 9.749 ( 4.601 11.307 -1.202) 12.266 10.180 ( 4.012 -4.968 5.185) 8.226 10.393 ( -0.229 -2.096 7.911) 8.188 10.514 ( -0.659 -2.571 -4.095) 4.879 10.617 ( -0.917 -5.054 -0.290) 5.144 10.806 ( -5.512 -4.330 -1.081) 7.092 11.009 ( 1.509 -3.756 -0.053) 4.048 11.150 ( -4.876 -3.104 -2.306) 6.223 11.194 ( 1.558 -3.207 -0.418) 3.590 11.584 ( 8.874 -3.541 7.494) 12.142 11.926 ( -3.585 -4.881 -8.943) 10.801 12.317 ( -1.185 0.551 0.014) 1.306 12.370 ( 2.496 0.216 -1.160) 2.760 12.646 ( 19.952 -1.240 14.862) 24.910 12.750 ( -3.422 0.427 0.676) 3.514 12.857 ( 0.148 -1.881 5.131) 5.467 13.659 ( -10.485 1.855 -26.549) 28.605 13.995 ( -0.619 10.748 1.262) 10.839 14.161 ( -0.957 1.189 2.696) 3.098 14.209 ( -8.360 1.945 -13.049) 15.619 14.407 ( 0.067 2.127 -5.936) 6.306 14.856 ( 3.524 2.035 3.577) 5.418 15.005 ( 0.461 4.690 6.428) 7.970 15.060 ( -3.117 -0.320 -4.974) 5.879 15.180 ( -2.679 3.395 -3.391) 5.496 15.631 ( 12.245 10.352 14.478) 21.604 16.062 ( -10.665 6.993 -10.833) 16.733 16.552 ( 1.902 -3.564 5.260) 6.632 16.634 ( -3.549 -3.276 1.229) 4.983 19.974 ( 3.307 1.233 3.220) 4.778 20.053 ( -2.922 0.043 -0.763) 3.021 20.135 ( 0.135 -2.147 0.414) 2.190 20.213 ( -1.250 -5.705 -2.117) 6.212 24.438 ( 6.202 1.640 7.152) 9.607 24.840 ( -5.328 4.040 -15.856) 17.208 25.038 ( -0.539 1.423 4.230) 4.495 25.169 ( -9.094 4.787 -1.203) 10.347 26.163 ( 1.736 0.790 1.142) 2.223 26.243 ( -4.476 2.981 -4.322) 6.899 26.559 ( 0.196 -1.545 1.023) 1.863 26.727 ( 0.546 0.091 -5.124) 5.153 27.117 ( 1.029 5.917 7.364) 9.502 27.203 ( 0.983 9.025 1.468) 9.196 27.360 ( -1.576 2.676 4.853) 5.761 27.574 ( -10.839 -2.093 0.091) 11.039 27.718 ( 9.834 4.069 -0.830) 10.675 27.863 ( 5.634 -4.417 -6.016) 9.351 28.890 ( 1.744 -9.827 4.850) 11.097 28.975 ( -4.486 -8.120 1.147) 9.347 29.034 ( 2.980 -10.885 1.427) 11.376 29.206 ( 0.049 -8.773 -5.102) 10.149 30.069 ( 7.132 0.817 4.941) 8.715 30.132 ( -1.745 2.469 -1.417) 3.339 ======================= Grid point 164 (74/117) ======================= q-point: (-0.30 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.629 ( -5.093 -13.073 11.334) 18.036 2.334 ( 8.158 -4.739 -2.444) 9.746 2.538 ( -16.640 -13.547 4.071) 21.840 2.728 ( -5.538 -21.563 9.426) 24.176 3.183 ( -1.542 -7.359 -8.493) 11.343 3.332 ( -1.093 -0.132 -8.260) 8.333 3.445 ( 0.071 -4.978 -8.059) 9.473 3.556 ( 16.850 -8.564 -3.058) 19.148 3.646 ( -2.678 -7.667 -8.201) 11.542 3.819 ( -7.576 -14.333 -14.464) 21.727 4.043 ( -2.984 -3.188 2.258) 4.916 4.074 ( 12.259 -9.966 4.774) 16.504 4.150 ( -10.489 -0.279 3.819) 11.166 4.411 ( -6.874 4.560 2.452) 8.606 4.572 ( -1.995 7.679 10.917) 13.495 4.682 ( -0.460 0.481 4.492) 4.541 4.877 ( -1.801 -1.240 8.158) 8.446 5.058 ( 8.518 4.737 13.366) 16.543 5.152 ( 1.602 3.070 -9.428) 10.044 5.335 ( 4.373 1.723 -6.085) 7.689 5.391 ( 1.644 1.855 3.183) 4.034 5.546 ( -9.975 -0.742 -6.058) 11.694 5.663 ( 3.450 10.514 11.463) 15.932 5.679 ( -1.857 5.867 -3.237) 6.954 5.834 ( 0.548 1.829 -6.488) 6.763 5.877 ( -3.799 12.237 7.998) 15.104 5.963 ( 4.311 7.722 -4.800) 10.062 6.044 ( 1.144 -3.720 7.530) 8.476 6.292 ( -6.320 -2.832 -12.426) 14.226 6.403 ( 0.533 3.081 3.672) 4.823 6.479 ( 1.309 -2.169 -6.278) 6.769 6.555 ( 1.479 3.526 2.925) 4.814 6.652 ( 0.265 8.431 3.229) 9.032 6.751 ( -1.898 0.731 -1.348) 2.440 6.823 ( 2.317 3.853 -0.888) 4.583 6.917 ( 6.079 6.472 -5.614) 10.505 6.926 ( 8.685 4.863 11.421) 15.149 7.111 ( -3.904 2.360 -0.139) 4.564 7.264 ( -0.341 4.149 -2.684) 4.953 7.322 ( 0.677 5.550 -4.197) 6.991 7.389 ( -8.709 -3.396 -10.053) 13.728 7.484 ( 1.973 4.738 -1.328) 5.301 7.709 ( 0.366 8.850 5.283) 10.313 7.927 ( 1.410 0.863 -4.826) 5.102 8.020 ( 6.115 3.254 5.823) 9.049 8.055 ( 0.689 -2.835 1.194) 3.152 8.213 ( -3.996 -2.904 4.329) 6.568 8.350 ( 0.770 2.088 2.887) 3.645 8.458 ( 0.043 3.405 1.226) 3.619 8.575 ( -3.240 1.467 -4.270) 5.557 8.643 ( -6.342 -6.881 -1.973) 9.563 8.745 ( -1.064 2.073 -0.079) 2.332 8.939 ( -4.108 -2.332 -0.702) 4.775 9.078 ( 3.616 4.147 0.744) 5.552 9.284 ( 7.660 10.316 7.203) 14.730 9.576 ( 6.622 9.313 -5.755) 12.795 10.286 ( 1.454 -3.241 4.045) 5.383 10.458 ( 0.704 -1.392 3.533) 3.862 10.483 ( -1.797 0.597 -0.181) 1.902 10.700 ( -5.373 -4.019 -7.588) 10.129 10.929 ( -0.411 -7.773 6.303) 10.015 11.085 ( -1.495 -4.468 1.101) 4.838 11.199 ( -4.266 -4.466 -2.427) 6.636 11.282 ( 2.349 -4.303 0.111) 4.903 11.730 ( 7.703 -5.455 7.036) 11.772 12.016 ( -3.546 -6.258 -8.627) 11.232 12.292 ( -2.452 0.468 -1.324) 2.826 12.391 ( 3.239 -0.285 -1.713) 3.675 12.707 ( -5.089 0.637 -0.134) 5.130 12.769 ( 12.144 0.103 7.214) 14.125 12.933 ( 7.902 -2.739 12.364) 14.927 13.457 ( -14.950 9.863 -22.769) 28.969 13.846 ( 4.207 3.994 3.762) 6.914 14.075 ( -5.483 4.870 -7.609) 10.568 14.148 ( 1.318 1.735 -0.539) 2.244 14.350 ( 1.233 3.788 -4.358) 5.905 14.780 ( 1.112 5.815 6.972) 9.147 14.950 ( -3.839 0.794 2.339) 4.565 15.013 ( -3.342 2.215 -4.302) 5.880 15.126 ( 1.788 1.247 -1.708) 2.770 15.512 ( 15.554 10.544 15.714) 24.495 15.821 ( -13.491 8.925 -14.573) 21.772 16.606 ( -3.347 -1.423 2.439) 4.379 16.683 ( 0.156 -2.608 1.983) 3.279 19.972 ( 4.872 1.430 3.611) 6.230 20.008 ( -5.069 1.413 -3.211) 6.164 20.232 ( 2.702 -5.945 3.323) 7.327 20.322 ( -2.078 -6.000 -3.373) 7.190 24.429 ( 4.924 3.024 6.910) 9.008 24.659 ( -10.129 8.008 -13.395) 18.605 24.992 ( -2.414 2.297 2.732) 4.309 25.048 ( -4.359 3.015 0.277) 5.307 26.162 ( 3.190 0.953 0.681) 3.398 26.171 ( -1.266 2.159 -1.798) 3.081 26.606 ( 1.272 -2.670 1.068) 3.144 26.728 ( 0.126 -0.268 -3.536) 3.548 27.025 ( 0.233 3.895 5.787) 6.980 27.062 ( 1.961 5.966 3.309) 7.098 27.270 ( -2.975 5.195 1.999) 6.311 27.544 ( -9.371 -0.858 0.324) 9.416 27.684 ( 6.241 3.582 -1.425) 7.336 27.945 ( 4.074 -1.309 -6.291) 7.609 29.093 ( -3.715 -6.725 3.671) 8.514 29.128 ( 1.548 -10.812 5.559) 12.256 29.283 ( 3.808 -9.644 1.237) 10.442 29.428 ( -1.322 -14.678 -7.213) 16.408 29.930 ( -6.642 6.741 -0.515) 9.477 30.261 ( 14.345 -5.479 0.692) 15.371 ======================= Grid point 165 (75/117) ======================= q-point: (-0.20 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.993 ( 0.876 -22.662 5.892) 23.432 2.361 ( -2.796 2.578 -4.681) 6.031 2.783 ( -7.637 -18.168 4.875) 20.302 3.104 ( -2.310 -16.012 10.653) 19.370 3.321 ( -5.094 -1.631 -2.773) 6.025 3.360 ( -5.435 -11.206 -3.902) 13.052 3.473 ( 1.861 -1.834 -14.798) 15.027 3.598 ( -4.217 3.530 -4.160) 6.895 3.815 ( 5.643 -1.621 -6.393) 8.680 3.982 ( -1.587 -0.521 -1.440) 2.206 4.090 ( -1.938 -9.383 -6.134) 11.376 4.139 ( 4.829 -2.761 1.135) 5.677 4.222 ( -3.451 -6.756 1.956) 7.834 4.474 ( 0.601 -3.656 2.907) 4.710 4.551 ( -1.730 -0.119 5.904) 6.153 4.728 ( 11.731 -3.803 9.239) 15.409 4.797 ( 1.052 13.987 -0.778) 14.048 5.020 ( -0.629 -0.511 -4.195) 4.273 5.078 ( 4.754 4.489 11.251) 13.013 5.220 ( 1.894 5.407 -3.476) 6.701 5.349 ( -1.729 -1.280 7.107) 7.426 5.466 ( -5.870 5.532 2.280) 8.382 5.515 ( -5.505 4.274 2.466) 7.393 5.593 ( -4.236 10.570 -1.436) 11.478 5.679 ( 0.790 -2.307 2.298) 3.351 5.742 ( -0.314 3.913 -7.562) 8.520 5.932 ( -2.009 -0.648 -2.452) 3.236 6.124 ( 7.198 -0.065 2.580) 7.647 6.213 ( -4.587 9.747 -3.627) 11.367 6.293 ( 1.593 5.763 2.731) 6.574 6.397 ( -6.794 4.787 -0.564) 8.330 6.507 ( 3.533 2.142 -4.422) 6.052 6.639 ( 6.533 -1.465 0.722) 6.735 6.721 ( -3.435 1.832 -2.570) 4.665 6.772 ( -3.154 0.104 -4.178) 5.236 6.843 ( 3.964 4.085 -0.574) 5.721 6.893 ( 8.764 3.885 6.241) 11.439 7.054 ( -2.817 6.902 -8.908) 11.616 7.130 ( -2.750 -2.349 5.037) 6.201 7.311 ( -1.128 6.985 0.514) 7.094 7.391 ( 1.736 -4.672 3.400) 6.033 7.470 ( -1.287 -4.237 -7.031) 8.309 7.560 ( 1.415 7.167 2.906) 7.862 7.932 ( -1.955 0.294 -4.448) 4.867 7.976 ( 6.055 4.704 5.543) 9.462 8.047 ( -3.948 8.524 1.923) 9.588 8.142 ( -1.610 -0.998 0.874) 2.086 8.291 ( 1.919 4.979 4.744) 7.140 8.514 ( 7.241 -4.579 6.916) 11.010 8.542 ( -4.545 -0.538 -3.185) 5.575 8.662 ( -3.410 2.543 -0.078) 4.255 8.714 ( -3.804 0.042 -1.859) 4.234 8.894 ( 1.973 5.500 4.160) 7.173 8.913 ( -3.627 2.541 -3.295) 5.520 9.259 ( 1.110 1.990 -2.047) 3.063 9.534 ( 16.146 3.787 -4.876) 17.286 10.334 ( -0.033 -1.461 2.058) 2.524 10.406 ( -4.198 0.955 -3.156) 5.338 10.538 ( 1.638 -1.465 5.172) 5.619 10.689 ( -4.844 0.779 -7.197) 8.710 11.059 ( 0.674 -4.835 7.545) 8.987 11.158 ( -4.670 -4.231 -0.454) 6.318 11.254 ( -4.116 -3.601 -2.851) 6.167 11.386 ( 5.118 -3.834 1.940) 6.683 11.874 ( 4.095 -4.798 4.548) 7.776 12.098 ( -2.785 -4.205 -7.157) 8.755 12.280 ( -2.205 -1.002 -1.592) 2.898 12.409 ( 1.868 0.003 -2.305) 2.967 12.660 ( -6.601 0.214 -1.492) 6.771 12.813 ( 5.556 0.966 2.768) 6.282 13.029 ( 10.866 0.542 13.174) 17.085 13.164 ( -9.511 9.655 -7.418) 15.450 13.871 ( 5.686 -2.296 1.441) 6.300 13.958 ( -2.447 3.279 -7.154) 8.241 14.133 ( 0.860 0.556 0.114) 1.030 14.278 ( 1.897 4.317 -2.721) 5.444 14.722 ( 2.607 1.156 7.383) 7.914 14.857 ( -11.308 2.956 -7.512) 13.894 14.994 ( 2.356 0.489 4.051) 4.712 15.127 ( 2.287 0.284 -1.785) 2.915 15.425 ( 14.882 8.831 14.831) 22.791 15.565 ( -13.173 7.650 -15.087) 21.440 16.575 ( -6.623 0.741 0.326) 6.672 16.723 ( 1.521 -0.504 1.560) 2.236 19.945 ( -5.591 1.258 -3.886) 6.925 19.986 ( 6.410 0.876 4.224) 7.726 20.372 ( 3.472 -5.668 3.526) 7.524 20.406 ( -2.943 -4.336 -3.852) 6.504 24.389 ( 2.465 3.494 4.802) 6.430 24.452 ( -8.338 5.955 -6.987) 12.402 24.935 ( -2.266 1.864 1.440) 3.269 24.986 ( -2.676 1.341 -0.957) 3.143 26.138 ( 0.281 0.929 -0.900) 1.324 26.167 ( 3.397 0.791 0.439) 3.515 26.676 ( 2.106 -3.238 1.443) 4.123 26.742 ( 0.169 -1.206 -2.090) 2.419 26.971 ( 0.329 2.024 4.314) 4.776 26.992 ( 1.765 2.777 3.406) 4.736 27.142 ( -3.643 5.335 0.451) 6.476 27.478 ( -6.157 2.659 -2.476) 7.149 27.671 ( 2.289 0.637 1.264) 2.692 27.976 ( 2.707 -0.271 -6.410) 6.963 29.145 ( -2.879 -1.626 4.787) 5.818 29.349 ( 1.345 -9.315 3.882) 10.180 29.431 ( -1.293 -5.656 -0.103) 5.802 29.626 ( 4.238 1.018 -8.369) 9.436 29.880 ( -7.935 -11.219 3.510) 14.183 30.447 ( 13.417 -3.833 -1.373) 14.021 ======================= Grid point 166 (76/117) ======================= q-point: (-0.10 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.275 ( -5.458 1.718 -8.005) 9.840 2.416 ( 3.490 -16.185 1.142) 16.596 3.100 ( 0.556 -13.738 2.721) 14.016 3.164 ( -6.689 5.335 6.542) 10.770 3.321 ( -1.164 -3.555 -1.997) 4.240 3.476 ( -7.286 -5.424 0.681) 9.109 3.536 ( 0.579 -2.383 -6.155) 6.625 3.662 ( -3.789 -9.042 -4.707) 10.875 3.844 ( 2.960 -2.982 -4.243) 5.971 3.998 ( -3.908 -6.313 -5.473) 9.224 4.221 ( 3.529 0.161 3.779) 5.173 4.246 ( 2.571 -3.130 1.496) 4.318 4.329 ( 2.062 -3.506 0.197) 4.072 4.394 ( -7.677 12.837 -6.355) 16.251 4.500 ( 1.684 2.009 7.487) 7.932 4.634 ( 7.500 -0.152 0.032) 7.502 4.735 ( 7.829 8.494 9.299) 14.830 4.903 ( -2.811 1.118 2.539) 3.949 5.125 ( 7.496 11.189 3.808) 13.996 5.228 ( -1.239 3.692 -4.630) 6.050 5.250 ( -2.751 -1.127 6.470) 7.121 5.376 ( 3.367 4.434 -3.299) 6.472 5.486 ( -6.122 -5.025 -1.888) 8.142 5.576 ( 1.007 -7.957 11.037) 13.644 5.630 ( 1.365 3.166 -7.154) 7.941 5.752 ( -2.533 -0.021 1.343) 2.867 5.900 ( -8.353 -0.088 0.473) 8.367 5.983 ( -2.019 4.995 -0.163) 5.390 6.099 ( -1.425 2.357 -6.240) 6.821 6.266 ( 11.117 3.071 -2.835) 11.876 6.342 ( -5.557 -1.820 -3.823) 6.987 6.469 ( -5.333 2.321 -5.397) 7.934 6.605 ( 2.987 2.013 2.251) 4.248 6.710 ( 4.544 0.182 3.539) 5.762 6.772 ( -0.179 0.836 1.924) 2.106 6.821 ( 1.819 -0.629 0.031) 1.925 6.906 ( 3.344 -0.062 -2.858) 4.399 6.957 ( -0.639 1.248 -3.012) 3.323 7.132 ( 1.833 8.792 4.404) 10.002 7.209 ( -2.876 -4.702 3.514) 6.536 7.381 ( -4.793 7.623 -6.851) 11.315 7.415 ( -2.282 5.746 4.198) 7.473 7.617 ( 4.627 -6.512 3.137) 8.582 7.809 ( -8.046 1.805 -3.184) 8.839 7.913 ( -1.065 1.105 3.852) 4.147 7.984 ( 8.543 2.934 0.440) 9.044 8.127 ( 1.494 5.852 5.696) 8.302 8.262 ( -0.879 -3.239 -0.656) 3.420 8.510 ( -1.513 2.200 1.024) 2.859 8.595 ( -0.807 1.542 0.440) 1.795 8.642 ( 1.685 -2.549 4.327) 5.297 8.683 ( 3.138 0.303 3.234) 4.517 8.826 ( -3.536 2.297 -2.424) 4.864 8.879 ( -2.966 -1.228 -3.046) 4.426 9.266 ( -3.132 -3.680 -4.246) 6.432 9.509 ( 15.060 8.898 -5.135) 18.230 10.352 ( -0.120 -0.427 0.645) 0.783 10.386 ( -1.637 -0.710 -1.854) 2.574 10.547 ( -1.496 0.394 1.231) 1.977 10.651 ( -0.937 0.217 -1.485) 1.769 11.112 ( -3.201 -0.562 2.829) 4.309 11.196 ( -2.109 -2.652 0.131) 3.391 11.280 ( -3.121 -1.439 -1.945) 3.949 11.488 ( 7.649 -2.288 3.385) 8.672 11.941 ( -4.720 -1.575 -2.434) 5.539 12.156 ( 1.981 -2.966 -2.439) 4.321 12.306 ( -0.461 -2.268 0.667) 2.408 12.416 ( -0.712 -0.687 -4.148) 4.264 12.621 ( -5.498 -0.078 -1.437) 5.684 12.803 ( 2.632 2.764 2.865) 4.772 12.954 ( -5.686 4.302 -1.467) 7.280 13.083 ( 10.841 3.332 9.652) 14.893 13.905 ( -2.734 -1.560 -5.213) 6.089 14.005 ( 9.710 -3.945 5.503) 11.838 14.135 ( -0.105 -0.532 -0.258) 0.600 14.211 ( 1.355 3.175 -1.520) 3.772 14.693 ( -14.063 4.105 -9.967) 17.719 14.765 ( 2.386 -1.429 3.504) 4.474 14.999 ( 1.989 0.825 4.097) 4.628 15.140 ( 2.590 0.006 -1.140) 2.830 15.343 ( 8.801 8.291 9.825) 15.580 15.391 ( -6.802 1.650 -9.581) 11.865 16.527 ( -4.734 -0.045 1.030) 4.845 16.721 ( 0.758 1.334 -0.136) 1.541 19.891 ( -5.389 0.604 -3.878) 6.666 20.019 ( 7.159 0.363 4.749) 8.599 20.435 ( -4.000 -1.743 -3.597) 5.654 20.496 ( 3.246 -3.652 2.533) 5.504 24.313 ( -4.655 2.626 -2.562) 5.927 24.356 ( 1.181 2.266 2.066) 3.286 24.896 ( -0.898 1.162 1.142) 1.860 24.959 ( -1.623 0.048 -1.826) 2.443 26.131 ( 0.277 0.100 -0.538) 0.613 26.171 ( 2.453 0.687 0.262) 2.561 26.743 ( 1.204 -1.384 0.772) 1.990 26.778 ( 1.010 -2.876 1.294) 3.311 26.942 ( 0.639 1.926 2.115) 2.931 26.965 ( -0.592 1.200 3.838) 4.064 27.045 ( -1.039 1.974 -1.227) 2.546 27.378 ( -4.051 3.693 -4.015) 6.795 27.676 ( 0.727 0.012 2.697) 2.794 27.991 ( 1.476 -0.299 -6.418) 6.593 29.148 ( -1.413 -0.186 5.282) 5.471 29.439 ( -4.710 -0.841 -1.788) 5.108 29.536 ( 1.132 -3.891 -2.077) 4.553 29.585 ( 4.543 1.107 1.684) 4.970 30.115 ( -4.724 -12.765 -0.697) 13.629 30.549 ( 8.708 0.680 -0.122) 8.736 ======================= Grid point 173 (77/117) ======================= q-point: (-0.40 -0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.696 ( 12.021 0.000 14.354) 18.723 2.047 ( -33.838 -0.000 9.940) 35.268 2.187 ( 17.391 0.000 3.639) 17.767 2.220 ( -39.069 -0.000 -3.689) 39.243 2.995 ( -8.840 -0.000 6.436) 10.935 3.080 ( 5.596 0.000 -13.396) 14.518 3.158 ( 23.538 0.000 9.113) 25.240 3.331 ( 10.634 0.000 -10.420) 14.888 3.510 ( -2.904 -0.000 -22.021) 22.212 3.596 ( -2.305 -0.000 -19.511) 19.647 3.791 ( -1.076 -0.000 6.778) 6.863 3.992 ( 1.425 0.000 6.700) 6.850 4.429 ( 2.752 0.000 0.816) 2.871 4.447 ( -6.305 -0.000 10.609) 12.341 4.697 ( -7.383 -0.000 14.555) 16.320 4.849 ( -12.967 -0.000 -11.690) 17.459 4.991 ( -6.026 -0.000 6.735) 9.037 5.037 ( -11.575 -0.000 -4.026) 12.255 5.136 ( 18.801 0.000 13.673) 23.247 5.202 ( 9.816 0.000 0.371) 9.823 5.442 ( 11.035 0.000 10.635) 15.326 5.653 ( -2.341 -0.000 -8.894) 9.197 5.719 ( 13.915 0.000 1.034) 13.953 5.902 ( 3.845 0.000 6.400) 7.466 5.941 ( -0.209 -0.000 7.193) 7.196 6.020 ( -4.306 -0.000 -2.025) 4.758 6.123 ( -9.496 -0.000 -18.677) 20.952 6.153 ( 1.270 0.000 8.390) 8.486 6.289 ( 1.616 0.000 -11.332) 11.447 6.291 ( -10.428 -0.000 -14.577) 17.923 6.511 ( 4.226 0.000 -4.169) 5.936 6.554 ( -8.658 -0.000 -1.033) 8.719 6.768 ( 7.321 0.000 7.902) 10.772 6.834 ( -4.605 -0.000 -2.209) 5.107 6.998 ( -7.397 -0.000 4.188) 8.500 7.021 ( -1.287 -0.000 -3.713) 3.930 7.031 ( 11.785 0.000 3.610) 12.325 7.206 ( 0.606 0.000 4.460) 4.501 7.247 ( -1.671 -0.000 -6.965) 7.163 7.552 ( 4.814 0.000 -3.471) 5.934 7.562 ( 4.581 0.000 5.256) 6.972 7.703 ( -0.043 -0.000 1.824) 1.825 7.770 ( 2.246 0.000 -2.031) 3.028 7.961 ( -5.644 -0.000 -2.760) 6.283 7.965 ( 7.916 0.000 2.906) 8.432 8.069 ( -3.844 -0.000 -14.250) 14.759 8.228 ( 13.948 0.000 18.972) 23.547 8.275 ( -14.377 -0.000 -8.938) 16.929 8.465 ( 3.044 0.000 6.590) 7.259 8.534 ( 0.958 0.000 6.082) 6.157 8.627 ( -3.952 -0.000 -4.403) 5.916 8.729 ( 2.191 0.000 -0.677) 2.293 8.870 ( -0.335 -0.000 5.358) 5.368 8.940 ( -0.309 -0.000 2.393) 2.413 9.808 ( 5.410 0.000 4.851) 7.266 9.901 ( -2.052 -0.000 -4.976) 5.382 10.140 ( 2.448 0.000 5.353) 5.886 10.295 ( -9.240 -0.000 -0.773) 9.272 10.493 ( 3.104 0.000 5.802) 6.580 10.583 ( 2.991 0.000 3.852) 4.877 10.747 ( -7.537 -0.000 -5.828) 9.527 10.945 ( -1.242 -0.000 -2.642) 2.920 11.069 ( -6.054 -0.000 -3.007) 6.759 11.200 ( 4.608 0.000 2.683) 5.332 11.609 ( 9.616 0.000 6.972) 11.878 11.846 ( -4.163 -0.000 -9.905) 10.744 12.322 ( -0.052 -0.000 0.166) 0.174 12.376 ( 0.483 0.000 -1.304) 1.390 12.725 ( -6.003 -0.000 -1.021) 6.089 12.767 ( 12.016 0.000 7.035) 13.924 12.862 ( 14.099 0.000 16.718) 21.869 13.600 ( -11.422 -0.000 -34.262) 36.116 14.107 ( -11.952 -0.000 -10.904) 16.178 14.147 ( -0.697 -0.000 3.030) 3.109 14.196 ( 5.822 0.000 0.933) 5.896 14.429 ( 0.921 0.000 -5.139) 5.221 14.890 ( 2.751 0.000 3.554) 4.495 15.035 ( -3.633 -0.000 -6.090) 7.091 15.086 ( 1.800 0.000 5.566) 5.850 15.177 ( -6.425 -0.000 -3.509) 7.321 15.815 ( 10.699 0.000 13.763) 17.433 16.077 ( -10.632 -0.000 -9.239) 14.086 16.523 ( 1.629 0.000 5.530) 5.765 16.563 ( -4.797 -0.000 0.522) 4.825 20.001 ( 1.968 0.000 3.329) 3.867 20.039 ( -2.684 -0.000 -0.142) 2.687 20.109 ( -1.517 -0.000 -1.139) 1.897 20.144 ( -0.406 -0.000 -1.252) 1.316 24.497 ( 6.284 0.000 8.300) 10.410 24.841 ( -6.600 -0.000 -19.812) 20.882 25.048 ( -2.099 -0.000 5.898) 6.261 25.154 ( -10.361 -0.000 -2.439) 10.645 26.186 ( 2.934 0.000 1.503) 3.296 26.242 ( -4.432 -0.000 -4.493) 6.311 26.547 ( 0.913 0.000 0.682) 1.140 26.730 ( 0.612 0.000 -4.690) 4.730 27.200 ( 0.917 0.000 5.297) 5.376 27.319 ( -0.949 -0.000 -1.025) 1.397 27.381 ( -2.070 -0.000 6.585) 6.903 27.470 ( -11.580 -0.000 -1.292) 11.652 27.840 ( 12.027 0.000 0.703) 12.048 27.844 ( 8.395 0.000 -2.837) 8.861 28.785 ( 0.819 0.000 2.883) 2.997 28.898 ( -1.329 -0.000 3.853) 4.076 28.900 ( 1.659 0.000 -2.839) 3.288 29.127 ( 1.856 0.000 -2.299) 2.955 30.132 ( 11.048 0.000 10.185) 15.027 30.132 ( -7.256 -0.000 -4.874) 8.741 ======================= Grid point 174 (78/117) ======================= q-point: (-0.30 -0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.489 ( -14.010 5.217 12.210) 19.302 2.097 ( -35.061 -12.950 3.457) 37.536 2.301 ( -3.199 -24.344 8.394) 25.949 2.332 ( 15.754 -2.644 -0.511) 15.983 3.076 ( -7.925 -7.175 -4.153) 11.468 3.120 ( -5.262 -9.762 2.457) 11.359 3.293 ( -2.086 -2.295 -10.296) 10.753 3.458 ( -2.665 -9.831 -14.034) 17.340 3.590 ( 16.609 -0.049 -3.606) 16.996 3.636 ( 11.686 -3.550 -14.915) 19.278 3.841 ( 5.694 -7.838 11.313) 14.894 4.051 ( 6.024 -3.029 3.760) 7.720 4.237 ( -0.343 9.534 6.255) 11.408 4.499 ( -11.502 3.000 0.801) 11.914 4.625 ( -2.050 0.775 5.319) 5.753 4.732 ( -7.345 4.848 4.442) 9.858 4.886 ( -6.762 4.118 0.263) 7.921 5.039 ( -2.784 -6.391 1.933) 7.234 5.208 ( 3.440 4.143 -0.506) 5.409 5.301 ( 8.703 -5.755 5.829) 11.952 5.477 ( 4.835 1.542 6.452) 8.208 5.662 ( 1.363 6.315 -12.813) 14.350 5.689 ( -4.374 3.317 -2.467) 6.018 5.849 ( 2.025 6.059 8.546) 10.670 5.912 ( 2.019 2.747 4.082) 5.318 5.967 ( -2.912 -0.460 2.952) 4.172 6.084 ( -3.870 7.930 0.880) 8.868 6.121 ( -6.913 -1.286 -11.910) 13.830 6.167 ( -2.072 2.211 -5.326) 6.128 6.347 ( 0.962 -3.329 -14.090) 14.510 6.478 ( -0.485 0.957 4.143) 4.280 6.562 ( -5.801 -0.254 -1.994) 6.140 6.740 ( 1.861 3.565 4.097) 5.741 6.806 ( -2.143 1.853 -4.725) 5.509 6.933 ( -1.533 3.577 5.522) 6.755 7.025 ( 4.635 1.265 0.273) 4.813 7.080 ( 12.540 2.066 1.717) 12.825 7.185 ( 0.791 1.767 3.350) 3.869 7.250 ( 1.408 0.304 -3.713) 3.983 7.415 ( -1.810 9.978 -1.815) 10.302 7.491 ( 2.198 8.754 -2.733) 9.430 7.632 ( 5.566 6.759 0.594) 8.776 7.834 ( -1.909 0.372 0.106) 1.947 7.927 ( -2.967 0.981 -1.764) 3.588 7.996 ( 0.265 -1.080 -1.323) 1.728 8.121 ( 2.816 -4.748 -2.403) 6.021 8.173 ( 9.021 6.674 13.689) 17.701 8.270 ( -11.309 -6.167 -10.530) 16.637 8.474 ( 0.134 1.705 2.991) 3.445 8.515 ( -1.199 -0.716 1.406) 1.982 8.674 ( -0.644 -1.086 -0.647) 1.419 8.767 ( 2.771 3.773 5.883) 7.518 8.889 ( -1.190 -0.705 2.255) 2.646 9.023 ( 10.836 -11.119 4.744) 16.234 9.615 ( -0.367 17.172 1.951) 17.287 9.796 ( 3.276 8.885 -3.060) 9.952 10.218 ( 1.120 -4.684 5.545) 7.344 10.361 ( -5.243 -8.043 -0.750) 9.630 10.498 ( -1.058 1.052 -1.217) 1.925 10.606 ( -2.342 0.432 -0.986) 2.578 10.754 ( -1.815 -8.531 4.648) 9.883 11.000 ( -2.498 -4.073 -0.988) 4.879 11.076 ( -5.211 -4.202 -3.511) 7.560 11.245 ( 4.746 -1.924 2.849) 5.861 11.698 ( 8.437 -2.800 5.844) 10.639 11.873 ( -3.271 -5.220 -9.053) 10.950 12.304 ( -0.763 1.497 -0.636) 1.797 12.392 ( 1.568 -1.042 -1.415) 2.355 12.675 ( -8.203 0.417 -2.998) 8.744 12.787 ( -2.385 -1.161 0.237) 2.663 13.031 ( 29.177 -0.071 23.596) 37.524 13.477 ( -15.803 3.373 -36.727) 40.125 13.970 ( -2.070 6.114 0.565) 6.480 14.127 ( -1.108 2.269 0.809) 2.651 14.210 ( 4.559 2.494 -0.960) 5.285 14.414 ( 1.335 2.067 -4.176) 4.846 14.882 ( -0.322 3.080 4.031) 5.083 14.975 ( -7.731 4.770 -1.862) 9.273 15.018 ( -0.746 1.359 0.188) 1.562 15.155 ( -0.632 0.457 -1.737) 1.904 15.798 ( 12.481 8.166 13.959) 20.428 15.909 ( -12.317 8.360 -11.330) 18.708 16.543 ( -4.750 -1.965 2.332) 5.645 16.608 ( -0.256 -4.845 2.576) 5.493 20.005 ( -4.207 1.112 -1.759) 4.694 20.019 ( 3.405 0.170 3.230) 4.696 20.139 ( 0.292 -4.083 1.421) 4.333 20.197 ( -1.185 -5.051 -2.589) 5.798 24.516 ( 5.299 2.112 8.447) 10.193 24.722 ( -11.886 5.687 -20.689) 24.529 25.012 ( -4.277 1.783 5.141) 6.921 25.067 ( -7.227 2.256 -0.032) 7.571 26.199 ( 0.027 1.249 -0.622) 1.396 26.203 ( 2.100 1.024 -0.421) 2.374 26.572 ( 1.844 -1.654 0.530) 2.533 26.729 ( 0.400 0.263 -3.733) 3.764 27.127 ( -0.104 5.980 4.419) 7.437 27.214 ( 0.462 7.750 1.841) 7.979 27.339 ( -2.362 3.342 3.491) 5.379 27.436 ( -10.847 -2.889 0.359) 11.231 27.815 ( 5.014 5.332 2.417) 7.708 27.953 ( 9.766 -1.508 -6.784) 11.986 28.909 ( 0.041 -9.085 2.364) 9.387 28.942 ( -0.530 -7.457 4.296) 8.622 29.076 ( 3.437 -13.569 0.778) 14.019 29.214 ( 1.992 -6.412 -3.731) 7.681 30.024 ( -6.694 5.726 -4.972) 10.115 30.252 ( 13.567 -4.344 6.337) 15.592 ======================= Grid point 175 (79/117) ======================= q-point: (-0.20 -0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.574 ( -4.845 -18.248 9.354) 21.070 2.284 ( -21.504 -23.044 5.935) 32.073 2.414 ( 4.595 1.614 -3.400) 5.939 2.755 ( 5.186 -18.939 10.554) 22.293 3.133 ( -6.934 -5.758 -7.609) 11.795 3.275 ( -1.023 -2.222 -12.696) 12.930 3.429 ( -7.223 -18.577 3.797) 20.291 3.570 ( -2.840 -0.544 -4.216) 5.112 3.672 ( -8.528 -8.322 -14.257) 18.581 3.814 ( 12.448 -7.443 1.759) 14.610 3.992 ( 0.587 0.079 -4.640) 4.678 4.120 ( 3.861 1.456 10.894) 11.649 4.197 ( 0.982 0.217 -1.692) 1.968 4.378 ( 3.461 -3.954 1.394) 5.437 4.578 ( 2.172 2.760 8.820) 9.493 4.666 ( -2.252 -1.430 3.910) 4.733 4.849 ( -1.710 -4.624 4.659) 6.783 5.112 ( 0.906 7.212 0.269) 7.274 5.179 ( 2.326 -5.333 2.330) 6.267 5.377 ( -10.941 9.553 -9.798) 17.520 5.406 ( 4.296 5.009 2.541) 7.071 5.456 ( 4.523 3.089 2.692) 6.103 5.621 ( -8.590 3.339 -2.212) 9.477 5.695 ( 1.850 9.095 1.153) 9.353 5.831 ( -3.539 9.898 7.105) 12.688 5.853 ( 2.233 5.889 0.497) 6.318 5.934 ( -2.721 3.397 -4.612) 6.341 6.132 ( 0.876 -5.041 -0.446) 5.136 6.195 ( -0.778 -0.594 -6.094) 6.172 6.395 ( -4.112 5.354 3.261) 7.497 6.429 ( -3.950 -5.208 -10.258) 12.164 6.535 ( -3.518 -0.200 -3.302) 4.829 6.667 ( 1.834 7.200 1.437) 7.568 6.725 ( -3.500 2.768 -6.909) 8.225 6.848 ( 2.783 5.611 6.302) 8.885 6.993 ( 6.397 5.855 -1.486) 8.798 7.083 ( 1.635 0.851 1.017) 2.105 7.112 ( 12.546 8.607 10.211) 18.323 7.220 ( -6.300 9.080 -2.709) 11.379 7.293 ( -2.548 -1.495 -3.404) 4.507 7.384 ( 6.398 -1.534 -2.040) 6.888 7.513 ( 2.892 8.288 -1.767) 8.954 7.713 ( -0.596 7.770 4.371) 8.935 7.926 ( -0.656 -0.046 -4.473) 4.521 8.005 ( -3.671 -3.444 -2.692) 5.708 8.148 ( 6.925 3.557 11.475) 13.867 8.183 ( 1.122 3.257 2.558) 4.291 8.309 ( -7.940 -3.140 -5.012) 9.900 8.464 ( 2.498 -1.984 1.559) 3.551 8.554 ( 0.411 -1.125 1.678) 2.062 8.627 ( 1.611 1.968 3.950) 4.698 8.729 ( -1.308 1.884 0.025) 2.294 8.885 ( -3.951 -1.540 -1.255) 4.423 9.120 ( 2.348 11.556 2.247) 12.004 9.406 ( 9.705 7.517 5.098) 13.292 9.665 ( 10.301 2.952 -7.367) 13.004 10.294 ( -0.314 -2.813 3.798) 4.737 10.395 ( -7.248 1.432 -6.338) 9.734 10.494 ( -0.540 -3.591 3.758) 5.225 10.632 ( -4.431 -3.105 -4.968) 7.345 10.942 ( 1.603 -8.347 7.868) 11.582 11.046 ( -4.401 -3.598 -0.539) 5.710 11.139 ( -4.422 -4.735 -2.426) 6.918 11.341 ( 5.703 -4.241 3.058) 7.737 11.810 ( 3.816 -4.078 2.052) 5.951 11.980 ( -0.184 -6.403 -5.638) 8.533 12.270 ( -0.964 0.933 -1.029) 1.691 12.419 ( 1.813 -0.331 -1.377) 2.301 12.613 ( -9.321 0.107 -3.812) 10.071 12.805 ( -2.441 -2.147 -0.835) 3.356 13.185 ( 21.570 3.703 18.077) 28.386 13.258 ( -10.904 6.498 -16.226) 20.601 13.895 ( 3.041 2.094 -0.006) 3.692 14.052 ( 2.686 5.012 -0.674) 5.726 14.175 ( 2.877 2.769 -0.079) 3.994 14.366 ( 1.484 3.488 -3.130) 4.916 14.775 ( -2.413 4.152 5.190) 7.071 14.849 ( -10.148 3.256 -6.023) 12.242 15.013 ( 1.264 0.064 3.441) 3.666 15.149 ( 2.084 0.552 -1.585) 2.675 15.638 ( -13.507 9.169 -14.579) 21.888 15.709 ( 13.656 9.828 13.938) 21.848 16.528 ( -8.532 -0.632 0.269) 8.560 16.695 ( 0.595 -3.231 2.194) 3.951 19.945 ( -4.601 1.865 -2.740) 5.671 20.041 ( 5.664 0.567 3.601) 6.735 20.265 ( 2.359 -7.082 3.162) 8.107 20.292 ( -2.440 -5.374 -4.397) 7.359 24.475 ( -2.653 4.767 0.851) 5.522 24.514 ( -7.162 5.641 -6.257) 11.057 24.945 ( -5.133 1.704 1.886) 5.728 24.997 ( -4.048 1.540 0.541) 4.365 26.165 ( 0.408 1.385 -0.622) 1.573 26.211 ( 4.450 1.131 0.643) 4.636 26.631 ( 2.628 -2.793 0.654) 3.891 26.728 ( 0.314 -0.261 -2.644) 2.676 27.029 ( 0.249 3.700 4.308) 5.685 27.090 ( 1.828 5.576 2.724) 6.469 27.223 ( -4.969 5.600 1.487) 7.633 27.432 ( -8.475 -1.921 1.137) 8.764 27.737 ( 1.989 4.101 1.568) 4.820 28.001 ( 5.933 0.738 -8.196) 10.145 29.040 ( -3.948 -6.660 1.494) 7.885 29.160 ( 1.987 -11.037 5.303) 12.405 29.328 ( 2.046 -4.728 -0.121) 5.153 29.432 ( 3.200 -18.091 0.876) 18.393 29.850 ( -5.613 7.294 -4.197) 10.115 30.449 ( 15.697 -5.160 -1.262) 16.572 ======================= Grid point 176 (80/117) ======================= q-point: (-0.10 -0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.016 ( 2.138 -24.097 3.868) 24.499 2.335 ( 0.259 5.268 -4.657) 7.036 2.690 ( -7.642 -25.246 7.739) 27.489 3.063 ( -9.035 -12.695 6.563) 16.907 3.236 ( -2.992 -8.257 3.486) 9.449 3.309 ( -3.725 0.830 -6.791) 7.790 3.494 ( 0.647 -0.482 -5.127) 5.190 3.575 ( 0.823 0.873 -8.416) 8.501 3.830 ( -2.057 -3.916 -12.907) 13.644 3.905 ( -6.136 -2.374 -0.788) 6.626 4.117 ( -2.692 -12.101 1.232) 12.458 4.167 ( 3.076 -7.272 9.694) 12.503 4.200 ( 3.998 -2.081 -3.842) 5.922 4.500 ( 1.948 -3.432 0.453) 3.972 4.580 ( 4.803 2.734 7.222) 9.094 4.744 ( -0.974 -1.097 -0.976) 1.762 4.851 ( 0.039 7.502 -1.011) 7.570 5.087 ( -1.696 -6.152 4.394) 7.748 5.096 ( 10.132 10.826 3.104) 15.149 5.230 ( -1.003 5.049 -4.125) 6.596 5.289 ( -10.135 -0.411 13.531) 16.911 5.436 ( 7.185 -1.526 -0.437) 7.358 5.501 ( -1.303 8.675 -5.205) 10.200 5.569 ( -0.362 12.478 3.757) 13.037 5.631 ( -8.342 -4.746 3.376) 10.174 5.776 ( 7.112 4.962 -1.104) 8.742 5.922 ( 0.444 2.239 -2.399) 3.312 6.120 ( -3.220 6.964 -7.813) 10.950 6.192 ( -7.273 -1.883 -1.519) 7.665 6.326 ( -0.191 7.606 -1.919) 7.846 6.346 ( 6.778 1.829 1.306) 7.141 6.497 ( -3.238 2.410 -8.305) 9.234 6.637 ( -4.230 -3.971 -3.958) 7.023 6.697 ( -4.550 -2.510 -5.226) 7.370 6.748 ( 3.715 6.441 4.619) 8.753 6.907 ( 5.833 5.359 -1.006) 7.985 6.969 ( -2.811 6.637 6.340) 9.599 7.034 ( 3.402 5.872 -4.325) 8.047 7.137 ( 2.389 -1.523 5.837) 6.488 7.299 ( -1.342 1.765 -1.199) 2.521 7.370 ( -0.144 4.839 0.877) 4.920 7.530 ( 6.079 -6.366 0.397) 8.811 7.586 ( 2.763 5.966 1.835) 6.826 7.851 ( -8.557 6.239 -4.451) 11.487 7.963 ( -3.050 7.821 5.526) 10.050 8.129 ( -0.605 -4.859 2.187) 5.363 8.140 ( 11.499 4.965 2.844) 12.844 8.269 ( -5.989 2.644 2.971) 7.189 8.501 ( 0.193 -0.994 -1.362) 1.697 8.600 ( 1.610 -2.141 5.068) 5.732 8.650 ( 3.802 1.584 5.537) 6.901 8.674 ( -3.213 -0.748 -0.466) 3.332 8.877 ( -1.693 1.430 -3.593) 4.221 8.918 ( 1.444 7.758 0.693) 7.921 9.254 ( -1.149 5.688 -3.793) 6.933 9.745 ( 17.700 3.745 -5.667) 18.959 10.332 ( -0.867 -1.197 1.971) 2.463 10.350 ( -3.429 -1.177 -2.651) 4.491 10.526 ( -3.901 -1.047 -1.965) 4.492 10.643 ( -1.985 -0.663 -0.930) 2.290 11.060 ( -2.557 -3.156 4.693) 6.206 11.103 ( -2.636 -4.738 0.856) 5.489 11.199 ( -4.212 -4.171 -2.266) 6.346 11.471 ( 7.471 -4.520 4.009) 9.608 11.877 ( -3.179 -2.082 -3.808) 5.380 12.101 ( 3.809 -4.826 -1.757) 6.394 12.270 ( 0.651 -1.175 0.516) 1.440 12.418 ( 0.065 0.898 -1.895) 2.098 12.567 ( -7.475 -1.126 -2.326) 7.909 12.827 ( -1.256 -0.869 -1.280) 1.993 13.016 ( -9.573 6.468 -3.484) 12.067 13.253 ( 14.992 5.888 13.708) 21.150 13.889 ( 2.866 0.277 -2.746) 3.979 14.034 ( 10.337 0.397 4.297) 11.202 14.146 ( 1.020 1.472 -0.208) 1.802 14.297 ( 1.105 4.247 -2.221) 4.918 14.692 ( -11.829 4.217 -8.741) 15.301 14.749 ( -0.611 -0.501 2.916) 3.022 15.021 ( 1.192 0.147 4.698) 4.849 15.156 ( 2.824 0.139 -1.581) 3.240 15.403 ( -10.838 5.856 -13.455) 18.243 15.601 ( 11.398 10.172 11.852) 19.335 16.481 ( -8.207 -0.520 -0.020) 8.223 16.733 ( -0.178 -0.520 0.700) 0.890 19.883 ( -3.918 1.547 -2.591) 4.945 20.070 ( 6.331 0.402 3.839) 7.414 20.359 ( -3.305 -3.517 -4.341) 6.491 20.418 ( 2.701 -6.237 2.556) 7.262 24.329 ( -8.332 3.196 -5.313) 10.386 24.428 ( 1.012 4.097 4.327) 6.044 24.899 ( -3.222 0.340 0.262) 3.251 24.953 ( -2.643 0.796 -0.297) 2.776 26.147 ( 1.182 1.018 -0.221) 1.575 26.211 ( 3.550 1.436 0.208) 3.835 26.707 ( 2.613 -3.155 1.555) 4.381 26.746 ( 0.879 -1.171 -1.515) 2.107 26.990 ( 2.293 1.509 3.672) 4.585 27.010 ( 0.730 3.842 2.371) 4.573 27.091 ( -4.520 4.230 -0.118) 6.191 27.391 ( -7.279 1.131 -0.825) 7.412 27.694 ( 0.745 1.353 2.450) 2.896 28.008 ( 3.389 0.944 -8.036) 8.772 29.112 ( -2.769 -2.861 3.880) 5.559 29.348 ( -0.638 -6.011 1.208) 6.164 29.428 ( -0.448 -6.531 -0.279) 6.553 29.678 ( 2.825 5.248 -3.831) 7.085 29.811 ( -1.794 -15.823 4.500) 16.548 30.601 ( 11.402 -1.475 -3.743) 12.091 ======================= Grid point 184 (81/117) ======================= q-point: (-0.30 -0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.612 ( -35.754 -0.000 14.690) 38.654 1.664 ( -42.354 -0.000 -18.130) 46.071 1.820 ( -2.931 -0.000 35.393) 35.514 2.413 ( 16.204 0.000 -5.038) 16.969 2.927 ( -0.883 -0.000 9.963) 10.002 3.073 ( -6.480 -0.000 -7.073) 9.592 3.247 ( -12.157 -0.000 -24.339) 27.207 3.356 ( 10.552 0.000 -3.620) 11.156 3.693 ( 23.443 0.000 -6.847) 24.422 3.714 ( 22.460 0.000 0.264) 22.461 3.819 ( 4.002 0.000 9.500) 10.309 4.060 ( 8.022 0.000 4.267) 9.086 4.342 ( -12.912 -0.000 -6.283) 14.359 4.452 ( 0.347 0.000 4.841) 4.854 4.603 ( -8.167 -0.000 7.516) 11.099 4.730 ( -4.550 -0.000 0.207) 4.554 4.913 ( -6.882 -0.000 7.400) 10.106 4.913 ( -5.527 -0.000 -3.452) 6.516 5.283 ( 3.151 0.000 0.586) 3.205 5.294 ( 0.813 0.000 -3.573) 3.664 5.477 ( -6.445 -0.000 -0.387) 6.457 5.635 ( 0.130 0.000 -1.340) 1.346 5.825 ( 0.952 0.000 -3.954) 4.066 5.919 ( -1.278 -0.000 13.029) 13.091 5.920 ( -7.973 -0.000 -9.539) 12.432 5.945 ( 5.738 0.000 2.790) 6.380 6.056 ( 0.030 0.000 -3.014) 3.014 6.141 ( -9.240 -0.000 -15.451) 18.003 6.178 ( -0.239 -0.000 4.275) 4.281 6.325 ( 2.761 0.000 -5.323) 5.996 6.479 ( -3.331 -0.000 4.943) 5.961 6.585 ( 6.467 0.000 -0.280) 6.473 6.760 ( -5.737 -0.000 -9.736) 11.300 6.794 ( -4.971 -0.000 5.204) 7.196 6.982 ( 5.662 0.000 3.397) 6.603 6.984 ( -4.343 -0.000 -1.750) 4.682 7.165 ( -1.454 -0.000 2.538) 2.925 7.204 ( 14.000 0.000 2.393) 14.203 7.329 ( 7.936 0.000 -4.151) 8.956 7.561 ( 1.538 0.000 0.587) 1.646 7.672 ( 9.772 0.000 2.824) 10.172 7.694 ( -2.047 -0.000 2.469) 3.207 7.808 ( 3.620 0.000 0.094) 3.621 7.875 ( -7.072 -0.000 0.391) 7.083 7.996 ( -6.877 -0.000 -17.587) 18.884 8.077 ( 8.662 0.000 3.022) 9.173 8.141 ( -4.539 -0.000 -6.701) 8.094 8.386 ( 8.280 0.000 11.290) 14.000 8.521 ( 4.994 0.000 7.107) 8.686 8.546 ( -0.581 -0.000 5.898) 5.926 8.553 ( -6.645 -0.000 -5.938) 8.911 8.812 ( 4.465 0.000 1.917) 4.859 8.906 ( 13.122 0.000 17.595) 21.949 8.930 ( -1.463 -0.000 1.443) 2.055 9.868 ( -3.170 -0.000 -5.408) 6.269 9.884 ( 6.574 0.000 3.312) 7.361 10.157 ( -0.330 -0.000 5.416) 5.426 10.171 ( -9.885 -0.000 -4.307) 10.782 10.530 ( 2.056 0.000 5.730) 6.088 10.618 ( 2.237 0.000 3.209) 3.911 10.639 ( -9.223 -0.000 -4.465) 10.247 10.907 ( -4.415 -0.000 -3.640) 5.722 11.008 ( -3.724 -0.000 -0.814) 3.812 11.255 ( 3.780 0.000 3.110) 4.895 11.732 ( 9.236 0.000 6.350) 11.208 11.793 ( -2.551 -0.000 -8.920) 9.277 12.326 ( 0.944 0.000 -0.542) 1.088 12.377 ( -0.425 -0.000 -2.207) 2.247 12.621 ( -10.236 -0.000 -6.163) 11.948 12.742 ( -6.345 -0.000 0.175) 6.348 13.245 ( 34.603 0.000 24.177) 42.212 13.383 ( -19.446 -0.000 -43.752) 47.879 14.014 ( -2.694 -0.000 -2.258) 3.515 14.150 ( 0.932 0.000 3.729) 3.843 14.277 ( 6.856 0.000 2.038) 7.153 14.442 ( 1.543 0.000 -3.365) 3.702 14.907 ( -0.860 -0.000 3.690) 3.789 14.954 ( -9.108 -0.000 -7.877) 12.042 15.104 ( -4.314 -0.000 -2.817) 5.152 15.106 ( 1.802 0.000 5.445) 5.735 15.929 ( -12.352 -0.000 -8.116) 14.780 15.959 ( 10.507 0.000 12.701) 16.483 16.503 ( -5.111 -0.000 -0.681) 5.156 16.532 ( -0.767 -0.000 4.928) 4.987 19.993 ( -4.247 -0.000 -1.597) 4.538 20.016 ( 0.087 0.000 2.423) 2.425 20.098 ( -0.397 -0.000 0.522) 0.656 20.143 ( 0.451 0.000 -0.798) 0.917 24.572 ( 4.809 0.000 8.712) 9.951 24.696 ( -14.512 -0.000 -26.127) 29.887 25.003 ( -5.875 -0.000 6.828) 9.008 25.042 ( -7.648 -0.000 -0.755) 7.685 26.203 ( -1.611 -0.000 -1.784) 2.403 26.235 ( 4.538 0.000 1.282) 4.715 26.570 ( 2.916 0.000 0.431) 2.947 26.735 ( 0.599 0.000 -3.351) 3.404 27.212 ( 0.394 0.000 2.929) 2.955 27.282 ( -7.190 -0.000 0.010) 7.190 27.349 ( -5.570 -0.000 -2.236) 6.002 27.359 ( -2.175 -0.000 4.086) 4.629 27.953 ( 9.729 0.000 -0.071) 9.730 27.981 ( 10.460 0.000 1.590) 10.580 28.801 ( 1.476 0.000 4.059) 4.319 28.884 ( -1.386 -0.000 3.334) 3.611 28.928 ( 3.071 0.000 -3.259) 4.478 29.157 ( 3.417 0.000 -1.570) 3.760 30.038 ( -7.113 -0.000 -7.078) 10.034 30.281 ( 11.996 0.000 11.132) 16.365 ======================= Grid point 185 (82/117) ======================= q-point: (-0.20 -0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.266 ( -20.830 -4.509 12.478) 24.696 1.679 ( -32.269 -20.049 9.123) 39.070 2.265 ( -7.759 -34.020 19.006) 39.734 2.485 ( 8.385 1.279 -9.139) 12.468 2.971 ( -6.067 -4.220 5.181) 9.025 3.063 ( -4.686 -4.549 -5.079) 8.273 3.189 ( -6.236 -3.108 -17.737) 19.056 3.469 ( 6.933 -4.260 -8.754) 11.952 3.753 ( 5.259 7.590 -4.126) 10.114 3.828 ( 17.330 -1.444 7.351) 18.880 3.982 ( 15.597 -5.904 4.184) 17.194 4.159 ( 8.803 -4.460 2.081) 10.085 4.212 ( -7.167 3.209 -0.749) 7.888 4.394 ( -1.144 4.733 3.062) 5.752 4.618 ( 2.315 -1.802 -0.179) 2.939 4.663 ( -4.404 -0.942 5.947) 7.460 4.782 ( -9.447 5.667 0.779) 11.044 5.049 ( 3.537 -9.458 6.628) 12.079 5.167 ( -9.740 3.066 -13.632) 17.032 5.356 ( -4.196 -1.762 -1.592) 4.822 5.444 ( -5.344 -0.907 1.553) 5.639 5.621 ( -7.393 5.946 -2.440) 9.796 5.670 ( 3.090 5.341 -5.983) 8.595 5.851 ( -7.345 4.763 2.070) 8.995 5.905 ( -2.818 3.167 -6.677) 7.909 5.941 ( 4.062 4.033 4.666) 7.385 6.002 ( -4.290 4.682 -6.248) 8.909 6.101 ( 0.926 0.036 4.281) 4.380 6.201 ( 4.725 -2.549 4.657) 7.107 6.343 ( -0.981 -0.089 -5.866) 5.948 6.461 ( -2.776 0.909 6.437) 7.068 6.517 ( -0.146 4.726 -3.731) 6.023 6.735 ( -8.064 1.169 -6.477) 10.410 6.761 ( 2.328 0.870 1.014) 2.684 6.942 ( 0.174 2.657 1.450) 3.032 7.084 ( 5.678 -3.713 0.449) 6.799 7.146 ( -0.272 2.584 1.544) 3.023 7.235 ( 2.058 3.168 -4.297) 5.722 7.325 ( 6.674 5.056 -0.007) 8.372 7.414 ( 5.525 10.907 5.203) 13.287 7.514 ( 1.506 9.565 -0.416) 9.691 7.707 ( 4.773 8.159 -1.459) 9.564 7.796 ( -1.595 -0.667 1.508) 2.294 7.906 ( 0.267 -0.303 2.627) 2.658 7.958 ( -4.390 0.533 -7.883) 9.039 8.148 ( -3.398 -5.183 -4.599) 7.718 8.175 ( 1.090 -2.877 3.857) 4.934 8.297 ( 7.616 4.793 6.293) 10.980 8.462 ( -0.298 0.552 -0.919) 1.113 8.536 ( 3.158 0.559 5.404) 6.283 8.648 ( -2.253 -4.019 -1.942) 5.000 8.803 ( 0.980 7.139 5.915) 9.322 8.868 ( -2.352 0.546 1.223) 2.706 9.230 ( 20.368 -8.640 10.686) 24.571 9.628 ( 3.191 11.696 1.379) 12.202 9.826 ( 2.124 8.906 -4.100) 10.032 10.216 ( -1.774 -4.951 2.289) 5.735 10.281 ( -6.780 -8.680 -6.168) 12.623 10.472 ( -3.807 3.657 -0.810) 5.341 10.560 ( -3.644 -0.785 0.927) 3.841 10.773 ( 2.980 -10.082 5.768) 11.991 10.951 ( -5.128 -4.160 -2.778) 7.163 11.024 ( -2.586 -4.161 -0.573) 4.932 11.301 ( 3.561 -2.657 2.986) 5.353 11.778 ( 4.028 -1.312 0.087) 4.237 11.866 ( 3.948 -5.605 -0.743) 6.896 12.295 ( -0.918 2.090 -1.689) 2.840 12.409 ( 1.438 -2.036 -2.085) 3.250 12.550 ( -10.926 0.136 -6.840) 12.891 12.728 ( -5.820 -2.662 -0.347) 6.409 13.224 ( -20.345 1.915 -32.717) 38.574 13.441 ( 32.202 2.716 21.891) 39.033 13.970 ( 2.457 3.148 -0.079) 3.994 14.137 ( 1.471 2.140 2.757) 3.787 14.277 ( 5.967 4.004 1.773) 7.402 14.427 ( 0.997 2.187 -2.400) 3.396 14.848 ( -9.643 2.938 -5.260) 11.370 14.851 ( -6.178 5.254 2.312) 8.433 15.025 ( 0.685 1.211 2.959) 3.270 15.162 ( 2.090 -0.823 -0.050) 2.247 15.740 ( -12.532 9.193 -9.969) 18.464 15.956 ( 10.030 6.675 11.541) 16.684 16.461 ( -8.018 -0.349 0.753) 8.061 16.607 ( -0.799 -5.502 2.043) 5.923 19.952 ( -3.877 1.402 -1.785) 4.492 20.064 ( 3.563 -2.336 2.227) 4.808 20.145 ( 0.601 -5.281 1.596) 5.550 20.180 ( -1.313 -3.810 -2.580) 4.785 24.518 ( -16.212 5.524 -18.099) 24.918 24.581 ( 2.219 2.398 6.279) 7.078 24.944 ( -7.165 1.769 4.480) 8.634 24.990 ( -5.459 0.772 0.251) 5.519 26.188 ( 0.012 0.750 -0.116) 0.759 26.258 ( 4.559 0.629 0.681) 4.652 26.607 ( 3.724 -1.523 0.362) 4.040 26.732 ( 0.381 0.428 -2.626) 2.688 27.118 ( -1.978 5.344 1.889) 6.003 27.215 ( -0.583 5.667 1.933) 6.016 27.290 ( -6.507 3.550 1.546) 7.572 27.339 ( -3.965 -1.700 1.739) 4.652 27.844 ( -0.394 7.333 7.588) 10.560 28.083 ( 11.691 1.849 -8.935) 14.830 28.901 ( -0.617 -4.789 0.409) 4.846 28.957 ( 1.413 -10.400 5.932) 12.056 29.114 ( 2.656 -14.798 0.414) 15.040 29.256 ( 4.916 -5.392 -0.500) 7.314 29.943 ( -5.293 4.962 -7.008) 10.087 30.433 ( 14.847 -6.082 2.934) 16.310 ======================= Grid point 186 (83/117) ======================= q-point: (-0.10 -0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.538 ( -1.443 -24.801 9.970) 26.769 2.054 ( -16.012 -31.216 10.958) 36.755 2.447 ( 1.598 4.326 -5.867) 7.463 2.791 ( -3.153 -12.554 2.425) 13.169 3.068 ( -0.473 -12.510 -1.350) 12.592 3.257 ( -7.192 -7.443 -4.722) 11.376 3.284 ( -9.209 -23.693 5.958) 26.109 3.545 ( 0.212 1.547 -3.623) 3.945 3.608 ( -0.764 3.846 -8.737) 9.577 3.866 ( -1.603 3.212 -6.108) 7.085 4.072 ( 5.418 -0.924 5.041) 7.457 4.192 ( 7.181 4.046 -1.243) 8.336 4.203 ( 5.502 0.656 5.934) 8.119 4.417 ( 0.048 -4.598 0.259) 4.605 4.628 ( 2.465 -1.042 8.855) 9.250 4.662 ( 4.193 0.175 1.155) 4.352 4.859 ( 0.637 -11.397 0.279) 11.418 5.087 ( -4.020 1.991 -7.998) 9.170 5.214 ( 0.467 -3.662 9.814) 10.486 5.255 ( -2.348 7.992 -7.990) 11.543 5.400 ( -7.758 1.492 1.390) 8.022 5.480 ( -5.817 1.521 -5.639) 8.242 5.538 ( 2.730 11.459 2.355) 12.013 5.689 ( -5.680 5.764 -4.814) 9.416 5.809 ( -0.273 6.185 0.898) 6.255 5.869 ( -0.394 1.073 -1.737) 2.080 5.911 ( -0.376 3.469 -1.284) 3.718 6.087 ( -0.583 1.175 -2.065) 2.446 6.223 ( -0.132 3.675 3.734) 5.241 6.384 ( 3.199 -4.245 -1.368) 5.489 6.413 ( 1.097 2.617 -0.076) 2.839 6.486 ( -2.569 -0.658 -4.951) 5.616 6.634 ( -7.073 3.391 -8.396) 11.490 6.699 ( 1.269 6.280 0.156) 6.408 6.872 ( -1.788 4.484 4.446) 6.563 7.060 ( 3.752 6.188 1.817) 7.461 7.094 ( 0.915 1.034 -1.139) 1.790 7.125 ( -5.184 9.466 2.119) 10.999 7.221 ( 1.912 3.877 3.936) 5.847 7.314 ( 4.465 5.319 -2.353) 7.332 7.463 ( 4.304 -1.886 -2.970) 5.559 7.560 ( 5.611 9.019 -0.385) 10.629 7.712 ( 1.073 5.929 6.539) 8.892 7.898 ( -2.920 2.959 -3.268) 5.288 7.991 ( 1.294 -5.780 1.221) 6.048 8.145 ( -2.162 6.242 7.806) 10.226 8.207 ( -6.392 -3.138 -4.578) 8.465 8.295 ( 9.845 3.391 3.557) 11.004 8.502 ( 2.235 -1.818 4.153) 5.054 8.563 ( 0.876 -1.856 3.538) 4.090 8.646 ( -0.229 2.161 0.053) 2.173 8.734 ( 2.559 2.112 3.998) 5.196 8.842 ( -2.965 -1.896 -0.419) 3.545 9.134 ( 0.019 13.532 0.724) 13.552 9.484 ( 2.494 15.126 -1.465) 15.400 9.844 ( 17.708 -4.370 -6.764) 19.453 10.292 ( -7.447 -1.616 -7.586) 10.753 10.298 ( 0.627 -2.721 4.352) 5.170 10.454 ( -5.506 -2.554 -3.992) 7.265 10.593 ( -1.969 -2.956 2.144) 4.149 10.956 ( -2.042 -6.302 4.078) 7.779 10.988 ( -4.069 -4.723 -3.604) 7.201 11.103 ( -0.494 -3.618 2.715) 4.550 11.408 ( 4.202 -5.472 2.861) 7.469 11.832 ( 1.979 -1.565 -1.880) 3.147 12.013 ( 4.458 -6.366 0.134) 7.773 12.270 ( 1.469 0.200 0.613) 1.604 12.436 ( 0.807 0.434 -0.563) 1.075 12.492 ( -8.539 -1.117 -4.453) 9.695 12.767 ( -2.817 -3.515 -1.023) 4.620 13.049 ( -14.580 3.908 -11.525) 18.991 13.506 ( 18.514 8.405 13.923) 24.642 13.951 ( 8.906 2.116 1.181) 9.230 14.112 ( 4.778 1.350 2.387) 5.510 14.219 ( 4.423 4.652 1.477) 6.587 14.373 ( -0.300 3.346 -2.104) 3.963 14.704 ( -10.940 4.294 -7.209) 13.788 14.751 ( -2.533 1.839 1.644) 3.535 15.024 ( -0.319 -0.092 4.258) 4.271 15.181 ( 3.820 0.372 -0.417) 3.861 15.478 ( -10.201 8.885 -11.717) 17.897 15.861 ( 8.714 9.129 9.805) 15.982 16.413 ( -9.537 -0.574 0.277) 9.558 16.691 ( -1.423 -3.353 0.543) 3.683 19.897 ( -2.692 1.888 -1.387) 3.568 20.112 ( 5.143 0.044 2.654) 5.788 20.257 ( -2.448 -4.900 -4.936) 7.374 20.294 ( 1.998 -7.752 2.201) 8.303 24.330 ( -11.545 3.316 -8.087) 14.481 24.522 ( 0.273 4.674 6.087) 7.679 24.879 ( -5.212 0.459 0.883) 5.307 24.949 ( -3.702 0.603 0.070) 3.751 26.177 ( 1.332 0.949 0.544) 1.724 26.264 ( 3.750 1.454 0.027) 4.022 26.669 ( 3.335 -2.393 0.665) 4.158 26.734 ( 1.075 -0.666 -1.921) 2.300 27.039 ( 0.928 2.313 2.541) 3.559 27.107 ( 0.773 5.156 1.860) 5.536 27.153 ( -6.205 5.517 2.441) 8.654 27.344 ( -5.968 -1.142 1.154) 6.185 27.734 ( -2.615 3.115 5.710) 7.010 28.076 ( 7.056 3.411 -10.886) 13.413 29.004 ( -2.003 -5.945 1.646) 6.486 29.178 ( 0.324 -10.968 2.822) 11.329 29.334 ( 0.171 -3.438 -2.968) 4.546 29.490 ( 3.548 -17.038 10.268) 20.207 29.803 ( -0.385 6.330 -5.616) 8.471 30.627 ( 12.803 -3.593 -6.496) 14.799 ======================= Grid point 195 (84/117) ======================= q-point: (-0.20 -0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.116 ( -40.577 -0.000 -0.618) 40.582 1.217 ( -29.627 -0.000 23.394) 37.750 1.742 ( -15.683 -0.000 46.544) 49.116 2.543 ( 5.258 0.000 -17.431) 18.207 2.958 ( -8.343 -0.000 -1.900) 8.557 2.972 ( -0.499 -0.000 -17.332) 17.339 3.131 ( 4.621 0.000 -9.771) 10.809 3.515 ( 15.665 0.000 0.477) 15.672 3.881 ( 4.753 0.000 3.994) 6.208 3.957 ( 11.952 0.000 2.792) 12.274 4.013 ( 21.044 0.000 9.054) 22.909 4.153 ( 5.306 0.000 3.044) 6.117 4.162 ( -6.621 -0.000 -9.117) 11.267 4.438 ( -2.886 -0.000 1.522) 3.262 4.538 ( -1.508 -0.000 1.387) 2.049 4.701 ( -1.849 -0.000 -1.842) 2.610 4.833 ( -7.407 -0.000 1.582) 7.574 4.915 ( 4.505 0.000 5.527) 7.130 5.119 ( -20.050 -0.000 -20.677) 28.801 5.258 ( -3.785 -0.000 -9.338) 10.075 5.453 ( 1.546 0.000 6.510) 6.691 5.611 ( -6.172 -0.000 6.903) 9.260 5.785 ( -3.053 -0.000 -6.677) 7.342 5.810 ( -11.377 -0.000 3.379) 11.868 5.904 ( -4.514 -0.000 -2.203) 5.023 6.025 ( -6.956 -0.000 -2.406) 7.361 6.034 ( 2.328 0.000 -4.642) 5.193 6.093 ( 10.393 0.000 -3.091) 10.843 6.199 ( 2.512 0.000 2.838) 3.790 6.353 ( 0.212 0.000 2.928) 2.936 6.447 ( -2.278 -0.000 9.845) 10.105 6.620 ( -2.130 -0.000 -1.598) 2.663 6.708 ( -0.571 -0.000 -12.051) 12.065 6.759 ( 1.310 0.000 8.614) 8.713 6.928 ( -3.477 -0.000 -4.092) 5.370 7.071 ( 6.856 0.000 1.499) 7.018 7.166 ( 0.419 0.000 3.292) 3.319 7.310 ( 1.971 0.000 -9.265) 9.473 7.410 ( 5.634 0.000 -5.234) 7.690 7.622 ( 7.128 0.000 6.260) 9.487 7.655 ( -3.329 -0.000 1.534) 3.666 7.786 ( 6.398 0.000 0.150) 6.400 7.830 ( -1.319 -0.000 4.922) 5.095 7.865 ( 6.512 0.000 3.382) 7.338 7.894 ( -5.552 -0.000 -13.395) 14.500 8.132 ( 2.103 0.000 -3.086) 3.734 8.154 ( 3.916 0.000 1.887) 4.347 8.440 ( -0.811 -0.000 -1.789) 1.964 8.496 ( 0.610 0.000 -0.948) 1.127 8.526 ( -2.941 -0.000 4.599) 5.459 8.592 ( 5.543 0.000 6.109) 8.249 8.794 ( -4.032 -0.000 -0.145) 4.035 8.905 ( -2.752 -0.000 0.460) 2.790 9.252 ( 34.787 0.000 28.732) 45.118 9.790 ( -10.261 -0.000 -10.651) 14.790 9.969 ( 6.468 0.000 1.976) 6.763 10.066 ( -6.075 -0.000 -4.242) 7.409 10.145 ( -1.889 -0.000 4.365) 4.756 10.511 ( -7.553 -0.000 -6.044) 9.673 10.559 ( -1.191 -0.000 5.490) 5.618 10.639 ( 0.657 0.000 1.146) 1.321 10.836 ( -6.416 -0.000 -4.162) 7.648 10.975 ( -1.605 -0.000 1.024) 1.904 11.287 ( 0.540 0.000 1.347) 1.451 11.814 ( 9.858 0.000 1.658) 9.996 11.836 ( 6.532 0.000 5.776) 8.720 12.332 ( -8.442 -0.000 -10.185) 13.229 12.345 ( 2.258 0.000 -1.070) 2.499 12.491 ( -7.621 -0.000 -5.271) 9.267 12.652 ( -7.737 -0.000 -0.150) 7.738 13.080 ( -23.719 -0.000 -32.007) 39.838 13.681 ( 31.989 0.000 20.215) 37.841 14.020 ( 3.224 0.000 -0.219) 3.231 14.164 ( 0.325 0.000 2.611) 2.631 14.361 ( 6.002 0.000 3.095) 6.753 14.456 ( 0.790 0.000 -1.212) 1.447 14.813 ( -12.048 -0.000 -6.821) 13.845 14.870 ( -5.122 -0.000 2.520) 5.708 15.070 ( -0.709 -0.000 -2.002) 2.123 15.155 ( 5.824 0.000 5.668) 8.127 15.769 ( -12.339 -0.000 -4.816) 13.246 16.072 ( 5.636 0.000 8.426) 10.137 16.439 ( -4.938 -0.000 -0.940) 5.026 16.513 ( -2.620 -0.000 3.188) 4.126 19.944 ( -3.299 -0.000 -1.443) 3.601 20.008 ( -1.346 -0.000 0.896) 1.616 20.098 ( 0.215 0.000 1.612) 1.626 20.152 ( 0.881 0.000 -0.314) 0.935 24.457 ( -20.096 -0.000 -22.940) 30.498 24.624 ( 2.326 0.000 7.990) 8.322 24.916 ( -8.764 -0.000 5.427) 10.308 24.964 ( -5.178 -0.000 -0.471) 5.199 26.195 ( 0.027 0.000 0.532) 0.533 26.290 ( 3.871 0.000 0.315) 3.883 26.620 ( 4.976 0.000 0.736) 5.030 26.740 ( 0.631 0.000 -2.296) 2.381 27.162 ( -10.048 -0.000 -0.218) 10.050 27.212 ( -0.636 -0.000 0.905) 1.106 27.318 ( -1.006 -0.000 -1.427) 1.746 27.335 ( -2.118 -0.000 2.046) 2.945 28.085 ( 11.535 0.000 0.844) 11.565 28.090 ( 6.682 0.000 2.520) 7.141 28.828 ( 2.296 0.000 6.058) 6.479 28.870 ( -0.827 -0.000 2.579) 2.708 28.963 ( 2.793 0.000 -3.340) 4.354 29.209 ( 4.877 0.000 -0.839) 4.949 29.959 ( -4.097 -0.000 -7.583) 8.619 30.432 ( 10.360 0.000 6.335) 12.143 ======================= Grid point 196 (85/117) ======================= q-point: (-0.10 -0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.072 ( -9.878 -18.578 19.557) 28.726 1.356 ( -20.383 -26.738 19.656) 38.945 2.124 ( -15.801 -39.941 35.151) 55.503 2.510 ( -2.378 3.062 -18.726) 19.123 2.878 ( -7.739 2.228 -2.333) 8.384 3.026 ( -3.855 -8.753 -21.292) 23.341 3.218 ( 13.649 -0.179 -1.903) 13.782 3.595 ( 11.233 1.551 -1.217) 11.405 3.775 ( -1.288 10.033 0.666) 10.138 3.911 ( -6.216 3.052 -2.545) 7.378 4.080 ( 3.157 -0.178 8.057) 8.656 4.223 ( 8.517 -1.557 4.738) 9.870 4.295 ( 12.792 -4.877 1.085) 13.733 4.426 ( 4.958 3.821 -1.903) 6.543 4.604 ( -8.006 -3.527 7.696) 11.652 4.695 ( 7.785 -3.675 2.015) 8.842 4.703 ( 0.251 1.653 -6.424) 6.638 4.966 ( -17.439 -1.844 -23.120) 29.018 5.106 ( 2.317 -7.458 7.492) 10.823 5.258 ( -4.161 -2.292 -5.576) 7.325 5.437 ( 2.224 3.585 1.796) 4.585 5.509 ( -9.838 2.932 0.532) 10.279 5.702 ( -7.773 6.591 -0.868) 10.228 5.728 ( -1.157 3.122 3.243) 4.648 5.829 ( -7.703 2.458 -13.394) 15.645 5.945 ( -2.194 5.809 -8.831) 10.795 6.010 ( -1.630 0.484 8.436) 8.606 6.153 ( 8.463 1.579 4.205) 9.581 6.243 ( -1.471 -1.183 6.736) 6.996 6.312 ( -2.904 -0.580 -4.305) 5.225 6.456 ( 2.687 0.752 9.693) 10.087 6.547 ( 3.549 4.935 1.011) 6.162 6.641 ( -3.674 2.749 -6.673) 8.098 6.794 ( 2.245 0.628 0.110) 2.333 6.915 ( -4.131 2.198 -2.166) 5.156 7.138 ( -1.545 2.239 -5.196) 5.865 7.148 ( 1.916 -1.808 4.710) 5.397 7.188 ( -4.453 7.624 -1.534) 8.962 7.380 ( 3.877 7.300 -0.711) 8.296 7.488 ( 1.085 9.027 -0.289) 9.096 7.530 ( 0.262 7.401 0.048) 7.406 7.726 ( 2.936 3.566 0.650) 4.665 7.850 ( 6.007 6.066 2.350) 8.855 7.896 ( -3.824 -2.374 -4.763) 6.553 7.938 ( 3.234 -1.013 3.805) 5.096 8.138 ( 2.290 -0.982 -0.520) 2.545 8.172 ( -0.411 -0.715 5.107) 5.173 8.382 ( 6.820 -0.715 4.260) 8.073 8.467 ( -0.901 -0.642 -0.805) 1.368 8.583 ( 3.620 1.241 2.589) 4.620 8.633 ( -0.354 -2.982 2.273) 3.766 8.796 ( -2.288 3.179 2.307) 4.545 8.837 ( -2.607 2.144 0.500) 3.412 9.419 ( 5.984 12.849 4.840) 14.977 9.729 ( 8.886 -2.061 -2.624) 9.491 9.849 ( 3.028 5.407 -7.518) 9.743 10.155 ( -6.614 -6.833 -8.879) 13.010 10.230 ( 0.135 -5.028 3.767) 6.284 10.417 ( -3.625 2.300 -1.767) 4.643 10.529 ( -2.055 -1.514 3.946) 4.700 10.788 ( -2.660 -8.922 -1.372) 9.411 10.879 ( -5.550 -4.523 -6.324) 9.553 11.025 ( 2.535 -5.403 3.617) 6.978 11.325 ( -0.127 -4.013 0.591) 4.059 11.872 ( 12.962 1.919 6.292) 14.536 11.926 ( 3.776 -4.379 2.531) 6.312 12.272 ( -0.997 -0.741 -0.498) 1.339 12.428 ( 1.859 -2.843 -4.551) 5.679 12.441 ( -3.109 0.900 -0.275) 3.248 12.667 ( -2.668 -4.890 -0.089) 5.571 12.960 ( -17.880 -2.001 -17.338) 24.986 13.785 ( 17.297 7.595 11.628) 22.183 14.050 ( 12.066 -0.014 3.799) 12.650 14.147 ( -0.196 1.485 1.322) 1.998 14.346 ( 3.994 4.330 2.621) 6.448 14.426 ( -1.363 2.770 -0.680) 3.161 14.708 ( -10.991 2.871 -5.714) 12.716 14.790 ( -4.200 3.677 0.693) 5.624 15.034 ( 0.888 1.631 4.214) 4.605 15.217 ( 7.026 -0.271 2.199) 7.367 15.597 ( -9.170 8.635 -6.337) 14.100 16.044 ( 1.954 5.237 5.602) 7.914 16.365 ( -6.445 1.678 1.357) 6.797 16.588 ( -2.355 -5.812 0.214) 6.275 19.915 ( -1.791 1.184 -0.670) 2.249 20.108 ( 3.135 -6.598 -1.527) 7.463 20.151 ( -0.294 -3.262 -1.379) 3.554 20.167 ( 0.272 -3.662 1.331) 3.906 24.305 ( -13.288 2.116 -9.744) 16.613 24.603 ( -0.815 3.199 6.871) 7.623 24.854 ( -7.062 0.610 2.287) 7.448 24.932 ( -3.856 0.209 -0.503) 3.895 26.195 ( 0.811 0.190 1.402) 1.631 26.306 ( 2.927 0.612 -0.400) 3.017 26.661 ( 4.786 -0.969 0.554) 4.914 26.735 ( 0.412 0.444 -1.646) 1.754 27.077 ( -4.468 2.065 0.378) 4.936 27.194 ( -2.822 2.580 0.943) 3.938 27.238 ( -1.477 6.061 2.816) 6.845 27.307 ( -2.130 0.746 1.408) 2.659 27.822 ( -4.311 10.481 12.270) 16.703 28.213 ( 10.134 4.337 -10.883) 15.490 28.898 ( -0.101 -3.675 1.280) 3.893 28.976 ( 0.846 -9.358 3.542) 10.041 29.148 ( 3.090 -14.781 1.654) 15.190 29.317 ( 3.995 -5.010 2.161) 6.763 29.901 ( 0.078 3.802 -6.046) 7.142 30.593 ( 9.411 -7.394 -7.984) 14.387 ======================= Grid point 206 (86/117) ======================= q-point: (-0.10 -0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 110 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.796 ( -7.560 -0.000 30.632) 31.551 0.957 ( -14.391 -0.000 35.767) 38.553 1.560 ( -16.852 -0.000 58.619) 60.994 2.516 ( -5.552 -0.000 -23.822) 24.460 2.850 ( -9.666 -0.000 -34.436) 35.767 2.911 ( 0.341 0.000 1.920) 1.950 3.340 ( 19.553 0.000 -3.268) 19.824 3.714 ( 14.609 0.000 3.719) 15.075 3.798 ( -16.495 -0.000 -9.689) 19.130 3.972 ( 4.206 0.000 8.863) 9.811 4.073 ( -8.376 -0.000 3.499) 9.077 4.241 ( -0.023 -0.000 6.845) 6.845 4.342 ( 21.940 0.000 7.889) 23.315 4.412 ( 1.334 0.000 -10.298) 10.384 4.579 ( 8.836 0.000 -5.134) 10.220 4.681 ( -0.444 -0.000 -4.392) 4.414 4.714 ( -8.380 -0.000 -12.185) 14.789 4.937 ( -5.362 -0.000 5.304) 7.542 4.960 ( -4.099 -0.000 1.606) 4.402 5.261 ( 7.890 0.000 -11.873) 14.255 5.485 ( 3.027 0.000 3.521) 4.643 5.502 ( -11.040 -0.000 8.509) 13.939 5.652 ( -13.563 -0.000 7.852) 15.672 5.752 ( -2.528 -0.000 -1.966) 3.203 5.814 ( -6.734 -0.000 -17.220) 18.490 5.974 ( -2.747 -0.000 12.242) 12.546 6.009 ( -4.235 -0.000 -15.850) 16.406 6.219 ( -2.767 -0.000 3.758) 4.667 6.225 ( 1.152 0.000 -3.929) 4.095 6.263 ( -1.616 -0.000 2.951) 3.364 6.517 ( 9.733 0.000 13.764) 16.857 6.580 ( -2.739 -0.000 3.444) 4.401 6.736 ( 6.067 0.000 -10.271) 11.929 6.793 ( 0.788 0.000 5.497) 5.553 6.904 ( -0.172 -0.000 -4.678) 4.681 7.134 ( 1.736 0.000 -0.336) 1.768 7.168 ( -0.575 -0.000 4.704) 4.739 7.252 ( -8.491 -0.000 -11.002) 13.897 7.458 ( 2.993 0.000 -4.791) 5.649 7.643 ( 0.927 0.000 0.485) 1.046 7.657 ( -5.335 -0.000 -0.703) 5.381 7.774 ( -4.588 -0.000 -4.498) 6.426 7.835 ( 4.326 0.000 1.632) 4.623 7.908 ( -2.622 -0.000 -3.481) 4.358 7.918 ( 7.150 0.000 5.878) 9.256 8.172 ( 4.485 0.000 0.487) 4.512 8.252 ( 13.118 0.000 5.153) 14.094 8.409 ( -1.886 -0.000 -3.675) 4.131 8.488 ( -3.385 -0.000 3.441) 4.827 8.529 ( 1.692 0.000 1.261) 2.110 8.654 ( 3.243 0.000 4.728) 5.733 8.728 ( -6.511 -0.000 -2.549) 6.992 8.868 ( -2.906 -0.000 -0.368) 2.929 9.517 ( -35.778 -0.000 -24.154) 43.168 9.687 ( 28.250 0.000 13.440) 31.284 10.017 ( -1.347 -0.000 -1.900) 2.329 10.032 ( 2.959 0.000 1.003) 3.125 10.122 ( -2.125 -0.000 2.412) 3.215 10.447 ( -0.452 -0.000 -0.370) 0.584 10.517 ( -7.080 -0.000 0.814) 7.126 10.626 ( -3.175 -0.000 -2.017) 3.761 10.760 ( -4.475 -0.000 -4.547) 6.380 10.974 ( 1.391 0.000 3.205) 3.493 11.273 ( -2.102 -0.000 -1.018) 2.336 11.886 ( 0.379 0.000 4.377) 4.393 12.037 ( 3.427 0.000 -11.010) 11.531 12.344 ( 40.166 0.000 24.572) 47.086 12.380 ( 3.404 0.000 -1.079) 3.571 12.455 ( 6.356 0.000 5.662) 8.512 12.569 ( -4.933 -0.000 0.195) 4.936 12.810 ( -15.337 -0.000 -9.157) 17.863 13.962 ( 3.274 0.000 5.338) 6.263 14.080 ( 6.124 0.000 0.781) 6.174 14.193 ( 9.250 0.000 7.951) 12.197 14.405 ( 0.988 0.000 -1.364) 1.685 14.455 ( -1.143 -0.000 1.352) 1.770 14.666 ( -10.458 -0.000 -4.559) 11.408 14.801 ( -5.716 -0.000 -0.578) 5.745 15.106 ( 7.109 0.000 4.593) 8.463 15.265 ( 11.733 0.000 4.664) 12.626 15.638 ( -7.323 -0.000 -1.208) 7.422 16.086 ( -4.687 -0.000 0.540) 4.718 16.393 ( -1.612 -0.000 0.790) 1.795 16.480 ( -2.672 -0.000 0.924) 2.827 19.919 ( -0.206 -0.000 -0.368) 0.422 19.989 ( -1.755 -0.000 -0.330) 1.786 20.105 ( 0.619 0.000 2.163) 2.250 20.161 ( 0.689 0.000 -0.243) 0.731 24.255 ( -4.364 -0.000 -2.580) 5.070 24.627 ( -3.842 -0.000 6.136) 7.240 24.817 ( -6.150 -0.000 1.943) 6.450 24.912 ( -3.196 -0.000 -0.936) 3.331 26.200 ( 0.604 0.000 2.105) 2.189 26.325 ( 1.736 0.000 -0.999) 2.003 26.684 ( 4.560 0.000 1.003) 4.669 26.747 ( 0.677 0.000 -1.418) 1.572 27.060 ( -5.762 -0.000 0.724) 5.808 27.197 ( -1.734 -0.000 -0.885) 1.946 27.311 ( -0.140 -0.000 -0.824) 0.836 27.312 ( -1.696 -0.000 0.792) 1.872 28.146 ( 2.103 0.000 2.759) 3.469 28.227 ( 10.701 0.000 -1.861) 10.862 28.839 ( -1.509 -0.000 5.144) 5.361 28.902 ( 6.345 0.000 4.839) 7.979 28.988 ( 1.626 0.000 -3.068) 3.473 29.254 ( 1.543 0.000 -1.479) 2.137 29.946 ( 3.276 0.000 -4.573) 5.625 30.475 ( -8.492 -0.000 -7.715) 11.473 ======================= Grid point 207 (87/117) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 62 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.742 ( -10.315 -0.000 -34.317) 35.834 1.742 ( 10.315 0.000 34.317) 35.834 1.857 ( -7.229 -0.000 -39.793) 40.445 1.857 ( 7.229 0.000 39.793) 40.445 2.935 ( -11.977 -0.000 -39.798) 41.561 2.935 ( 11.977 0.000 39.798) 41.561 3.149 ( 4.586 0.000 -9.248) 10.323 3.149 ( -4.586 -0.000 9.248) 10.323 3.815 ( -2.879 -0.000 -5.599) 6.296 3.815 ( 2.879 0.000 5.599) 6.296 4.042 ( 12.389 0.000 -4.420) 13.154 4.042 ( -12.389 -0.000 4.420) 13.154 4.531 ( -2.779 -0.000 -4.856) 5.595 4.531 ( 2.779 0.000 4.856) 5.595 4.734 ( -9.526 -0.000 -6.345) 11.446 4.734 ( 9.526 0.000 6.345) 11.446 4.944 ( 0.165 0.000 -11.392) 11.393 4.944 ( -0.165 -0.000 11.392) 11.393 5.078 ( -10.381 -0.000 -1.859) 10.546 5.078 ( 10.381 0.000 1.859) 10.546 5.381 ( -6.273 -0.000 1.494) 6.449 5.381 ( 6.273 0.000 -1.494) 6.449 5.625 ( -2.480 -0.000 -4.352) 5.009 5.625 ( 2.480 0.000 4.352) 5.009 5.749 ( 7.214 0.000 -6.567) 9.756 5.749 ( -7.214 -0.000 6.567) 9.756 6.116 ( -4.816 -0.000 -0.170) 4.819 6.116 ( 4.816 0.000 0.170) 4.819 6.231 ( 4.039 0.000 -11.321) 12.020 6.231 ( -4.039 -0.000 11.321) 12.020 6.734 ( -7.870 -0.000 -1.132) 7.951 6.734 ( 7.870 0.000 1.132) 7.951 6.764 ( 2.556 0.000 -7.194) 7.635 6.764 ( -2.556 -0.000 7.194) 7.635 6.922 ( -4.827 -0.000 -7.174) 8.647 6.922 ( 4.827 0.000 7.174) 8.647 7.305 ( -2.829 -0.000 -5.077) 5.812 7.305 ( 2.829 0.000 5.077) 5.812 7.415 ( -9.956 -0.000 -7.546) 12.492 7.415 ( 9.956 0.000 7.546) 12.492 7.652 ( -10.479 -0.000 -3.601) 11.080 7.652 ( 10.479 0.000 3.601) 11.080 7.871 ( -3.099 -0.000 -3.365) 4.574 7.871 ( 3.099 0.000 3.365) 4.574 8.191 ( -5.041 -0.000 -7.597) 9.117 8.191 ( 5.041 0.000 7.597) 9.117 8.358 ( -11.791 -0.000 -5.432) 12.982 8.358 ( 11.791 0.000 5.432) 12.982 8.504 ( 1.753 0.000 -0.724) 1.896 8.504 ( -1.753 -0.000 0.724) 1.896 8.684 ( -5.157 -0.000 -2.117) 5.575 8.684 ( 5.157 0.000 2.117) 5.575 8.909 ( -8.338 -0.000 -5.390) 9.928 8.909 ( 8.338 0.000 5.390) 9.928 10.028 ( -6.910 -0.000 -1.555) 7.083 10.028 ( 6.910 0.000 1.555) 7.083 10.058 ( -9.261 -0.000 -1.790) 9.432 10.058 ( 9.261 0.000 1.790) 9.432 10.467 ( -1.856 -0.000 -3.476) 3.940 10.467 ( 1.856 0.000 3.476) 3.940 10.611 ( -0.511 -0.000 -6.277) 6.298 10.611 ( 0.511 0.000 6.277) 6.298 11.134 ( -5.935 -0.000 -5.333) 7.979 11.134 ( 5.935 0.000 5.333) 7.979 11.909 ( 7.598 0.000 -3.558) 8.390 11.909 ( -7.598 -0.000 3.558) 8.390 12.410 ( -2.875 -0.000 0.165) 2.879 12.410 ( 2.875 0.000 -0.165) 2.879 12.592 ( -4.483 -0.000 -2.342) 5.058 12.592 ( 4.483 0.000 2.342) 5.058 13.582 ( -47.487 -0.000 -6.611) 47.945 13.582 ( 47.487 0.000 6.611) 47.945 14.236 ( -9.365 -0.000 -3.529) 10.008 14.236 ( 9.365 0.000 3.529) 10.008 14.508 ( -2.198 -0.000 -2.974) 3.698 14.508 ( 2.198 0.000 2.974) 3.698 14.605 ( -13.499 -0.000 -6.482) 14.975 14.605 ( 13.499 0.000 6.482) 14.975 15.380 ( 6.560 0.000 -5.579) 8.611 15.380 ( -6.560 -0.000 5.579) 8.611 15.763 ( -20.482 -0.000 -8.061) 22.011 15.763 ( 20.482 0.000 8.061) 22.011 16.440 ( -3.923 -0.000 -0.495) 3.954 16.440 ( 3.923 0.000 0.495) 3.954 19.941 ( -2.430 -0.000 -0.801) 2.558 19.941 ( 2.430 0.000 0.801) 2.558 20.152 ( 0.160 0.000 -1.284) 1.294 20.152 ( -0.160 -0.000 1.284) 1.294 24.533 ( -24.001 -0.000 0.346) 24.003 24.533 ( 24.001 0.000 -0.346) 24.003 24.840 ( -1.553 -0.000 -2.302) 2.777 24.840 ( 1.553 0.000 2.302) 2.777 26.278 ( -1.053 -0.000 -2.851) 3.039 26.278 ( 1.053 0.000 2.851) 3.039 26.730 ( 0.765 0.000 -1.081) 1.325 26.730 ( -0.765 -0.000 1.081) 1.325 27.106 ( -3.205 -0.000 -3.304) 4.603 27.106 ( 3.205 0.000 3.304) 4.603 27.303 ( 1.314 0.000 -0.517) 1.412 27.303 ( -1.314 -0.000 0.517) 1.412 28.216 ( 2.756 0.000 -3.798) 4.693 28.216 ( -2.756 -0.000 3.798) 4.693 28.920 ( 1.797 0.000 -4.386) 4.740 28.920 ( -1.797 -0.000 4.386) 4.740 29.127 ( -7.332 -0.000 -5.405) 9.109 29.127 ( 7.332 0.000 5.405) 9.109 30.064 ( -22.033 -0.000 -1.595) 22.090 30.064 ( 22.033 0.000 1.595) 22.090 ======================= Grid point 209 (88/117) ======================= q-point: ( 0.10 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( -7.613 -7.605 -29.475) 31.378 1.836 ( 6.926 -6.427 29.945) 31.401 1.969 ( -6.365 -15.997 -33.274) 37.465 2.127 ( 13.673 -16.075 32.949) 39.128 2.957 ( -11.549 3.346 -11.069) 16.344 3.079 ( 1.153 -8.425 -3.816) 9.321 3.228 ( 3.454 -12.187 -30.672) 33.185 3.393 ( 21.290 -22.170 51.583) 60.046 3.675 ( -9.604 5.568 -4.188) 11.865 3.793 ( 7.154 5.986 1.139) 9.398 3.987 ( -15.567 -2.994 -4.792) 16.560 4.135 ( 6.140 0.009 3.767) 7.204 4.425 ( -3.016 8.844 -2.298) 9.622 4.474 ( 3.466 8.630 1.051) 9.359 4.643 ( -6.636 -4.723 2.232) 8.446 4.740 ( 6.996 1.412 -5.928) 9.278 4.939 ( -15.195 0.580 -9.536) 17.949 4.970 ( -9.011 -0.118 -13.259) 16.032 5.116 ( 10.831 -3.389 8.857) 14.396 5.136 ( 11.239 3.613 8.959) 14.820 5.273 ( -7.609 1.700 7.726) 10.976 5.405 ( 9.597 -2.714 -1.870) 10.148 5.549 ( -5.053 3.526 -4.606) 7.693 5.640 ( 7.809 2.607 3.445) 8.925 5.750 ( -8.400 -2.773 2.496) 9.192 5.854 ( 7.078 -2.359 -4.257) 8.590 6.000 ( -7.970 4.974 8.158) 12.442 6.136 ( 13.204 4.249 -1.019) 13.908 6.251 ( -4.708 -4.415 9.572) 11.545 6.316 ( 5.407 -1.193 -10.151) 11.563 6.530 ( -10.833 9.778 -3.012) 14.901 6.665 ( 7.377 7.579 7.422) 12.921 6.737 ( -2.556 1.856 -5.163) 6.053 6.777 ( 3.040 1.926 1.115) 3.767 6.928 ( -7.175 -1.514 -9.786) 12.229 6.996 ( 3.260 -1.772 7.407) 8.285 7.197 ( -2.702 4.389 -4.680) 6.962 7.260 ( 5.903 3.977 5.188) 8.808 7.378 ( -10.200 2.481 -8.481) 13.495 7.444 ( -0.934 3.942 2.180) 4.601 7.512 ( 1.009 6.168 3.080) 6.968 7.591 ( 11.060 10.192 5.955) 16.175 7.898 ( -3.111 -3.367 -1.768) 4.913 7.909 ( -1.906 -3.326 -1.122) 3.994 8.096 ( -6.622 4.423 -6.939) 10.562 8.176 ( 4.311 2.774 6.248) 8.081 8.278 ( -9.178 0.447 -3.488) 9.828 8.425 ( 11.651 0.508 6.523) 13.362 8.508 ( -7.446 0.248 -4.059) 8.484 8.595 ( 5.229 -2.528 1.379) 5.969 8.754 ( -3.929 -4.118 -2.716) 6.306 8.800 ( 2.988 -3.352 0.420) 4.510 8.877 ( -10.461 -6.189 -8.942) 15.090 9.064 ( 17.592 -11.298 16.643) 26.723 9.632 ( -8.371 20.642 -4.348) 22.696 9.726 ( 6.123 21.936 3.300) 23.012 10.194 ( -2.040 -5.142 -2.673) 6.144 10.222 ( 2.808 -3.997 2.529) 5.501 10.471 ( -10.861 -3.813 -1.593) 11.621 10.608 ( 9.581 -6.043 2.576) 11.617 10.652 ( -1.051 -4.933 -3.657) 6.230 10.688 ( 5.009 -5.807 3.014) 8.240 11.153 ( -4.753 -4.948 -4.663) 8.295 11.225 ( 6.012 -4.780 4.887) 9.104 11.899 ( -8.811 -3.366 3.391) 10.023 11.991 ( 5.336 -3.749 -1.969) 6.812 12.382 ( -3.229 0.587 -0.087) 3.283 12.421 ( 2.720 0.356 -0.191) 2.750 12.578 ( -3.169 -0.587 -2.054) 3.822 12.642 ( 6.587 -1.394 2.857) 7.314 13.207 ( -44.930 5.877 -12.909) 47.115 13.707 ( 30.885 13.132 4.393) 33.847 14.174 ( -4.312 0.460 -3.715) 5.711 14.257 ( 6.780 3.001 4.840) 8.854 14.419 ( -9.484 4.026 -2.182) 10.531 14.484 ( 0.171 2.635 3.395) 4.301 14.557 ( -1.947 0.320 -7.229) 7.494 14.675 ( 12.179 1.675 2.820) 12.613 15.266 ( -5.726 5.408 -3.558) 8.642 15.325 ( 2.785 6.989 0.570) 7.545 15.570 ( -21.900 5.462 -4.753) 23.066 15.861 ( 22.208 3.879 6.052) 23.343 16.443 ( -2.896 -1.568 -4.059) 5.227 16.501 ( 5.923 -2.697 2.632) 7.020 19.947 ( -3.144 -1.073 -2.590) 4.212 19.992 ( 3.680 -2.410 3.199) 5.439 20.175 ( -2.127 -3.009 0.312) 3.698 20.200 ( 1.714 -4.735 -1.004) 5.134 24.372 ( -15.329 2.548 -3.398) 15.906 24.609 ( 20.597 6.542 -2.502) 21.755 24.838 ( 0.654 -0.133 -1.625) 1.756 24.859 ( 3.338 -0.464 1.415) 3.655 26.266 ( -1.518 0.533 -2.497) 2.970 26.282 ( 0.915 0.457 2.237) 2.460 26.717 ( -1.817 -0.116 -0.335) 1.851 26.724 ( -1.012 0.140 0.539) 1.155 27.075 ( -2.003 1.571 -1.727) 3.076 27.125 ( 5.568 1.293 1.593) 5.934 27.271 ( -1.976 2.395 0.287) 3.118 27.299 ( 2.640 1.288 -0.387) 2.963 28.025 ( -6.350 11.430 13.488) 18.785 28.071 ( 2.429 10.050 -12.056) 15.883 28.939 ( -2.474 -4.313 -0.024) 4.972 28.969 ( 2.272 -4.597 0.703) 5.176 29.262 ( -7.705 -11.394 0.012) 13.754 29.366 ( 8.827 -11.995 -2.274) 15.065 29.987 ( -21.459 -6.414 -4.988) 22.946 30.229 ( 15.492 -3.679 10.599) 19.128 ======================= Grid point 210 (89/117) ======================= q-point: ( 0.20 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.903 ( -5.726 -14.202 -17.086) 22.944 2.124 ( 8.270 -15.445 17.630) 24.855 2.368 ( 1.266 -25.909 -21.933) 33.970 2.588 ( 13.750 -19.870 23.182) 33.485 2.748 ( -11.099 7.290 -0.019) 13.279 3.162 ( 16.645 1.754 4.150) 17.244 3.475 ( -11.242 -3.369 -3.756) 12.322 3.658 ( -1.803 7.655 -4.511) 9.067 3.743 ( -3.282 -20.211 -26.746) 33.684 3.935 ( -7.806 -5.816 0.340) 9.740 4.059 ( -1.725 -7.612 10.574) 13.142 4.079 ( 9.597 -10.867 18.986) 23.889 4.317 ( 2.448 7.724 -3.930) 9.006 4.371 ( 9.008 -0.134 5.469) 10.539 4.626 ( -5.366 2.923 -8.263) 10.277 4.776 ( -2.007 -6.119 3.564) 7.360 4.847 ( -4.068 5.835 -6.732) 9.793 4.889 ( -2.582 0.261 -0.027) 2.596 5.104 ( 7.124 5.022 7.934) 11.787 5.197 ( 11.873 0.430 4.269) 12.625 5.322 ( -11.504 -6.739 2.889) 13.642 5.435 ( 0.234 -0.228 -6.890) 6.898 5.534 ( 6.000 1.092 -2.465) 6.578 5.657 ( 10.957 1.030 3.345) 11.503 5.690 ( -9.128 4.119 -0.851) 10.051 5.852 ( -2.420 -0.289 -10.486) 10.765 5.950 ( 1.956 0.592 14.353) 14.498 6.079 ( 8.514 8.505 -1.692) 12.153 6.187 ( -2.373 11.226 -0.865) 11.507 6.268 ( 3.823 9.242 6.853) 12.124 6.382 ( -8.609 -5.686 1.783) 10.470 6.604 ( 0.284 3.819 -1.474) 4.103 6.697 ( -1.908 6.271 -4.960) 8.220 6.744 ( 3.628 -3.397 -0.346) 4.982 6.793 ( -10.247 8.154 -11.420) 17.375 6.993 ( 4.761 5.028 9.747) 11.956 7.155 ( 0.000 3.817 -1.002) 3.946 7.162 ( -4.082 3.277 1.120) 5.353 7.294 ( -0.271 -2.012 3.850) 4.352 7.332 ( 1.009 12.125 -3.660) 12.705 7.383 ( 0.144 3.151 -6.385) 7.122 7.507 ( 7.219 4.917 8.912) 12.478 7.862 ( -4.570 5.196 -1.048) 6.998 7.942 ( -2.484 2.436 -4.501) 5.689 8.053 ( -3.873 -7.953 -3.389) 9.472 8.166 ( 1.650 1.253 4.257) 4.734 8.194 ( -5.156 4.040 -1.263) 6.671 8.441 ( -3.204 1.880 -3.420) 5.050 8.488 ( 5.825 -0.513 3.104) 6.620 8.617 ( 3.845 2.490 1.813) 4.926 8.717 ( -2.069 3.256 0.282) 3.868 8.785 ( 1.819 2.480 -1.068) 3.256 9.050 ( -10.257 -9.802 -11.922) 18.532 9.189 ( -3.855 13.135 -6.262) 15.053 9.308 ( 4.187 22.507 4.344) 23.302 9.432 ( 11.467 -8.408 21.799) 26.026 10.252 ( -1.300 -2.398 -2.076) 3.428 10.301 ( 3.302 -2.434 2.211) 4.660 10.474 ( -11.690 -3.743 -2.246) 12.479 10.693 ( 1.894 -1.970 -4.180) 4.994 10.824 ( 4.696 -8.298 2.073) 9.757 10.855 ( 7.918 -6.130 2.757) 10.386 11.224 ( -3.894 -4.221 -3.936) 6.963 11.374 ( 6.437 -5.835 4.516) 9.792 11.900 ( -10.702 -1.937 0.390) 10.883 12.086 ( 0.888 -3.760 -1.136) 4.027 12.374 ( 0.099 -1.135 1.786) 2.118 12.431 ( 2.425 0.372 -2.548) 3.537 12.551 ( -9.641 -0.445 -5.865) 11.293 12.718 ( 4.073 -2.523 2.160) 5.256 12.912 ( -17.168 2.616 -5.944) 18.355 13.515 ( 16.344 18.575 6.943) 25.698 14.156 ( 1.941 1.575 -2.082) 3.253 14.210 ( -0.954 3.417 2.820) 4.532 14.309 ( -4.938 1.876 -3.789) 6.500 14.414 ( -0.604 4.535 4.342) 6.307 14.529 ( -0.747 1.928 -6.949) 7.251 14.697 ( 4.655 1.019 0.529) 4.795 15.148 ( -2.623 3.653 -6.166) 7.632 15.197 ( 1.402 6.752 6.859) 9.726 15.346 ( -17.060 3.788 -3.769) 17.877 15.870 ( 17.355 8.024 3.867) 19.507 16.450 ( -2.661 -1.440 -6.207) 6.905 16.596 ( 6.471 -2.365 4.319) 8.131 19.923 ( -3.747 0.976 -3.194) 5.020 20.052 ( 5.385 -0.525 5.012) 7.375 20.239 ( -4.717 -5.329 -0.671) 7.148 20.333 ( 2.188 -6.742 -0.938) 7.150 24.269 ( -5.964 1.240 -2.913) 6.752 24.556 ( 12.387 8.210 -1.297) 14.917 24.846 ( 1.144 -0.095 -0.341) 1.197 24.896 ( 4.848 -0.477 -0.163) 4.874 26.233 ( -2.294 1.480 -1.725) 3.229 26.266 ( 0.051 1.590 1.629) 2.277 26.723 ( -3.037 -1.558 1.694) 3.811 26.734 ( -1.726 -2.550 -1.754) 3.544 27.027 ( -0.531 2.197 0.085) 2.262 27.103 ( 5.077 4.362 0.143) 6.695 27.194 ( -2.523 3.639 -0.196) 4.432 27.294 ( 5.056 1.786 0.095) 5.363 27.830 ( -6.557 4.480 11.251) 13.771 27.944 ( 3.067 4.492 -9.819) 11.224 29.047 ( -1.667 -7.425 -2.148) 7.907 29.113 ( 2.856 -7.686 4.479) 9.343 29.381 ( -4.367 -5.005 -3.264) 7.401 29.540 ( 8.033 -0.672 3.505) 8.790 30.053 ( -17.514 -11.860 -15.881) 26.450 30.373 ( 4.770 -4.129 15.816) 17.028 ======================= Grid point 211 (90/117) ======================= q-point: ( 0.30 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.151 ( -2.574 -12.217 -5.405) 13.605 2.316 ( -6.963 0.307 1.110) 7.058 2.740 ( 7.362 -14.377 10.631) 19.337 2.917 ( 4.975 -23.930 -13.777) 28.057 3.024 ( 10.159 -13.567 10.510) 19.943 3.242 ( 16.372 -0.140 6.029) 17.447 3.534 ( -3.460 -3.824 -6.988) 8.685 3.570 ( -2.501 -8.182 -6.133) 10.527 3.705 ( -12.134 5.565 0.304) 13.352 4.027 ( -2.253 4.717 -8.435) 9.923 4.112 ( -2.617 -4.384 -0.975) 5.198 4.213 ( -1.385 -1.353 0.451) 1.989 4.363 ( 1.706 -5.924 2.214) 6.550 4.460 ( 8.290 -2.196 -1.495) 8.705 4.588 ( -6.255 5.535 4.219) 9.357 4.757 ( -2.463 7.274 4.705) 9.006 4.827 ( -8.838 -3.287 -0.159) 9.431 4.940 ( 9.734 -8.815 0.599) 13.146 5.106 ( 7.497 2.306 5.938) 9.838 5.281 ( 9.388 -0.722 1.435) 9.524 5.327 ( -6.717 0.477 2.398) 7.149 5.415 ( -2.415 -0.027 5.839) 6.319 5.532 ( -7.307 5.704 -5.231) 10.644 5.573 ( 2.094 -3.479 -4.802) 6.288 5.708 ( 6.333 1.360 -3.742) 7.481 5.866 ( 2.077 2.929 -10.771) 11.354 5.890 ( 1.975 5.563 2.305) 6.337 5.932 ( -3.143 5.321 2.733) 6.757 6.040 ( 8.188 -1.708 3.717) 9.153 6.179 ( 11.973 4.137 10.097) 16.199 6.417 ( -17.247 9.239 -5.089) 20.217 6.467 ( -4.250 -3.311 3.344) 6.341 6.562 ( -5.434 3.538 -7.391) 9.832 6.609 ( -1.331 2.061 1.164) 2.715 6.849 ( 4.067 1.550 1.550) 4.620 6.902 ( 3.651 3.283 3.988) 6.326 6.997 ( -3.768 6.274 1.051) 7.393 7.087 ( 1.413 9.141 -3.381) 9.848 7.216 ( 0.384 0.219 -1.666) 1.724 7.294 ( -2.459 1.937 -1.890) 3.656 7.373 ( 1.239 -3.021 1.057) 3.432 7.482 ( 6.725 2.347 3.486) 7.930 7.660 ( -3.584 11.347 -1.350) 11.976 7.885 ( -0.888 2.652 -6.555) 7.127 8.030 ( -5.894 6.190 -1.399) 8.661 8.147 ( -2.207 0.711 3.363) 4.085 8.207 ( 4.137 -1.959 1.556) 4.834 8.358 ( -5.642 0.702 -5.308) 7.778 8.547 ( 7.165 0.761 5.823) 9.264 8.578 ( 0.681 1.348 0.944) 1.781 8.646 ( 0.073 3.409 -1.168) 3.604 8.751 ( 2.876 2.851 -0.094) 4.050 8.848 ( -5.038 9.198 3.347) 11.009 8.982 ( 0.381 10.908 -3.056) 11.335 9.235 ( -7.400 -7.307 -11.797) 15.726 9.560 ( 2.718 1.680 17.484) 17.774 10.284 ( -0.428 -1.919 -0.212) 1.978 10.360 ( 3.744 -1.106 -0.111) 3.905 10.482 ( -6.974 -3.186 -1.490) 7.811 10.724 ( 1.709 -0.073 -4.498) 4.812 10.963 ( 4.467 -3.360 2.265) 6.031 11.046 ( 6.240 -8.024 2.501) 10.468 11.253 ( -3.451 -1.433 -4.185) 5.610 11.519 ( 7.485 -4.174 5.293) 10.073 11.842 ( -12.111 -0.156 -3.463) 12.597 12.158 ( -0.817 -3.827 -1.186) 4.089 12.401 ( 0.784 0.047 2.122) 2.263 12.414 ( -5.007 0.358 -5.766) 7.645 12.524 ( -4.601 -2.882 -4.430) 7.008 12.773 ( -0.998 -1.793 1.397) 2.483 12.861 ( 5.093 0.892 2.034) 5.557 13.279 ( 12.050 13.376 7.857) 19.643 14.114 ( 1.202 3.021 1.950) 3.792 14.168 ( -2.381 -0.377 -3.623) 4.351 14.252 ( -3.585 1.855 -4.104) 5.756 14.308 ( -4.859 4.528 3.054) 7.310 14.450 ( -2.766 4.784 -5.477) 7.780 14.713 ( -0.886 -2.085 0.974) 2.467 15.095 ( 1.494 2.519 3.212) 4.346 15.103 ( 1.579 2.522 1.032) 3.149 15.221 ( -8.436 1.267 -1.563) 8.672 15.763 ( 9.106 11.083 0.360) 14.348 16.478 ( -0.099 -2.604 -5.221) 5.835 16.661 ( 5.099 -0.269 4.107) 6.553 19.874 ( -3.206 1.430 -2.590) 4.363 20.088 ( 5.217 0.262 4.492) 6.889 20.308 ( -4.991 -4.613 -1.292) 6.918 20.464 ( 1.490 -5.268 -0.365) 5.487 24.236 ( -1.182 0.137 -1.225) 1.708 24.467 ( 6.563 6.435 -0.581) 9.209 24.858 ( 1.056 -0.501 0.509) 1.275 24.929 ( 4.010 0.096 -1.069) 4.151 26.184 ( -2.367 1.770 -1.253) 3.210 26.227 ( -0.764 1.996 1.286) 2.494 26.739 ( -3.555 -1.946 1.958) 4.501 26.789 ( -2.425 -4.151 -2.596) 5.463 26.992 ( 0.366 1.389 1.661) 2.196 27.037 ( 3.852 4.566 -1.228) 6.099 27.110 ( -1.259 3.565 -0.961) 3.901 27.279 ( 5.305 3.158 1.614) 6.382 27.759 ( -4.423 0.323 5.376) 6.969 27.903 ( 2.220 1.642 -5.221) 5.906 29.180 ( -0.157 -6.223 -3.657) 7.219 29.265 ( 2.550 -4.743 7.584) 9.301 29.426 ( -1.667 -2.232 -4.127) 4.980 29.576 ( 5.589 -0.712 3.284) 6.521 30.161 ( -12.477 -8.429 -14.811) 21.121 30.467 ( -0.570 -3.883 12.921) 13.504 ======================= Grid point 212 (91/117) ======================= q-point: ( 0.40 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.144 ( -4.179 3.865 -0.734) 5.739 2.441 ( -0.948 -11.116 1.468) 11.252 3.030 ( 7.262 -3.902 5.354) 9.830 3.236 ( 5.384 -7.625 -2.380) 9.632 3.295 ( 3.976 -11.463 -3.876) 12.737 3.395 ( 2.742 -5.829 8.336) 10.535 3.523 ( 0.160 1.067 -6.963) 7.046 3.668 ( -2.898 -5.621 -7.603) 9.889 3.842 ( -0.732 -11.942 -3.723) 12.531 3.944 ( 0.384 -2.922 -1.857) 3.484 4.126 ( -2.179 4.822 7.564) 9.231 4.223 ( 4.813 -3.922 -0.924) 6.277 4.354 ( 1.103 7.459 0.337) 7.547 4.473 ( -7.654 -1.756 -0.864) 7.900 4.592 ( -2.159 -3.183 -4.045) 5.581 4.619 ( 8.158 3.946 10.710) 14.030 4.772 ( -6.687 3.634 -1.036) 7.681 5.043 ( 4.336 0.128 6.024) 7.424 5.092 ( 3.493 3.455 -1.598) 5.166 5.147 ( -9.155 4.764 -5.462) 11.677 5.265 ( 6.323 6.842 2.275) 9.590 5.379 ( -1.504 11.450 3.359) 12.027 5.481 ( -4.876 -1.236 1.802) 5.344 5.530 ( -11.568 0.226 3.277) 12.026 5.713 ( 8.096 -2.623 -0.790) 8.547 5.798 ( 2.352 3.038 -1.977) 4.321 5.862 ( 5.086 3.603 0.028) 6.233 5.989 ( -1.255 -2.926 -13.498) 13.869 6.147 ( 2.292 1.125 3.007) 3.945 6.184 ( -0.037 -3.532 -1.314) 3.768 6.299 ( 0.637 -5.423 -1.491) 5.660 6.415 ( -5.849 3.265 3.366) 7.497 6.536 ( 2.166 -4.899 1.788) 5.647 6.666 ( 0.969 -4.697 4.074) 6.293 6.756 ( 3.333 3.832 1.902) 5.423 6.873 ( -3.566 3.111 0.025) 4.732 6.933 ( 1.387 -0.547 -0.617) 1.614 6.983 ( -1.030 2.700 0.171) 2.894 7.131 ( -1.054 8.164 -2.094) 8.494 7.220 ( 4.186 7.888 -2.888) 9.385 7.363 ( -5.882 3.111 2.510) 7.111 7.468 ( 2.596 1.502 -1.514) 3.360 7.580 ( 4.327 -5.040 0.728) 6.682 7.817 ( 1.511 4.085 -6.220) 7.593 7.913 ( -0.229 2.570 -0.619) 2.654 8.072 ( -1.839 4.770 1.962) 5.475 8.181 ( -4.505 2.130 5.098) 7.129 8.378 ( -2.385 -2.158 -3.057) 4.437 8.507 ( 0.605 3.357 2.880) 4.464 8.576 ( 0.615 1.570 -0.739) 1.841 8.634 ( 3.467 -2.714 3.357) 5.537 8.724 ( 0.498 -0.593 0.997) 1.262 8.780 ( 0.423 -0.018 -1.509) 1.568 8.850 ( -1.934 3.226 -2.991) 4.806 9.275 ( -4.450 -0.967 -7.281) 8.588 9.451 ( -2.627 7.537 9.724) 12.580 10.326 ( 0.956 -2.007 0.802) 2.363 10.383 ( 1.892 0.451 -1.436) 2.417 10.511 ( -2.448 -2.452 0.219) 3.471 10.713 ( 1.372 1.645 -2.936) 3.634 11.029 ( 2.074 -1.433 1.653) 3.014 11.208 ( 4.126 -4.596 1.139) 6.280 11.252 ( -2.133 -0.740 -2.576) 3.426 11.627 ( 9.054 -1.587 6.378) 11.188 11.777 ( -11.372 -0.823 -5.216) 12.538 12.218 ( -0.840 -2.620 -1.287) 3.038 12.366 ( -1.940 2.312 -0.249) 3.029 12.384 ( -3.895 -0.468 -3.934) 5.556 12.575 ( 0.433 -2.620 -0.464) 2.696 12.787 ( 1.515 0.072 1.855) 2.396 12.886 ( 4.123 0.031 0.807) 4.201 13.166 ( 7.250 5.157 5.682) 10.557 14.084 ( 6.539 2.498 3.859) 7.994 14.161 ( -0.868 0.984 -1.342) 1.877 14.191 ( -18.488 -2.886 -13.057) 22.817 14.203 ( -1.885 2.710 1.269) 3.537 14.335 ( 2.636 5.860 2.732) 6.982 14.768 ( -0.204 -3.129 1.329) 3.406 15.055 ( 1.049 1.350 5.572) 5.829 15.099 ( 1.013 1.315 -2.967) 3.400 15.208 ( -2.040 -4.303 2.762) 5.505 15.569 ( 2.974 11.893 -3.129) 12.652 16.538 ( 1.117 -3.071 -3.581) 4.848 16.672 ( 2.597 1.574 3.262) 4.457 19.833 ( -1.873 0.931 -1.455) 2.548 20.111 ( 3.293 0.180 2.719) 4.274 20.352 ( -3.249 -2.486 -1.093) 4.234 20.550 ( 0.707 -2.732 -0.039) 2.822 24.238 ( 0.264 -0.381 -0.221) 0.514 24.396 ( 2.703 3.654 -0.361) 4.560 24.879 ( 0.841 -0.934 1.101) 1.671 24.937 ( 1.950 0.793 -1.492) 2.580 26.143 ( -1.446 1.042 -0.681) 1.908 26.189 ( -0.704 1.349 0.753) 1.698 26.752 ( -2.298 -1.076 1.048) 2.746 26.851 ( -3.412 -3.859 -1.394) 5.336 26.967 ( 1.589 2.182 0.388) 2.727 26.997 ( 2.504 1.143 -0.065) 2.753 27.045 ( -0.334 2.458 -1.651) 2.980 27.243 ( 3.169 2.928 2.082) 4.791 27.746 ( -2.030 -0.488 1.889) 2.816 27.891 ( 1.066 0.593 -2.136) 2.460 29.265 ( 0.868 -2.425 -5.706) 6.261 29.315 ( 0.959 0.331 7.743) 7.809 29.459 ( -1.054 -2.122 -1.242) 2.675 29.660 ( 4.449 -3.457 1.295) 5.781 30.212 ( -7.617 -3.794 -8.317) 11.899 30.529 ( -1.215 -2.548 6.689) 7.260 ======================= Grid point 213 (92/117) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.091 ( -0.000 0.000 0.000) 0.000 2.567 ( -0.000 0.000 0.000) 0.000 3.065 ( -0.000 0.000 -0.000) 0.000 3.287 ( -0.000 0.000 0.000) 0.000 3.444 ( -0.000 0.000 0.000) 0.000 3.480 ( 0.000 -0.000 0.000) 0.000 3.538 ( 0.000 0.000 -0.000) 0.000 3.723 ( -0.000 0.000 0.000) 0.000 3.941 ( 0.000 0.000 -0.000) 0.000 3.956 ( -0.000 -0.000 0.000) 0.000 4.162 ( -0.000 0.000 0.000) 0.000 4.245 ( -0.000 0.000 0.000) 0.000 4.306 ( -0.000 0.000 -0.000) 0.000 4.462 ( 0.000 0.000 0.000) 0.000 4.475 ( -0.000 -0.000 -0.000) 0.000 4.713 ( -0.000 0.000 0.000) 0.000 4.759 ( -0.000 0.000 0.000) 0.000 5.001 ( 0.000 0.000 0.000) 0.000 5.085 ( -0.000 0.000 -0.000) 0.000 5.144 ( 0.000 0.000 0.000) 0.000 5.168 ( -0.000 -0.000 -0.000) 0.000 5.190 ( 0.000 0.000 0.000) 0.000 5.389 ( -0.000 -0.000 0.000) 0.000 5.581 ( -0.000 0.000 -0.000) 0.000 5.713 ( -0.000 -0.000 0.000) 0.000 5.804 ( -0.000 0.000 -0.000) 0.000 5.828 ( -0.000 0.000 -0.000) 0.000 5.981 ( -0.000 0.000 0.000) 0.000 6.135 ( -0.000 0.000 -0.000) 0.000 6.289 ( 0.001 -0.000 -0.000) 0.001 6.289 ( -0.001 0.000 0.000) 0.001 6.428 ( -0.000 0.000 0.000) 0.000 6.608 ( -0.000 0.000 0.000) 0.000 6.736 ( -0.000 0.000 0.000) 0.000 6.802 ( -0.000 0.000 -0.000) 0.000 6.811 ( 0.000 -0.000 0.000) 0.000 6.892 ( -0.000 0.000 -0.000) 0.000 6.977 ( -0.000 0.000 0.000) 0.000 7.035 ( -0.000 0.000 0.000) 0.000 7.084 ( -0.000 -0.000 0.000) 0.000 7.334 ( -0.000 0.000 -0.000) 0.000 7.467 ( -0.000 0.000 0.000) 0.000 7.662 ( 0.000 0.000 0.000) 0.000 7.772 ( 0.000 0.000 0.000) 0.000 7.913 ( -0.000 0.000 -0.000) 0.000 8.017 ( -0.000 0.000 -0.000) 0.000 8.110 ( -0.000 0.000 0.000) 0.000 8.427 ( -0.000 0.000 0.000) 0.000 8.436 ( -0.000 -0.000 -0.000) 0.000 8.577 ( -0.000 0.000 -0.000) 0.000 8.674 ( -0.000 0.000 0.000) 0.000 8.762 ( 0.000 -0.000 0.000) 0.000 8.785 ( -0.000 0.000 -0.000) 0.000 8.807 ( 0.000 0.000 0.000) 0.000 9.243 ( 0.000 0.000 0.000) 0.000 9.359 ( -0.000 0.000 0.000) 0.000 10.358 ( -0.000 0.000 0.000) 0.000 10.375 ( 0.000 0.000 0.000) 0.000 10.530 ( -0.000 0.000 0.000) 0.000 10.696 ( 0.000 0.000 0.000) 0.000 11.049 ( -0.000 0.000 0.000) 0.000 11.251 ( -0.000 0.000 0.000) 0.000 11.269 ( -0.000 0.000 0.000) 0.000 11.689 ( -0.000 0.000 0.000) 0.000 11.734 ( -0.000 0.000 0.000) 0.000 12.242 ( -0.000 0.000 0.000) 0.000 12.329 ( -0.000 0.000 -0.000) 0.000 12.379 ( -0.000 0.000 0.000) 0.000 12.605 ( -0.000 0.000 0.000) 0.000 12.793 ( -0.000 0.000 -0.000) 0.000 12.901 ( -0.000 0.000 0.000) 0.000 13.142 ( -0.000 0.000 0.000) 0.000 14.089 ( 0.000 0.000 0.000) 0.000 14.136 ( -0.000 -0.000 -0.000) 0.000 14.144 ( 0.000 0.000 -0.000) 0.000 14.182 ( -0.000 0.000 -0.000) 0.000 14.286 ( 0.000 0.000 0.000) 0.000 14.803 ( -0.000 0.000 0.000) 0.000 15.053 ( 0.000 -0.000 0.000) 0.000 15.077 ( -0.000 0.000 -0.000) 0.000 15.321 ( -0.000 0.000 -0.000) 0.000 15.387 ( -0.000 0.000 0.000) 0.000 16.583 ( -0.000 -0.000 -0.000) 0.000 16.654 ( -0.000 0.000 0.000) 0.000 19.818 ( -0.000 0.000 0.000) 0.000 20.120 ( -0.000 0.000 -0.000) 0.000 20.366 ( -0.000 0.000 0.000) 0.000 20.578 ( -0.000 0.000 0.000) 0.000 24.244 ( -0.000 0.000 0.000) 0.000 24.366 ( -0.000 0.000 0.000) 0.000 24.896 ( -0.000 0.000 -0.000) 0.000 24.930 ( -0.000 0.000 0.000) 0.000 26.128 ( -0.000 0.000 0.000) 0.000 26.172 ( -0.000 0.000 0.000) 0.000 26.755 ( -0.000 0.000 0.000) 0.000 26.883 ( -0.000 0.000 0.000) 0.000 26.946 ( -0.000 0.000 0.000) 0.000 26.998 ( -0.000 0.000 -0.000) 0.000 27.018 ( 0.000 -0.000 0.000) 0.000 27.221 ( 0.000 0.000 0.000) 0.000 27.746 ( -0.000 0.000 0.000) 0.000 27.888 ( -0.000 0.000 0.000) 0.000 29.292 ( 0.000 -0.000 -0.000) 0.000 29.306 ( -0.000 0.000 0.000) 0.000 29.480 ( 0.000 0.000 0.000) 0.000 29.715 ( 0.000 0.000 0.000) 0.000 30.222 ( -0.000 0.000 -0.000) 0.000 30.552 ( -0.000 0.000 0.000) 0.000 ======================= Grid point 220 (93/117) ======================= q-point: ( 0.10 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.563 ( -12.434 -0.000 -34.191) 36.381 1.786 ( 1.978 0.000 -29.337) 29.403 1.864 ( 4.846 0.000 26.215) 26.659 2.022 ( 14.357 0.000 37.530) 40.182 2.800 ( -4.682 -0.000 -43.273) 43.525 2.971 ( -4.229 -0.000 -3.658) 5.591 3.255 ( 9.303 0.000 -1.837) 9.483 3.369 ( 31.745 0.000 55.259) 63.729 3.735 ( -4.247 -0.000 -5.318) 6.806 3.764 ( -10.056 -0.000 -0.591) 10.073 3.911 ( -11.428 -0.000 6.349) 13.074 4.197 ( 9.646 0.000 -4.729) 10.743 4.477 ( -7.841 -0.000 -9.786) 12.540 4.566 ( 0.187 0.000 -0.990) 1.007 4.606 ( -7.265 -0.000 2.049) 7.549 4.694 ( -19.986 -0.000 -2.388) 20.128 4.880 ( -1.991 -0.000 -21.786) 21.877 4.895 ( 9.761 0.000 9.179) 13.399 5.124 ( 5.590 0.000 -2.091) 5.968 5.163 ( -2.081 -0.000 -8.722) 8.967 5.404 ( -4.822 -0.000 11.009) 12.019 5.408 ( 9.465 0.000 14.815) 17.581 5.631 ( 7.991 0.000 -2.423) 8.351 5.635 ( 0.144 0.000 4.343) 4.345 5.712 ( -1.495 -0.000 3.404) 3.718 5.868 ( 11.605 0.000 -5.307) 12.761 6.057 ( -1.925 -0.000 6.404) 6.687 6.064 ( -9.337 -0.000 14.432) 17.189 6.318 ( 8.106 0.000 -14.690) 16.778 6.337 ( 13.929 0.000 -0.619) 13.943 6.583 ( -11.251 -0.000 2.370) 11.498 6.730 ( -1.670 -0.000 -6.455) 6.668 6.759 ( -1.196 -0.000 2.666) 2.922 6.815 ( 0.135 0.000 1.597) 1.603 6.854 ( -6.263 -0.000 -7.230) 9.565 7.000 ( 6.205 0.000 8.944) 10.886 7.256 ( -4.154 -0.000 -6.920) 8.071 7.298 ( -4.946 -0.000 -6.515) 8.180 7.350 ( -0.452 -0.000 3.724) 3.751 7.533 ( -6.355 -0.000 4.268) 7.656 7.577 ( 13.698 0.000 8.500) 16.121 7.741 ( 2.680 0.000 6.216) 6.769 7.823 ( -3.889 -0.000 -5.477) 6.718 7.904 ( 2.331 0.000 -1.142) 2.595 8.110 ( -6.896 -0.000 -8.031) 10.586 8.214 ( -10.716 -0.000 -3.208) 11.186 8.240 ( 1.758 0.000 4.948) 5.251 8.418 ( -6.336 -0.000 -1.265) 6.461 8.525 ( 6.661 0.000 3.274) 7.422 8.533 ( 3.753 0.000 -1.187) 3.936 8.661 ( 2.367 0.000 0.132) 2.370 8.740 ( 1.594 0.000 -0.971) 1.866 8.854 ( -0.128 -0.000 0.242) 0.274 9.079 ( 17.879 0.000 15.744) 23.823 9.844 ( -16.543 -0.000 -5.245) 17.354 10.016 ( -1.949 -0.000 -1.095) 2.236 10.042 ( -1.405 -0.000 -0.091) 1.408 10.187 ( 7.987 0.000 -2.765) 8.452 10.453 ( -0.842 -0.000 -0.655) 1.067 10.521 ( 5.877 0.000 7.540) 9.560 10.624 ( 3.507 0.000 -6.797) 7.649 10.642 ( 4.035 0.000 5.298) 6.659 11.068 ( -4.054 -0.000 -4.742) 6.238 11.213 ( 5.955 0.000 4.437) 7.427 11.813 ( -8.053 -0.000 6.871) 10.586 11.970 ( 1.754 0.000 -2.907) 3.395 12.370 ( -2.997 -0.000 -0.238) 3.006 12.431 ( 0.579 0.000 -0.117) 0.591 12.577 ( 2.245 0.000 -0.549) 2.311 12.673 ( 6.822 0.000 3.173) 7.524 12.939 ( -49.651 -0.000 -17.881) 52.773 14.020 ( 21.507 0.000 -3.906) 21.859 14.123 ( -8.048 -0.000 -2.654) 8.475 14.313 ( -3.462 -0.000 4.605) 5.761 14.425 ( -2.885 -0.000 -6.357) 6.981 14.465 ( -3.783 -0.000 0.749) 3.856 14.598 ( 7.012 0.000 -0.222) 7.015 14.787 ( 14.141 0.000 0.354) 14.145 15.288 ( -7.435 -0.000 1.437) 7.572 15.334 ( -16.242 -0.000 -14.832) 21.995 15.610 ( 0.129 0.000 1.637) 1.642 16.007 ( 16.777 0.000 6.843) 18.119 16.416 ( -0.296 -0.000 -1.145) 1.183 16.515 ( 7.804 0.000 -2.455) 8.181 19.918 ( -1.067 -0.000 -0.571) 1.210 19.975 ( 2.951 0.000 0.553) 3.002 20.150 ( -0.122 -0.000 0.898) 0.906 20.151 ( -0.216 -0.000 -1.578) 1.592 24.309 ( -10.872 -0.000 -3.871) 11.541 24.772 ( 5.178 0.000 -6.308) 8.161 24.875 ( 3.710 0.000 2.196) 4.312 24.904 ( 20.184 0.000 -7.475) 21.523 26.260 ( -1.578 -0.000 -2.822) 3.233 26.293 ( 1.278 0.000 1.511) 1.979 26.709 ( -2.445 -0.000 1.784) 3.026 26.714 ( -3.545 -0.000 -1.582) 3.881 27.099 ( 2.975 0.000 -2.643) 3.980 27.163 ( 5.016 0.000 2.062) 5.424 27.291 ( -0.773 -0.000 0.859) 1.155 27.324 ( 2.339 0.000 -0.375) 2.369 28.153 ( -7.424 -0.000 3.318) 8.132 28.207 ( -4.055 -0.000 -2.197) 4.612 28.897 ( -2.531 -0.000 4.922) 5.534 28.934 ( 0.877 0.000 -3.632) 3.736 29.034 ( -6.297 -0.000 -6.546) 9.083 29.194 ( 1.420 0.000 3.545) 3.819 29.819 ( -14.737 -0.000 7.754) 16.653 30.295 ( 13.408 0.000 7.195) 15.217 ======================= Grid point 221 (94/117) ======================= q-point: ( 0.20 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.616 ( -5.552 -11.055 -27.198) 29.880 1.939 ( 5.961 -8.939 24.780) 27.009 1.955 ( 7.748 -13.796 -24.753) 29.378 2.329 ( 15.097 -16.543 31.494) 38.645 2.843 ( -5.384 4.368 -9.287) 11.589 2.993 ( -9.491 -14.841 -15.728) 23.615 3.352 ( 12.813 -5.196 -14.415) 19.973 3.594 ( -3.010 3.674 -4.164) 6.317 3.745 ( -1.224 0.256 12.980) 13.041 3.781 ( 16.562 -10.678 32.137) 37.698 3.844 ( -2.974 -3.680 1.013) 4.839 4.152 ( -1.224 5.818 1.002) 6.029 4.360 ( -10.841 2.023 -6.397) 12.749 4.435 ( -6.899 2.140 0.961) 7.287 4.665 ( 8.800 -2.973 -3.092) 9.790 4.733 ( -7.378 2.105 -13.013) 15.107 4.820 ( -3.481 -1.990 -6.259) 7.433 4.916 ( 1.621 3.782 -7.160) 8.258 5.097 ( -3.063 -5.437 2.944) 6.900 5.272 ( 9.055 -1.926 3.197) 9.795 5.332 ( 6.317 8.792 14.034) 17.724 5.425 ( -3.318 -1.749 2.641) 4.587 5.557 ( 1.972 1.541 -3.892) 4.627 5.655 ( -0.475 2.636 4.578) 5.304 5.779 ( 9.445 -2.211 2.453) 10.006 5.906 ( 1.531 5.341 -4.136) 6.927 5.962 ( 1.479 0.309 14.206) 14.286 6.161 ( -5.755 -5.457 5.543) 9.676 6.298 ( 2.338 5.896 -8.532) 10.631 6.354 ( 4.401 5.458 0.524) 7.031 6.480 ( 4.957 5.507 0.918) 7.466 6.661 ( -3.685 3.585 -7.495) 9.089 6.733 ( -1.417 1.543 3.209) 3.832 6.802 ( -8.726 1.544 -11.991) 14.910 6.834 ( 3.015 0.821 2.315) 3.889 7.030 ( 1.897 0.056 7.090) 7.340 7.189 ( 0.533 2.685 -3.092) 4.130 7.252 ( -7.670 1.981 -3.069) 8.496 7.326 ( 3.529 3.860 4.652) 7.000 7.420 ( -2.153 4.926 1.610) 5.612 7.549 ( 2.550 8.544 -0.208) 8.919 7.710 ( 4.995 9.630 4.172) 11.623 7.842 ( -4.000 -7.730 1.349) 8.808 7.873 ( -1.930 -0.064 -3.056) 3.615 8.018 ( -5.326 5.017 -3.624) 8.165 8.153 ( -5.466 0.017 -2.414) 5.976 8.242 ( -1.042 0.539 1.685) 2.053 8.403 ( -5.568 -0.547 -3.182) 6.436 8.551 ( 5.233 1.233 2.662) 5.999 8.622 ( -0.741 -7.640 -4.157) 8.729 8.726 ( -0.759 -1.811 -3.686) 4.177 8.785 ( -2.078 -2.567 -0.325) 3.319 8.841 ( 2.482 1.529 0.506) 2.959 9.299 ( 16.405 -9.404 21.912) 28.943 9.524 ( -8.417 16.676 -3.808) 19.064 9.783 ( 2.850 20.164 1.525) 20.421 10.141 ( -6.480 -6.872 -3.257) 9.991 10.271 ( 4.952 -3.002 0.887) 5.858 10.384 ( -2.131 1.119 0.657) 2.495 10.647 ( 0.630 -3.608 -4.561) 5.849 10.700 ( 6.096 -6.405 4.218) 9.797 10.778 ( 7.661 -7.491 2.105) 10.919 11.106 ( -2.439 -5.220 -3.641) 6.816 11.298 ( 4.955 -4.730 3.222) 7.571 11.795 ( -8.761 -2.419 6.713) 11.300 12.005 ( -2.765 -3.342 -2.986) 5.266 12.355 ( -0.990 -0.446 -0.522) 1.205 12.441 ( -0.071 -0.957 -0.445) 1.057 12.519 ( -12.587 4.174 -9.101) 16.084 12.689 ( -5.676 -2.314 -2.381) 6.575 12.789 ( -4.177 -3.922 0.428) 5.746 13.906 ( 3.157 12.974 -2.280) 13.546 14.150 ( -6.756 -1.550 -3.871) 7.939 14.236 ( -4.419 3.005 -2.949) 6.104 14.372 ( 1.976 3.880 -0.031) 4.354 14.463 ( -1.003 0.969 -1.424) 1.993 14.611 ( 7.339 3.178 0.499) 8.013 14.811 ( 9.269 5.232 -1.981) 10.826 15.170 ( -9.861 2.486 -7.890) 12.871 15.261 ( -9.553 0.296 -2.687) 9.928 15.452 ( 2.410 13.319 7.290) 15.373 16.083 ( 12.158 3.482 1.737) 12.766 16.430 ( 1.385 -0.601 -3.124) 3.469 16.583 ( 6.588 -2.369 0.025) 7.001 19.917 ( -1.231 0.116 -1.137) 1.680 20.038 ( 3.230 -3.662 2.963) 5.712 20.152 ( -1.643 -0.989 -0.223) 1.930 20.212 ( 0.515 -5.675 -1.855) 5.992 24.258 ( -2.811 0.606 -2.094) 3.557 24.753 ( 2.557 3.603 -6.149) 7.572 24.892 ( 5.180 1.396 1.592) 5.596 24.966 ( 15.969 4.506 -6.940) 17.985 26.241 ( -2.228 0.835 -2.170) 3.221 26.292 ( 0.466 0.984 0.620) 1.253 26.680 ( -4.205 -0.323 -1.064) 4.350 26.699 ( -2.515 -0.279 1.525) 2.954 27.078 ( 2.288 3.087 -0.216) 3.848 27.205 ( 6.967 1.385 -0.036) 7.104 27.252 ( -0.903 2.992 0.891) 3.249 27.336 ( 3.513 0.191 -0.980) 3.652 27.941 ( -8.742 11.061 13.680) 19.645 28.063 ( -2.451 7.049 -9.365) 11.975 28.911 ( -1.985 -4.746 0.678) 5.189 28.996 ( 2.043 -5.297 1.282) 5.820 29.183 ( -5.060 -11.520 -1.286) 12.648 29.439 ( 0.311 -18.339 -8.467) 20.202 29.758 ( -11.472 -1.223 6.489) 13.237 30.363 ( 4.967 -0.512 10.136) 11.299 ======================= Grid point 222 (95/117) ======================= q-point: ( 0.30 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.844 ( -1.635 -14.774 -16.258) 22.029 2.209 ( 2.534 -11.812 16.197) 20.206 2.425 ( 10.150 -25.604 -19.706) 33.866 2.678 ( 1.791 3.685 5.987) 7.255 2.792 ( 14.169 -17.822 22.875) 32.275 3.241 ( -6.365 -15.109 -10.785) 19.625 3.435 ( 6.359 4.407 4.059) 8.737 3.551 ( -12.634 4.229 -3.656) 13.816 3.692 ( -4.956 -4.593 -7.979) 10.456 3.850 ( -1.253 -9.304 -13.144) 16.153 4.051 ( 2.084 0.355 4.223) 4.722 4.236 ( -0.500 -2.480 4.292) 4.982 4.288 ( 0.704 -1.442 -0.949) 1.864 4.441 ( -1.480 -2.496 5.314) 6.055 4.597 ( 4.565 -1.880 2.956) 5.754 4.753 ( 3.505 0.338 0.032) 3.522 4.826 ( 0.938 1.248 -2.739) 3.153 4.948 ( 7.777 -4.615 -1.063) 9.106 5.118 ( -7.499 4.361 2.990) 9.176 5.245 ( 1.730 -0.880 10.847) 11.019 5.348 ( 11.754 0.175 5.279) 12.886 5.450 ( 1.926 -2.395 -5.113) 5.965 5.562 ( -4.122 -0.661 -4.248) 5.956 5.602 ( -1.355 4.823 -2.517) 5.606 5.776 ( 4.317 5.687 0.875) 7.193 5.875 ( 7.780 -1.449 -1.640) 8.082 5.987 ( 3.515 1.423 11.910) 12.499 6.071 ( -4.860 4.903 -5.591) 8.884 6.163 ( -2.203 12.230 -0.913) 12.460 6.290 ( -2.595 -1.410 7.370) 7.940 6.394 ( 7.506 6.148 5.783) 11.294 6.532 ( -9.097 7.493 -6.874) 13.644 6.635 ( -3.217 5.913 -8.735) 11.028 6.709 ( -2.367 5.191 -4.116) 7.035 6.824 ( 5.180 -0.280 3.528) 6.273 7.027 ( -1.485 2.533 4.965) 5.768 7.130 ( -0.003 7.422 4.169) 8.513 7.181 ( 2.035 1.260 -2.185) 3.241 7.255 ( -4.340 -0.385 3.243) 5.432 7.326 ( -1.125 9.470 0.594) 9.555 7.390 ( 0.090 3.238 -9.351) 9.896 7.566 ( 1.450 4.240 3.260) 5.542 7.825 ( -1.733 6.018 -1.027) 6.346 7.890 ( -3.941 1.729 -4.276) 6.066 8.008 ( -3.173 -5.895 0.870) 6.751 8.130 ( -2.288 -1.790 1.738) 3.385 8.206 ( 0.463 2.559 -0.765) 2.711 8.364 ( -5.394 2.172 -3.924) 7.015 8.566 ( 4.476 -1.128 1.794) 4.952 8.638 ( -0.359 3.484 -0.515) 3.540 8.721 ( 2.219 3.492 0.727) 4.201 8.795 ( -0.400 0.435 -2.836) 2.896 8.931 ( -7.715 -10.308 -10.938) 16.895 9.154 ( -0.681 16.258 -2.178) 16.417 9.353 ( 2.292 22.357 6.711) 23.455 9.544 ( 2.376 -5.353 17.863) 18.799 10.217 ( -3.145 -4.577 -1.881) 5.863 10.352 ( 4.474 -2.417 3.881) 6.396 10.390 ( -0.920 -1.856 -2.678) 3.386 10.703 ( 0.843 -2.068 -5.098) 5.565 10.898 ( 6.746 -8.417 3.255) 11.267 10.944 ( 5.554 -5.402 2.555) 8.158 11.190 ( -1.409 -3.830 -3.171) 5.168 11.439 ( 2.937 -6.499 1.174) 7.228 11.775 ( -9.129 -0.836 3.138) 9.689 12.055 ( -4.370 -4.559 -3.447) 7.195 12.373 ( -9.404 0.043 -8.195) 12.474 12.393 ( -1.209 -1.135 1.980) 2.582 12.468 ( 1.496 -1.449 -1.263) 2.436 12.731 ( 1.234 -2.445 1.742) 3.246 12.872 ( 4.860 -2.691 5.149) 7.574 13.637 ( 4.159 15.771 0.751) 16.328 14.065 ( -16.468 0.058 -5.801) 17.460 14.193 ( 1.792 1.964 -4.654) 5.360 14.305 ( -0.823 3.589 -0.272) 3.692 14.378 ( -5.353 5.358 -3.753) 8.453 14.564 ( 5.323 5.549 1.695) 7.874 14.744 ( 5.947 4.176 0.385) 7.277 15.113 ( -1.686 0.108 -3.817) 4.175 15.199 ( -5.540 1.098 -0.952) 5.728 15.239 ( 2.689 9.511 9.241) 13.531 16.004 ( 3.793 8.937 -2.782) 10.099 16.456 ( 4.498 -0.657 -3.082) 5.492 16.670 ( 4.820 -2.200 2.295) 5.774 19.891 ( -1.040 1.588 -1.019) 2.155 20.116 ( 3.961 -0.598 3.936) 5.615 20.183 ( -3.765 -4.839 -0.608) 6.161 20.346 ( 0.100 -7.049 -1.973) 7.320 24.245 ( 1.988 0.624 0.296) 2.105 24.656 ( 3.924 7.791 -5.542) 10.335 24.885 ( 4.876 1.982 0.937) 5.346 24.972 ( 7.234 1.727 -2.374) 7.807 26.200 ( -2.802 1.533 -1.246) 3.428 26.259 ( -1.487 1.954 0.484) 2.503 26.682 ( -3.342 -1.924 0.334) 3.871 26.707 ( -2.239 -2.287 -0.257) 3.211 27.030 ( 0.682 2.502 1.271) 2.888 27.142 ( -0.124 4.943 -0.685) 4.992 27.202 ( 5.045 4.452 -0.165) 6.731 27.361 ( 5.721 1.144 0.123) 5.835 27.758 ( -6.270 3.233 9.471) 11.810 27.954 ( -0.438 3.184 -7.088) 7.783 29.036 ( 0.362 -7.898 -0.936) 7.962 29.151 ( 2.848 -8.098 5.281) 10.078 29.335 ( -2.723 -6.492 -3.758) 7.980 29.646 ( 7.890 2.788 5.527) 10.028 29.821 ( -17.047 -16.621 -15.020) 28.151 30.394 ( -2.889 -2.141 12.354) 12.867 ======================= Grid point 223 (96/117) ======================= q-point: ( 0.40 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.144 ( 1.336 -15.599 -6.711) 17.033 2.236 ( -4.203 4.218 2.993) 6.664 2.871 ( 10.593 -16.362 13.933) 23.959 2.977 ( 5.971 -21.886 -13.151) 26.222 3.165 ( 10.727 -7.751 7.092) 15.015 3.406 ( 5.304 1.842 3.271) 6.498 3.485 ( -4.963 -8.174 -10.732) 14.374 3.489 ( -2.610 -5.311 0.092) 5.918 3.619 ( -2.908 -4.750 -0.443) 5.587 3.987 ( -2.489 3.946 -6.896) 8.326 4.083 ( -3.862 -2.990 3.211) 5.845 4.191 ( -0.623 -4.687 -3.451) 5.854 4.376 ( 0.300 -3.934 -1.714) 4.301 4.459 ( -7.962 -4.629 -3.705) 9.927 4.588 ( 4.233 9.952 6.890) 12.823 4.738 ( -0.430 7.900 7.803) 11.112 4.769 ( 1.122 -0.451 0.585) 1.343 5.066 ( 8.487 -3.473 -0.904) 9.215 5.193 ( 5.192 5.107 3.704) 8.171 5.215 ( -11.571 -10.214 0.145) 15.435 5.349 ( -2.865 13.648 2.384) 14.148 5.405 ( 4.453 3.266 1.035) 5.618 5.499 ( 5.792 0.002 2.525) 6.319 5.642 ( 6.530 -7.742 -3.480) 10.710 5.722 ( -4.625 11.203 -2.208) 12.319 5.818 ( -5.422 2.932 -2.498) 6.651 5.930 ( 4.732 0.437 -4.052) 6.245 5.974 ( 6.846 2.400 -6.450) 9.707 6.157 ( 8.255 -0.780 3.203) 8.889 6.236 ( -8.024 6.805 2.527) 10.820 6.280 ( 0.457 0.510 7.284) 7.316 6.437 ( 1.120 -1.958 5.871) 6.290 6.509 ( -0.840 7.518 -2.710) 8.036 6.615 ( 0.963 -0.463 2.451) 2.674 6.862 ( -2.632 1.118 -1.519) 3.238 6.901 ( -3.642 5.979 -2.778) 7.531 6.949 ( -4.304 5.660 2.356) 7.490 7.103 ( 2.223 8.662 -0.275) 8.946 7.201 ( -2.503 0.211 -0.699) 2.607 7.284 ( 0.601 0.267 -1.615) 1.744 7.378 ( -0.390 -1.281 -1.173) 1.780 7.536 ( 2.358 2.108 -0.591) 3.217 7.660 ( 1.540 7.979 -0.155) 8.128 7.855 ( -1.544 1.038 -6.023) 6.304 7.978 ( -1.943 3.399 2.429) 4.607 8.128 ( -0.927 1.005 1.364) 1.931 8.173 ( -9.016 3.857 -1.373) 9.902 8.355 ( 4.399 -4.716 -0.920) 6.514 8.540 ( -3.888 4.517 -2.804) 6.586 8.617 ( 1.216 0.320 3.655) 3.866 8.682 ( 4.097 1.506 -1.415) 4.589 8.784 ( 2.228 2.989 -0.870) 3.828 8.813 ( -0.207 10.204 6.586) 12.147 8.962 ( -2.021 8.429 -9.100) 12.568 9.161 ( -3.866 -4.380 -1.077) 5.941 9.550 ( -6.231 3.605 10.976) 13.127 10.288 ( 1.398 -3.008 0.974) 3.457 10.402 ( 1.956 0.196 -2.201) 2.950 10.440 ( 1.302 -3.558 2.301) 4.433 10.728 ( -0.219 -0.331 -5.052) 5.067 11.030 ( 5.609 -2.021 3.492) 6.909 11.118 ( 4.935 -7.581 1.883) 9.240 11.228 ( -0.318 -1.064 -3.196) 3.383 11.563 ( -3.391 -5.604 -2.905) 7.165 11.747 ( -0.304 -0.098 5.408) 5.418 12.127 ( -3.349 -4.872 -3.433) 6.836 12.325 ( -6.013 -1.248 -4.397) 7.553 12.403 ( -0.622 1.027 -0.095) 1.204 12.527 ( 3.245 -2.849 0.929) 4.417 12.780 ( 1.554 -1.379 2.608) 3.334 12.930 ( 5.064 0.330 3.849) 6.369 13.383 ( 4.137 12.279 2.338) 13.166 13.987 ( -16.779 -2.887 -9.667) 19.579 14.160 ( -1.120 1.398 -3.707) 4.118 14.200 ( -5.693 4.355 -6.508) 9.681 14.251 ( -3.235 3.560 1.757) 5.122 14.486 ( 7.733 6.227 7.119) 12.216 14.746 ( 6.442 0.087 3.022) 7.116 15.115 ( 0.339 2.073 5.003) 5.426 15.119 ( -0.152 1.562 -2.388) 2.857 15.160 ( -0.486 1.025 3.439) 3.621 15.806 ( -1.655 11.333 -6.079) 12.967 16.508 ( 5.009 -1.504 -2.120) 5.644 16.713 ( 2.828 0.388 2.364) 3.706 19.853 ( 0.016 1.686 -0.095) 1.689 20.124 ( -0.655 0.212 0.035) 0.689 20.271 ( -0.015 -4.521 2.067) 4.971 20.468 ( -0.666 -5.495 -1.602) 5.763 24.250 ( 3.305 0.658 1.485) 3.682 24.522 ( 2.323 7.233 -3.547) 8.384 24.885 ( 3.108 0.629 1.139) 3.369 24.975 ( 3.398 1.472 -1.744) 4.093 26.154 ( -2.338 1.304 -0.721) 2.773 26.209 ( -2.217 1.677 0.398) 2.808 26.705 ( -2.177 -2.068 1.335) 3.286 26.754 ( -2.719 -3.760 -1.516) 4.881 26.993 ( -0.227 1.579 1.953) 2.521 27.058 ( -0.148 3.216 -1.600) 3.596 27.138 ( 5.302 5.038 -1.634) 7.494 27.338 ( 3.591 4.052 3.110) 6.244 27.720 ( -2.187 -0.870 2.833) 3.684 27.910 ( -0.594 1.230 -3.360) 3.627 29.192 ( 2.513 -6.284 -2.256) 7.134 29.301 ( 2.369 -4.057 8.037) 9.309 29.408 ( -0.987 -2.658 -3.874) 4.800 29.634 ( 2.269 -0.393 1.539) 2.770 30.015 ( -8.052 -10.973 -12.245) 18.308 30.435 ( -5.927 -4.460 10.127) 12.553 ======================= Grid point 224 (97/117) ======================= q-point: ( 0.50 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.145 ( 4.151 3.456 1.626) 5.641 2.441 ( 0.507 -12.009 -0.806) 12.047 3.122 ( 7.158 1.558 5.019) 8.880 3.268 ( 1.040 -9.059 -7.025) 11.511 3.332 ( 1.947 -8.228 -0.506) 8.470 3.368 ( -5.381 0.187 2.882) 6.107 3.564 ( 3.824 -5.585 -3.765) 7.745 3.671 ( 2.935 -4.184 -3.446) 6.163 3.817 ( -2.117 -8.396 -2.954) 9.149 3.948 ( 0.681 -6.979 -1.661) 7.206 4.104 ( -1.626 0.438 9.221) 9.373 4.308 ( 8.284 -2.870 -0.715) 8.796 4.323 ( -4.426 7.941 -1.166) 9.166 4.386 ( -6.283 0.880 -3.303) 7.152 4.534 ( -4.125 -3.631 2.078) 5.875 4.657 ( -3.725 1.629 3.612) 5.439 4.803 ( 6.766 -0.407 3.895) 7.818 5.030 ( -5.113 7.961 -2.294) 9.736 5.095 ( -0.998 2.959 -3.845) 4.953 5.133 ( 3.297 2.405 0.935) 4.187 5.305 ( -2.639 4.123 1.991) 5.284 5.361 ( -1.335 15.087 6.033) 16.303 5.434 ( -1.964 -4.119 2.348) 5.131 5.470 ( 5.459 2.044 0.554) 5.856 5.780 ( -0.895 2.714 -6.651) 7.239 5.849 ( 9.010 -3.440 4.785) 10.766 5.894 ( -0.537 6.048 4.420) 7.510 5.966 ( -0.918 -0.271 -9.594) 9.642 6.129 ( -1.927 -1.819 -11.350) 11.655 6.189 ( 2.869 -0.662 2.252) 3.707 6.322 ( -8.735 1.880 -0.746) 8.967 6.356 ( 5.831 -1.791 4.374) 7.506 6.617 ( 7.100 -3.781 4.657) 9.295 6.682 ( 0.666 -4.307 5.618) 7.110 6.763 ( -0.512 -1.898 -1.738) 2.624 6.830 ( -3.853 2.256 1.481) 4.704 6.899 ( -6.335 -0.103 -4.036) 7.512 6.982 ( -0.251 4.108 -1.873) 4.522 7.117 ( -0.258 7.865 1.508) 8.013 7.242 ( 0.413 6.764 -0.660) 6.809 7.316 ( -2.121 1.932 1.487) 3.232 7.527 ( 6.930 1.375 -2.486) 7.490 7.633 ( 2.233 -1.753 -0.484) 2.880 7.814 ( 1.396 2.762 -5.119) 5.982 7.936 ( 3.029 1.309 1.562) 3.651 8.029 ( -5.554 2.809 -0.972) 6.299 8.120 ( -4.422 0.905 4.920) 6.677 8.342 ( -4.731 1.835 -2.821) 5.806 8.501 ( -0.698 0.318 1.595) 1.770 8.587 ( 1.969 0.587 1.516) 2.554 8.686 ( 2.589 0.906 2.349) 3.611 8.738 ( 0.157 -1.772 1.126) 2.105 8.784 ( 1.324 0.940 -1.718) 2.364 8.849 ( 3.728 3.015 -2.675) 5.490 9.216 ( -4.566 -2.925 -2.224) 5.861 9.394 ( -7.169 5.956 4.019) 10.150 10.342 ( 1.354 -1.516 1.305) 2.415 10.392 ( -0.035 1.081 -2.294) 2.536 10.510 ( 2.102 -2.121 2.354) 3.803 10.710 ( -1.454 1.270 -4.279) 4.694 11.079 ( 5.224 0.607 3.939) 6.571 11.245 ( 1.013 -1.187 0.326) 1.594 11.247 ( 2.001 -2.632 -1.473) 3.619 11.595 ( -10.822 -2.807 -6.267) 12.817 11.796 ( 10.769 -0.693 8.708) 13.866 12.185 ( -3.783 -3.336 -3.831) 6.334 12.335 ( -2.181 -1.826 -0.512) 2.891 12.371 ( 0.921 1.153 -1.237) 1.925 12.593 ( 2.437 -1.550 1.039) 3.070 12.799 ( -0.038 0.202 2.206) 2.215 12.929 ( 2.673 1.925 1.184) 3.501 13.212 ( -0.595 6.864 -0.003) 6.890 13.953 ( -14.762 -3.920 -9.677) 18.081 14.130 ( -2.626 0.037 -3.036) 4.015 14.144 ( -1.179 -1.414 -2.108) 2.799 14.185 ( -1.566 1.754 0.513) 2.407 14.427 ( 12.267 6.432 11.304) 17.878 14.797 ( 4.034 -1.172 1.370) 4.418 15.066 ( -0.474 1.436 1.522) 2.145 15.101 ( 0.378 1.745 1.062) 2.078 15.197 ( -0.292 -4.785 3.556) 5.969 15.561 ( -3.535 11.206 -7.556) 13.970 16.565 ( 3.281 -1.517 -1.878) 4.073 16.694 ( 0.595 2.481 2.018) 3.253 19.832 ( 1.687 0.913 1.218) 2.273 20.107 ( -3.827 -0.009 -2.516) 4.580 20.350 ( 2.766 -2.505 3.007) 4.792 20.544 ( -1.411 -2.974 -1.431) 3.589 24.257 ( 2.736 0.663 1.641) 3.258 24.413 ( 0.211 4.437 -2.202) 4.958 24.896 ( 1.725 -0.041 1.345) 2.188 24.954 ( 0.854 1.799 -1.678) 2.604 26.127 ( -0.997 0.264 -0.205) 1.052 26.173 ( -1.734 0.633 0.012) 1.846 26.734 ( -0.721 -1.756 0.949) 2.123 26.811 ( -3.020 -3.807 -0.700) 4.909 26.966 ( -0.347 1.059 1.429) 1.812 27.019 ( -0.009 0.785 -1.550) 1.737 27.076 ( 5.257 4.521 -2.327) 7.313 27.267 ( 0.258 4.016 3.375) 5.252 27.738 ( 0.732 -1.004 0.231) 1.264 27.888 ( -1.319 0.399 -1.018) 1.713 29.282 ( 2.531 -1.502 -5.425) 6.171 29.332 ( 0.879 1.313 8.291) 8.440 29.453 ( 0.251 -2.640 -0.152) 2.656 29.681 ( -1.660 -2.664 -2.382) 3.941 30.154 ( -0.135 -6.585 -4.377) 7.908 30.492 ( -5.281 -4.326 4.504) 8.179 ======================= Grid point 225 (98/117) ======================= q-point: (-0.40 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.153 ( 9.588 0.263 1.717) 9.744 2.549 ( -3.379 0.387 -1.775) 3.836 3.088 ( 3.826 4.599 -1.320) 6.126 3.312 ( 2.356 1.328 -0.084) 2.705 3.399 ( -4.726 1.239 4.562) 6.684 3.453 ( -2.931 -4.373 1.437) 5.456 3.513 ( -3.930 6.145 -7.866) 10.727 3.689 ( -5.312 -0.564 -0.193) 5.345 3.967 ( 4.242 -5.154 2.059) 6.986 4.023 ( 8.228 3.004 4.696) 9.938 4.155 ( -0.682 0.825 0.933) 1.420 4.215 ( -2.903 1.705 2.924) 4.459 4.291 ( -4.233 2.717 -1.359) 5.210 4.437 ( 0.692 -7.506 -8.875) 11.644 4.537 ( 2.908 1.210 3.723) 4.877 4.642 ( -5.249 0.183 -1.492) 5.460 4.772 ( -2.055 4.773 4.191) 6.676 4.971 ( -8.371 -4.589 -0.539) 9.561 5.033 ( 1.476 -4.601 -2.074) 5.258 5.132 ( 0.024 -0.870 -9.260) 9.301 5.180 ( 1.719 3.849 1.147) 4.369 5.247 ( 4.666 0.840 -0.749) 4.800 5.484 ( 11.503 -3.817 8.928) 15.053 5.630 ( 6.431 -5.051 8.467) 11.772 5.697 ( -0.894 2.303 -5.250) 5.803 5.764 ( -2.799 5.630 5.568) 8.398 5.823 ( -4.617 3.754 -8.359) 10.260 5.979 ( -0.082 -2.056 4.227) 4.701 6.157 ( 0.268 0.017 -5.518) 5.524 6.249 ( -2.420 1.468 -1.373) 3.146 6.324 ( 4.943 -6.343 0.430) 8.053 6.438 ( 1.735 -0.892 3.119) 3.679 6.622 ( 0.579 5.513 2.231) 5.975 6.684 ( -7.763 1.513 -5.214) 9.473 6.745 ( -3.376 2.396 -1.717) 4.482 6.857 ( 3.592 -2.164 -0.633) 4.241 6.898 ( -0.187 -5.381 1.356) 5.553 6.929 ( -6.006 1.192 -1.714) 6.359 7.038 ( -0.828 -1.367 5.558) 5.783 7.077 ( -0.733 3.769 -1.507) 4.125 7.355 ( 4.129 -2.405 0.025) 4.778 7.515 ( 6.767 4.296 0.590) 8.037 7.651 ( -3.078 0.308 -2.611) 4.048 7.763 ( -1.259 3.290 0.755) 3.603 7.896 ( -1.747 1.052 1.198) 2.365 8.015 ( -0.663 -0.660 -1.209) 1.529 8.127 ( 3.027 -5.131 0.957) 6.034 8.380 ( -5.254 -6.093 -1.880) 8.263 8.477 ( 4.545 2.789 0.632) 5.370 8.586 ( 1.372 1.144 0.779) 1.949 8.662 ( -1.565 1.630 0.166) 2.266 8.721 ( -5.524 0.337 -0.934) 5.613 8.807 ( 5.041 1.456 -0.616) 5.283 8.855 ( 3.835 0.543 2.739) 4.744 9.242 ( -0.173 -3.712 1.853) 4.152 9.337 ( -3.222 -3.648 -3.132) 5.788 10.356 ( -0.199 1.144 -0.412) 1.232 10.369 ( -0.899 0.214 0.217) 0.949 10.547 ( 2.419 -0.231 1.158) 2.692 10.678 ( -2.561 0.010 -1.763) 3.109 11.077 ( 4.070 2.526 2.686) 5.491 11.252 ( -2.063 1.946 -1.166) 3.066 11.275 ( 3.106 -0.394 1.664) 3.545 11.559 ( -10.895 -0.997 -6.916) 12.943 11.877 ( 12.768 0.514 7.898) 15.022 12.212 ( -3.905 -1.918 -3.043) 5.309 12.359 ( 3.371 -0.761 3.679) 5.048 12.389 ( 1.415 -1.626 -1.496) 2.624 12.611 ( 1.604 0.848 1.145) 2.145 12.774 ( -2.845 0.990 0.384) 3.036 12.896 ( -0.566 2.190 0.482) 2.313 13.098 ( -6.907 2.403 -5.274) 9.016 13.967 ( -6.128 -4.423 -3.961) 8.533 14.129 ( -1.072 -1.299 -1.078) 1.999 14.172 ( 0.022 -1.029 -1.104) 1.509 14.204 ( -4.991 -5.044 -3.588) 7.952 14.407 ( 19.155 5.131 14.801) 24.745 14.818 ( 1.538 1.009 -0.849) 2.026 15.042 ( -0.935 0.591 -3.251) 3.434 15.080 ( -0.716 0.219 3.220) 3.306 15.302 ( -2.070 -1.095 -1.477) 2.768 15.373 ( -2.147 0.192 -1.748) 2.775 16.589 ( 0.922 1.103 0.652) 1.578 16.646 ( -1.142 1.265 -0.601) 1.807 19.841 ( 3.532 -0.083 2.629) 4.404 20.077 ( -5.841 -0.166 -4.281) 7.243 20.401 ( 4.667 -0.149 3.194) 5.657 20.565 ( -2.129 -0.254 -1.416) 2.569 24.256 ( 1.821 0.938 1.371) 2.465 24.355 ( -1.669 0.901 -1.347) 2.326 24.898 ( 0.417 0.869 -0.232) 0.991 24.926 ( -0.663 0.706 0.251) 1.001 26.131 ( 0.406 -0.787 0.408) 0.976 26.167 ( -0.858 -0.771 -0.612) 1.306 26.764 ( 1.425 -1.041 0.131) 1.769 26.866 ( -2.688 -3.745 0.265) 4.617 26.942 ( 0.520 1.941 1.043) 2.264 27.008 ( -0.978 0.889 -1.200) 1.785 27.038 ( 4.600 1.467 -0.820) 4.898 27.205 ( -2.688 1.273 1.045) 3.152 27.761 ( 2.345 -0.311 -1.091) 2.604 27.875 ( -2.083 -0.114 0.781) 2.228 29.297 ( 0.713 0.778 -0.145) 1.065 29.307 ( 0.127 0.833 0.599) 1.034 29.492 ( 1.932 -0.122 1.406) 2.393 29.677 ( -5.268 0.933 -3.271) 6.271 30.266 ( 6.381 -2.662 3.376) 7.694 30.528 ( -3.784 -1.859 -1.942) 4.642 ======================= Grid point 226 (99/117) ======================= q-point: (-0.30 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.241 ( 10.668 -1.836 2.496) 11.109 2.448 ( -1.037 6.419 -2.990) 7.156 2.952 ( -3.350 10.266 -3.663) 11.403 3.120 ( -12.394 10.302 -0.444) 16.123 3.268 ( -0.604 10.484 7.041) 12.644 3.333 ( -4.410 11.307 -8.123) 14.604 3.573 ( 6.262 -5.412 7.821) 11.387 3.714 ( 1.065 0.478 0.846) 1.442 3.847 ( 0.675 17.889 6.373) 19.003 3.928 ( -2.527 3.313 -1.117) 4.314 4.157 ( 4.305 -5.266 -3.783) 7.783 4.196 ( 0.445 0.812 1.492) 1.756 4.305 ( -5.384 -6.827 -1.945) 8.910 4.420 ( -12.881 -1.223 -5.751) 14.159 4.601 ( 7.910 -0.555 0.515) 7.946 4.670 ( 4.172 -3.755 1.358) 5.775 4.875 ( 8.706 -5.887 2.251) 10.748 5.008 ( -0.910 1.086 -3.527) 3.801 5.039 ( -4.308 0.201 3.266) 5.410 5.151 ( -7.431 -3.990 -5.912) 10.300 5.290 ( 8.690 -6.269 3.608) 11.307 5.398 ( 1.013 -11.513 -1.476) 11.652 5.547 ( 5.202 4.072 -1.110) 6.698 5.625 ( -2.975 0.351 -7.442) 8.023 5.670 ( 7.892 2.756 1.072) 8.428 5.762 ( -3.621 -2.543 7.138) 8.398 5.811 ( -1.266 -4.208 3.457) 5.591 6.005 ( 0.218 7.558 11.107) 13.436 6.051 ( -11.688 0.616 -8.721) 14.596 6.115 ( -7.678 9.639 -6.298) 13.840 6.391 ( 11.047 -0.328 6.112) 12.630 6.479 ( 6.153 -2.387 -0.529) 6.621 6.551 ( 0.673 -1.468 0.895) 1.846 6.679 ( 4.326 2.468 -3.372) 6.015 6.685 ( -6.228 -4.466 -2.731) 8.136 6.878 ( -6.404 -0.621 -0.648) 6.466 6.921 ( 3.697 -3.020 -0.521) 4.802 7.000 ( 1.292 -1.087 -0.990) 1.957 7.126 ( -3.166 -6.413 -0.232) 7.156 7.146 ( -6.174 -12.221 5.079) 14.603 7.444 ( 5.115 3.558 0.589) 6.258 7.475 ( 4.610 -2.146 -2.074) 5.492 7.542 ( -1.042 4.191 1.721) 4.649 7.756 ( -8.756 -6.518 0.616) 10.933 7.946 ( 4.524 -4.510 3.600) 7.333 8.070 ( -2.416 -5.451 -4.325) 7.366 8.227 ( 5.194 -0.569 -1.699) 5.495 8.408 ( -2.760 1.076 0.773) 3.061 8.481 ( 1.600 -0.910 -0.557) 1.923 8.567 ( -0.486 0.900 -2.199) 2.425 8.625 ( 1.062 0.519 1.336) 1.784 8.695 ( -3.955 -0.980 0.442) 4.098 8.807 ( 3.926 0.067 -1.273) 4.128 8.865 ( -0.085 -1.784 2.079) 2.741 9.336 ( 4.493 -1.919 12.018) 12.973 9.447 ( -1.617 -7.194 -13.800) 15.647 10.320 ( 0.157 1.826 -0.577) 1.922 10.355 ( -2.413 0.523 0.932) 2.639 10.559 ( 4.913 0.834 0.372) 4.997 10.681 ( -4.026 -1.909 1.314) 4.646 11.031 ( 2.354 4.367 1.223) 5.109 11.148 ( -5.296 5.968 -2.624) 8.399 11.301 ( 5.290 0.494 4.808) 7.165 11.501 ( -9.638 0.340 -7.323) 12.109 11.940 ( 13.158 1.199 6.767) 14.844 12.195 ( -4.941 0.910 -2.389) 5.563 12.400 ( 3.082 -0.417 0.534) 3.156 12.431 ( 1.950 -0.749 2.506) 3.262 12.604 ( 5.908 1.257 4.704) 7.656 12.764 ( -2.423 -2.733 -0.911) 3.764 12.839 ( -2.179 2.779 -0.298) 3.544 13.034 ( -12.648 -2.836 -8.975) 15.766 14.032 ( -0.128 -3.823 -0.609) 3.873 14.149 ( -3.575 -1.424 -1.646) 4.186 14.220 ( 1.086 -3.225 -0.789) 3.493 14.249 ( -3.171 -3.447 -2.160) 5.157 14.485 ( 19.268 0.803 13.524) 23.554 14.777 ( -0.847 3.151 -2.661) 4.211 15.041 ( -0.584 -1.315 -5.148) 5.345 15.067 ( -3.723 -0.232 2.299) 4.382 15.261 ( 6.995 0.400 -0.801) 7.052 15.496 ( -8.709 -9.670 -0.212) 13.015 16.544 ( 1.574 3.062 4.892) 5.982 16.629 ( -3.695 -0.109 -4.422) 5.763 19.878 ( 4.935 -0.837 3.790) 6.279 20.042 ( -6.620 -0.399 -5.178) 8.414 20.412 ( 5.459 2.407 2.651) 6.528 20.527 ( -2.910 2.503 -1.274) 4.044 24.252 ( 2.431 0.530 1.629) 2.974 24.351 ( -4.280 -2.094 -1.250) 4.926 24.875 ( 0.428 1.278 -0.994) 1.675 24.912 ( -2.267 0.292 1.256) 2.608 26.162 ( 1.449 -1.712 1.095) 2.496 26.190 ( -0.394 -1.862 -1.273) 2.290 26.789 ( 3.824 0.357 -1.286) 4.051 26.885 ( -0.087 3.835 2.962) 4.846 26.926 ( -1.609 -3.743 0.543) 4.110 26.980 ( -1.565 0.523 -2.448) 2.953 27.073 ( 3.707 -1.920 1.492) 4.434 27.192 ( -4.803 -2.060 -1.187) 5.359 27.781 ( 3.648 -0.056 -3.062) 4.763 27.867 ( -2.980 -0.581 3.002) 4.270 29.268 ( 0.409 2.489 6.708) 7.166 29.298 ( -0.907 0.767 -7.694) 7.785 29.481 ( 2.555 2.258 2.052) 3.980 29.592 ( -5.732 3.468 -2.656) 7.207 30.328 ( 9.275 1.750 9.882) 13.666 30.511 ( -3.277 1.278 -8.578) 9.271 ======================= Grid point 227 (100/117) ======================= q-point: (-0.20 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.222 ( 8.085 11.440 5.317) 14.984 2.327 ( -5.999 8.346 -4.463) 11.206 2.743 ( 9.158 6.269 -2.743) 11.432 2.865 ( -7.178 13.735 4.233) 16.065 2.936 ( -0.572 21.176 0.628) 21.193 3.033 ( -14.820 8.678 -6.434) 18.340 3.570 ( 1.739 2.946 2.427) 4.195 3.582 ( -0.270 2.991 1.684) 3.443 3.872 ( 13.490 -8.032 2.159) 15.848 4.010 ( -7.449 -9.182 2.891) 12.172 4.160 ( 5.587 3.966 1.677) 7.054 4.222 ( -1.475 5.591 -2.002) 6.119 4.336 ( -0.894 2.100 -2.433) 3.336 4.368 ( -5.194 4.878 1.513) 7.284 4.667 ( 5.719 0.356 -1.146) 5.843 4.734 ( -5.302 -3.071 -3.067) 6.852 4.879 ( 4.021 7.708 3.267) 9.287 4.952 ( 0.343 2.522 -2.303) 3.432 5.030 ( 2.916 -1.175 -4.792) 5.731 5.152 ( -11.277 -0.527 1.932) 11.453 5.412 ( 7.572 -1.145 -1.940) 7.900 5.461 ( 4.762 3.922 -1.035) 6.255 5.502 ( -4.111 1.825 0.344) 4.511 5.569 ( -9.657 0.022 0.787) 9.689 5.736 ( 13.624 -1.138 8.756) 16.235 5.855 ( 0.296 -3.315 9.802) 10.352 5.879 ( -1.298 -5.802 -6.122) 8.534 5.919 ( -10.019 -2.178 -7.621) 12.775 5.978 ( 1.923 -6.826 -0.744) 7.130 6.034 ( -8.056 -6.159 -3.852) 10.848 6.514 ( 4.250 -0.739 0.917) 4.410 6.555 ( -1.176 0.035 -1.767) 2.123 6.654 ( 13.970 -9.549 6.861) 18.260 6.685 ( 7.804 0.088 3.980) 8.760 6.781 ( -5.816 -3.741 -3.112) 7.583 6.825 ( -8.399 -1.874 -4.837) 9.871 7.028 ( 1.692 -6.034 -2.036) 6.590 7.056 ( -3.425 -6.912 3.425) 8.440 7.235 ( 4.241 -2.974 -1.190) 5.315 7.300 ( -4.367 -5.153 4.178) 7.942 7.362 ( 1.514 4.330 -3.233) 5.612 7.399 ( -4.707 -0.613 -1.784) 5.071 7.746 ( 8.982 -10.039 2.803) 13.759 7.854 ( -6.818 -7.271 0.265) 9.971 8.089 ( 3.602 -5.075 2.979) 6.899 8.140 ( -3.958 -1.765 -4.372) 6.155 8.227 ( 9.600 2.327 4.110) 10.699 8.362 ( -9.195 -1.038 -3.538) 9.907 8.498 ( 3.809 -0.091 1.424) 4.067 8.554 ( -3.428 -0.941 -3.149) 4.749 8.670 ( 3.011 -2.887 0.928) 4.273 8.711 ( -3.514 -2.921 0.502) 4.597 8.911 ( 4.923 -9.067 -1.103) 10.377 8.960 ( -3.038 -9.931 0.109) 10.386 9.350 ( 9.223 5.538 17.811) 20.808 9.474 ( -8.150 2.158 -19.456) 21.205 10.295 ( 1.436 1.471 -0.220) 2.067 10.320 ( -2.703 1.438 0.398) 3.088 10.588 ( 9.133 0.669 0.148) 9.159 10.683 ( -5.796 -0.829 2.815) 6.496 10.934 ( 0.429 6.451 -0.177) 6.467 10.972 ( -5.065 8.201 -1.992) 9.843 11.318 ( 6.414 2.032 5.467) 8.669 11.414 ( -8.235 2.808 -6.260) 10.719 12.000 ( 12.083 1.201 4.247) 12.863 12.124 ( -6.833 2.258 -2.293) 7.553 12.398 ( 1.416 1.312 -3.107) 3.658 12.423 ( -2.135 0.990 3.716) 4.399 12.644 ( 10.421 1.722 5.655) 11.981 12.750 ( -6.330 3.237 -2.584) 7.565 12.885 ( 11.275 -7.444 6.543) 15.012 13.085 ( -17.378 -12.340 -11.051) 24.008 14.103 ( 1.446 -2.920 0.377) 3.281 14.146 ( -4.221 -1.615 -1.751) 4.847 14.295 ( 2.376 -3.223 2.947) 4.972 14.318 ( -1.164 -4.455 -3.970) 6.079 14.569 ( 12.016 1.296 9.296) 15.248 14.693 ( -5.917 2.864 -4.496) 7.964 15.083 ( -0.204 -3.367 3.918) 5.170 15.089 ( -0.475 -3.711 -4.984) 6.232 15.376 ( 16.279 -4.272 4.205) 17.348 15.594 ( -16.995 -8.291 -4.397) 19.414 16.514 ( 4.630 2.144 6.530) 8.286 16.587 ( -6.011 1.156 -5.742) 8.393 19.932 ( 5.532 -1.055 4.471) 7.191 20.010 ( -6.363 -0.611 -5.266) 8.282 20.375 ( 5.221 4.801 1.453) 7.241 20.432 ( -3.719 5.018 -0.735) 6.289 24.282 ( 5.826 -1.266 2.580) 6.497 24.373 ( -8.139 -3.876 -1.865) 9.206 24.859 ( 1.174 0.899 -0.231) 1.496 24.885 ( -3.009 0.716 0.470) 3.129 26.211 ( 1.694 -2.068 1.628) 3.129 26.227 ( -0.617 -2.131 -1.707) 2.799 26.783 ( 3.445 2.520 -2.711) 5.056 26.807 ( -0.338 3.865 3.219) 5.041 26.984 ( -0.371 -2.422 -0.063) 2.452 26.995 ( -2.360 -3.862 -0.464) 4.550 27.149 ( 4.355 -3.117 1.137) 5.475 27.211 ( -5.393 -2.950 -1.147) 6.253 27.814 ( 4.939 -1.146 -6.498) 8.242 27.866 ( -4.170 -1.597 6.368) 7.778 29.197 ( 1.835 5.914 5.210) 8.093 29.228 ( -2.514 5.411 -6.617) 8.910 29.458 ( 3.052 1.710 4.058) 5.358 29.508 ( -4.695 1.201 -3.774) 6.142 30.317 ( 10.419 5.915 15.519) 19.606 30.427 ( -5.429 4.301 -14.881) 16.414 ======================= Grid point 228 (101/117) ======================= q-point: (-0.10 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 105 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.004 ( -8.446 14.771 -17.431) 24.359 2.004 ( 8.446 14.771 17.431) 24.359 2.429 ( -8.246 23.111 -23.547) 34.008 2.429 ( 8.246 23.111 23.547) 34.008 2.936 ( -15.001 -5.883 -7.254) 17.671 2.936 ( 15.001 -5.883 7.254) 17.671 3.610 ( -6.316 -4.192 0.702) 7.613 3.610 ( 6.316 -4.192 -0.702) 7.613 3.843 ( -9.806 28.641 -36.114) 47.124 3.843 ( 9.806 28.641 36.114) 47.124 4.098 ( -3.439 -1.700 -5.276) 6.524 4.098 ( 3.439 -1.700 5.276) 6.524 4.279 ( -1.338 -4.446 -0.747) 4.703 4.279 ( 1.338 -4.446 0.747) 4.703 4.715 ( -5.237 -1.280 -7.807) 9.488 4.715 ( 5.237 -1.280 7.807) 9.488 4.935 ( 0.278 -4.062 -7.698) 8.708 4.935 ( -0.278 -4.062 7.698) 8.708 5.062 ( -5.072 1.695 -5.386) 7.590 5.062 ( 5.072 1.695 5.386) 7.590 5.434 ( 4.872 3.451 -6.994) 9.196 5.434 ( -4.872 3.451 6.994) 9.196 5.514 ( -6.153 -2.824 -4.721) 8.254 5.514 ( 6.153 -2.824 4.721) 8.254 5.845 ( 9.168 0.650 -5.051) 10.487 5.845 ( -9.168 0.650 5.051) 10.487 5.940 ( 1.468 -5.264 -6.537) 8.521 5.940 ( -1.468 -5.264 6.537) 8.521 6.229 ( -1.169 -11.114 -5.800) 12.591 6.229 ( 1.169 -11.114 5.800) 12.591 6.515 ( -9.524 1.929 -3.335) 10.274 6.515 ( 9.524 1.929 3.335) 10.274 6.721 ( -1.569 -1.172 -2.529) 3.199 6.721 ( 1.569 -1.172 2.529) 3.199 6.917 ( -6.800 -6.853 -10.985) 14.625 6.917 ( 6.800 -6.853 10.985) 14.625 7.185 ( -1.512 -3.841 -4.540) 6.136 7.185 ( 1.512 -3.841 4.540) 6.136 7.293 ( 2.483 -6.027 -6.288) 9.057 7.293 ( -2.483 -6.027 6.288) 9.057 7.419 ( -4.674 -3.192 -6.888) 8.915 7.419 ( 4.674 -3.192 6.888) 8.915 7.927 ( -4.666 -3.022 0.111) 5.560 7.927 ( 4.666 -3.022 -0.111) 5.560 8.110 ( -4.162 1.014 -8.028) 9.099 8.110 ( 4.162 1.014 8.028) 9.099 8.324 ( -12.498 -1.898 -5.338) 13.722 8.324 ( 12.498 -1.898 5.338) 13.722 8.547 ( -5.707 -1.095 -5.175) 7.781 8.547 ( 5.707 -1.095 5.175) 7.781 8.754 ( -1.727 -3.213 -0.734) 3.721 8.754 ( 1.727 -3.213 0.734) 3.721 9.188 ( -8.377 -1.819 -9.016) 12.441 9.188 ( 8.377 -1.819 9.016) 12.441 9.294 ( -5.605 -5.653 -17.538) 19.260 9.294 ( 5.605 -5.653 17.538) 19.260 10.269 ( -1.136 2.381 -2.446) 3.598 10.269 ( 1.136 2.381 2.446) 3.598 10.625 ( -8.873 2.430 -0.570) 9.217 10.625 ( 8.873 2.430 0.570) 9.217 10.792 ( -0.595 7.680 -1.444) 7.837 10.792 ( 0.595 7.680 1.444) 7.837 11.290 ( -6.123 4.953 -4.877) 9.263 11.290 ( 6.123 4.953 4.877) 9.263 12.023 ( -8.395 3.259 -0.644) 9.028 12.023 ( 8.395 3.259 0.644) 9.028 12.395 ( 1.278 0.097 -1.925) 2.312 12.395 ( -1.278 0.097 1.925) 2.312 12.644 ( -5.229 2.819 -4.354) 7.365 12.644 ( 5.229 2.819 4.354) 7.365 13.227 ( -27.335 -14.287 -11.774) 33.014 13.227 ( 27.335 -14.287 11.774) 33.014 14.166 ( -3.188 -2.450 -4.092) 5.737 14.166 ( 3.188 -2.450 4.092) 5.737 14.385 ( -3.960 -4.010 -3.735) 6.761 14.385 ( 3.960 -4.010 3.735) 6.761 14.606 ( -7.068 0.927 -8.230) 10.888 14.606 ( 7.068 0.927 8.230) 10.888 15.176 ( -1.068 -5.580 -7.583) 9.475 15.176 ( 1.068 -5.580 7.583) 9.475 15.609 ( -22.402 -6.199 -6.879) 24.241 15.609 ( 22.402 -6.199 6.879) 24.241 16.513 ( -5.939 2.106 -6.319) 8.924 16.513 ( 5.939 2.106 6.319) 8.924 19.982 ( -5.211 -0.249 -4.646) 6.985 19.982 ( 5.211 -0.249 4.646) 6.985 20.294 ( -3.190 6.176 -0.586) 6.976 20.294 ( 3.190 6.176 0.586) 6.976 24.391 ( -12.774 -4.339 -2.636) 13.746 24.391 ( 12.774 -4.339 2.636) 13.746 24.854 ( -1.346 0.675 -1.615) 2.208 24.854 ( 1.346 0.675 1.615) 2.208 26.257 ( -1.100 -1.454 -2.287) 2.925 26.257 ( 1.100 -1.454 2.287) 2.925 26.744 ( 0.494 2.112 -2.261) 3.133 26.744 ( -0.494 2.112 2.261) 3.133 27.050 ( -2.362 -3.123 -1.652) 4.250 27.050 ( 2.362 -3.123 1.652) 4.250 27.237 ( -2.772 -2.817 -1.611) 4.268 27.237 ( 2.772 -2.817 1.611) 4.268 27.898 ( 4.490 -4.928 -13.965) 15.475 27.898 ( -4.490 -4.928 13.965) 15.475 29.076 ( -2.593 7.385 -3.393) 8.531 29.076 ( 2.593 7.385 3.393) 8.531 29.449 ( -6.309 3.023 -3.151) 7.673 29.449 ( 6.309 3.023 3.151) 7.673 30.253 ( -12.089 7.573 -17.833) 22.837 30.253 ( 12.089 7.573 17.833) 22.837 ======================= Grid point 232 (102/117) ======================= q-point: ( 0.20 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.454 ( 0.395 0.000 -25.376) 25.379 1.858 ( 12.081 0.000 -19.831) 23.221 1.926 ( 3.055 0.000 22.802) 23.005 2.253 ( 18.466 0.000 32.857) 37.691 2.702 ( -8.187 -0.000 -30.119) 31.212 2.940 ( 0.299 0.000 -0.293) 0.419 3.353 ( 8.703 0.000 -21.420) 23.120 3.581 ( -15.778 -0.000 -2.999) 16.061 3.719 ( -12.626 -0.000 6.224) 14.077 3.802 ( 5.484 0.000 9.314) 10.809 3.872 ( 37.192 0.000 44.795) 58.222 4.163 ( -15.021 -0.000 -2.548) 15.236 4.327 ( -10.886 -0.000 -14.197) 17.890 4.362 ( -20.587 -0.000 -8.591) 22.308 4.644 ( 10.980 0.000 2.480) 11.257 4.660 ( 5.960 0.000 1.475) 6.140 4.872 ( 2.392 0.000 -19.301) 19.449 5.032 ( 5.672 0.000 5.036) 7.585 5.113 ( -1.121 -0.000 -7.458) 7.542 5.127 ( -1.014 -0.000 -9.291) 9.347 5.390 ( 0.807 0.000 19.846) 19.862 5.475 ( -2.082 -0.000 14.077) 14.230 5.663 ( 4.427 0.000 1.786) 4.774 5.696 ( -0.760 -0.000 4.691) 4.752 5.759 ( 10.826 0.000 -0.339) 10.831 5.949 ( -11.702 -0.000 11.441) 16.365 6.030 ( 14.675 0.000 -1.173) 14.722 6.083 ( 4.487 0.000 5.515) 7.110 6.376 ( 2.398 0.000 -15.404) 15.590 6.410 ( -1.010 -0.000 5.989) 6.073 6.565 ( 4.758 0.000 -4.033) 6.238 6.708 ( -1.725 -0.000 -6.485) 6.711 6.714 ( -8.106 -0.000 -13.793) 15.999 6.787 ( -2.781 -0.000 3.225) 4.258 6.788 ( 0.451 0.000 7.187) 7.201 7.068 ( 3.547 0.000 10.494) 11.077 7.196 ( -4.686 -0.000 -8.005) 9.276 7.233 ( -3.448 -0.000 -3.492) 4.908 7.348 ( -0.583 -0.000 0.849) 1.030 7.520 ( 1.999 0.000 12.385) 12.545 7.690 ( 1.116 0.000 1.188) 1.630 7.752 ( -0.364 -0.000 6.367) 6.377 7.778 ( -2.406 -0.000 -4.847) 5.411 7.937 ( 3.256 0.000 -2.546) 4.133 8.020 ( -6.344 -0.000 -6.804) 9.303 8.097 ( -7.727 -0.000 -0.735) 7.762 8.208 ( -6.503 -0.000 -2.781) 7.073 8.365 ( -0.172 -0.000 2.288) 2.294 8.527 ( -4.918 -0.000 -3.327) 5.938 8.588 ( 4.855 0.000 -1.676) 5.136 8.718 ( -3.573 -0.000 -3.648) 5.106 8.739 ( 7.326 0.000 4.264) 8.477 8.887 ( 3.504 0.000 2.190) 4.132 9.298 ( 8.696 0.000 20.862) 22.602 9.665 ( -8.057 -0.000 -4.693) 9.324 10.004 ( -4.304 -0.000 -1.472) 4.548 10.007 ( 0.891 0.000 0.065) 0.893 10.259 ( 4.865 0.000 -5.193) 7.115 10.449 ( 1.100 0.000 0.244) 1.126 10.588 ( 3.356 0.000 6.562) 7.371 10.679 ( 5.572 0.000 -6.188) 8.327 10.717 ( 6.766 0.000 5.013) 8.421 11.033 ( -0.939 -0.000 -3.241) 3.374 11.278 ( 3.808 0.000 1.953) 4.279 11.716 ( -9.774 -0.000 9.646) 13.732 11.944 ( -4.935 -0.000 -3.903) 6.292 12.344 ( -1.206 -0.000 -0.934) 1.525 12.379 ( -14.948 -0.000 -9.723) 17.832 12.481 ( -8.909 -0.000 -5.389) 10.412 12.638 ( 7.069 0.000 0.966) 7.134 12.788 ( 7.630 0.000 5.767) 9.564 14.032 ( -16.535 -0.000 -10.187) 19.422 14.043 ( -4.500 -0.000 -1.875) 4.875 14.264 ( 1.713 0.000 -5.530) 5.789 14.417 ( -4.283 -0.000 2.132) 4.785 14.466 ( 2.079 0.000 -5.180) 5.582 14.692 ( 7.533 0.000 2.346) 7.890 14.938 ( 10.005 0.000 -3.094) 10.472 15.110 ( -13.548 -0.000 -7.495) 15.483 15.213 ( -4.672 -0.000 -0.267) 4.680 15.663 ( 5.494 0.000 5.052) 7.463 16.162 ( 7.308 0.000 0.826) 7.355 16.425 ( 1.882 0.000 0.188) 1.891 16.605 ( 6.403 0.000 -4.949) 8.093 19.917 ( 1.073 0.000 0.506) 1.187 20.012 ( 2.845 0.000 0.308) 2.862 20.144 ( -0.546 -0.000 -1.882) 1.960 20.149 ( -0.216 -0.000 0.115) 0.244 24.263 ( 2.719 0.000 0.640) 2.793 24.775 ( -0.885 -0.000 -5.502) 5.572 24.932 ( 5.232 0.000 2.176) 5.666 25.144 ( 15.728 0.000 -15.870) 22.343 26.235 ( -2.101 -0.000 -2.195) 3.039 26.310 ( 1.068 0.000 -2.198) 2.443 26.650 ( -5.679 -0.000 -2.017) 6.027 26.679 ( -2.623 -0.000 2.850) 3.874 27.175 ( 9.250 0.000 -1.453) 9.363 27.220 ( 3.884 0.000 0.020) 3.884 27.285 ( -0.400 -0.000 1.499) 1.551 27.364 ( 4.238 0.000 -0.509) 4.269 28.046 ( -10.038 -0.000 2.292) 10.297 28.111 ( -11.276 -0.000 2.144) 11.478 28.866 ( -2.956 -0.000 5.055) 5.856 28.923 ( -2.810 -0.000 -3.067) 4.160 28.984 ( -0.655 -0.000 -6.449) 6.482 29.156 ( -6.357 -0.000 4.041) 7.532 29.762 ( 3.229 0.000 10.363) 10.855 30.392 ( 1.928 0.000 5.741) 6.057 ======================= Grid point 233 (103/117) ======================= q-point: ( 0.30 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.589 ( 4.623 -10.305 -18.501) 21.676 2.013 ( 1.706 -8.867 29.077) 30.447 2.100 ( 18.635 -14.079 -24.535) 33.874 2.542 ( 15.531 -15.128 25.357) 33.362 2.790 ( -4.045 -6.762 -14.791) 16.759 2.887 ( -2.751 -1.328 1.312) 3.325 3.426 ( -8.495 -1.595 -10.919) 13.926 3.517 ( -3.090 -6.470 -20.428) 21.649 3.590 ( -10.502 3.069 5.816) 12.391 3.833 ( 1.828 2.920 6.677) 7.514 4.059 ( 0.302 -1.762 7.893) 8.093 4.108 ( -13.239 -3.541 -2.693) 13.967 4.306 ( 21.497 -2.360 14.140) 25.839 4.393 ( -0.817 -5.967 4.093) 7.282 4.630 ( -4.940 0.101 -9.180) 10.425 4.724 ( -1.373 2.951 -9.221) 9.778 4.847 ( 12.449 0.740 0.647) 12.488 4.967 ( 6.133 5.157 -5.293) 9.603 5.127 ( 4.048 -6.434 0.549) 7.622 5.331 ( -3.657 -7.798 -1.812) 8.802 5.345 ( 1.282 4.454 10.665) 11.629 5.447 ( 4.271 2.681 15.485) 16.285 5.533 ( -1.669 5.512 -1.346) 5.915 5.694 ( 2.412 3.841 0.358) 4.550 5.868 ( -1.572 -2.020 12.601) 12.859 5.897 ( 2.801 -1.772 0.042) 3.315 6.030 ( 6.081 5.408 2.027) 8.387 6.140 ( 4.284 1.964 -0.151) 4.715 6.284 ( -2.450 5.071 -6.691) 8.746 6.389 ( 2.278 4.779 5.952) 7.966 6.530 ( -4.394 5.625 -10.744) 12.899 6.624 ( -0.117 3.793 -5.078) 6.339 6.688 ( -2.584 -0.186 -4.689) 5.357 6.724 ( -1.087 2.082 -1.976) 3.069 6.874 ( 1.870 -1.279 6.177) 6.579 7.052 ( 0.401 2.863 7.457) 7.998 7.155 ( -4.199 0.237 -4.234) 5.968 7.224 ( 1.847 -0.558 -1.714) 2.581 7.349 ( -0.531 1.827 2.398) 3.061 7.401 ( -1.379 9.456 4.761) 10.677 7.545 ( -3.265 10.192 -2.924) 11.094 7.694 ( -4.246 7.383 -1.097) 8.588 7.829 ( -0.199 -3.699 -0.254) 3.713 7.869 ( -0.147 -0.840 -0.975) 1.296 7.966 ( -3.166 3.673 0.740) 4.906 8.097 ( -2.376 -0.877 -1.679) 3.039 8.195 ( -3.824 -1.954 -1.694) 4.617 8.385 ( 1.189 0.795 1.260) 1.906 8.563 ( -7.228 -9.041 -7.748) 13.929 8.589 ( 2.250 0.621 -2.145) 3.170 8.691 ( -3.582 0.124 -3.725) 5.169 8.822 ( 5.097 1.658 3.782) 6.560 8.870 ( 1.946 2.082 0.552) 2.903 9.345 ( -14.105 -2.609 6.303) 15.668 9.518 ( 9.210 9.317 6.595) 14.667 9.792 ( -1.903 18.167 -0.049) 18.266 10.088 ( 0.677 -6.418 1.666) 6.665 10.336 ( 5.051 -2.971 -2.864) 6.522 10.405 ( 4.259 2.425 3.913) 6.272 10.651 ( 0.056 -3.427 -4.122) 5.361 10.782 ( 6.684 -6.656 2.420) 9.738 10.855 ( 4.610 -7.048 3.037) 8.952 11.087 ( -0.386 -4.954 -3.283) 5.956 11.339 ( 0.879 -4.234 -0.181) 4.328 11.685 ( -9.277 -2.538 7.689) 12.313 11.940 ( -6.181 -3.279 -4.826) 8.500 12.309 ( -7.243 -0.340 -6.050) 9.443 12.355 ( 0.019 -1.708 0.835) 1.901 12.464 ( 1.610 -0.441 0.719) 1.817 12.706 ( 5.654 -1.906 1.607) 6.179 12.858 ( 6.880 -2.115 7.215) 10.191 13.852 ( -13.641 6.460 -11.973) 19.265 13.987 ( -8.678 2.446 -2.354) 9.318 14.245 ( 0.884 2.379 -6.538) 7.014 14.354 ( -4.094 3.059 1.810) 5.421 14.426 ( -6.937 3.211 -8.631) 11.529 14.707 ( 8.246 3.529 4.254) 9.927 14.905 ( 7.052 6.454 -1.605) 9.693 15.078 ( -3.058 -1.743 -3.344) 4.855 15.185 ( -3.734 0.635 -0.907) 3.895 15.524 ( 7.227 14.169 9.811) 18.688 16.146 ( -1.012 4.985 -5.119) 7.216 16.475 ( 5.616 -1.924 0.297) 5.944 16.650 ( 4.104 -1.813 -2.017) 4.920 19.918 ( 1.406 1.028 0.781) 1.908 20.073 ( 1.933 -4.151 1.738) 4.898 20.136 ( -0.810 0.291 -0.242) 0.894 20.210 ( -0.527 -5.791 -2.513) 6.334 24.286 ( 6.441 0.782 3.561) 7.401 24.749 ( -1.391 2.022 -6.785) 7.215 24.958 ( 5.573 1.066 2.024) 6.024 25.131 ( 9.954 7.299 -11.444) 16.832 26.210 ( -2.348 1.138 -1.416) 2.968 26.289 ( -1.222 1.998 -2.393) 3.348 26.627 ( -3.525 -1.215 -1.581) 4.050 26.670 ( -2.390 -0.597 2.659) 3.625 27.118 ( 3.724 5.530 0.758) 6.711 27.234 ( -0.727 4.456 0.640) 4.561 27.312 ( 8.854 0.846 -0.351) 8.901 27.386 ( 4.863 -0.959 -1.986) 5.340 27.837 ( -9.449 9.170 12.441) 18.115 27.999 ( -6.900 3.154 -5.733) 9.509 28.896 ( -0.303 -5.952 1.158) 6.071 29.021 ( 1.842 -6.306 1.862) 6.828 29.133 ( -3.083 -11.585 -2.876) 12.328 29.327 ( -13.388 -19.949 -6.482) 24.884 29.766 ( 7.969 3.278 8.501) 12.104 30.373 ( -3.643 1.298 5.951) 7.097 ======================= Grid point 234 (104/117) ======================= q-point: ( 0.40 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.846 ( 3.867 -14.023 -14.191) 20.322 2.207 ( -4.194 -6.967 15.197) 17.236 2.574 ( 15.388 -21.368 -17.467) 31.599 2.770 ( 10.636 -1.256 12.911) 16.775 2.962 ( 9.266 -17.348 12.090) 23.087 3.145 ( -4.112 -18.724 -8.899) 21.135 3.351 ( -14.117 -2.081 -1.415) 14.340 3.517 ( 0.030 0.665 1.987) 2.095 3.610 ( -6.472 1.674 1.304) 6.811 3.882 ( 5.482 -10.091 -9.970) 15.208 4.040 ( -12.656 -1.933 -3.496) 13.271 4.131 ( -0.023 1.004 -0.427) 1.091 4.353 ( 3.654 -0.776 -0.221) 3.742 4.398 ( -1.450 5.444 -7.179) 9.125 4.686 ( 5.370 0.511 3.816) 6.608 4.813 ( 1.604 -4.233 -8.404) 9.546 4.855 ( 2.185 -6.766 9.689) 12.018 5.010 ( 7.986 4.307 3.306) 9.657 5.115 ( 4.375 8.880 6.653) 11.928 5.273 ( 1.220 -2.917 5.752) 6.564 5.445 ( -0.531 -3.260 -2.883) 4.385 5.486 ( 1.819 -3.445 8.603) 9.444 5.528 ( -3.638 -0.212 -6.750) 7.671 5.567 ( 7.409 5.002 1.716) 9.103 5.836 ( 3.261 8.422 3.073) 9.540 5.949 ( 2.705 3.097 -2.896) 5.029 5.982 ( -4.588 5.161 -7.082) 9.891 6.049 ( 3.471 -3.981 13.272) 14.285 6.176 ( 0.275 5.433 -5.297) 7.593 6.313 ( 8.567 5.123 9.989) 14.121 6.349 ( -8.616 7.983 -7.677) 14.032 6.533 ( 4.935 5.056 5.199) 8.772 6.628 ( 1.653 4.205 -2.931) 5.385 6.678 ( -2.479 4.100 -3.835) 6.137 6.856 ( -0.761 2.471 3.269) 4.168 6.987 ( -3.731 4.701 1.885) 6.290 7.125 ( -4.840 12.538 4.448) 14.156 7.139 ( -3.734 -1.815 -1.973) 4.597 7.273 ( 4.080 -1.691 -1.478) 4.657 7.308 ( -1.663 9.448 1.549) 9.717 7.360 ( -3.718 0.527 -6.985) 7.931 7.553 ( -3.880 2.214 -3.737) 5.824 7.812 ( -0.159 6.796 -2.009) 7.088 7.852 ( -2.236 0.453 0.357) 2.309 7.961 ( -2.927 -2.579 -0.069) 3.901 8.145 ( 1.479 -4.014 5.652) 7.089 8.189 ( 0.279 1.948 0.795) 2.122 8.324 ( -0.943 3.069 -3.708) 4.905 8.610 ( -3.918 3.780 -1.860) 5.753 8.616 ( 3.598 -1.730 1.170) 4.160 8.729 ( -6.211 -5.843 -13.675) 16.116 8.752 ( -1.084 2.935 0.041) 3.129 8.881 ( 1.070 -2.057 -1.316) 2.666 9.158 ( 0.043 12.622 -0.326) 12.626 9.370 ( -0.328 21.349 6.498) 22.318 9.506 ( -7.948 -2.143 7.510) 11.143 10.225 ( 4.554 -5.023 4.622) 8.206 10.398 ( 2.470 -1.086 -2.958) 4.004 10.427 ( 5.694 -0.916 4.390) 7.248 10.703 ( -0.689 -1.937 -6.077) 6.415 10.983 ( 5.817 -8.928 2.714) 10.996 10.997 ( 3.570 -4.794 3.416) 6.885 11.179 ( -0.150 -4.139 -3.515) 5.432 11.422 ( -5.747 -5.198 -4.230) 8.829 11.716 ( -0.039 -3.515 8.596) 9.287 11.994 ( -4.920 -5.660 -5.217) 9.136 12.279 ( -2.860 -0.055 -2.638) 3.891 12.391 ( -1.246 -1.349 1.400) 2.309 12.514 ( 6.286 -1.817 3.136) 7.256 12.768 ( 3.397 -1.369 2.391) 4.374 12.945 ( 5.581 -2.053 7.978) 9.951 13.613 ( -9.979 9.767 -11.634) 18.175 13.878 ( -8.962 2.089 -2.612) 9.566 14.175 ( -5.642 3.579 -8.202) 10.578 14.249 ( -5.386 4.076 -5.942) 8.996 14.300 ( -4.938 3.820 0.538) 6.267 14.668 ( 10.244 5.971 7.412) 13.984 14.846 ( 8.588 4.234 0.521) 9.590 15.094 ( -1.784 -1.231 -3.087) 3.772 15.140 ( -3.896 1.398 -0.940) 4.244 15.322 ( 9.156 10.896 13.177) 19.395 15.974 ( -6.841 9.050 -9.320) 14.682 16.536 ( 7.425 -0.260 0.209) 7.433 16.713 ( 1.971 -1.931 0.474) 2.800 19.897 ( 1.898 2.026 1.290) 3.061 20.111 ( -3.948 0.010 -2.550) 4.700 20.189 ( 3.470 -4.850 4.476) 7.456 20.335 ( -1.390 -7.023 -2.825) 7.696 24.307 ( 7.166 1.644 4.680) 8.716 24.661 ( -1.689 5.793 -7.697) 9.781 24.952 ( 5.406 2.932 1.500) 6.331 25.049 ( 4.947 4.425 -4.064) 7.782 26.167 ( -2.295 1.566 -0.534) 2.829 26.230 ( -3.063 2.196 -0.982) 3.895 26.650 ( -1.619 -2.365 -0.703) 2.951 26.681 ( -1.978 -2.017 1.025) 3.005 27.044 ( 1.311 3.603 1.742) 4.211 27.130 ( -1.193 4.783 -0.245) 4.936 27.280 ( 6.793 5.416 -1.852) 8.883 27.430 ( 4.941 2.082 2.007) 5.725 27.698 ( -3.812 0.896 5.343) 6.624 27.922 ( -4.124 1.322 -3.700) 5.696 29.058 ( 3.373 -8.748 0.187) 9.378 29.189 ( 2.683 -8.432 5.706) 10.528 29.305 ( -1.825 -7.473 -4.387) 8.855 29.573 ( -16.281 -10.861 -4.791) 20.149 29.792 ( 10.112 -3.078 -2.003) 10.758 30.330 ( -8.278 -1.196 8.060) 11.616 ======================= Grid point 235 (105/117) ======================= q-point: ( 0.50 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.159 ( 2.340 -14.556 -7.003) 16.322 2.228 ( 0.958 -0.170 5.350) 5.437 2.991 ( 6.678 -15.053 4.660) 17.115 3.039 ( 5.174 -14.078 -1.774) 15.103 3.260 ( 2.473 -8.693 -4.076) 9.915 3.341 ( -4.148 0.344 2.015) 4.624 3.440 ( -1.237 -9.539 -7.160) 11.991 3.566 ( -1.333 -7.692 5.745) 9.693 3.617 ( 9.976 -7.417 -0.640) 12.447 3.960 ( -2.381 5.001 -0.519) 5.563 4.005 ( -6.743 -2.500 0.017) 7.192 4.196 ( -1.561 -9.941 -3.040) 10.512 4.357 ( -4.589 -3.313 3.748) 6.788 4.380 ( 1.173 0.969 -8.289) 8.427 4.670 ( 8.294 11.005 6.465) 15.222 4.699 ( -3.905 10.155 7.244) 13.071 4.858 ( 7.326 1.018 3.062) 8.005 5.011 ( -15.422 -7.463 -8.738) 19.233 5.161 ( 3.223 2.313 -2.222) 4.547 5.244 ( 3.140 1.916 1.785) 4.089 5.319 ( -2.198 10.185 6.334) 12.193 5.476 ( 6.185 1.660 -1.714) 6.629 5.587 ( 5.757 1.066 0.993) 5.938 5.643 ( -5.148 10.750 0.982) 11.959 5.669 ( -3.553 -1.823 -3.351) 5.213 5.800 ( 3.768 -3.244 -0.447) 4.992 5.992 ( -0.028 5.195 -12.116) 13.183 6.004 ( 2.147 2.773 -1.637) 3.870 6.178 ( 1.300 3.168 2.145) 4.041 6.240 ( 0.977 -2.248 6.672) 7.108 6.310 ( 7.747 5.055 7.868) 12.144 6.487 ( 2.875 8.310 -1.516) 8.923 6.554 ( 8.675 -3.901 11.286) 14.759 6.625 ( -0.225 -2.006 2.546) 3.249 6.788 ( -8.115 4.178 -4.241) 10.064 6.844 ( -4.397 5.220 -4.289) 8.061 6.889 ( -4.898 4.376 2.780) 7.132 7.110 ( -3.175 8.627 -5.500) 10.712 7.186 ( 0.781 -2.106 1.710) 2.823 7.284 ( 0.308 2.001 0.736) 2.155 7.365 ( -1.380 0.137 -1.924) 2.372 7.537 ( -4.230 -2.754 -5.484) 7.454 7.661 ( 1.415 5.918 -3.488) 7.013 7.859 ( 0.521 -0.966 1.201) 1.627 7.977 ( 0.542 -0.600 5.115) 5.178 8.066 ( -4.821 6.543 -1.569) 8.278 8.149 ( 3.467 5.004 0.349) 6.097 8.394 ( 1.198 -3.455 1.245) 3.863 8.478 ( -5.253 4.535 -2.177) 7.273 8.622 ( -0.477 1.908 3.017) 3.601 8.703 ( -0.435 0.592 -3.390) 3.468 8.772 ( -3.621 -0.070 -10.244) 10.865 8.847 ( 4.407 6.430 4.878) 9.196 8.972 ( 4.678 7.040 -3.427) 9.121 9.130 ( -1.421 0.732 5.950) 6.161 9.439 ( -11.610 3.037 3.588) 12.525 10.321 ( 3.474 -2.120 3.280) 5.227 10.407 ( 0.069 0.520 -3.633) 3.671 10.498 ( 5.963 -1.719 5.469) 8.271 10.709 ( -2.457 0.014 -5.941) 6.429 11.097 ( 4.650 -2.730 4.800) 7.219 11.169 ( 3.073 -6.403 0.379) 7.112 11.236 ( 1.805 -1.535 -2.594) 3.513 11.462 ( -9.404 -4.041 -5.399) 11.572 11.818 ( 8.031 -3.537 9.737) 13.108 12.075 ( -4.517 -5.211 -5.672) 8.929 12.281 ( -0.803 -1.514 -1.526) 2.295 12.386 ( -2.203 0.320 -0.263) 2.242 12.593 ( 7.163 -1.376 3.850) 8.248 12.799 ( 0.511 -0.374 2.384) 2.467 12.989 ( 4.256 1.239 5.556) 7.108 13.360 ( -8.585 9.489 -8.833) 15.548 13.819 ( -6.602 -1.383 -2.455) 7.178 14.059 ( -10.698 0.712 -9.673) 14.441 14.172 ( -0.404 2.389 -3.442) 4.209 14.215 ( -3.012 2.677 2.589) 4.790 14.627 ( 12.473 5.451 10.912) 17.446 14.834 ( 5.966 1.858 -0.528) 6.271 15.087 ( -3.011 1.515 -0.313) 3.385 15.099 ( -2.922 -0.837 -2.768) 4.112 15.230 ( 9.453 5.179 13.261) 17.089 15.728 ( -9.287 10.167 -11.580) 17.992 16.582 ( 6.526 0.014 0.103) 6.527 16.731 ( -0.129 0.792 0.776) 1.117 19.874 ( 3.105 1.729 2.269) 4.216 20.078 ( -5.460 0.235 -3.680) 6.589 20.305 ( 4.000 -4.348 4.572) 7.471 20.448 ( -2.308 -5.526 -2.740) 6.585 24.312 ( 6.008 2.124 4.308) 7.692 24.520 ( -1.903 6.527 -5.765) 8.914 24.930 ( 3.837 1.978 1.617) 4.610 25.003 ( 1.310 2.689 -2.111) 3.661 26.130 ( -1.322 0.857 -0.106) 1.579 26.176 ( -2.939 1.207 -0.437) 3.207 26.688 ( -0.652 -2.309 0.862) 2.550 26.723 ( -2.123 -3.311 -0.789) 4.011 26.995 ( 0.595 2.064 1.868) 2.847 27.049 ( -1.057 2.732 -1.246) 3.183 27.211 ( 6.299 5.489 -3.204) 8.948 27.363 ( -0.258 5.255 5.193) 7.392 27.718 ( 1.896 -1.867 -0.270) 2.674 27.883 ( -3.457 0.411 -1.232) 3.693 29.240 ( 5.551 -5.846 -1.437) 8.188 29.335 ( 2.230 -3.526 8.505) 9.473 29.393 ( -1.022 -3.109 -3.301) 4.649 29.598 ( -7.767 -3.157 -3.628) 9.136 29.987 ( 4.704 -9.992 -6.446) 12.787 30.343 ( -9.611 -5.504 7.263) 13.245 ======================= Grid point 236 (106/117) ======================= q-point: ( 0.60 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 204 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.235 ( 9.397 0.419 3.612) 10.076 2.431 ( -2.835 -9.270 -3.125) 10.185 3.206 ( 4.797 0.247 -4.313) 6.456 3.267 ( 1.067 -9.648 7.241) 12.109 3.300 ( -3.573 -3.607 1.113) 5.198 3.369 ( 2.406 -2.758 -5.766) 6.830 3.571 ( -1.299 0.197 -2.799) 3.092 3.660 ( -5.462 2.314 -0.423) 5.947 3.833 ( 5.316 -10.433 -2.263) 11.925 3.946 ( -1.667 -10.476 -0.745) 10.634 4.135 ( 6.253 -6.268 9.814) 13.217 4.274 ( -2.729 6.879 -0.114) 7.401 4.302 ( -5.266 4.831 -2.962) 7.735 4.370 ( -3.771 -7.753 -3.220) 9.203 4.540 ( 8.248 0.460 5.377) 9.856 4.643 ( 1.498 2.355 5.217) 5.917 4.792 ( -5.955 2.417 -4.697) 7.960 4.968 ( -15.049 5.001 -10.146) 18.826 5.049 ( 4.327 7.856 5.761) 10.659 5.153 ( -1.324 2.164 -0.523) 2.590 5.296 ( 2.625 2.989 0.922) 4.083 5.378 ( 0.070 12.625 0.751) 12.648 5.464 ( 7.798 -4.273 7.712) 11.771 5.592 ( 11.902 0.594 3.061) 12.304 5.720 ( -7.212 -4.275 -6.244) 10.454 5.866 ( -4.916 3.470 -2.874) 6.668 5.937 ( 0.852 1.496 7.633) 7.825 5.982 ( 8.349 7.775 -0.322) 11.413 6.095 ( -3.204 -4.304 -11.604) 12.784 6.186 ( -8.706 2.825 -6.743) 11.368 6.296 ( 10.094 -0.463 8.494) 13.200 6.444 ( 7.959 -0.163 5.630) 9.751 6.612 ( -7.457 0.252 -3.844) 8.393 6.695 ( -1.932 -3.510 1.357) 4.230 6.762 ( -5.224 3.564 2.146) 6.678 6.803 ( 5.356 -4.089 2.918) 7.343 6.816 ( -4.512 -1.340 -3.942) 6.140 6.944 ( -4.938 4.115 -4.203) 7.680 7.144 ( 3.843 7.708 3.057) 9.139 7.237 ( -2.080 9.371 2.488) 9.916 7.328 ( 5.347 -3.761 -0.650) 6.569 7.569 ( -7.331 -2.890 -1.929) 8.113 7.645 ( 8.292 1.109 -4.550) 9.523 7.887 ( 5.323 0.360 1.237) 5.477 7.898 ( -5.465 6.802 -1.335) 8.827 8.029 ( 6.018 -3.350 3.495) 7.723 8.077 ( -3.975 3.971 1.856) 5.918 8.253 ( -8.834 1.281 -3.123) 9.457 8.513 ( 2.981 -1.317 2.022) 3.835 8.618 ( 1.566 0.021 1.565) 2.214 8.678 ( -4.089 0.276 -3.418) 5.337 8.702 ( -2.121 3.015 -0.042) 3.687 8.856 ( 7.479 -1.082 2.750) 8.042 8.914 ( 5.441 3.221 -2.859) 6.939 9.166 ( -2.764 -3.533 3.456) 5.663 9.290 ( -9.327 3.400 -1.693) 10.071 10.360 ( 1.261 -0.385 1.831) 2.256 10.386 ( -0.598 1.177 -2.387) 2.728 10.555 ( 4.443 -0.649 4.053) 6.049 10.674 ( -3.690 1.079 -5.047) 6.344 11.152 ( 5.702 0.855 4.943) 7.595 11.250 ( -1.046 -1.286 -2.706) 3.173 11.279 ( 4.351 -1.332 1.592) 4.821 11.462 ( -9.695 -2.176 -5.272) 11.248 11.939 ( 10.558 -2.195 8.707) 13.861 12.128 ( -4.838 -3.477 -5.427) 8.059 12.325 ( 0.703 -2.862 -0.282) 2.960 12.375 ( -0.899 -0.580 -0.611) 1.232 12.645 ( 6.048 0.420 3.125) 6.821 12.785 ( -2.639 1.268 1.425) 3.256 12.960 ( 2.804 3.561 2.388) 5.122 13.143 ( -9.366 6.680 -7.239) 13.592 13.854 ( -0.497 -4.366 0.743) 4.457 14.034 ( -9.641 -4.219 -8.182) 13.330 14.143 ( 0.348 0.287 -0.926) 1.030 14.165 ( -1.490 0.832 0.766) 1.871 14.618 ( 15.284 4.593 13.343) 20.803 14.835 ( 0.864 0.574 -3.339) 3.496 15.051 ( -1.235 0.867 -1.074) 1.852 15.085 ( -3.520 0.276 -0.614) 3.583 15.238 ( 6.685 -0.231 10.594) 12.529 15.479 ( -8.318 8.602 -11.270) 16.437 16.610 ( 4.047 0.514 -0.683) 4.136 16.688 ( -1.644 2.681 0.955) 3.286 19.874 ( 4.729 0.747 3.465) 5.911 20.035 ( -6.714 0.095 -4.737) 8.217 20.404 ( 4.830 -2.675 4.230) 6.955 20.514 ( -3.166 -3.070 -2.713) 5.178 24.302 ( 4.084 2.088 3.238) 5.614 24.398 ( -2.271 4.289 -3.582) 6.032 24.920 ( 1.914 1.105 1.586) 2.720 24.955 ( -0.413 2.277 -1.754) 2.904 26.121 ( -0.003 -0.295 0.256) 0.391 26.149 ( -1.980 -0.043 -0.501) 2.043 26.734 ( 0.653 -2.387 0.899) 2.632 26.777 ( -2.458 -3.529 -0.630) 4.346 26.971 ( 0.989 1.031 1.262) 1.906 27.008 ( -1.293 0.777 -1.143) 1.893 27.144 ( 5.795 4.918 -3.466) 8.353 27.254 ( -2.821 4.760 4.202) 6.948 27.764 ( 3.277 -1.042 -0.878) 3.549 27.859 ( -3.353 -0.027 0.101) 3.355 29.314 ( 3.061 0.214 -6.692) 7.362 29.345 ( -0.051 2.015 8.915) 9.140 29.470 ( 2.880 -3.689 2.102) 5.130 29.620 ( -6.812 -2.847 -5.238) 9.052 30.200 ( 7.066 -7.858 -1.284) 10.646 30.411 ( -8.153 -6.099 2.479) 10.479 ======================= Grid point 237 (107/117) ======================= q-point: (-0.30 0.20 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.306 ( 13.790 0.120 2.946) 14.102 2.464 ( -10.352 0.046 -3.102) 10.807 3.159 ( 7.940 8.952 -1.953) 12.124 3.267 ( -8.598 8.261 1.369) 12.002 3.387 ( 1.382 0.976 7.408) 7.599 3.436 ( -4.221 -0.220 -8.572) 9.558 3.491 ( 6.784 -3.175 1.661) 7.672 3.600 ( -8.768 -3.619 -1.507) 9.605 4.034 ( 5.839 -5.263 0.500) 7.876 4.089 ( -1.160 -0.612 1.347) 1.880 4.157 ( 2.334 -3.319 2.553) 4.794 4.218 ( -5.966 2.335 -1.777) 6.649 4.244 ( 8.391 12.101 6.803) 16.221 4.379 ( -9.909 7.780 -7.728) 14.780 4.565 ( 3.720 -3.343 0.222) 5.006 4.610 ( -2.653 -4.190 0.038) 4.959 4.769 ( 3.698 -4.669 -1.099) 6.057 4.854 ( -9.132 -7.584 0.521) 11.882 5.085 ( 4.295 -2.070 6.998) 8.468 5.125 ( -0.946 1.189 -10.804) 10.910 5.218 ( 3.810 0.911 5.041) 6.384 5.262 ( -1.788 -1.477 -4.478) 5.043 5.621 ( 8.770 -0.690 6.789) 11.112 5.691 ( 3.443 -0.144 -1.024) 3.595 5.723 ( -5.796 1.735 -4.136) 7.329 5.746 ( -4.137 4.835 1.132) 6.464 5.771 ( 11.028 2.044 9.282) 14.559 5.919 ( -9.871 -0.590 -7.680) 12.520 6.161 ( 2.369 -1.384 4.723) 5.462 6.209 ( -3.711 0.222 -8.415) 9.199 6.429 ( 9.928 -6.351 6.331) 13.378 6.489 ( 6.568 1.682 5.785) 8.913 6.556 ( -9.858 4.470 -6.692) 12.726 6.589 ( -7.264 0.320 -5.077) 8.868 6.756 ( 4.386 0.875 4.051) 6.034 6.829 ( -6.384 -0.218 -4.550) 7.842 6.898 ( 1.268 -3.085 -1.528) 3.668 6.905 ( -0.354 -5.750 3.159) 6.570 7.031 ( 0.708 4.017 1.542) 4.361 7.058 ( -2.566 4.676 0.077) 5.334 7.442 ( 9.445 -3.253 1.677) 10.130 7.562 ( -7.975 -1.911 -0.458) 8.214 7.619 ( 7.176 6.479 -2.608) 10.013 7.713 ( -6.932 8.436 -0.035) 10.918 7.917 ( 4.675 -1.192 2.685) 5.522 7.981 ( -4.534 -0.537 -2.160) 5.051 8.195 ( 7.534 -6.505 2.207) 10.196 8.296 ( -7.932 -6.437 -2.311) 10.473 8.547 ( 6.383 1.182 0.959) 6.562 8.602 ( -0.092 2.112 -0.471) 2.166 8.641 ( -1.714 1.334 0.914) 2.356 8.653 ( -4.250 -0.437 -0.923) 4.371 8.867 ( 3.999 3.265 -3.754) 6.383 8.886 ( 0.430 2.613 4.802) 5.484 9.250 ( 1.500 -6.688 3.925) 7.899 9.287 ( -3.802 -6.572 -4.782) 8.973 10.355 ( 0.065 1.439 -0.597) 1.559 10.359 ( -0.670 0.869 0.485) 1.199 10.587 ( 3.710 -0.183 2.110) 4.272 10.636 ( -3.831 -0.033 -2.464) 4.555 11.142 ( 5.590 3.699 3.893) 7.752 11.209 ( -4.528 3.390 -3.467) 6.635 11.336 ( 6.263 -0.780 4.538) 7.773 11.432 ( -8.812 -1.019 -6.008) 10.714 12.030 ( 10.768 -0.282 7.108) 12.906 12.144 ( -6.939 -1.614 -5.089) 8.756 12.394 ( 1.574 -2.889 3.088) 4.512 12.402 ( 0.561 -2.230 -2.530) 3.419 12.659 ( 5.549 1.382 3.591) 6.753 12.728 ( -4.702 1.487 -1.116) 5.056 12.904 ( 2.747 3.670 2.604) 5.272 12.984 ( -9.175 3.617 -6.973) 12.078 13.966 ( 4.996 -4.769 3.442) 7.717 14.062 ( -8.556 -4.024 -6.255) 11.337 14.166 ( -0.244 -2.499 0.046) 2.512 14.169 ( -0.327 -1.871 -0.496) 1.963 14.649 ( 16.732 2.921 13.197) 21.509 14.801 ( -5.806 1.652 -6.596) 8.941 15.033 ( 0.198 0.562 -3.266) 3.320 15.052 ( -3.190 0.711 2.221) 3.952 15.297 ( 1.804 -1.094 1.308) 2.482 15.336 ( -3.430 -0.315 -2.648) 4.344 16.605 ( 1.588 1.874 1.022) 2.660 16.627 ( -1.726 1.974 -0.991) 2.803 19.904 ( 6.109 -0.162 4.539) 7.612 19.991 ( -7.131 -0.207 -5.272) 8.870 20.466 ( 5.124 -0.315 3.456) 6.189 20.525 ( -3.961 -0.373 -2.645) 4.778 24.288 ( 2.888 1.497 2.213) 3.934 24.326 ( -2.795 1.474 -2.198) 3.849 24.905 ( 0.782 1.330 -0.394) 1.593 24.916 ( -0.934 1.230 0.406) 1.597 26.139 ( 0.883 -1.270 0.748) 1.718 26.153 ( -1.158 -1.260 -0.873) 1.921 26.789 ( 2.645 -2.142 0.117) 3.406 26.827 ( -3.340 -3.265 0.087) 4.671 26.961 ( 2.064 1.354 0.978) 2.655 26.988 ( -1.997 0.812 -0.862) 2.321 27.100 ( 5.283 2.342 -1.666) 6.015 27.160 ( -4.532 2.119 1.625) 5.261 27.798 ( 3.596 -0.381 -1.571) 3.943 27.841 ( -3.445 -0.263 1.387) 3.723 29.306 ( 0.590 1.283 -1.071) 1.772 29.309 ( -0.088 1.341 1.345) 1.902 29.532 ( 4.354 0.118 2.954) 5.263 29.600 ( -6.143 0.703 -3.956) 7.340 30.363 ( 8.145 -3.625 4.250) 9.877 30.460 ( -6.797 -3.211 -3.509) 8.296 ======================= Grid point 238 (108/117) ======================= q-point: (-0.20 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 107 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.379 ( -9.682 1.361 -3.318) 10.325 2.379 ( 9.682 1.361 3.318) 10.325 2.980 ( -1.409 12.101 -4.513) 12.991 2.980 ( 1.409 12.101 4.513) 12.991 3.286 ( -2.157 11.393 -7.399) 13.755 3.286 ( 2.157 11.393 7.399) 13.755 3.666 ( -6.742 -2.660 -6.477) 9.720 3.666 ( 6.742 -2.660 6.477) 9.720 3.885 ( -3.302 11.502 -6.485) 13.611 3.885 ( 3.302 11.502 6.485) 13.611 4.211 ( -1.043 -3.146 -2.869) 4.383 4.211 ( 1.043 -3.146 2.869) 4.383 4.282 ( -6.545 -5.271 -5.380) 9.978 4.282 ( 6.545 -5.271 5.380) 9.978 4.677 ( 0.998 -2.663 -1.767) 3.348 4.677 ( -0.998 -2.663 1.767) 3.348 4.969 ( 4.282 -6.164 -5.789) 9.479 4.969 ( -4.282 -6.164 5.789) 9.479 5.053 ( -6.172 3.309 -5.906) 9.161 5.053 ( 6.172 3.309 5.906) 9.161 5.379 ( -3.328 -9.399 -3.076) 10.434 5.379 ( 3.328 -9.399 3.076) 10.434 5.587 ( -0.854 4.104 -6.569) 7.792 5.587 ( 0.854 4.104 6.569) 7.792 5.735 ( 2.248 -2.845 -7.299) 8.150 5.735 ( -2.248 -2.845 7.299) 8.150 5.884 ( -11.513 -0.421 -10.474) 15.570 5.884 ( 11.513 -0.421 10.474) 15.570 6.036 ( -2.652 11.428 -12.949) 17.473 6.036 ( 2.652 11.428 12.949) 17.473 6.503 ( -5.251 -2.381 -4.019) 7.028 6.503 ( 5.251 -2.381 4.019) 7.028 6.586 ( -7.937 -4.219 -3.008) 9.479 6.586 ( 7.937 -4.219 3.008) 9.479 6.779 ( -7.972 0.227 -3.446) 8.688 6.779 ( 7.972 0.227 3.446) 8.688 6.976 ( -2.021 -1.284 -0.978) 2.587 6.976 ( 2.021 -1.284 0.978) 2.587 7.102 ( 1.706 -10.169 -5.532) 11.702 7.102 ( -1.706 -10.169 5.532) 11.702 7.484 ( -1.778 7.511 -4.451) 8.910 7.484 ( 1.778 7.511 4.451) 8.910 7.625 ( -11.139 -7.527 -2.856) 13.743 7.625 ( 11.139 -7.527 2.856) 13.743 8.014 ( -5.324 -5.190 -5.223) 9.087 8.014 ( 5.324 -5.190 5.223) 9.087 8.316 ( -2.661 -0.353 -10.707) 11.038 8.316 ( 2.661 -0.353 10.707) 11.038 8.541 ( -4.141 1.927 -3.163) 5.556 8.541 ( 4.141 1.927 3.163) 5.556 8.649 ( -2.624 -1.268 -0.888) 3.047 8.649 ( 2.624 -1.268 0.888) 3.047 8.849 ( 1.448 -0.672 -3.083) 3.472 8.849 ( -1.448 -0.672 3.083) 3.472 9.400 ( -3.613 -5.010 -15.770) 16.937 9.400 ( 3.613 -5.010 15.770) 16.937 10.331 ( 0.319 1.259 -1.029) 1.657 10.331 ( -0.319 1.259 1.029) 1.657 10.623 ( -2.881 -1.016 -1.769) 3.530 10.623 ( 2.881 -1.016 1.769) 3.530 11.081 ( -4.700 6.047 -3.174) 8.291 11.081 ( 4.700 6.047 3.174) 8.291 11.387 ( -7.247 0.293 -7.417) 10.373 11.387 ( 7.247 0.293 7.417) 10.373 12.094 ( -9.566 0.740 -6.645) 11.671 12.094 ( 9.566 0.740 6.645) 11.671 12.431 ( 0.730 0.164 -4.445) 4.508 12.431 ( -0.730 0.164 4.445) 4.508 12.703 ( -7.323 -2.090 -3.713) 8.472 12.703 ( 7.323 -2.090 3.713) 8.472 12.880 ( -9.141 0.656 -5.620) 10.750 12.880 ( 9.141 0.656 5.620) 10.750 14.076 ( -6.112 -2.560 -3.230) 7.372 14.076 ( 6.112 -2.560 3.230) 7.372 14.229 ( 0.274 -3.900 -2.588) 4.689 14.229 ( -0.274 -3.900 2.588) 4.689 14.695 ( -12.085 2.704 -9.320) 15.499 14.695 ( 12.085 2.704 9.320) 15.499 15.038 ( 0.765 -1.058 -4.845) 5.018 15.038 ( -0.765 -1.058 4.845) 5.018 15.372 ( -10.316 -4.799 -1.049) 11.426 15.372 ( 10.316 -4.799 1.049) 11.426 16.580 ( -3.214 1.662 -5.489) 6.574 16.580 ( 3.214 1.662 5.489) 6.574 19.954 ( -6.682 -0.650 -5.172) 8.475 19.954 ( 6.682 -0.650 5.172) 8.475 20.478 ( -4.614 2.398 -2.411) 5.732 20.478 ( 4.614 2.398 2.411) 5.732 24.296 ( -4.125 -0.425 -2.111) 4.653 24.296 ( 4.125 -0.425 2.111) 4.653 24.888 ( 0.738 1.043 -1.503) 1.972 24.888 ( -0.738 1.043 1.503) 1.972 26.179 ( -1.115 -2.011 -1.353) 2.668 26.179 ( 1.115 -2.011 1.353) 2.668 26.841 ( 0.884 0.023 -1.751) 1.962 26.841 ( -0.884 0.023 1.751) 1.962 26.950 ( -2.799 0.327 -1.822) 3.356 26.950 ( 2.799 0.327 1.822) 3.356 27.129 ( -4.084 -1.725 -1.880) 4.816 27.129 ( 4.084 -1.725 1.880) 4.816 27.826 ( 1.442 -0.406 -8.993) 9.116 27.826 ( -1.442 -0.406 8.993) 9.116 29.281 ( -0.857 1.831 -7.487) 7.756 29.281 ( 0.857 1.831 7.487) 7.756 29.526 ( -3.405 2.843 -4.059) 6.013 29.526 ( 3.405 2.843 4.059) 6.013 30.439 ( -6.538 0.940 -10.968) 12.803 30.439 ( 6.538 0.940 10.968) 12.803 ======================= Grid point 244 (109/117) ======================= q-point: ( 0.30 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.551 ( 16.205 0.000 -7.544) 17.875 1.934 ( -1.185 -0.000 32.111) 32.133 2.085 ( 23.083 0.000 -25.108) 34.106 2.461 ( 5.325 0.000 -0.862) 5.394 2.630 ( 8.199 0.000 3.736) 9.011 2.984 ( 6.339 0.000 5.090) 8.129 3.343 ( -22.158 -0.000 -7.543) 23.407 3.421 ( 1.677 0.000 -24.457) 24.515 3.479 ( -22.546 -0.000 5.633) 23.239 3.895 ( -24.538 -0.000 -9.264) 26.228 3.926 ( 6.272 0.000 7.474) 9.757 4.096 ( -7.674 -0.000 -0.382) 7.683 4.216 ( 1.575 0.000 -2.419) 2.887 4.456 ( 32.355 0.000 24.137) 40.366 4.758 ( 3.281 0.000 -6.882) 7.624 4.765 ( 10.807 0.000 2.757) 11.153 4.955 ( 16.642 0.000 -6.427) 17.840 4.968 ( -6.311 -0.000 -11.050) 12.725 5.112 ( -2.460 -0.000 -1.987) 3.163 5.203 ( 7.361 0.000 6.486) 9.810 5.389 ( -4.105 -0.000 15.680) 16.208 5.425 ( -4.132 -0.000 7.334) 8.418 5.730 ( 0.263 0.000 2.279) 2.294 5.735 ( 7.076 0.000 10.921) 13.013 5.789 ( -9.556 -0.000 7.470) 12.129 5.877 ( 8.086 0.000 -0.670) 8.114 6.141 ( 3.121 0.000 3.028) 4.348 6.183 ( 8.969 0.000 -1.324) 9.066 6.349 ( -4.727 -0.000 -16.036) 16.718 6.450 ( 3.942 0.000 10.080) 10.823 6.521 ( -8.726 -0.000 -11.639) 14.547 6.609 ( -3.386 -0.000 -8.123) 8.801 6.646 ( -6.796 -0.000 -3.827) 7.800 6.802 ( 4.141 0.000 0.971) 4.253 6.855 ( 5.451 0.000 8.594) 10.177 7.098 ( -0.268 -0.000 9.587) 9.590 7.132 ( -4.177 -0.000 -8.711) 9.661 7.229 ( 3.049 0.000 -3.231) 4.443 7.330 ( -2.621 -0.000 -1.742) 3.148 7.572 ( 4.235 0.000 16.904) 17.426 7.638 ( -8.691 -0.000 -2.228) 8.972 7.716 ( -4.428 -0.000 0.164) 4.431 7.761 ( -0.475 -0.000 -3.016) 3.053 7.937 ( -3.214 -0.000 -8.848) 9.413 7.956 ( -3.275 -0.000 -3.045) 4.472 8.042 ( -0.079 -0.000 1.891) 1.892 8.142 ( -5.292 -0.000 -3.569) 6.383 8.387 ( 3.244 0.000 5.933) 6.762 8.472 ( -1.503 -0.000 -0.919) 1.762 8.635 ( 1.896 0.000 -3.294) 3.801 8.669 ( -2.809 -0.000 -4.232) 5.080 8.803 ( 1.771 0.000 2.038) 2.700 8.924 ( 2.199 0.000 2.135) 3.065 9.197 ( -19.584 -0.000 0.071) 19.584 9.717 ( 9.771 0.000 8.015) 12.637 9.944 ( -4.828 -0.000 -2.541) 5.455 10.041 ( 4.832 0.000 3.210) 5.802 10.303 ( 2.840 0.000 -6.729) 7.304 10.490 ( 4.928 0.000 2.836) 5.686 10.614 ( 0.552 0.000 5.169) 5.199 10.739 ( 4.711 0.000 -6.989) 8.428 10.787 ( 3.477 0.000 3.774) 5.132 11.043 ( 2.660 0.000 -1.715) 3.165 11.296 ( -1.796 -0.000 -0.905) 2.012 11.603 ( -6.516 -0.000 9.012) 11.121 11.863 ( -7.006 -0.000 -5.761) 9.070 12.299 ( 3.536 0.000 1.477) 3.832 12.335 ( -0.185 -0.000 -1.210) 1.224 12.469 ( 2.894 0.000 3.431) 4.489 12.730 ( 6.804 0.000 1.398) 6.946 12.882 ( 6.532 0.000 8.481) 10.705 13.757 ( -24.552 -0.000 -18.996) 31.043 14.014 ( -0.005 -0.000 -1.135) 1.135 14.270 ( -0.249 -0.000 -7.155) 7.159 14.365 ( -4.489 -0.000 3.202) 5.514 14.400 ( -10.343 -0.000 -10.101) 14.458 14.790 ( 7.877 0.000 5.678) 9.710 15.012 ( 2.225 0.000 -5.098) 5.562 15.040 ( 1.193 0.000 2.181) 2.486 15.181 ( -0.289 -0.000 -1.533) 1.560 15.742 ( 6.748 0.000 8.529) 10.876 16.181 ( -3.277 -0.000 -6.497) 7.276 16.468 ( 4.768 0.000 2.550) 5.407 16.652 ( 1.717 0.000 -5.127) 5.407 19.945 ( 3.156 0.000 2.024) 3.749 20.043 ( 2.170 0.000 0.071) 2.171 20.136 ( -0.595 -0.000 -1.983) 2.070 20.142 ( -0.954 -0.000 -0.757) 1.218 24.348 ( 9.570 0.000 7.203) 11.978 24.752 ( -2.341 -0.000 -7.184) 7.556 25.005 ( 6.323 0.000 2.537) 6.813 25.250 ( 3.876 0.000 -14.987) 15.480 26.209 ( -1.722 -0.000 -1.043) 2.013 26.303 ( -2.026 -0.000 -5.865) 6.205 26.594 ( -2.591 -0.000 -1.910) 3.219 26.650 ( -2.501 -0.000 3.737) 4.497 27.256 ( 2.146 0.000 -1.526) 2.633 27.281 ( 0.322 0.000 1.418) 1.454 27.312 ( 11.712 0.000 -0.388) 11.718 27.428 ( 6.315 0.000 -1.640) 6.524 27.917 ( -11.057 -0.000 1.745) 11.194 27.952 ( -14.232 -0.000 6.044) 15.462 28.837 ( -2.001 -0.000 4.299) 4.742 28.880 ( -3.040 -0.000 -3.237) 4.441 28.989 ( 1.407 0.000 -5.375) 5.556 29.087 ( -4.699 -0.000 4.761) 6.689 29.860 ( 10.064 0.000 8.633) 13.259 30.367 ( -5.645 -0.000 1.345) 5.803 ======================= Grid point 245 (110/117) ======================= q-point: ( 0.40 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.694 ( 12.799 -4.959 -8.828) 16.320 2.018 ( -3.866 -7.902 25.331) 26.815 2.359 ( 25.173 -12.083 -19.278) 33.931 2.649 ( 0.693 -16.718 -14.720) 22.286 2.837 ( 14.583 -9.042 18.141) 24.970 2.923 ( 4.124 5.417 9.226) 11.466 3.194 ( -20.127 -2.034 0.183) 20.230 3.427 ( -15.479 -5.709 2.982) 16.765 3.497 ( -3.736 -6.661 -17.831) 19.398 3.781 ( -22.683 -3.623 -12.814) 26.303 3.893 ( 3.126 0.412 2.267) 3.883 4.153 ( -1.789 -4.503 1.239) 5.002 4.303 ( 3.252 -4.267 -2.106) 5.764 4.575 ( -1.094 11.397 -7.830) 13.871 4.672 ( 18.700 -2.460 7.162) 20.175 4.780 ( 12.050 4.187 0.415) 12.764 4.970 ( 2.303 5.353 4.682) 7.475 5.102 ( 17.802 -0.621 0.144) 17.814 5.142 ( 0.003 -10.458 -8.328) 13.369 5.235 ( -10.064 -0.305 12.016) 15.677 5.376 ( -2.493 -0.010 9.652) 9.969 5.495 ( 6.367 -2.338 3.190) 7.495 5.592 ( 7.243 10.080 2.917) 12.750 5.645 ( -6.159 -0.320 7.677) 9.848 5.864 ( 4.354 -3.374 10.572) 11.920 5.974 ( 6.576 -0.356 2.581) 7.073 6.091 ( 2.501 5.061 -1.725) 5.903 6.144 ( -6.982 9.627 -8.625) 14.691 6.250 ( -0.978 1.352 -3.611) 3.978 6.366 ( -11.361 3.842 -9.394) 15.234 6.519 ( 11.151 3.740 3.932) 12.402 6.599 ( -2.072 -0.252 -3.715) 4.262 6.664 ( -1.570 -2.932 -2.837) 4.372 6.755 ( 3.256 5.979 1.003) 6.881 6.886 ( -0.702 0.991 5.329) 5.466 7.042 ( -3.261 3.919 6.206) 8.032 7.110 ( -2.262 -0.414 -5.319) 5.795 7.256 ( 2.487 -0.197 -3.556) 4.344 7.317 ( -3.958 -0.166 -2.001) 4.439 7.380 ( -3.014 12.866 4.078) 13.829 7.488 ( -4.169 9.725 -0.457) 10.591 7.619 ( -8.001 7.629 -3.542) 11.609 7.848 ( 3.637 -3.347 0.240) 4.948 7.868 ( 1.400 -2.001 1.357) 2.794 7.930 ( -2.027 3.358 -0.211) 3.928 8.097 ( 0.809 -2.049 2.281) 3.171 8.171 ( -0.902 -3.555 -0.075) 3.668 8.395 ( -0.492 1.880 -2.318) 3.025 8.485 ( -2.574 -4.679 -4.450) 6.951 8.614 ( 1.321 -0.298 -2.914) 3.213 8.642 ( -3.124 0.440 -1.536) 3.509 8.867 ( -0.150 6.273 -0.340) 6.284 8.895 ( 3.040 -1.519 1.744) 3.820 9.127 ( -18.361 -6.371 -1.420) 19.487 9.615 ( 5.644 11.963 3.237) 13.618 9.750 ( -3.930 16.066 0.189) 16.541 10.159 ( 8.534 -6.082 8.533) 13.514 10.377 ( 1.855 -3.467 -6.330) 7.452 10.473 ( 5.483 2.358 5.062) 7.826 10.635 ( -2.291 -2.725 -3.491) 4.986 10.854 ( 4.588 -7.372 -1.960) 8.901 10.900 ( 2.236 -7.113 4.827) 8.882 11.093 ( 2.071 -3.364 -2.790) 4.836 11.302 ( -6.425 -2.885 -2.571) 7.498 11.634 ( 0.829 -4.389 10.229) 11.162 11.858 ( -6.402 -4.004 -6.877) 10.213 12.295 ( 2.239 1.695 0.451) 2.844 12.359 ( -0.171 -1.169 1.274) 1.737 12.528 ( 9.663 -1.782 7.249) 12.210 12.773 ( 4.171 -0.596 1.524) 4.481 12.943 ( 6.120 -1.840 10.828) 12.573 13.579 ( -24.592 1.556 -23.300) 33.913 13.966 ( 2.233 5.274 0.823) 5.786 14.222 ( -5.126 4.163 -7.221) 9.785 14.284 ( -5.424 2.980 -4.992) 7.951 14.328 ( -5.647 2.034 0.225) 6.006 14.816 ( 8.367 2.546 6.646) 10.985 14.984 ( 5.084 4.219 -1.556) 6.787 15.052 ( -1.278 -0.918 -1.605) 2.248 15.157 ( -1.206 2.109 -1.610) 2.915 15.639 ( 10.196 12.654 12.332) 20.400 16.078 ( -8.347 6.635 -10.126) 14.705 16.548 ( 5.612 -3.092 2.180) 6.768 16.676 ( 0.351 -2.098 -2.856) 3.561 19.950 ( 3.436 1.571 2.457) 4.506 20.079 ( -1.172 -1.352 -1.347) 2.240 20.138 ( 1.114 -1.905 1.545) 2.694 20.198 ( -1.165 -5.453 -2.715) 6.202 24.397 ( 10.097 1.609 8.714) 13.433 24.713 ( -3.776 2.068 -8.722) 9.727 25.031 ( 5.998 1.533 2.534) 6.689 25.189 ( 1.356 5.999 -9.964) 11.710 26.186 ( -1.296 1.394 -0.165) 1.910 26.256 ( -3.456 2.362 -4.050) 5.825 26.601 ( -0.488 -1.670 -2.336) 2.913 26.645 ( -2.175 -0.833 3.423) 4.140 27.161 ( 3.023 6.789 0.387) 7.441 27.225 ( -0.855 5.054 1.119) 5.246 27.420 ( 7.890 3.996 -2.100) 9.090 27.460 ( 7.892 -3.011 -1.550) 8.587 27.734 ( -8.188 6.117 9.284) 13.808 27.893 ( -9.583 -0.261 -2.140) 9.822 28.907 ( 1.972 -7.944 1.524) 8.326 29.042 ( 0.892 -8.702 2.778) 9.178 29.096 ( -2.673 -12.009 -6.469) 13.900 29.176 ( -9.454 -12.499 -0.501) 15.680 29.895 ( 11.137 2.955 6.098) 13.037 30.298 ( -8.509 2.202 1.376) 8.897 ======================= Grid point 246 (111/117) ======================= q-point: ( 0.50 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.916 ( 8.827 -11.476 -12.712) 19.267 2.138 ( -8.438 -6.805 15.023) 18.526 2.756 ( 15.280 -13.980 -14.333) 25.186 2.917 ( 9.549 -4.300 17.589) 20.471 2.992 ( -1.415 -15.295 -9.442) 18.030 3.114 ( -6.757 -13.607 -6.230) 16.420 3.274 ( 4.900 -10.154 14.714) 18.537 3.463 ( -7.098 -4.401 1.081) 8.421 3.561 ( -1.222 -3.144 0.124) 3.375 3.799 ( -16.669 -10.819 -10.046) 22.267 3.988 ( 6.656 -5.020 1.023) 8.400 4.147 ( -1.319 4.175 0.703) 4.434 4.359 ( 0.092 3.222 2.582) 4.130 4.403 ( -0.343 1.014 -13.097) 13.140 4.728 ( 4.744 0.813 -3.750) 6.102 4.823 ( 1.785 -0.279 1.159) 2.146 4.910 ( 5.030 1.188 2.873) 5.913 5.065 ( -5.117 12.836 7.138) 15.553 5.186 ( 9.297 0.933 1.705) 9.498 5.289 ( 0.010 -1.257 4.461) 4.635 5.399 ( -4.968 -7.609 -5.466) 10.604 5.438 ( -6.318 4.677 0.293) 7.867 5.548 ( 9.092 -0.217 1.900) 9.291 5.756 ( 11.577 1.966 10.230) 15.574 5.818 ( -2.553 8.625 -3.886) 9.799 5.897 ( -0.136 9.111 -2.588) 9.473 6.042 ( -3.260 -5.577 12.831) 14.366 6.080 ( 4.801 -0.315 0.952) 4.904 6.122 ( -3.787 8.115 -11.840) 14.845 6.281 ( -0.767 -1.461 -4.388) 4.688 6.499 ( 15.574 6.894 10.523) 20.020 6.579 ( 2.269 1.370 0.659) 2.731 6.643 ( -0.050 3.938 3.024) 4.965 6.657 ( 0.993 5.625 -2.977) 6.441 6.807 ( -6.405 3.590 0.191) 7.346 6.939 ( -6.189 5.858 -2.150) 8.788 7.063 ( -2.252 11.902 8.996) 15.088 7.126 ( 1.510 -0.796 -3.516) 3.908 7.225 ( -8.405 7.348 -9.091) 14.398 7.292 ( -6.276 -1.455 -0.221) 6.446 7.349 ( 4.621 0.751 -2.070) 5.119 7.475 ( -6.776 1.919 -4.656) 8.442 7.811 ( 0.165 6.969 -0.316) 6.978 7.835 ( -0.724 1.203 0.805) 1.619 7.976 ( 4.534 -1.522 4.061) 6.274 8.116 ( -4.192 1.025 0.595) 4.356 8.265 ( 8.060 -4.165 7.214) 11.591 8.330 ( 2.454 2.570 -2.390) 4.282 8.544 ( -6.132 3.418 -3.020) 7.642 8.583 ( -9.345 -5.110 -10.856) 15.208 8.682 ( 2.917 -2.124 -0.118) 3.610 8.745 ( -1.220 4.233 -1.891) 4.794 8.926 ( 5.469 -0.503 1.203) 5.622 9.117 ( -7.048 2.236 -1.816) 7.614 9.366 ( 0.023 18.343 5.579) 19.173 9.428 ( -4.326 7.040 1.102) 8.336 10.307 ( 6.764 -2.980 7.551) 10.567 10.411 ( -0.118 -0.146 -5.429) 5.433 10.509 ( 6.652 -1.539 6.567) 9.474 10.669 ( -4.115 -2.165 -7.031) 8.430 11.027 ( 2.609 -6.831 3.323) 8.032 11.051 ( 2.910 -7.021 0.810) 7.643 11.185 ( 2.084 -4.363 -2.454) 5.422 11.325 ( -8.140 -4.156 -3.663) 9.847 11.766 ( 5.694 -6.016 10.484) 13.361 11.926 ( -5.487 -6.348 -7.725) 11.405 12.282 ( 2.436 0.880 -0.171) 2.596 12.364 ( -3.006 -0.438 0.703) 3.118 12.628 ( 10.922 -1.033 6.659) 12.834 12.796 ( 0.132 -0.190 1.393) 1.412 13.022 ( 6.431 -1.303 12.283) 13.926 13.388 ( -20.413 2.994 -22.948) 30.859 13.865 ( 3.788 5.993 4.863) 8.598 14.056 ( -9.931 5.718 -9.003) 14.573 14.218 ( -0.416 2.611 -5.115) 5.758 14.251 ( -3.463 2.835 3.647) 5.773 14.801 ( 9.840 4.767 8.729) 13.991 14.925 ( 3.592 4.141 -3.949) 6.757 15.061 ( -2.584 -1.062 -2.453) 3.718 15.097 ( -3.322 1.952 -0.516) 3.887 15.477 ( 13.830 11.118 15.874) 23.809 15.845 ( -12.167 9.476 -13.432) 20.451 16.621 ( 6.109 -0.742 1.518) 6.338 16.718 ( -1.183 -1.702 -0.930) 2.272 19.935 ( 3.971 2.120 3.001) 5.410 20.055 ( -4.697 0.827 -3.549) 5.945 20.235 ( 3.349 -5.199 4.218) 7.486 20.310 ( -2.260 -6.634 -3.382) 7.782 24.413 ( 8.852 3.061 8.063) 12.358 24.612 ( -5.158 4.944 -9.136) 11.598 25.015 ( 4.606 3.369 1.931) 6.024 25.080 ( 0.584 4.775 -3.784) 6.120 26.148 ( -0.597 1.616 0.378) 1.764 26.188 ( -3.271 2.034 -1.627) 4.181 26.640 ( 0.044 -2.323 -1.501) 2.766 26.661 ( -1.553 -1.970 1.731) 3.048 27.065 ( 1.915 4.476 1.570) 5.116 27.113 ( -1.584 4.813 -0.434) 5.086 27.359 ( 6.383 5.753 -3.974) 9.467 27.464 ( -0.716 5.008 6.226) 8.022 27.692 ( 3.123 -2.239 -0.706) 3.907 27.852 ( -6.836 -0.608 -0.476) 6.880 29.121 ( 6.775 -9.875 1.411) 12.059 29.225 ( 2.333 -8.619 5.658) 10.571 29.281 ( -1.705 -8.001 -4.900) 9.536 29.382 ( -13.693 -12.700 -4.513) 19.214 29.927 ( 11.647 -0.526 -0.564) 11.672 30.213 ( -11.070 -0.653 4.320) 11.901 ======================= Grid point 247 (112/117) ======================= q-point: ( 0.60 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.196 ( 4.033 -11.069 -6.136) 13.283 2.231 ( -1.732 -7.076 5.879) 9.361 3.042 ( 3.165 -10.902 -7.473) 13.591 3.071 ( -1.595 -8.677 8.281) 12.099 3.277 ( 4.102 -9.468 0.575) 10.334 3.325 ( -2.046 -3.704 -2.520) 4.924 3.447 ( 3.103 -9.798 -3.072) 10.727 3.506 ( -6.069 -10.346 1.141) 12.049 3.770 ( 11.519 -5.915 1.460) 13.031 3.885 ( -8.025 -1.925 1.743) 8.434 3.999 ( 4.778 -0.040 3.854) 6.138 4.105 ( -10.078 -6.516 -7.202) 13.996 4.371 ( 3.010 -0.620 7.008) 7.653 4.393 ( 0.804 2.365 -7.117) 7.543 4.691 ( 3.519 4.192 9.308) 10.798 4.787 ( 6.180 11.025 5.704) 13.866 4.815 ( -9.761 -0.693 -9.501) 13.639 4.890 ( -4.160 5.842 -3.365) 7.922 5.194 ( 2.818 3.133 -4.168) 5.927 5.233 ( -4.097 4.200 4.725) 7.533 5.367 ( 9.612 -0.444 5.387) 11.028 5.504 ( -7.499 -5.737 -11.839) 15.143 5.568 ( 0.510 5.574 7.373) 9.257 5.611 ( -3.201 9.502 -0.662) 10.049 5.714 ( 11.536 5.467 3.221) 13.166 5.833 ( -2.507 0.705 -5.091) 5.719 5.960 ( -2.151 0.626 -5.496) 5.935 5.962 ( -5.265 -0.660 2.687) 5.948 6.239 ( 7.394 2.237 -0.813) 7.768 6.287 ( 0.647 7.077 1.935) 7.366 6.422 ( 10.519 6.894 10.517) 16.395 6.509 ( 0.188 4.837 -2.622) 5.505 6.599 ( -2.994 0.376 -0.765) 3.113 6.625 ( -5.249 -0.337 1.900) 5.592 6.733 ( 4.734 -0.900 3.711) 6.082 6.793 ( -3.661 2.732 -4.894) 6.695 6.878 ( 4.686 5.907 7.722) 10.792 7.003 ( -11.415 6.703 -10.829) 17.102 7.233 ( 6.327 -4.175 3.163) 8.214 7.298 ( -0.986 -0.825 1.243) 1.788 7.349 ( 1.000 2.785 0.113) 2.961 7.427 ( -9.798 -2.279 -7.150) 12.342 7.721 ( 7.220 2.682 -2.366) 8.058 7.813 ( -7.274 -1.105 2.641) 7.817 8.007 ( 3.756 0.470 1.962) 4.263 8.044 ( -1.532 2.459 0.716) 2.984 8.222 ( 8.396 9.143 0.713) 12.434 8.338 ( -9.123 8.213 -2.458) 12.519 8.485 ( 5.878 -3.617 6.963) 9.804 8.579 ( -6.913 -1.401 -5.820) 9.145 8.696 ( 1.014 0.970 -1.772) 2.260 8.722 ( -2.853 -0.558 -3.771) 4.761 8.923 ( 6.543 4.019 4.466) 8.883 8.992 ( -2.837 4.660 -5.450) 7.712 9.168 ( 7.468 3.768 7.689) 11.362 9.293 ( -11.476 3.149 -2.122) 12.088 10.366 ( 3.077 -0.358 4.070) 5.114 10.397 ( -1.358 0.633 -4.003) 4.275 10.580 ( 6.432 -0.713 6.755) 9.355 10.658 ( -5.061 -0.041 -6.788) 8.467 11.151 ( 3.479 -3.983 5.405) 7.562 11.183 ( -0.765 -4.891 -3.582) 6.110 11.274 ( 4.819 -2.626 0.505) 5.511 11.353 ( -7.632 -3.407 -3.316) 8.991 11.923 ( 7.368 -5.180 9.410) 13.026 12.008 ( -5.575 -5.428 -7.867) 11.065 12.298 ( 3.299 -0.828 -0.192) 3.406 12.347 ( -4.011 -0.391 -0.160) 4.033 12.699 ( 8.726 0.113 3.991) 9.597 12.782 ( -3.862 0.428 0.207) 3.891 13.057 ( 7.030 2.665 9.692) 12.267 13.195 ( -13.597 5.193 -14.907) 20.834 13.825 ( 5.282 0.511 6.734) 8.574 13.925 ( -9.418 0.527 -9.387) 13.308 14.170 ( 0.684 2.015 -3.167) 3.816 14.185 ( -2.040 2.147 2.926) 4.163 14.778 ( 9.906 3.837 10.726) 15.096 14.862 ( -1.816 2.736 -7.281) 7.987 15.056 ( -1.804 0.516 1.579) 2.452 15.059 ( -2.102 -0.279 -2.963) 3.643 15.391 ( 13.994 7.472 16.234) 22.698 15.575 ( -13.456 8.940 -15.146) 22.144 16.657 ( 5.424 0.768 0.829) 5.540 16.711 ( -3.088 0.941 -0.413) 3.255 19.928 ( 5.209 1.452 3.848) 6.637 20.002 ( -6.064 0.860 -4.373) 7.525 20.360 ( 4.120 -4.772 4.384) 7.679 20.410 ( -3.428 -5.260 -3.675) 7.275 24.395 ( 6.488 3.802 6.218) 9.758 24.472 ( -4.972 5.302 -6.718) 9.898 24.975 ( 3.019 2.886 1.894) 4.586 25.003 ( -1.118 3.166 -2.092) 3.956 26.125 ( 0.491 0.646 0.460) 0.932 26.142 ( -2.252 0.786 -0.726) 2.493 26.689 ( 0.536 -2.567 0.607) 2.692 26.701 ( -1.411 -2.903 -0.558) 3.275 27.010 ( 1.502 2.383 1.699) 3.289 27.031 ( -1.591 2.563 -1.404) 3.328 27.283 ( 5.729 5.664 -4.698) 9.326 27.340 ( -3.901 5.713 5.726) 8.980 27.762 ( 5.017 -1.639 -1.482) 5.482 27.827 ( -5.288 -0.647 0.617) 5.363 29.318 ( 6.373 -3.663 -2.347) 7.716 29.362 ( -0.633 -1.360 4.938) 5.161 29.387 ( 2.582 -6.557 3.440) 7.842 29.478 ( -9.690 -6.409 -6.549) 13.336 30.085 ( 10.442 -7.836 -4.185) 13.709 30.218 ( -11.238 -6.603 5.042) 13.976 ======================= Grid point 248 (113/117) ======================= q-point: ( 0.70 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 105 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.356 ( -8.576 -4.298 -4.403) 10.555 2.356 ( 8.576 -4.298 4.403) 10.555 3.240 ( 3.419 -7.503 -7.946) 11.451 3.240 ( -3.419 -7.503 7.946) 11.451 3.349 ( -5.276 -1.680 -8.405) 10.065 3.349 ( 5.276 -1.680 8.405) 10.065 3.584 ( -1.679 4.237 -3.487) 5.738 3.584 ( 1.679 4.237 3.487) 5.738 3.903 ( -0.538 -10.986 -6.607) 12.831 3.903 ( 0.538 -10.986 6.607) 12.831 4.246 ( -5.471 0.794 -9.363) 10.873 4.246 ( 5.471 0.794 9.363) 10.873 4.273 ( -4.112 -4.844 -2.412) 6.796 4.273 ( 4.111 -4.843 2.412) 6.796 4.658 ( -4.994 7.053 -5.168) 10.070 4.658 ( 4.994 7.053 5.168) 10.070 4.779 ( -7.651 0.611 -9.531) 12.238 4.779 ( 7.651 0.611 9.531) 12.238 5.109 ( -3.963 4.316 -4.444) 7.354 5.109 ( 3.963 4.316 4.444) 7.354 5.348 ( -3.932 9.103 -0.962) 9.962 5.348 ( 3.932 9.103 0.962) 9.962 5.595 ( -8.940 -6.793 -10.633) 15.464 5.595 ( 8.940 -6.793 10.633) 15.464 5.753 ( -10.277 1.191 -7.600) 12.838 5.753 ( 10.277 1.191 7.600) 12.838 5.999 ( -6.376 5.774 -12.435) 15.120 5.999 ( 6.376 5.774 12.435) 15.120 6.090 ( -5.846 0.852 -3.943) 7.103 6.090 ( 5.846 0.852 3.943) 7.103 6.455 ( -11.773 -1.153 -8.574) 14.610 6.455 ( 11.773 -1.153 8.574) 14.610 6.585 ( -9.184 1.385 -7.350) 11.845 6.585 ( 9.184 1.385 7.350) 11.845 6.770 ( -2.624 -0.947 -5.619) 6.274 6.770 ( 2.624 -0.947 5.619) 6.274 6.876 ( -4.768 0.530 -4.525) 6.595 6.876 ( 4.768 0.530 4.525) 6.595 7.197 ( -2.025 8.673 -2.416) 9.228 7.197 ( 2.025 8.673 2.416) 9.228 7.439 ( -10.217 -4.453 -4.319) 11.952 7.439 ( 10.217 -4.453 4.319) 11.952 7.767 ( -6.343 1.243 -3.128) 7.181 7.767 ( 6.343 1.243 3.128) 7.181 8.002 ( -7.829 4.393 0.970) 9.030 8.002 ( 7.829 4.393 -0.970) 9.030 8.134 ( -4.867 -0.600 -9.457) 10.653 8.134 ( 4.867 -0.600 9.457) 10.653 8.575 ( -6.125 -1.742 -2.860) 6.981 8.575 ( 6.125 -1.742 2.860) 6.981 8.675 ( -2.091 2.498 -0.026) 3.257 8.675 ( 2.091 2.498 0.026) 3.257 8.932 ( -2.488 0.839 -6.603) 7.106 8.932 ( 2.488 0.839 6.603) 7.106 9.185 ( -5.801 -0.230 -6.510) 8.723 9.185 ( 5.801 -0.230 6.510) 8.723 10.375 ( -0.944 0.724 -2.189) 2.491 10.375 ( 0.944 0.724 2.189) 2.491 10.617 ( -4.385 0.498 -5.682) 7.195 10.617 ( 4.385 0.498 5.682) 7.195 11.216 ( -3.882 0.008 -4.708) 6.103 11.216 ( 3.882 0.008 4.708) 6.103 11.354 ( -5.965 -1.740 -5.411) 8.239 11.354 ( 5.965 -1.740 5.411) 8.239 12.053 ( -5.835 -3.189 -9.141) 11.304 12.053 ( 5.835 -3.189 9.141) 11.304 12.349 ( -1.886 -2.192 -0.916) 3.033 12.349 ( 1.886 -2.192 0.916) 3.033 12.731 ( -6.068 1.568 -2.181) 6.636 12.731 ( 6.068 1.568 2.181) 6.636 13.022 ( -7.486 5.130 -6.357) 11.080 13.022 ( 7.486 5.130 6.357) 11.080 13.913 ( -8.065 -4.446 -7.090) 11.622 13.913 ( 8.065 -4.446 7.090) 11.622 14.151 ( 0.784 0.356 -0.817) 1.187 14.151 ( -0.784 0.356 0.817) 1.187 14.783 ( -8.932 2.083 -10.256) 13.759 14.783 ( 8.932 2.083 10.256) 13.759 15.048 ( 0.121 0.303 -3.090) 3.107 15.048 ( -0.121 0.303 3.090) 3.107 15.354 ( -9.845 4.704 -12.890) 16.888 15.354 ( 9.845 4.704 12.890) 16.888 16.657 ( -0.881 2.031 -2.132) 3.073 16.657 ( 0.881 2.031 2.132) 3.073 19.948 ( -6.541 0.437 -4.740) 8.090 19.948 ( 6.541 0.437 4.740) 8.090 20.465 ( -4.381 -2.946 -3.779) 6.493 20.465 ( 4.381 -2.946 3.779) 6.493 24.356 ( -3.864 3.412 -4.022) 6.538 24.356 ( 3.864 3.412 4.022) 6.538 24.942 ( -1.056 2.010 -2.414) 3.314 24.942 ( 1.056 2.010 2.414) 3.314 26.128 ( -1.132 -0.408 -0.663) 1.374 26.128 ( 1.132 -0.408 0.663) 1.374 26.750 ( -1.330 -3.001 -1.275) 3.521 26.750 ( 1.330 -3.001 1.275) 3.521 26.989 ( -0.906 0.902 -2.457) 2.770 26.989 ( 0.906 0.902 2.457) 2.770 27.208 ( 1.887 5.002 -9.351) 10.771 27.208 ( -1.887 5.002 9.351) 10.771 27.811 ( 0.105 -0.595 -6.969) 6.995 27.811 ( -0.105 -0.595 6.969) 6.995 29.340 ( 1.756 1.683 -8.678) 9.012 29.340 ( -1.756 1.683 8.678) 9.012 29.531 ( -6.298 -3.744 -4.948) 8.841 29.531 ( 6.298 -3.744 4.948) 8.841 30.303 ( -9.049 -7.416 1.062) 11.747 30.303 ( 9.049 -7.416 -1.062) 11.747 ======================= Grid point 256 (114/117) ======================= q-point: ( 0.40 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.771 ( 16.140 0.000 1.154) 16.181 1.926 ( -3.019 -0.000 25.316) 25.495 2.395 ( 29.083 0.000 -19.152) 34.822 2.471 ( 7.567 0.000 -21.250) 22.557 2.872 ( 21.006 0.000 24.814) 32.511 3.025 ( -26.419 -0.000 -9.330) 28.018 3.094 ( 7.847 0.000 12.790) 15.006 3.141 ( -28.464 -0.000 8.800) 29.793 3.395 ( -5.778 -0.000 -19.579) 20.413 3.572 ( -25.457 -0.000 -14.167) 29.134 3.954 ( 1.243 0.000 -6.679) 6.794 4.006 ( -5.316 -0.000 1.865) 5.633 4.364 ( 16.505 0.000 11.525) 20.130 4.682 ( -3.174 -0.000 -17.474) 17.760 4.857 ( 19.681 0.000 9.013) 21.647 4.877 ( 2.491 0.000 -0.220) 2.501 4.980 ( 14.596 0.000 -8.316) 16.799 5.031 ( -9.738 -0.000 7.884) 12.530 5.214 ( 16.899 0.000 -3.332) 17.224 5.222 ( -6.815 -0.000 4.635) 8.242 5.352 ( -1.149 -0.000 13.067) 13.117 5.462 ( 11.246 0.000 17.509) 20.810 5.533 ( -17.851 -0.000 -0.427) 17.856 5.872 ( 11.953 0.000 15.112) 19.268 5.876 ( 10.724 0.000 5.468) 12.038 5.924 ( -2.448 -0.000 -8.707) 9.045 6.162 ( 1.731 0.000 3.121) 3.569 6.243 ( -10.216 -0.000 -12.515) 16.155 6.244 ( 1.005 0.000 -3.693) 3.828 6.319 ( -14.609 -0.000 -12.197) 19.031 6.496 ( -1.861 -0.000 2.641) 3.231 6.569 ( -4.870 -0.000 -6.036) 7.756 6.688 ( 13.009 0.000 5.865) 14.270 6.844 ( 1.163 0.000 -1.797) 2.141 6.901 ( 2.112 0.000 6.486) 6.821 7.056 ( -5.987 -0.000 0.689) 6.026 7.111 ( 1.145 0.000 -1.992) 2.298 7.246 ( -4.164 -0.000 -4.068) 5.821 7.314 ( 3.892 0.000 -4.086) 5.643 7.497 ( -11.666 -0.000 -0.365) 11.672 7.646 ( 5.393 0.000 18.329) 19.106 7.684 ( -0.662 -0.000 -2.670) 2.751 7.745 ( -1.404 -0.000 -1.902) 2.364 7.871 ( -5.951 -0.000 -12.438) 13.788 7.935 ( -0.077 -0.000 1.424) 1.426 8.040 ( -8.853 -0.000 -4.721) 10.033 8.127 ( 13.268 0.000 6.189) 14.640 8.433 ( 0.236 0.000 1.921) 1.935 8.499 ( 5.441 0.000 5.100) 7.458 8.605 ( -3.599 -0.000 -5.351) 6.449 8.664 ( -0.194 -0.000 -4.533) 4.537 8.744 ( -12.030 -0.000 -1.203) 12.090 8.945 ( 1.051 0.000 2.089) 2.338 9.000 ( -8.039 -0.000 -3.567) 8.795 9.808 ( 4.153 0.000 5.216) 6.667 9.888 ( -3.768 -0.000 -3.037) 4.839 10.136 ( 9.186 0.000 8.211) 12.321 10.309 ( -1.415 -0.000 -8.731) 8.845 10.554 ( 4.395 0.000 2.824) 5.224 10.613 ( -1.070 -0.000 3.719) 3.869 10.781 ( 2.982 0.000 -8.063) 8.597 10.810 ( 0.080 0.000 4.434) 4.435 11.088 ( 4.595 0.000 -1.404) 4.804 11.233 ( -6.966 -0.000 -0.778) 7.009 11.605 ( 4.124 0.000 10.759) 11.523 11.772 ( -6.915 -0.000 -7.991) 10.568 12.337 ( 0.554 0.000 -1.090) 1.223 12.346 ( 1.260 0.000 1.821) 2.215 12.588 ( 15.131 0.000 11.641) 19.091 12.790 ( 2.252 0.000 0.807) 2.392 12.967 ( 6.941 0.000 14.189) 15.795 13.424 ( -25.897 -0.000 -27.256) 37.597 14.041 ( 4.427 0.000 -0.125) 4.429 14.231 ( -8.139 -0.000 -5.894) 10.049 14.284 ( -2.863 -0.000 -7.149) 7.701 14.315 ( -3.796 -0.000 4.441) 5.842 14.882 ( 6.082 0.000 6.546) 8.935 14.999 ( -2.775 -0.000 -5.464) 6.128 15.093 ( 5.483 0.000 4.306) 6.972 15.183 ( -0.217 -0.000 -3.348) 3.355 15.844 ( 8.763 0.000 11.235) 14.248 16.096 ( -8.709 -0.000 -10.762) 13.844 16.534 ( 5.283 0.000 3.340) 6.250 16.644 ( -2.256 -0.000 -4.379) 4.926 19.993 ( 4.088 0.000 3.118) 5.141 20.060 ( 0.333 0.000 -0.990) 1.044 20.126 ( -1.270 -0.000 -0.535) 1.378 20.127 ( -0.583 -0.000 -1.831) 1.921 24.484 ( 10.645 0.000 11.177) 15.435 24.702 ( -5.030 -0.000 -9.664) 10.895 25.088 ( 6.733 0.000 3.755) 7.709 25.239 ( -3.251 -0.000 -10.661) 11.145 26.197 ( -0.057 -0.000 0.756) 0.758 26.258 ( -3.984 -0.000 -5.513) 6.802 26.584 ( 0.797 0.000 -3.110) 3.211 26.623 ( -2.306 -0.000 4.227) 4.815 27.274 ( 1.039 0.000 -2.316) 2.538 27.282 ( -0.143 -0.000 2.459) 2.463 27.462 ( 12.060 0.000 -0.593) 12.074 27.513 ( 7.647 0.000 -3.865) 8.568 27.782 ( -10.931 -0.000 1.930) 11.100 27.789 ( -12.402 -0.000 6.224) 13.876 28.825 ( -0.486 -0.000 3.356) 3.391 28.848 ( -1.902 -0.000 -2.946) 3.507 29.004 ( 1.688 0.000 -5.030) 5.305 29.047 ( -2.714 -0.000 4.841) 5.550 30.000 ( 11.323 0.000 6.966) 13.294 30.271 ( -9.366 -0.000 -2.550) 9.707 ======================= Grid point 257 (115/117) ======================= q-point: ( 0.50 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.849 ( 12.041 -1.983 -8.702) 14.988 1.961 ( -7.795 -4.697 17.407) 19.643 2.643 ( 18.838 -9.218 -12.859) 24.600 2.721 ( 17.474 -12.312 -16.848) 27.218 2.850 ( -16.875 -4.010 3.707) 17.737 2.936 ( -10.117 -0.486 17.327) 20.070 3.142 ( 13.829 -8.040 17.780) 23.917 3.273 ( -6.674 -9.686 -0.788) 11.789 3.416 ( -5.400 -6.836 -8.126) 11.913 3.494 ( -19.313 -7.471 -13.006) 24.454 3.959 ( 6.263 -1.834 3.272) 7.300 4.054 ( -8.653 -5.487 -6.857) 12.329 4.431 ( 10.613 3.509 10.687) 15.464 4.531 ( -4.450 8.392 -11.835) 15.175 4.881 ( 15.680 4.309 -3.812) 16.702 4.910 ( 6.386 3.793 -2.530) 7.847 4.962 ( -2.446 2.182 6.353) 7.149 5.076 ( -13.788 3.492 6.889) 15.804 5.176 ( 8.566 -7.316 -11.744) 16.273 5.303 ( -10.083 -0.356 14.204) 17.423 5.314 ( 11.472 -0.641 -0.458) 11.499 5.436 ( -10.703 0.120 -1.759) 10.847 5.716 ( 15.825 0.937 8.460) 17.969 5.777 ( 13.427 -1.007 14.937) 20.110 5.910 ( -1.977 1.621 -0.621) 2.631 6.008 ( -8.738 7.806 -5.874) 13.107 6.051 ( 3.867 -3.357 -1.102) 5.238 6.115 ( 3.596 5.652 4.101) 7.855 6.199 ( -12.405 2.036 -9.908) 16.006 6.207 ( -5.557 3.664 -6.547) 9.336 6.592 ( 1.681 -4.961 3.677) 6.400 6.620 ( -0.699 -5.221 -6.218) 8.149 6.717 ( 11.483 5.100 6.270) 14.043 6.778 ( 0.667 5.590 -0.600) 5.662 6.871 ( -0.586 4.876 3.422) 5.986 6.954 ( -10.852 4.473 -1.955) 11.900 7.127 ( 5.624 -0.212 -0.855) 5.693 7.217 ( -7.533 -0.420 -2.100) 7.831 7.306 ( 2.350 5.394 -5.317) 7.930 7.340 ( -3.496 8.558 4.033) 10.086 7.471 ( 1.660 9.646 0.957) 9.835 7.523 ( -6.268 8.602 -2.131) 10.855 7.884 ( 2.025 1.549 0.174) 2.555 7.901 ( -0.055 -1.304 1.188) 1.765 7.943 ( 6.473 -3.928 4.205) 8.661 8.047 ( -8.185 -5.244 -4.508) 10.715 8.227 ( 9.367 -1.872 7.833) 12.353 8.347 ( -7.113 2.081 -8.532) 11.302 8.503 ( 4.190 1.659 1.544) 4.764 8.566 ( -5.355 1.622 -3.568) 6.636 8.680 ( 6.826 -3.137 2.678) 7.976 8.796 ( -10.295 -0.560 -3.798) 10.988 8.933 ( 2.644 -0.918 0.679) 2.880 8.973 ( -5.511 -3.449 -0.184) 6.504 9.669 ( 3.363 13.627 -0.381) 14.041 9.707 ( -3.205 14.565 1.236) 14.965 10.276 ( 8.471 -5.533 10.382) 14.497 10.362 ( -3.729 -4.455 -9.301) 10.966 10.538 ( 4.555 1.381 4.423) 6.497 10.593 ( -3.901 -0.742 -3.461) 5.268 10.895 ( 2.607 -7.787 -2.902) 8.710 10.913 ( -0.567 -7.860 3.330) 8.555 11.136 ( 5.028 -2.176 -1.027) 5.574 11.211 ( -7.083 -2.259 -0.786) 7.476 11.691 ( 5.806 -4.847 10.580) 13.005 11.774 ( -6.358 -4.584 -9.098) 12.009 12.324 ( 2.167 1.331 -0.396) 2.574 12.347 ( -1.686 0.196 0.815) 1.883 12.691 ( 12.910 -0.323 7.901) 15.140 12.790 ( -2.388 0.158 -0.372) 2.422 13.045 ( 10.469 -1.693 19.447) 22.151 13.265 ( -21.937 -0.261 -27.407) 35.106 14.020 ( 6.171 5.244 2.118) 8.371 14.116 ( -8.836 5.368 -4.630) 11.328 14.259 ( 0.587 1.708 -5.911) 6.181 14.279 ( -3.067 1.756 4.602) 5.803 14.912 ( 6.226 1.072 6.771) 9.261 14.979 ( -3.914 0.309 -6.102) 7.255 15.083 ( 4.717 3.531 2.605) 6.443 15.134 ( -2.810 3.508 -2.498) 5.143 15.787 ( 11.966 10.280 13.592) 20.824 15.944 ( -11.559 8.213 -12.888) 19.162 16.612 ( 4.423 -3.262 2.844) 6.188 16.658 ( -2.618 -2.790 -3.029) 4.880 20.000 ( 4.037 1.647 3.277) 5.454 20.048 ( -3.225 0.984 -3.010) 4.520 20.158 ( 1.656 -4.004 2.326) 4.918 20.179 ( -1.507 -4.910 -2.580) 5.748 24.529 ( 9.637 2.190 11.116) 14.874 24.640 ( -6.926 2.284 -10.708) 12.956 25.105 ( 5.502 2.500 3.948) 7.219 25.166 ( -3.496 4.051 -6.642) 8.529 26.183 ( 0.870 1.649 1.529) 2.412 26.210 ( -3.096 2.008 -3.269) 4.930 26.605 ( 1.238 -1.442 -3.344) 3.847 26.622 ( -1.869 -1.111 3.712) 4.302 27.192 ( 2.077 6.571 -0.373) 6.902 27.212 ( -1.322 5.803 0.952) 6.027 27.501 ( 6.242 4.595 -5.832) 9.701 27.543 ( 1.702 2.289 5.290) 6.010 27.678 ( 1.457 -0.305 1.298) 1.974 27.769 ( -10.080 -2.372 0.609) 10.373 28.947 ( 4.258 -10.976 2.082) 11.956 29.012 ( -5.536 -14.829 -1.930) 15.945 29.081 ( 1.436 -6.662 -3.216) 7.535 29.106 ( -3.063 -6.969 2.296) 7.951 30.038 ( 11.402 2.889 4.310) 12.527 30.177 ( -10.675 2.682 -2.042) 11.194 ======================= Grid point 258 (116/117) ======================= q-point: ( 0.60 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 107 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.030 ( 9.774 -8.750 -14.105) 19.263 2.030 ( -9.774 -8.750 14.105) 19.263 2.908 ( 5.109 -6.650 -11.293) 14.066 2.908 ( -5.109 -6.650 11.293) 14.066 3.030 ( -2.861 -15.295 -12.774) 20.132 3.030 ( 2.861 -15.295 12.774) 20.132 3.372 ( -7.383 -5.169 -3.142) 9.545 3.372 ( 7.383 -5.169 3.142) 9.545 3.614 ( -8.880 -12.516 -9.015) 17.798 3.614 ( 8.880 -12.516 9.015) 17.798 4.084 ( -7.492 -1.668 -4.877) 9.094 4.084 ( 7.492 -1.668 4.877) 9.094 4.375 ( -1.524 2.875 -9.004) 9.574 4.375 ( 1.524 2.875 9.004) 9.574 4.805 ( 3.911 6.202 -6.660) 9.905 4.805 ( -3.911 6.202 6.660) 9.905 4.983 ( 0.667 1.537 -14.058) 14.158 4.983 ( -0.667 1.537 14.058) 14.158 5.273 ( 4.107 2.030 -5.379) 7.066 5.273 ( -4.107 2.030 5.379) 7.066 5.374 ( 2.235 -0.865 -6.335) 6.773 5.374 ( -2.235 -0.865 6.335) 6.773 5.679 ( -7.832 4.092 -4.918) 10.113 5.679 ( 7.832 4.092 4.918) 10.113 5.925 ( 3.079 5.207 -3.631) 7.055 5.925 ( -3.079 5.207 3.631) 7.055 5.996 ( -6.483 7.031 -14.045) 16.992 5.996 ( 6.483 7.031 14.045) 16.992 6.227 ( -7.586 -7.685 -9.211) 14.194 6.227 ( 7.586 -7.685 9.211) 14.194 6.604 ( 0.724 5.228 -6.950) 8.727 6.604 ( -0.724 5.228 6.950) 8.727 6.663 ( 3.406 5.140 -5.530) 8.283 6.663 ( -3.406 5.140 5.530) 8.283 6.811 ( -10.967 3.078 -4.287) 12.171 6.811 ( 10.967 3.078 4.287) 12.171 7.100 ( -5.229 10.998 -12.203) 17.240 7.100 ( 5.229 10.998 12.203) 17.240 7.200 ( -6.092 -1.929 -1.366) 6.534 7.200 ( 6.092 -1.929 1.366) 6.534 7.405 ( -2.517 1.647 -1.839) 3.526 7.405 ( 2.517 1.647 1.839) 3.526 7.822 ( -0.192 4.408 -4.478) 6.286 7.822 ( 0.192 4.408 4.478) 6.286 8.050 ( -5.988 0.251 -4.095) 7.258 8.050 ( 5.988 0.251 4.095) 7.258 8.350 ( -2.363 -3.360 -5.668) 7.000 8.350 ( 2.363 -3.360 5.668) 7.000 8.492 ( -0.245 1.038 -3.825) 3.971 8.492 ( 0.245 1.038 3.825) 3.971 8.720 ( -1.704 1.862 -3.548) 4.354 8.720 ( 1.704 1.862 3.548) 4.354 9.012 ( -7.020 -1.764 -2.856) 7.781 9.012 ( 7.020 -1.764 2.856) 7.781 9.388 ( -0.791 14.104 -7.242) 15.874 9.388 ( 0.791 14.104 7.242) 15.874 10.381 ( -3.859 -0.888 -7.292) 8.297 10.381 ( 3.859 -0.888 7.292) 8.297 10.596 ( -5.901 -2.208 -8.324) 10.440 10.596 ( 5.901 -2.208 8.324) 10.440 11.057 ( -0.738 -7.034 -4.782) 8.537 11.057 ( 0.738 -7.034 4.782) 8.537 11.235 ( -5.344 -4.112 -1.430) 6.893 11.235 ( 5.344 -4.112 1.430) 6.893 11.848 ( -5.557 -6.587 -10.691) 13.731 11.848 ( 5.557 -6.587 10.691) 13.731 12.322 ( -3.321 0.508 0.121) 3.362 12.322 ( 3.321 0.508 -0.121) 3.362 12.754 ( -7.310 0.201 -2.745) 7.811 12.754 ( 7.310 0.201 2.745) 7.811 13.151 ( -13.833 0.072 -20.480) 24.714 13.151 ( 13.833 0.072 20.480) 24.714 13.942 ( -6.501 6.145 -8.694) 12.475 13.942 ( 6.501 6.145 8.694) 12.475 14.222 ( 1.622 2.516 -4.858) 5.706 14.222 ( -1.622 2.516 4.858) 5.706 14.907 ( -5.558 3.802 -8.697) 10.999 14.907 ( 5.558 3.802 8.697) 10.999 15.058 ( -0.526 1.108 -3.387) 3.602 15.058 ( 0.526 1.108 3.387) 3.602 15.667 ( -14.581 10.283 -15.758) 23.804 15.667 ( 14.581 10.283 15.758) 23.804 16.685 ( -3.225 -1.342 -2.477) 4.283 16.685 ( 3.225 -1.342 2.477) 4.283 19.993 ( -4.783 1.717 -3.737) 6.308 19.993 ( 4.783 1.717 3.737) 6.308 20.276 ( -2.830 -5.972 -3.803) 7.624 20.276 ( 2.830 -5.972 3.803) 7.624 24.524 ( -7.808 4.196 -9.537) 13.020 24.524 ( 7.808 4.196 9.537) 13.020 25.063 ( -2.558 4.067 -2.952) 5.639 25.063 ( 2.558 4.067 2.952) 5.639 26.155 ( -1.664 1.764 -1.288) 2.746 26.155 ( 1.664 1.764 1.288) 2.746 26.646 ( 0.684 -2.102 -2.889) 3.638 26.646 ( -0.684 -2.102 2.889) 3.638 27.091 ( -1.968 4.807 -1.044) 5.298 27.091 ( 1.968 4.807 1.044) 5.298 27.427 ( 3.668 5.846 -7.932) 10.514 27.427 ( -3.668 5.846 7.932) 10.514 27.762 ( -0.534 -2.210 -5.747) 6.180 27.762 ( 0.534 -2.210 5.747) 6.180 29.224 ( -7.714 -10.228 -3.700) 13.334 29.224 ( 7.714 -10.228 3.700) 13.334 29.260 ( -0.986 -9.706 -8.310) 12.816 29.260 ( 0.986 -9.706 8.310) 12.816 30.072 ( -8.303 -0.319 -0.383) 8.318 30.072 ( 8.303 -0.319 0.383) 8.318 ======================= Grid point 269 (117/117) ======================= q-point: ( 0.50 0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.98e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 61 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.894 ( 5.348 0.000 -12.380) 13.486 1.894 ( -5.348 -0.000 12.380) 13.486 2.679 ( -25.143 -0.000 4.096) 25.475 2.679 ( 25.143 0.000 -4.096) 25.475 2.756 ( 29.868 0.000 -14.267) 33.100 2.756 ( -29.868 -0.000 14.267) 33.100 3.149 ( -10.025 -0.000 -7.611) 12.587 3.149 ( 10.025 0.000 7.611) 12.587 3.325 ( 4.177 0.000 -3.386) 5.377 3.325 ( -4.177 -0.000 3.386) 5.377 3.968 ( 1.981 0.000 -6.572) 6.864 3.968 ( -1.981 -0.000 6.572) 6.864 4.563 ( -12.714 -0.000 -17.345) 21.506 4.563 ( 12.714 0.000 17.345) 21.506 4.922 ( 7.147 0.000 -8.173) 10.857 4.922 ( -7.147 -0.000 8.173) 10.857 5.077 ( -14.678 -0.000 0.566) 14.689 5.077 ( 14.678 0.000 -0.566) 14.689 5.205 ( -16.832 -0.000 -1.827) 16.930 5.205 ( 16.832 0.000 1.827) 16.930 5.363 ( -2.160 -0.000 -7.484) 7.790 5.363 ( 2.160 0.000 7.484) 7.790 5.750 ( -21.896 -0.000 -19.593) 29.382 5.750 ( 21.896 0.000 19.593) 29.382 5.990 ( 2.054 0.000 -1.073) 2.318 5.990 ( -2.054 -0.000 1.073) 2.318 6.155 ( -4.260 -0.000 -5.877) 7.259 6.155 ( 4.260 0.000 5.877) 7.259 6.216 ( -5.201 -0.000 -5.021) 7.229 6.216 ( 5.201 0.000 5.021) 7.229 6.511 ( -3.536 -0.000 -7.299) 8.111 6.511 ( 3.536 0.000 7.299) 8.111 6.818 ( -5.422 -0.000 -5.208) 7.518 6.818 ( 5.422 0.000 5.208) 7.518 6.959 ( -7.873 -0.000 -4.168) 8.908 6.959 ( 7.873 0.000 4.168) 8.908 7.165 ( -6.727 -0.000 -1.602) 6.915 7.165 ( 6.727 0.000 1.602) 6.915 7.383 ( 7.288 0.000 -4.573) 8.603 7.383 ( -7.288 -0.000 4.573) 8.603 7.687 ( 0.838 0.000 -5.880) 5.939 7.687 ( -0.838 -0.000 5.880) 5.939 7.777 ( -6.822 -0.000 -11.279) 13.182 7.777 ( 6.822 0.000 11.279) 13.182 7.958 ( -3.781 -0.000 -3.107) 4.894 7.958 ( 3.781 0.000 3.107) 4.894 8.332 ( -15.999 -0.000 -8.095) 17.931 8.332 ( 15.999 0.000 8.095) 17.931 8.561 ( -3.107 -0.000 -5.767) 6.551 8.561 ( 3.107 0.000 5.767) 6.551 8.649 ( 0.282 0.000 -4.793) 4.802 8.649 ( -0.282 -0.000 4.793) 4.802 8.958 ( -1.088 -0.000 -2.204) 2.458 8.958 ( 1.088 0.000 2.204) 2.458 9.848 ( -2.598 -0.000 -3.361) 4.248 9.848 ( 2.598 0.000 3.361) 4.248 10.249 ( -7.083 -0.000 -9.809) 12.099 10.249 ( 7.083 0.000 9.809) 12.099 10.595 ( -2.261 -0.000 0.504) 2.316 10.595 ( 2.261 0.000 -0.504) 2.316 10.803 ( 1.635 0.000 -6.809) 7.003 10.803 ( -1.635 -0.000 6.809) 7.003 11.151 ( -5.951 -0.000 0.980) 6.031 11.151 ( 5.951 0.000 -0.980) 6.031 11.683 ( -6.562 -0.000 -9.929) 11.901 11.683 ( 6.562 0.000 9.929) 11.901 12.345 ( 0.787 0.000 -0.929) 1.218 12.345 ( -0.787 -0.000 0.929) 1.218 12.761 ( -8.286 -0.000 -3.861) 9.142 12.761 ( 8.286 0.000 3.861) 9.142 13.122 ( -17.853 -0.000 -26.630) 32.060 13.122 ( 17.853 0.000 26.630) 32.060 14.119 ( -8.006 -0.000 -1.963) 8.243 14.119 ( 8.006 0.000 1.963) 8.243 14.283 ( 1.948 0.000 -5.866) 6.181 14.283 ( -1.948 -0.000 5.866) 6.181 14.950 ( -4.333 -0.000 -6.038) 7.432 14.950 ( 4.333 0.000 6.038) 7.432 15.156 ( -3.769 -0.000 -4.250) 5.681 15.156 ( 3.769 0.000 4.250) 5.681 15.970 ( -9.975 -0.000 -12.195) 15.755 15.970 ( 9.975 0.000 12.195) 15.755 16.598 ( -4.461 -0.000 -3.747) 5.826 16.598 ( 4.461 0.000 3.747) 5.826 20.042 ( -3.033 -0.000 -3.016) 4.277 20.042 ( 3.033 0.000 3.016) 4.277 20.120 ( -0.210 -0.000 -1.218) 1.236 20.120 ( 0.210 0.000 1.218) 1.236 24.611 ( -8.407 -0.000 -11.636) 14.355 24.611 ( 8.407 0.000 11.636) 14.355 25.172 ( -6.090 -0.000 -6.450) 8.871 25.172 ( 6.090 0.000 6.450) 8.871 26.213 ( -2.429 -0.000 -3.139) 3.969 26.213 ( 2.429 0.000 3.139) 3.969 26.600 ( 1.940 0.000 -4.106) 4.541 26.600 ( -1.940 -0.000 4.106) 4.541 27.280 ( 0.418 0.000 -2.618) 2.651 27.280 ( -0.418 -0.000 2.618) 2.651 27.577 ( -2.117 -0.000 -3.697) 4.260 27.577 ( 2.117 0.000 3.697) 4.260 27.686 ( 0.528 0.000 -0.329) 0.622 27.686 ( -0.528 -0.000 0.329) 0.622 28.829 ( -0.780 -0.000 -2.904) 3.007 28.829 ( 0.780 0.000 2.904) 3.007 29.023 ( 1.943 0.000 -4.898) 5.269 29.023 ( -1.943 -0.000 4.898) 5.269 30.142 ( -10.938 -0.000 -5.171) 12.099 30.142 ( 10.938 0.000 5.171) 12.099 =================== 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 3/43200 10.0 4975.160 1113.961 1661.955 0.000 183.788 0.000 3/43200 20.0 393.465 340.447 383.048 0.000 78.058 0.000 3/43200 30.0 119.607 125.385 141.996 0.000 31.188 0.000 3/43200 40.0 58.073 62.299 71.651 0.000 16.761 0.000 3/43200 50.0 34.937 37.183 43.174 0.000 10.521 0.000 3/43200 60.0 23.859 25.078 29.290 0.000 7.323 0.000 3/43200 70.0 17.715 18.409 21.581 0.000 5.489 0.000 3/43200 80.0 13.939 14.349 16.859 0.000 4.341 0.000 3/43200 90.0 11.434 11.681 13.744 0.000 3.574 0.000 3/43200 100.0 9.676 9.822 11.567 0.000 3.033 0.000 3/43200 110.0 8.384 8.465 9.973 0.000 2.636 0.000 3/43200 120.0 7.400 7.437 8.764 0.000 2.333 0.000 3/43200 130.0 6.629 6.634 7.820 0.000 2.096 0.000 3/43200 140.0 6.010 5.991 7.063 0.000 1.906 0.000 3/43200 150.0 5.503 5.465 6.445 0.000 1.751 0.000 3/43200 160.0 5.080 5.028 5.931 0.000 1.621 0.000 3/43200 170.0 4.722 4.658 5.496 0.000 1.511 0.000 3/43200 180.0 4.415 4.342 5.125 0.000 1.416 0.000 3/43200 190.0 4.149 4.068 4.804 0.000 1.334 0.000 3/43200 200.0 3.916 3.829 4.523 0.000 1.262 0.000 3/43200 210.0 3.710 3.619 4.277 0.000 1.198 0.000 3/43200 220.0 3.526 3.432 4.057 0.000 1.141 0.000 3/43200 230.0 3.362 3.265 3.861 0.000 1.090 0.000 3/43200 240.0 3.214 3.114 3.685 0.000 1.043 0.000 3/43200 250.0 3.080 2.978 3.526 0.000 1.001 0.000 3/43200 260.0 2.957 2.855 3.381 0.000 0.962 0.000 3/43200 270.0 2.845 2.742 3.249 0.000 0.926 0.000 3/43200 280.0 2.742 2.638 3.127 0.000 0.893 0.000 3/43200 290.0 2.647 2.543 3.015 0.000 0.863 0.000 3/43200 300.0 2.559 2.455 2.912 0.000 0.834 0.000 3/43200 310.0 2.477 2.374 2.816 0.000 0.808 0.000 3/43200 320.0 2.401 2.298 2.727 0.000 0.783 0.000 3/43200 330.0 2.329 2.227 2.644 0.000 0.760 0.000 3/43200 340.0 2.263 2.161 2.566 0.000 0.738 0.000 3/43200 350.0 2.200 2.099 2.493 0.000 0.718 0.000 3/43200 360.0 2.140 2.040 2.424 0.000 0.699 0.000 3/43200 370.0 2.085 1.985 2.360 0.000 0.680 0.000 3/43200 380.0 2.032 1.934 2.299 0.000 0.663 0.000 3/43200 390.0 1.982 1.885 2.241 0.000 0.646 0.000 3/43200 400.0 1.934 1.838 2.186 0.000 0.631 0.000 3/43200 410.0 1.889 1.794 2.134 0.000 0.616 0.000 3/43200 420.0 1.846 1.753 2.085 0.000 0.602 0.000 3/43200 430.0 1.805 1.713 2.038 0.000 0.588 0.000 3/43200 440.0 1.766 1.675 1.993 0.000 0.575 0.000 3/43200 450.0 1.729 1.639 1.950 0.000 0.563 0.000 3/43200 460.0 1.693 1.604 1.910 0.000 0.551 0.000 3/43200 470.0 1.659 1.571 1.870 0.000 0.540 0.000 3/43200 480.0 1.626 1.539 1.833 0.000 0.529 0.000 3/43200 490.0 1.595 1.509 1.797 0.000 0.519 0.000 3/43200 500.0 1.564 1.480 1.762 0.000 0.509 0.000 3/43200 510.0 1.535 1.452 1.729 0.000 0.499 0.000 3/43200 520.0 1.507 1.425 1.697 0.000 0.490 0.000 3/43200 530.0 1.480 1.399 1.667 0.000 0.481 0.000 3/43200 540.0 1.454 1.374 1.637 0.000 0.472 0.000 3/43200 550.0 1.429 1.350 1.609 0.000 0.464 0.000 3/43200 560.0 1.405 1.327 1.581 0.000 0.456 0.000 3/43200 570.0 1.382 1.305 1.554 0.000 0.448 0.000 3/43200 580.0 1.359 1.283 1.529 0.000 0.441 0.000 3/43200 590.0 1.337 1.262 1.504 0.000 0.434 0.000 3/43200 600.0 1.316 1.242 1.480 0.000 0.427 0.000 3/43200 610.0 1.295 1.223 1.457 0.000 0.420 0.000 3/43200 620.0 1.275 1.204 1.434 0.000 0.413 0.000 3/43200 630.0 1.256 1.185 1.412 0.000 0.407 0.000 3/43200 640.0 1.238 1.168 1.391 0.000 0.401 0.000 3/43200 650.0 1.219 1.150 1.371 0.000 0.395 0.000 3/43200 660.0 1.202 1.134 1.351 0.000 0.389 0.000 3/43200 670.0 1.185 1.117 1.331 0.000 0.383 0.000 3/43200 680.0 1.168 1.102 1.313 0.000 0.378 0.000 3/43200 690.0 1.152 1.086 1.294 0.000 0.373 0.000 3/43200 700.0 1.136 1.071 1.277 0.000 0.368 0.000 3/43200 710.0 1.121 1.057 1.259 0.000 0.362 0.000 3/43200 720.0 1.106 1.043 1.242 0.000 0.358 0.000 3/43200 730.0 1.092 1.029 1.226 0.000 0.353 0.000 3/43200 740.0 1.077 1.016 1.210 0.000 0.348 0.000 3/43200 750.0 1.064 1.003 1.195 0.000 0.344 0.000 3/43200 760.0 1.050 0.990 1.180 0.000 0.339 0.000 3/43200 770.0 1.037 0.978 1.165 0.000 0.335 0.000 3/43200 780.0 1.024 0.965 1.150 0.000 0.331 0.000 3/43200 790.0 1.012 0.954 1.136 0.000 0.327 0.000 3/43200 800.0 1.000 0.942 1.123 0.000 0.323 0.000 3/43200 810.0 0.988 0.931 1.109 0.000 0.319 0.000 3/43200 820.0 0.976 0.920 1.096 0.000 0.315 0.000 3/43200 830.0 0.965 0.909 1.084 0.000 0.311 0.000 3/43200 840.0 0.954 0.899 1.071 0.000 0.308 0.000 3/43200 850.0 0.943 0.889 1.059 0.000 0.304 0.000 3/43200 860.0 0.933 0.879 1.047 0.000 0.301 0.000 3/43200 870.0 0.922 0.869 1.035 0.000 0.297 0.000 3/43200 880.0 0.912 0.859 1.024 0.000 0.294 0.000 3/43200 890.0 0.902 0.850 1.013 0.000 0.291 0.000 3/43200 900.0 0.893 0.841 1.002 0.000 0.288 0.000 3/43200 910.0 0.883 0.832 0.991 0.000 0.285 0.000 3/43200 920.0 0.874 0.823 0.981 0.000 0.282 0.000 3/43200 930.0 0.865 0.815 0.971 0.000 0.279 0.000 3/43200 940.0 0.856 0.806 0.961 0.000 0.276 0.000 3/43200 950.0 0.847 0.798 0.951 0.000 0.273 0.000 3/43200 960.0 0.839 0.790 0.941 0.000 0.270 0.000 3/43200 970.0 0.830 0.782 0.932 0.000 0.267 0.000 3/43200 980.0 0.822 0.774 0.923 0.000 0.265 0.000 3/43200 990.0 0.814 0.767 0.914 0.000 0.262 0.000 3/43200 1000.0 0.806 0.759 0.905 0.000 0.260 0.000 3/43200 Thermal conductivity related properties were written into "kappa-m10104.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 12:59:18]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|