----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 12:46:04]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 2 1] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.024533880188214 0.000000000000000 0.000000000000000 b 0.000000000000000 6.963405039999999 0.000000000000000 c -4.609464195117199 0.000000000000000 9.677622483010314 Atomic positions (fractional): *1 Na 0.47240757044982 0.06330527882294 0.74584454457025 22.990 2 Na 0.52759242955018 0.56330527882294 0.75415545542975 22.990 *3 Na 0.11918895540006 0.30910135718930 0.89537070067015 22.990 4 Na 0.88081104459994 0.80910135718930 0.60462929932985 22.990 5 Na 0.52759242955018 0.93669472117706 0.25415545542975 22.990 6 Na 0.88081104459994 0.69089864281070 0.10462929932985 22.990 7 Na 0.11918895540006 0.19089864281070 0.39537070067015 22.990 8 Na 0.47240757044982 0.43669472117706 0.24584454457025 22.990 *9 P 0.75686696068883 0.26242946283973 0.57317844192553 30.974 10 P 0.24313303931117 0.76242946283973 0.92682155807447 30.974 11 P 0.24313303931117 0.73757053716027 0.42682155807447 30.974 12 P 0.75686696068883 0.23757053716027 0.07317844192553 30.974 *13 H 0.92170415019312 0.43326654261995 0.58564441974406 1.008 14 H 0.92170415019312 0.06673345738005 0.08564441974406 1.008 15 H 0.07829584980688 0.93326654261995 0.91435558025594 1.008 16 H 0.07829584980688 0.56673345738005 0.41435558025594 1.008 *17 O 0.03595075636596 0.87415551765823 0.31326845453403 15.999 *18 O 0.67151964678480 0.31153553360139 0.92534855017507 15.999 19 O 0.96404924363404 0.37415551765823 0.18673154546597 15.999 20 O 0.67151964678480 0.18846446639861 0.42534855017507 15.999 *21 O 0.48667481730271 0.31459421924449 0.59776689720440 15.999 22 O 0.32848035321520 0.68846446639861 0.07465144982494 15.999 23 O 0.96404924363404 0.12584448234177 0.68673154546597 15.999 24 O 0.51332518269729 0.68540578075551 0.40223310279560 15.999 25 O 0.03595075636596 0.62584448234177 0.81326845453403 15.999 26 O 0.32848035321520 0.81153553360139 0.57465144982493 15.999 27 O 0.51332518269729 0.81459421924449 0.90223310279560 15.999 28 O 0.48667481730271 0.18540578075551 0.09776689720440 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.024533880188214 0.000000000000000 0.000000000000000 b 0.000000000000000 6.963405039999999 0.000000000000000 c -4.609464195117199 0.000000000000000 9.677622483010314 Atomic positions (fractional): *1 Na 0.47240757044982 0.06330527882294 0.74584454457025 22.990 > 1 2 Na 0.52759242955018 0.56330527882294 0.75415545542975 22.990 > 2 *3 Na 0.11918895540006 0.30910135718930 0.89537070067015 22.990 > 3 4 Na 0.88081104459994 0.80910135718930 0.60462929932985 22.990 > 4 5 Na 0.52759242955018 0.93669472117706 0.25415545542975 22.990 > 5 6 Na 0.88081104459994 0.69089864281070 0.10462929932985 22.990 > 6 7 Na 0.11918895540006 0.19089864281070 0.39537070067015 22.990 > 7 8 Na 0.47240757044982 0.43669472117706 0.24584454457025 22.990 > 8 *9 P 0.75686696068883 0.26242946283973 0.57317844192553 30.974 > 9 10 P 0.24313303931117 0.76242946283973 0.92682155807447 30.974 > 10 11 P 0.24313303931117 0.73757053716027 0.42682155807447 30.974 > 11 12 P 0.75686696068883 0.23757053716027 0.07317844192553 30.974 > 12 *13 H 0.92170415019312 0.43326654261995 0.58564441974406 1.008 > 13 14 H 0.92170415019312 0.06673345738005 0.08564441974406 1.008 > 14 15 H 0.07829584980688 0.93326654261995 0.91435558025594 1.008 > 15 16 H 0.07829584980688 0.56673345738005 0.41435558025594 1.008 > 16 *17 O 0.03595075636596 0.87415551765823 0.31326845453403 15.999 > 17 *18 O 0.67151964678480 0.31153553360139 0.92534855017507 15.999 > 18 19 O 0.96404924363404 0.37415551765823 0.18673154546597 15.999 > 19 20 O 0.67151964678480 0.18846446639861 0.42534855017507 15.999 > 20 *21 O 0.48667481730271 0.31459421924449 0.59776689720440 15.999 > 21 22 O 0.32848035321520 0.68846446639861 0.07465144982494 15.999 > 22 23 O 0.96404924363404 0.12584448234177 0.68673154546597 15.999 > 23 24 O 0.51332518269729 0.68540578075551 0.40223310279560 15.999 > 24 25 O 0.03595075636596 0.62584448234177 0.81326845453403 15.999 > 25 26 O 0.32848035321520 0.81153553360139 0.57465144982493 15.999 > 26 27 O 0.51332518269729 0.81459421924449 0.90223310279560 15.999 > 27 28 O 0.48667481730271 0.18540578075551 0.09776689720440 15.999 > 28 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.049067760376428 0.000000000000000 0.000000000000000 b 0.000000000000000 13.926810079999997 0.000000000000000 c -4.609464195117199 0.000000000000000 9.677622483010314 Atomic positions (fractional): *1 Na 0.23620378522491 0.03165263941147 0.74584454457025 22.990 > 1 2 Na 0.73620378522491 0.03165263941147 0.74584454457025 22.990 > 1 3 Na 0.23620378522491 0.53165263941147 0.74584454457025 22.990 > 1 4 Na 0.73620378522491 0.53165263941147 0.74584454457025 22.990 > 1 5 Na 0.26379621477509 0.28165263941147 0.75415545542975 22.990 > 2 6 Na 0.76379621477509 0.28165263941147 0.75415545542975 22.990 > 2 7 Na 0.26379621477509 0.78165263941147 0.75415545542975 22.990 > 2 8 Na 0.76379621477509 0.78165263941147 0.75415545542975 22.990 > 2 *9 Na 0.05959447770003 0.15455067859465 0.89537070067015 22.990 > 3 10 Na 0.55959447770003 0.15455067859465 0.89537070067015 22.990 > 3 11 Na 0.05959447770003 0.65455067859465 0.89537070067015 22.990 > 3 12 Na 0.55959447770003 0.65455067859465 0.89537070067015 22.990 > 3 13 Na 0.44040552229997 0.40455067859465 0.60462929932985 22.990 > 4 14 Na 0.94040552229997 0.40455067859465 0.60462929932985 22.990 > 4 15 Na 0.44040552229997 0.90455067859465 0.60462929932985 22.990 > 4 16 Na 0.94040552229997 0.90455067859465 0.60462929932985 22.990 > 4 17 Na 0.26379621477509 0.46834736058853 0.25415545542975 22.990 > 5 18 Na 0.76379621477509 0.46834736058853 0.25415545542975 22.990 > 5 19 Na 0.26379621477509 0.96834736058853 0.25415545542975 22.990 > 5 20 Na 0.76379621477509 0.96834736058853 0.25415545542975 22.990 > 5 21 Na 0.44040552229997 0.34544932140535 0.10462929932985 22.990 > 6 22 Na 0.94040552229997 0.34544932140535 0.10462929932985 22.990 > 6 23 Na 0.44040552229997 0.84544932140535 0.10462929932985 22.990 > 6 24 Na 0.94040552229997 0.84544932140535 0.10462929932985 22.990 > 6 25 Na 0.05959447770003 0.09544932140535 0.39537070067015 22.990 > 7 26 Na 0.55959447770003 0.09544932140535 0.39537070067015 22.990 > 7 27 Na 0.05959447770003 0.59544932140535 0.39537070067015 22.990 > 7 28 Na 0.55959447770003 0.59544932140535 0.39537070067015 22.990 > 7 29 Na 0.23620378522491 0.21834736058853 0.24584454457025 22.990 > 8 30 Na 0.73620378522491 0.21834736058853 0.24584454457025 22.990 > 8 31 Na 0.23620378522491 0.71834736058853 0.24584454457025 22.990 > 8 32 Na 0.73620378522491 0.71834736058853 0.24584454457025 22.990 > 8 *33 P 0.37843348034441 0.13121473141986 0.57317844192553 30.974 > 9 34 P 0.87843348034441 0.13121473141986 0.57317844192553 30.974 > 9 35 P 0.37843348034441 0.63121473141986 0.57317844192553 30.974 > 9 36 P 0.87843348034441 0.63121473141986 0.57317844192553 30.974 > 9 37 P 0.12156651965559 0.38121473141986 0.92682155807447 30.974 > 10 38 P 0.62156651965559 0.38121473141986 0.92682155807447 30.974 > 10 39 P 0.12156651965559 0.88121473141986 0.92682155807447 30.974 > 10 40 P 0.62156651965559 0.88121473141986 0.92682155807447 30.974 > 10 41 P 0.12156651965559 0.36878526858014 0.42682155807447 30.974 > 11 42 P 0.62156651965559 0.36878526858014 0.42682155807447 30.974 > 11 43 P 0.12156651965559 0.86878526858014 0.42682155807447 30.974 > 11 44 P 0.62156651965559 0.86878526858014 0.42682155807447 30.974 > 11 45 P 0.37843348034441 0.11878526858014 0.07317844192553 30.974 > 12 46 P 0.87843348034441 0.11878526858014 0.07317844192553 30.974 > 12 47 P 0.37843348034441 0.61878526858014 0.07317844192553 30.974 > 12 48 P 0.87843348034441 0.61878526858014 0.07317844192553 30.974 > 12 *49 H 0.46085207509656 0.21663327130998 0.58564441974406 1.008 > 13 50 H 0.96085207509656 0.21663327130998 0.58564441974406 1.008 > 13 51 H 0.46085207509656 0.71663327130998 0.58564441974406 1.008 > 13 52 H 0.96085207509656 0.71663327130998 0.58564441974406 1.008 > 13 53 H 0.46085207509656 0.03336672869002 0.08564441974406 1.008 > 14 54 H 0.96085207509656 0.03336672869002 0.08564441974406 1.008 > 14 55 H 0.46085207509656 0.53336672869002 0.08564441974406 1.008 > 14 56 H 0.96085207509656 0.53336672869002 0.08564441974406 1.008 > 14 57 H 0.03914792490344 0.46663327130998 0.91435558025594 1.008 > 15 58 H 0.53914792490344 0.46663327130998 0.91435558025594 1.008 > 15 59 H 0.03914792490344 0.96663327130998 0.91435558025594 1.008 > 15 60 H 0.53914792490344 0.96663327130998 0.91435558025594 1.008 > 15 61 H 0.03914792490344 0.28336672869002 0.41435558025594 1.008 > 16 62 H 0.53914792490344 0.28336672869002 0.41435558025594 1.008 > 16 63 H 0.03914792490344 0.78336672869002 0.41435558025594 1.008 > 16 64 H 0.53914792490344 0.78336672869002 0.41435558025594 1.008 > 16 *65 O 0.01797537818298 0.43707775882911 0.31326845453403 15.999 > 17 66 O 0.51797537818298 0.43707775882911 0.31326845453403 15.999 > 17 67 O 0.01797537818298 0.93707775882911 0.31326845453403 15.999 > 17 68 O 0.51797537818298 0.93707775882911 0.31326845453403 15.999 > 17 *69 O 0.33575982339240 0.15576776680069 0.92534855017507 15.999 > 18 70 O 0.83575982339240 0.15576776680069 0.92534855017507 15.999 > 18 71 O 0.33575982339240 0.65576776680069 0.92534855017507 15.999 > 18 72 O 0.83575982339240 0.65576776680069 0.92534855017507 15.999 > 18 73 O 0.48202462181702 0.18707775882911 0.18673154546597 15.999 > 19 74 O 0.98202462181702 0.18707775882911 0.18673154546597 15.999 > 19 75 O 0.48202462181702 0.68707775882911 0.18673154546597 15.999 > 19 76 O 0.98202462181702 0.68707775882911 0.18673154546597 15.999 > 19 77 O 0.33575982339240 0.09423223319931 0.42534855017507 15.999 > 20 78 O 0.83575982339240 0.09423223319931 0.42534855017507 15.999 > 20 79 O 0.33575982339240 0.59423223319931 0.42534855017507 15.999 > 20 80 O 0.83575982339240 0.59423223319931 0.42534855017507 15.999 > 20 *81 O 0.24333740865135 0.15729710962225 0.59776689720440 15.999 > 21 82 O 0.74333740865135 0.15729710962225 0.59776689720440 15.999 > 21 83 O 0.24333740865135 0.65729710962225 0.59776689720440 15.999 > 21 84 O 0.74333740865135 0.65729710962225 0.59776689720440 15.999 > 21 85 O 0.16424017660760 0.34423223319931 0.07465144982494 15.999 > 22 86 O 0.66424017660760 0.34423223319931 0.07465144982494 15.999 > 22 87 O 0.16424017660760 0.84423223319931 0.07465144982494 15.999 > 22 88 O 0.66424017660760 0.84423223319931 0.07465144982494 15.999 > 22 89 O 0.48202462181702 0.06292224117089 0.68673154546597 15.999 > 23 90 O 0.98202462181702 0.06292224117089 0.68673154546597 15.999 > 23 91 O 0.48202462181702 0.56292224117089 0.68673154546597 15.999 > 23 92 O 0.98202462181702 0.56292224117089 0.68673154546597 15.999 > 23 93 O 0.25666259134865 0.34270289037775 0.40223310279560 15.999 > 24 94 O 0.75666259134865 0.34270289037775 0.40223310279560 15.999 > 24 95 O 0.25666259134865 0.84270289037775 0.40223310279560 15.999 > 24 96 O 0.75666259134865 0.84270289037775 0.40223310279560 15.999 > 24 97 O 0.01797537818298 0.31292224117089 0.81326845453403 15.999 > 25 98 O 0.51797537818298 0.31292224117089 0.81326845453403 15.999 > 25 99 O 0.01797537818298 0.81292224117089 0.81326845453403 15.999 > 25 100 O 0.51797537818298 0.81292224117089 0.81326845453403 15.999 > 25 101 O 0.16424017660760 0.40576776680069 0.57465144982493 15.999 > 26 102 O 0.66424017660760 0.40576776680069 0.57465144982493 15.999 > 26 103 O 0.16424017660760 0.90576776680069 0.57465144982493 15.999 > 26 104 O 0.66424017660760 0.90576776680069 0.57465144982493 15.999 > 26 105 O 0.25666259134865 0.40729710962225 0.90223310279560 15.999 > 27 106 O 0.75666259134865 0.40729710962225 0.90223310279560 15.999 > 27 107 O 0.25666259134865 0.90729710962225 0.90223310279560 15.999 > 27 108 O 0.75666259134865 0.90729710962225 0.90223310279560 15.999 > 27 109 O 0.24333740865135 0.09270289037775 0.09776689720440 15.999 > 28 110 O 0.74333740865135 0.09270289037775 0.09776689720440 15.999 > 28 111 O 0.24333740865135 0.59270289037775 0.09776689720440 15.999 > 28 112 O 0.74333740865135 0.59270289037775 0.09776689720440 15.999 > 28 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.4532864 0.0000000 0.0060963 0.0000000 2.4698766 0.0000000 0.0060975 0.0000000 2.4521959 -------------------------- Born effective charges -------------------------- 1 Na 1.0929484 0.0954775 -0.0926807 0.0108433 1.0583826 -0.0249765 -0.0148798 0.0646692 1.1771356 2 Na 1.0929484 -0.0954775 -0.0926807 -0.0108433 1.0583826 0.0249765 -0.0148798 -0.0646692 1.1771356 3 Na 1.0656270 -0.0231440 0.0628591 -0.0004259 1.0860980 -0.0074137 0.0169518 0.0354318 1.0459606 4 Na 1.0656270 0.0231440 0.0628591 0.0004259 1.0860980 0.0074137 0.0169518 -0.0354318 1.0459606 5 Na 1.0929484 0.0954775 -0.0926807 0.0108433 1.0583826 -0.0249765 -0.0148798 0.0646692 1.1771356 6 Na 1.0656270 -0.0231440 0.0628591 -0.0004259 1.0860980 -0.0074137 0.0169518 0.0354318 1.0459606 7 Na 1.0656270 0.0231440 0.0628591 0.0004259 1.0860980 0.0074137 0.0169518 -0.0354318 1.0459606 8 Na 1.0929484 -0.0954775 -0.0926807 -0.0108433 1.0583826 0.0249765 -0.0148798 -0.0646692 1.1771356 9 P 2.4890140 -0.3870151 -0.0008028 -0.4352205 2.2422078 -0.0839716 0.0259354 -0.0749815 2.7419473 10 P 2.4890140 0.3870151 -0.0008028 0.4352205 2.2422078 0.0839716 0.0259354 0.0749815 2.7419473 11 P 2.4890140 -0.3870151 -0.0008028 -0.4352205 2.2422078 -0.0839716 0.0259354 -0.0749815 2.7419473 12 P 2.4890140 0.3870151 -0.0008028 0.4352205 2.2422078 0.0839716 0.0259354 0.0749815 2.7419473 13 H -0.2668224 -0.1328394 -0.0183016 -0.1368386 -0.3909951 -0.0202318 -0.0240859 -0.0128200 -0.1655769 14 H -0.2668224 0.1328394 -0.0183016 0.1368386 -0.3909951 0.0202318 -0.0240859 0.0128200 -0.1655769 15 H -0.2668224 0.1328394 -0.0183016 0.1368386 -0.3909951 0.0202318 -0.0240859 0.0128200 -0.1655769 16 H -0.2668224 -0.1328394 -0.0183016 -0.1368386 -0.3909951 -0.0202318 -0.0240859 -0.0128200 -0.1655769 17 O -1.2181700 0.2510627 -0.2599787 0.2396021 -1.5672342 0.5309980 -0.2305798 0.4555044 -1.6762177 18 O -1.1681032 -0.0663801 0.1684551 -0.0555799 -1.2623444 0.3292802 0.1251580 0.3256863 -1.9790691 19 O -1.2181700 -0.2510627 -0.2599787 -0.2396021 -1.5672342 -0.5309980 -0.2305798 -0.4555044 -1.6762177 20 O -1.1681032 0.0663801 0.1684551 0.0555799 -1.2623444 -0.3292802 0.1251580 -0.3256863 -1.9790691 21 O -1.9944938 0.1919547 0.1404496 0.2503964 -1.1661148 0.0007985 0.1015004 -0.0140130 -1.1441797 22 O -1.1681032 -0.0663801 0.1684551 -0.0555799 -1.2623444 0.3292802 0.1251580 0.3256863 -1.9790691 23 O -1.2181700 0.2510627 -0.2599787 0.2396021 -1.5672342 0.5309980 -0.2305798 0.4555044 -1.6762177 24 O -1.9944938 0.1919547 0.1404496 0.2503964 -1.1661148 0.0007985 0.1015004 -0.0140130 -1.1441797 25 O -1.2181700 -0.2510627 -0.2599787 -0.2396021 -1.5672342 -0.5309980 -0.2305798 -0.4555044 -1.6762177 26 O -1.1681032 0.0663801 0.1684551 0.0555799 -1.2623444 -0.3292802 0.1251580 -0.3256863 -1.9790691 27 O -1.9944938 -0.1919547 0.1404496 -0.2503964 -1.1661148 -0.0007985 0.1015004 0.0140130 -1.1441797 28 O -1.9944938 -0.1919547 0.1404496 -0.2503964 -1.1661148 -0.0007985 0.1015004 0.0140130 -1.1441797 ---------------------------------------------------------------------------- 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: 336/336 Permutation basis: 14448/14448 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3654 Number of blocks in projector: 3654 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: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 270 eigenvectors found. (1) Complementary block size: 28 (1) Compute compressed projector. (1) Use standard solver. (1) 14 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 270 eigenvectors found. (1) Complementary block size: 28 (1) Compute compressed projector. (1) Use standard solver. (1) 14 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 237 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 487 eigenvectors found. (1) Block: 784 / 784 (1) 275 eigenvectors found. (1) Complementary block size: 22 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 434 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 434 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 434 Use standard eigh solver. Tree of FC basis block matrices: - (3654, 3592), data: False |-- (434, 427), data: True |-- (434, 427), data: True |-- (434, 427), data: True |-- (784, 771), data: False |-- (784, 9), data: (784, 22) @ (22, 9) |-- (284, 275), data: True |-- (500, 487), data: False |-- (500, 11), data: (500, 24) @ (24, 11) |-- (250, 239), data: True |-- (250, 237), data: True |-- (784, 770), data: False |-- (784, 14), data: (784, 28) @ (28, 14) |-- (284, 270), data: True |-- (500, 486), data: False |-- (500, 12), data: (500, 26) @ (26, 12) |-- (250, 238), data: True |-- (250, 236), data: True |-- (784, 770), data: False |-- (784, 14), data: (784, 28) @ (28, 14) |-- (284, 270), data: True |-- (500, 486), data: False |-- (500, 12), data: (500, 26) @ (26, 12) |-- (250, 238), data: True |-- (250, 236), data: True ----- Solver_atoms: 1 -- 112 / 112 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 880 - Time: 1.097 Solver_block: 200 / 880 - Time: 0.975 Solver_block: 300 / 880 - Time: 0.924 Solver_block: 400 / 880 - Time: 0.940 Solver_block: 500 / 880 - Time: 0.952 Solver_block: 600 / 880 - Time: 0.951 Solver_block: 700 / 880 - Time: 0.934 Solver_block: 800 / 880 - Time: 0.944 Solver_block: 880 / 880 - Time: 0.791 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 8.980 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 336/336 Permutation basis: 14448/14448 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3654 Number of blocks in projector: 3654 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: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 270 eigenvectors found. (1) Complementary block size: 28 (1) Compute compressed projector. (1) Use standard solver. (1) 14 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 270 eigenvectors found. (1) Complementary block size: 28 (1) Compute compressed projector. (1) Use standard solver. (1) 14 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 237 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 487 eigenvectors found. (1) Block: 784 / 784 (1) 275 eigenvectors found. (1) Complementary block size: 22 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 434 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 434 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 434 Use standard eigh solver. Tree of FC basis block matrices: - (3654, 3592), data: False |-- (434, 427), data: True |-- (434, 427), data: True |-- (434, 427), data: True |-- (784, 771), data: False |-- (784, 9), data: (784, 22) @ (22, 9) |-- (284, 275), data: True |-- (500, 487), data: False |-- (500, 11), data: (500, 24) @ (24, 11) |-- (250, 239), data: True |-- (250, 237), data: True |-- (784, 770), data: False |-- (784, 14), data: (784, 28) @ (28, 14) |-- (284, 270), data: True |-- (500, 486), data: False |-- (500, 12), data: (500, 26) @ (26, 12) |-- (250, 238), data: True |-- (250, 236), data: True |-- (784, 770), data: False |-- (784, 14), data: (784, 28) @ (28, 14) |-- (284, 270), data: True |-- (500, 486), data: False |-- (500, 12), data: (500, 26) @ (26, 12) |-- (250, 238), data: True |-- (250, 236), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xx) -0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 12:46:58]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 12:46:58]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 2 1] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.024533880188214 0.000000000000000 0.000000000000000 b 0.000000000000000 6.963405039999999 0.000000000000000 c -4.609464195117199 0.000000000000000 9.677622483010314 Atomic positions (fractional): 1 Na 0.47240757044982 0.06330527882294 0.74584454457025 22.990 2 Na 0.52759242955018 0.56330527882294 0.75415545542975 22.990 3 Na 0.11918895540006 0.30910135718930 0.89537070067015 22.990 4 Na 0.88081104459994 0.80910135718930 0.60462929932985 22.990 5 Na 0.52759242955018 0.93669472117706 0.25415545542975 22.990 6 Na 0.88081104459994 0.69089864281070 0.10462929932985 22.990 7 Na 0.11918895540006 0.19089864281070 0.39537070067015 22.990 8 Na 0.47240757044982 0.43669472117706 0.24584454457025 22.990 9 P 0.75686696068883 0.26242946283973 0.57317844192553 30.974 10 P 0.24313303931117 0.76242946283973 0.92682155807447 30.974 11 P 0.24313303931117 0.73757053716027 0.42682155807447 30.974 12 P 0.75686696068883 0.23757053716027 0.07317844192553 30.974 13 H 0.92170415019312 0.43326654261995 0.58564441974406 1.008 14 H 0.92170415019312 0.06673345738005 0.08564441974406 1.008 15 H 0.07829584980688 0.93326654261995 0.91435558025594 1.008 16 H 0.07829584980688 0.56673345738005 0.41435558025594 1.008 17 O 0.03595075636596 0.87415551765823 0.31326845453403 15.999 18 O 0.67151964678480 0.31153553360139 0.92534855017507 15.999 19 O 0.96404924363404 0.37415551765823 0.18673154546597 15.999 20 O 0.67151964678480 0.18846446639861 0.42534855017507 15.999 21 O 0.48667481730271 0.31459421924449 0.59776689720440 15.999 22 O 0.32848035321520 0.68846446639861 0.07465144982494 15.999 23 O 0.96404924363404 0.12584448234177 0.68673154546597 15.999 24 O 0.51332518269729 0.68540578075551 0.40223310279560 15.999 25 O 0.03595075636596 0.62584448234177 0.81326845453403 15.999 26 O 0.32848035321520 0.81153553360139 0.57465144982493 15.999 27 O 0.51332518269729 0.81459421924449 0.90223310279560 15.999 28 O 0.48667481730271 0.18540578075551 0.09776689720440 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.049067760376428 0.000000000000000 0.000000000000000 b 0.000000000000000 13.926810079999997 0.000000000000000 c -4.609464195117199 0.000000000000000 9.677622483010314 Atomic positions (fractional): 1 Na 0.23620378522491 0.03165263941147 0.74584454457025 22.990 > 1 2 Na 0.73620378522491 0.03165263941147 0.74584454457025 22.990 > 1 3 Na 0.23620378522491 0.53165263941147 0.74584454457025 22.990 > 1 4 Na 0.73620378522491 0.53165263941147 0.74584454457025 22.990 > 1 5 Na 0.26379621477509 0.28165263941147 0.75415545542975 22.990 > 5 6 Na 0.76379621477509 0.28165263941147 0.75415545542975 22.990 > 5 7 Na 0.26379621477509 0.78165263941147 0.75415545542975 22.990 > 5 8 Na 0.76379621477509 0.78165263941147 0.75415545542975 22.990 > 5 9 Na 0.05959447770003 0.15455067859465 0.89537070067015 22.990 > 9 10 Na 0.55959447770003 0.15455067859465 0.89537070067015 22.990 > 9 11 Na 0.05959447770003 0.65455067859465 0.89537070067015 22.990 > 9 12 Na 0.55959447770003 0.65455067859465 0.89537070067015 22.990 > 9 13 Na 0.44040552229997 0.40455067859465 0.60462929932985 22.990 > 13 14 Na 0.94040552229997 0.40455067859465 0.60462929932985 22.990 > 13 15 Na 0.44040552229997 0.90455067859465 0.60462929932985 22.990 > 13 16 Na 0.94040552229997 0.90455067859465 0.60462929932985 22.990 > 13 17 Na 0.26379621477509 0.46834736058853 0.25415545542975 22.990 > 17 18 Na 0.76379621477509 0.46834736058853 0.25415545542975 22.990 > 17 19 Na 0.26379621477509 0.96834736058853 0.25415545542975 22.990 > 17 20 Na 0.76379621477509 0.96834736058853 0.25415545542975 22.990 > 17 21 Na 0.44040552229997 0.34544932140535 0.10462929932985 22.990 > 21 22 Na 0.94040552229997 0.34544932140535 0.10462929932985 22.990 > 21 23 Na 0.44040552229997 0.84544932140535 0.10462929932985 22.990 > 21 24 Na 0.94040552229997 0.84544932140535 0.10462929932985 22.990 > 21 25 Na 0.05959447770003 0.09544932140535 0.39537070067015 22.990 > 25 26 Na 0.55959447770003 0.09544932140535 0.39537070067015 22.990 > 25 27 Na 0.05959447770003 0.59544932140535 0.39537070067015 22.990 > 25 28 Na 0.55959447770003 0.59544932140535 0.39537070067015 22.990 > 25 29 Na 0.23620378522491 0.21834736058853 0.24584454457025 22.990 > 29 30 Na 0.73620378522491 0.21834736058853 0.24584454457025 22.990 > 29 31 Na 0.23620378522491 0.71834736058853 0.24584454457025 22.990 > 29 32 Na 0.73620378522491 0.71834736058853 0.24584454457025 22.990 > 29 33 P 0.37843348034441 0.13121473141986 0.57317844192553 30.974 > 33 34 P 0.87843348034441 0.13121473141986 0.57317844192553 30.974 > 33 35 P 0.37843348034441 0.63121473141986 0.57317844192553 30.974 > 33 36 P 0.87843348034441 0.63121473141986 0.57317844192553 30.974 > 33 37 P 0.12156651965559 0.38121473141986 0.92682155807447 30.974 > 37 38 P 0.62156651965559 0.38121473141986 0.92682155807447 30.974 > 37 39 P 0.12156651965559 0.88121473141986 0.92682155807447 30.974 > 37 40 P 0.62156651965559 0.88121473141986 0.92682155807447 30.974 > 37 41 P 0.12156651965559 0.36878526858014 0.42682155807447 30.974 > 41 42 P 0.62156651965559 0.36878526858014 0.42682155807447 30.974 > 41 43 P 0.12156651965559 0.86878526858014 0.42682155807447 30.974 > 41 44 P 0.62156651965559 0.86878526858014 0.42682155807447 30.974 > 41 45 P 0.37843348034441 0.11878526858014 0.07317844192553 30.974 > 45 46 P 0.87843348034441 0.11878526858014 0.07317844192553 30.974 > 45 47 P 0.37843348034441 0.61878526858014 0.07317844192553 30.974 > 45 48 P 0.87843348034441 0.61878526858014 0.07317844192553 30.974 > 45 49 H 0.46085207509656 0.21663327130998 0.58564441974406 1.008 > 49 50 H 0.96085207509656 0.21663327130998 0.58564441974406 1.008 > 49 51 H 0.46085207509656 0.71663327130998 0.58564441974406 1.008 > 49 52 H 0.96085207509656 0.71663327130998 0.58564441974406 1.008 > 49 53 H 0.46085207509656 0.03336672869002 0.08564441974406 1.008 > 53 54 H 0.96085207509656 0.03336672869002 0.08564441974406 1.008 > 53 55 H 0.46085207509656 0.53336672869002 0.08564441974406 1.008 > 53 56 H 0.96085207509656 0.53336672869002 0.08564441974406 1.008 > 53 57 H 0.03914792490344 0.46663327130998 0.91435558025594 1.008 > 57 58 H 0.53914792490344 0.46663327130998 0.91435558025594 1.008 > 57 59 H 0.03914792490344 0.96663327130998 0.91435558025594 1.008 > 57 60 H 0.53914792490344 0.96663327130998 0.91435558025594 1.008 > 57 61 H 0.03914792490344 0.28336672869002 0.41435558025594 1.008 > 61 62 H 0.53914792490344 0.28336672869002 0.41435558025594 1.008 > 61 63 H 0.03914792490344 0.78336672869002 0.41435558025594 1.008 > 61 64 H 0.53914792490344 0.78336672869002 0.41435558025594 1.008 > 61 65 O 0.01797537818298 0.43707775882911 0.31326845453403 15.999 > 65 66 O 0.51797537818298 0.43707775882911 0.31326845453403 15.999 > 65 67 O 0.01797537818298 0.93707775882911 0.31326845453403 15.999 > 65 68 O 0.51797537818298 0.93707775882911 0.31326845453403 15.999 > 65 69 O 0.33575982339240 0.15576776680069 0.92534855017507 15.999 > 69 70 O 0.83575982339240 0.15576776680069 0.92534855017507 15.999 > 69 71 O 0.33575982339240 0.65576776680069 0.92534855017507 15.999 > 69 72 O 0.83575982339240 0.65576776680069 0.92534855017507 15.999 > 69 73 O 0.48202462181702 0.18707775882911 0.18673154546597 15.999 > 73 74 O 0.98202462181702 0.18707775882911 0.18673154546597 15.999 > 73 75 O 0.48202462181702 0.68707775882911 0.18673154546597 15.999 > 73 76 O 0.98202462181702 0.68707775882911 0.18673154546597 15.999 > 73 77 O 0.33575982339240 0.09423223319931 0.42534855017507 15.999 > 77 78 O 0.83575982339240 0.09423223319931 0.42534855017507 15.999 > 77 79 O 0.33575982339240 0.59423223319931 0.42534855017507 15.999 > 77 80 O 0.83575982339240 0.59423223319931 0.42534855017507 15.999 > 77 81 O 0.24333740865135 0.15729710962225 0.59776689720440 15.999 > 81 82 O 0.74333740865135 0.15729710962225 0.59776689720440 15.999 > 81 83 O 0.24333740865135 0.65729710962225 0.59776689720440 15.999 > 81 84 O 0.74333740865135 0.65729710962225 0.59776689720440 15.999 > 81 85 O 0.16424017660760 0.34423223319931 0.07465144982494 15.999 > 85 86 O 0.66424017660760 0.34423223319931 0.07465144982494 15.999 > 85 87 O 0.16424017660760 0.84423223319931 0.07465144982494 15.999 > 85 88 O 0.66424017660760 0.84423223319931 0.07465144982494 15.999 > 85 89 O 0.48202462181702 0.06292224117089 0.68673154546597 15.999 > 89 90 O 0.98202462181702 0.06292224117089 0.68673154546597 15.999 > 89 91 O 0.48202462181702 0.56292224117089 0.68673154546597 15.999 > 89 92 O 0.98202462181702 0.56292224117089 0.68673154546597 15.999 > 89 93 O 0.25666259134865 0.34270289037775 0.40223310279560 15.999 > 93 94 O 0.75666259134865 0.34270289037775 0.40223310279560 15.999 > 93 95 O 0.25666259134865 0.84270289037775 0.40223310279560 15.999 > 93 96 O 0.75666259134865 0.84270289037775 0.40223310279560 15.999 > 93 97 O 0.01797537818298 0.31292224117089 0.81326845453403 15.999 > 97 98 O 0.51797537818298 0.31292224117089 0.81326845453403 15.999 > 97 99 O 0.01797537818298 0.81292224117089 0.81326845453403 15.999 > 97 100 O 0.51797537818298 0.81292224117089 0.81326845453403 15.999 > 97 101 O 0.16424017660760 0.40576776680069 0.57465144982493 15.999 > 101 102 O 0.66424017660760 0.40576776680069 0.57465144982493 15.999 > 101 103 O 0.16424017660760 0.90576776680069 0.57465144982493 15.999 > 101 104 O 0.66424017660760 0.90576776680069 0.57465144982493 15.999 > 101 105 O 0.25666259134865 0.40729710962225 0.90223310279560 15.999 > 105 106 O 0.75666259134865 0.40729710962225 0.90223310279560 15.999 > 105 107 O 0.25666259134865 0.90729710962225 0.90223310279560 15.999 > 105 108 O 0.75666259134865 0.90729710962225 0.90223310279560 15.999 > 105 109 O 0.24333740865135 0.09270289037775 0.09776689720440 15.999 > 109 110 O 0.74333740865135 0.09270289037775 0.09776689720440 15.999 > 109 111 O 0.24333740865135 0.59270289037775 0.09776689720440 15.999 > 109 112 O 0.74333740865135 0.59270289037775 0.09776689720440 15.999 > 109 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.4532864 0.0000000 0.0060963 0.0000000 2.4698766 0.0000000 0.0060975 0.0000000 2.4521959 -------------------------- Born effective charges -------------------------- 1 Na 1.0929484 0.0954775 -0.0926807 0.0108433 1.0583826 -0.0249765 -0.0148798 0.0646692 1.1771356 2 Na 1.0929484 -0.0954775 -0.0926807 -0.0108433 1.0583826 0.0249765 -0.0148798 -0.0646692 1.1771356 3 Na 1.0656270 -0.0231440 0.0628591 -0.0004259 1.0860980 -0.0074137 0.0169518 0.0354318 1.0459606 4 Na 1.0656270 0.0231440 0.0628591 0.0004259 1.0860980 0.0074137 0.0169518 -0.0354318 1.0459606 5 Na 1.0929484 0.0954775 -0.0926807 0.0108433 1.0583826 -0.0249765 -0.0148798 0.0646692 1.1771356 6 Na 1.0656270 -0.0231440 0.0628591 -0.0004259 1.0860980 -0.0074137 0.0169518 0.0354318 1.0459606 7 Na 1.0656270 0.0231440 0.0628591 0.0004259 1.0860980 0.0074137 0.0169518 -0.0354318 1.0459606 8 Na 1.0929484 -0.0954775 -0.0926807 -0.0108433 1.0583826 0.0249765 -0.0148798 -0.0646692 1.1771356 9 P 2.4890140 -0.3870151 -0.0008028 -0.4352205 2.2422078 -0.0839716 0.0259354 -0.0749815 2.7419473 10 P 2.4890140 0.3870151 -0.0008028 0.4352205 2.2422078 0.0839716 0.0259354 0.0749815 2.7419473 11 P 2.4890140 -0.3870151 -0.0008028 -0.4352205 2.2422078 -0.0839716 0.0259354 -0.0749815 2.7419473 12 P 2.4890140 0.3870151 -0.0008028 0.4352205 2.2422078 0.0839716 0.0259354 0.0749815 2.7419473 13 H -0.2668224 -0.1328394 -0.0183016 -0.1368386 -0.3909951 -0.0202318 -0.0240859 -0.0128200 -0.1655769 14 H -0.2668224 0.1328394 -0.0183016 0.1368386 -0.3909951 0.0202318 -0.0240859 0.0128200 -0.1655769 15 H -0.2668224 0.1328394 -0.0183016 0.1368386 -0.3909951 0.0202318 -0.0240859 0.0128200 -0.1655769 16 H -0.2668224 -0.1328394 -0.0183016 -0.1368386 -0.3909951 -0.0202318 -0.0240859 -0.0128200 -0.1655769 17 O -1.2181700 0.2510627 -0.2599787 0.2396021 -1.5672342 0.5309980 -0.2305798 0.4555044 -1.6762177 18 O -1.1681032 -0.0663801 0.1684551 -0.0555799 -1.2623444 0.3292802 0.1251580 0.3256863 -1.9790691 19 O -1.2181700 -0.2510627 -0.2599787 -0.2396021 -1.5672342 -0.5309980 -0.2305798 -0.4555044 -1.6762177 20 O -1.1681032 0.0663801 0.1684551 0.0555799 -1.2623444 -0.3292802 0.1251580 -0.3256863 -1.9790691 21 O -1.9944938 0.1919547 0.1404496 0.2503964 -1.1661148 0.0007985 0.1015004 -0.0140130 -1.1441797 22 O -1.1681032 -0.0663801 0.1684551 -0.0555799 -1.2623444 0.3292802 0.1251580 0.3256863 -1.9790691 23 O -1.2181700 0.2510627 -0.2599787 0.2396021 -1.5672342 0.5309980 -0.2305798 0.4555044 -1.6762177 24 O -1.9944938 0.1919547 0.1404496 0.2503964 -1.1661148 0.0007985 0.1015004 -0.0140130 -1.1441797 25 O -1.2181700 -0.2510627 -0.2599787 -0.2396021 -1.5672342 -0.5309980 -0.2305798 -0.4555044 -1.6762177 26 O -1.1681032 0.0663801 0.1684551 0.0555799 -1.2623444 -0.3292802 0.1251580 -0.3256863 -1.9790691 27 O -1.9944938 -0.1919547 0.1404496 -0.2503964 -1.1661148 -0.0007985 0.1015004 0.0140130 -1.1441797 28 O -1.9944938 -0.1919547 0.1404496 -0.2503964 -1.1661148 -0.0007985 0.1015004 0.0140130 -1.1441797 ---------------------------------------------------------------------------- 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] [-0.0043 0.0000 0.0090] [ 0.0043 0.0000 -0.0090] Computing fc3[ 9, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0043 0.0000 0.0090] [ 0.0043 0.0000 -0.0090] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0043 0.0000 0.0090] [ 0.0043 0.0000 -0.0090] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0043 0.0000 0.0090] [ 0.0043 0.0000 -0.0090] 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] [-0.0043 0.0000 0.0090] [ 0.0043 0.0000 -0.0090] 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] [-0.0043 0.0000 0.0090] [ 0.0043 0.0000 -0.0090] Computing fc3[ 81, 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] [-0.0043 0.0000 0.0090] [ 0.0043 0.0000 -0.0090] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000003 (xxx) 0.00000003 (xxx) 0.00000003 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000001 (xy) 0.00000001 (xy) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 12:47:32]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 12:47:33]------------------------- 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): [2 2 1] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.024533880188214 0.000000000000000 0.000000000000000 b 0.000000000000000 6.963405039999999 0.000000000000000 c -4.609464195117199 0.000000000000000 9.677622483010314 Atomic positions (fractional): 1 Na 0.47240757044982 0.06330527882294 0.74584454457025 22.990 2 Na 0.52759242955018 0.56330527882294 0.75415545542975 22.990 3 Na 0.11918895540006 0.30910135718930 0.89537070067015 22.990 4 Na 0.88081104459994 0.80910135718930 0.60462929932985 22.990 5 Na 0.52759242955018 0.93669472117706 0.25415545542975 22.990 6 Na 0.88081104459994 0.69089864281070 0.10462929932985 22.990 7 Na 0.11918895540006 0.19089864281070 0.39537070067015 22.990 8 Na 0.47240757044982 0.43669472117706 0.24584454457025 22.990 9 P 0.75686696068883 0.26242946283973 0.57317844192553 30.974 10 P 0.24313303931117 0.76242946283973 0.92682155807447 30.974 11 P 0.24313303931117 0.73757053716027 0.42682155807447 30.974 12 P 0.75686696068883 0.23757053716027 0.07317844192553 30.974 13 H 0.92170415019312 0.43326654261995 0.58564441974406 1.008 14 H 0.92170415019312 0.06673345738005 0.08564441974406 1.008 15 H 0.07829584980688 0.93326654261995 0.91435558025594 1.008 16 H 0.07829584980688 0.56673345738005 0.41435558025594 1.008 17 O 0.03595075636596 0.87415551765823 0.31326845453403 15.999 18 O 0.67151964678480 0.31153553360139 0.92534855017507 15.999 19 O 0.96404924363404 0.37415551765823 0.18673154546597 15.999 20 O 0.67151964678480 0.18846446639861 0.42534855017507 15.999 21 O 0.48667481730271 0.31459421924449 0.59776689720440 15.999 22 O 0.32848035321520 0.68846446639861 0.07465144982494 15.999 23 O 0.96404924363404 0.12584448234177 0.68673154546597 15.999 24 O 0.51332518269729 0.68540578075551 0.40223310279560 15.999 25 O 0.03595075636596 0.62584448234177 0.81326845453403 15.999 26 O 0.32848035321520 0.81153553360139 0.57465144982493 15.999 27 O 0.51332518269729 0.81459421924449 0.90223310279560 15.999 28 O 0.48667481730271 0.18540578075551 0.09776689720440 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.049067760376428 0.000000000000000 0.000000000000000 b 0.000000000000000 13.926810079999997 0.000000000000000 c -4.609464195117199 0.000000000000000 9.677622483010314 Atomic positions (fractional): 1 Na 0.23620378522491 0.03165263941147 0.74584454457025 22.990 > 1 2 Na 0.73620378522491 0.03165263941147 0.74584454457025 22.990 > 1 3 Na 0.23620378522491 0.53165263941147 0.74584454457025 22.990 > 1 4 Na 0.73620378522491 0.53165263941147 0.74584454457025 22.990 > 1 5 Na 0.26379621477509 0.28165263941147 0.75415545542975 22.990 > 5 6 Na 0.76379621477509 0.28165263941147 0.75415545542975 22.990 > 5 7 Na 0.26379621477509 0.78165263941147 0.75415545542975 22.990 > 5 8 Na 0.76379621477509 0.78165263941147 0.75415545542975 22.990 > 5 9 Na 0.05959447770003 0.15455067859465 0.89537070067015 22.990 > 9 10 Na 0.55959447770003 0.15455067859465 0.89537070067015 22.990 > 9 11 Na 0.05959447770003 0.65455067859465 0.89537070067015 22.990 > 9 12 Na 0.55959447770003 0.65455067859465 0.89537070067015 22.990 > 9 13 Na 0.44040552229997 0.40455067859465 0.60462929932985 22.990 > 13 14 Na 0.94040552229997 0.40455067859465 0.60462929932985 22.990 > 13 15 Na 0.44040552229997 0.90455067859465 0.60462929932985 22.990 > 13 16 Na 0.94040552229997 0.90455067859465 0.60462929932985 22.990 > 13 17 Na 0.26379621477509 0.46834736058853 0.25415545542975 22.990 > 17 18 Na 0.76379621477509 0.46834736058853 0.25415545542975 22.990 > 17 19 Na 0.26379621477509 0.96834736058853 0.25415545542975 22.990 > 17 20 Na 0.76379621477509 0.96834736058853 0.25415545542975 22.990 > 17 21 Na 0.44040552229997 0.34544932140535 0.10462929932985 22.990 > 21 22 Na 0.94040552229997 0.34544932140535 0.10462929932985 22.990 > 21 23 Na 0.44040552229997 0.84544932140535 0.10462929932985 22.990 > 21 24 Na 0.94040552229997 0.84544932140535 0.10462929932985 22.990 > 21 25 Na 0.05959447770003 0.09544932140535 0.39537070067015 22.990 > 25 26 Na 0.55959447770003 0.09544932140535 0.39537070067015 22.990 > 25 27 Na 0.05959447770003 0.59544932140535 0.39537070067015 22.990 > 25 28 Na 0.55959447770003 0.59544932140535 0.39537070067015 22.990 > 25 29 Na 0.23620378522491 0.21834736058853 0.24584454457025 22.990 > 29 30 Na 0.73620378522491 0.21834736058853 0.24584454457025 22.990 > 29 31 Na 0.23620378522491 0.71834736058853 0.24584454457025 22.990 > 29 32 Na 0.73620378522491 0.71834736058853 0.24584454457025 22.990 > 29 33 P 0.37843348034441 0.13121473141986 0.57317844192553 30.974 > 33 34 P 0.87843348034441 0.13121473141986 0.57317844192553 30.974 > 33 35 P 0.37843348034441 0.63121473141986 0.57317844192553 30.974 > 33 36 P 0.87843348034441 0.63121473141986 0.57317844192553 30.974 > 33 37 P 0.12156651965559 0.38121473141986 0.92682155807447 30.974 > 37 38 P 0.62156651965559 0.38121473141986 0.92682155807447 30.974 > 37 39 P 0.12156651965559 0.88121473141986 0.92682155807447 30.974 > 37 40 P 0.62156651965559 0.88121473141986 0.92682155807447 30.974 > 37 41 P 0.12156651965559 0.36878526858014 0.42682155807447 30.974 > 41 42 P 0.62156651965559 0.36878526858014 0.42682155807447 30.974 > 41 43 P 0.12156651965559 0.86878526858014 0.42682155807447 30.974 > 41 44 P 0.62156651965559 0.86878526858014 0.42682155807447 30.974 > 41 45 P 0.37843348034441 0.11878526858014 0.07317844192553 30.974 > 45 46 P 0.87843348034441 0.11878526858014 0.07317844192553 30.974 > 45 47 P 0.37843348034441 0.61878526858014 0.07317844192553 30.974 > 45 48 P 0.87843348034441 0.61878526858014 0.07317844192553 30.974 > 45 49 H 0.46085207509656 0.21663327130998 0.58564441974406 1.008 > 49 50 H 0.96085207509656 0.21663327130998 0.58564441974406 1.008 > 49 51 H 0.46085207509656 0.71663327130998 0.58564441974406 1.008 > 49 52 H 0.96085207509656 0.71663327130998 0.58564441974406 1.008 > 49 53 H 0.46085207509656 0.03336672869002 0.08564441974406 1.008 > 53 54 H 0.96085207509656 0.03336672869002 0.08564441974406 1.008 > 53 55 H 0.46085207509656 0.53336672869002 0.08564441974406 1.008 > 53 56 H 0.96085207509656 0.53336672869002 0.08564441974406 1.008 > 53 57 H 0.03914792490344 0.46663327130998 0.91435558025594 1.008 > 57 58 H 0.53914792490344 0.46663327130998 0.91435558025594 1.008 > 57 59 H 0.03914792490344 0.96663327130998 0.91435558025594 1.008 > 57 60 H 0.53914792490344 0.96663327130998 0.91435558025594 1.008 > 57 61 H 0.03914792490344 0.28336672869002 0.41435558025594 1.008 > 61 62 H 0.53914792490344 0.28336672869002 0.41435558025594 1.008 > 61 63 H 0.03914792490344 0.78336672869002 0.41435558025594 1.008 > 61 64 H 0.53914792490344 0.78336672869002 0.41435558025594 1.008 > 61 65 O 0.01797537818298 0.43707775882911 0.31326845453403 15.999 > 65 66 O 0.51797537818298 0.43707775882911 0.31326845453403 15.999 > 65 67 O 0.01797537818298 0.93707775882911 0.31326845453403 15.999 > 65 68 O 0.51797537818298 0.93707775882911 0.31326845453403 15.999 > 65 69 O 0.33575982339240 0.15576776680069 0.92534855017507 15.999 > 69 70 O 0.83575982339240 0.15576776680069 0.92534855017507 15.999 > 69 71 O 0.33575982339240 0.65576776680069 0.92534855017507 15.999 > 69 72 O 0.83575982339240 0.65576776680069 0.92534855017507 15.999 > 69 73 O 0.48202462181702 0.18707775882911 0.18673154546597 15.999 > 73 74 O 0.98202462181702 0.18707775882911 0.18673154546597 15.999 > 73 75 O 0.48202462181702 0.68707775882911 0.18673154546597 15.999 > 73 76 O 0.98202462181702 0.68707775882911 0.18673154546597 15.999 > 73 77 O 0.33575982339240 0.09423223319931 0.42534855017507 15.999 > 77 78 O 0.83575982339240 0.09423223319931 0.42534855017507 15.999 > 77 79 O 0.33575982339240 0.59423223319931 0.42534855017507 15.999 > 77 80 O 0.83575982339240 0.59423223319931 0.42534855017507 15.999 > 77 81 O 0.24333740865135 0.15729710962225 0.59776689720440 15.999 > 81 82 O 0.74333740865135 0.15729710962225 0.59776689720440 15.999 > 81 83 O 0.24333740865135 0.65729710962225 0.59776689720440 15.999 > 81 84 O 0.74333740865135 0.65729710962225 0.59776689720440 15.999 > 81 85 O 0.16424017660760 0.34423223319931 0.07465144982494 15.999 > 85 86 O 0.66424017660760 0.34423223319931 0.07465144982494 15.999 > 85 87 O 0.16424017660760 0.84423223319931 0.07465144982494 15.999 > 85 88 O 0.66424017660760 0.84423223319931 0.07465144982494 15.999 > 85 89 O 0.48202462181702 0.06292224117089 0.68673154546597 15.999 > 89 90 O 0.98202462181702 0.06292224117089 0.68673154546597 15.999 > 89 91 O 0.48202462181702 0.56292224117089 0.68673154546597 15.999 > 89 92 O 0.98202462181702 0.56292224117089 0.68673154546597 15.999 > 89 93 O 0.25666259134865 0.34270289037775 0.40223310279560 15.999 > 93 94 O 0.75666259134865 0.34270289037775 0.40223310279560 15.999 > 93 95 O 0.25666259134865 0.84270289037775 0.40223310279560 15.999 > 93 96 O 0.75666259134865 0.84270289037775 0.40223310279560 15.999 > 93 97 O 0.01797537818298 0.31292224117089 0.81326845453403 15.999 > 97 98 O 0.51797537818298 0.31292224117089 0.81326845453403 15.999 > 97 99 O 0.01797537818298 0.81292224117089 0.81326845453403 15.999 > 97 100 O 0.51797537818298 0.81292224117089 0.81326845453403 15.999 > 97 101 O 0.16424017660760 0.40576776680069 0.57465144982493 15.999 > 101 102 O 0.66424017660760 0.40576776680069 0.57465144982493 15.999 > 101 103 O 0.16424017660760 0.90576776680069 0.57465144982493 15.999 > 101 104 O 0.66424017660760 0.90576776680069 0.57465144982493 15.999 > 101 105 O 0.25666259134865 0.40729710962225 0.90223310279560 15.999 > 105 106 O 0.75666259134865 0.40729710962225 0.90223310279560 15.999 > 105 107 O 0.25666259134865 0.90729710962225 0.90223310279560 15.999 > 105 108 O 0.75666259134865 0.90729710962225 0.90223310279560 15.999 > 105 109 O 0.24333740865135 0.09270289037775 0.09776689720440 15.999 > 109 110 O 0.74333740865135 0.09270289037775 0.09776689720440 15.999 > 109 111 O 0.24333740865135 0.59270289037775 0.09776689720440 15.999 > 109 112 O 0.74333740865135 0.59270289037775 0.09776689720440 15.999 > 109 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.4532864 0.0000000 0.0060963 0.0000000 2.4698766 0.0000000 0.0060975 0.0000000 2.4521959 -------------------------- Born effective charges -------------------------- 1 Na 1.0929484 0.0954775 -0.0926807 0.0108433 1.0583826 -0.0249765 -0.0148798 0.0646692 1.1771356 2 Na 1.0929484 -0.0954775 -0.0926807 -0.0108433 1.0583826 0.0249765 -0.0148798 -0.0646692 1.1771356 3 Na 1.0656270 -0.0231440 0.0628591 -0.0004259 1.0860980 -0.0074137 0.0169518 0.0354318 1.0459606 4 Na 1.0656270 0.0231440 0.0628591 0.0004259 1.0860980 0.0074137 0.0169518 -0.0354318 1.0459606 5 Na 1.0929484 0.0954775 -0.0926807 0.0108433 1.0583826 -0.0249765 -0.0148798 0.0646692 1.1771356 6 Na 1.0656270 -0.0231440 0.0628591 -0.0004259 1.0860980 -0.0074137 0.0169518 0.0354318 1.0459606 7 Na 1.0656270 0.0231440 0.0628591 0.0004259 1.0860980 0.0074137 0.0169518 -0.0354318 1.0459606 8 Na 1.0929484 -0.0954775 -0.0926807 -0.0108433 1.0583826 0.0249765 -0.0148798 -0.0646692 1.1771356 9 P 2.4890140 -0.3870151 -0.0008028 -0.4352205 2.2422078 -0.0839716 0.0259354 -0.0749815 2.7419473 10 P 2.4890140 0.3870151 -0.0008028 0.4352205 2.2422078 0.0839716 0.0259354 0.0749815 2.7419473 11 P 2.4890140 -0.3870151 -0.0008028 -0.4352205 2.2422078 -0.0839716 0.0259354 -0.0749815 2.7419473 12 P 2.4890140 0.3870151 -0.0008028 0.4352205 2.2422078 0.0839716 0.0259354 0.0749815 2.7419473 13 H -0.2668224 -0.1328394 -0.0183016 -0.1368386 -0.3909951 -0.0202318 -0.0240859 -0.0128200 -0.1655769 14 H -0.2668224 0.1328394 -0.0183016 0.1368386 -0.3909951 0.0202318 -0.0240859 0.0128200 -0.1655769 15 H -0.2668224 0.1328394 -0.0183016 0.1368386 -0.3909951 0.0202318 -0.0240859 0.0128200 -0.1655769 16 H -0.2668224 -0.1328394 -0.0183016 -0.1368386 -0.3909951 -0.0202318 -0.0240859 -0.0128200 -0.1655769 17 O -1.2181700 0.2510627 -0.2599787 0.2396021 -1.5672342 0.5309980 -0.2305798 0.4555044 -1.6762177 18 O -1.1681032 -0.0663801 0.1684551 -0.0555799 -1.2623444 0.3292802 0.1251580 0.3256863 -1.9790691 19 O -1.2181700 -0.2510627 -0.2599787 -0.2396021 -1.5672342 -0.5309980 -0.2305798 -0.4555044 -1.6762177 20 O -1.1681032 0.0663801 0.1684551 0.0555799 -1.2623444 -0.3292802 0.1251580 -0.3256863 -1.9790691 21 O -1.9944938 0.1919547 0.1404496 0.2503964 -1.1661148 0.0007985 0.1015004 -0.0140130 -1.1441797 22 O -1.1681032 -0.0663801 0.1684551 -0.0555799 -1.2623444 0.3292802 0.1251580 0.3256863 -1.9790691 23 O -1.2181700 0.2510627 -0.2599787 0.2396021 -1.5672342 0.5309980 -0.2305798 0.4555044 -1.6762177 24 O -1.9944938 0.1919547 0.1404496 0.2503964 -1.1661148 0.0007985 0.1015004 -0.0140130 -1.1441797 25 O -1.2181700 -0.2510627 -0.2599787 -0.2396021 -1.5672342 -0.5309980 -0.2305798 -0.4555044 -1.6762177 26 O -1.1681032 0.0663801 0.1684551 0.0555799 -1.2623444 -0.3292802 0.1251580 -0.3256863 -1.9790691 27 O -1.9944938 -0.1919547 0.1404496 -0.2503964 -1.1661148 -0.0007985 0.1015004 0.0140130 -1.1441797 28 O -1.9944938 -0.1919547 0.1404496 -0.2503964 -1.1661148 -0.0007985 0.1015004 0.0140130 -1.1441797 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000003 (xxx) 0.00000003 (xxx) 0.00000003 (xxx) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 11 7 5 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.60, Number of G-points: 291, Lambda: 0.10 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/112) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 1.473 ( 0.000 0.000 0.000) 0.000 2.545 ( 0.000 0.000 0.000) 0.000 2.602 ( 0.000 0.000 0.000) 0.000 2.958 ( 0.000 0.000 0.000) 0.000 3.113 ( 0.000 0.000 0.000) 0.000 3.222 ( 0.000 0.000 0.000) 0.000 3.282 ( 0.000 0.000 0.000) 0.000 3.524 ( 0.000 0.000 0.000) 0.000 3.770 ( 0.000 0.000 0.000) 0.000 3.833 ( 0.000 0.000 0.000) 0.000 4.040 ( 0.000 0.000 0.000) 0.000 4.315 ( 0.000 0.000 0.000) 0.000 4.376 ( 0.000 0.000 0.000) 0.000 4.619 ( 0.000 0.000 0.000) 0.000 4.699 ( 0.000 0.000 0.000) 0.000 4.701 ( 0.000 0.000 0.000) 0.000 4.802 ( 0.000 0.000 0.000) 0.000 4.918 ( 0.000 0.000 0.000) 0.000 4.954 ( 0.000 0.000 0.000) 0.000 5.036 ( 0.000 0.000 0.000) 0.000 5.052 ( 0.000 0.000 0.000) 0.000 5.310 ( 0.000 0.000 0.000) 0.000 5.354 ( 0.000 0.000 0.000) 0.000 5.400 ( 0.000 0.000 0.000) 0.000 5.484 ( 0.000 0.000 0.000) 0.000 5.578 ( 0.000 0.000 0.000) 0.000 5.605 ( 0.000 0.000 0.000) 0.000 5.650 ( 0.000 0.000 0.000) 0.000 5.657 ( 0.000 0.000 0.000) 0.000 5.776 ( 0.000 0.000 0.000) 0.000 5.951 ( 0.000 0.000 0.000) 0.000 6.120 ( 0.000 0.000 0.000) 0.000 6.126 ( 0.000 0.000 0.000) 0.000 6.432 ( 0.000 0.000 0.000) 0.000 6.542 ( 0.000 0.000 0.000) 0.000 6.632 ( 0.000 0.000 0.000) 0.000 6.706 ( 0.000 0.000 0.000) 0.000 6.942 ( 0.000 0.000 0.000) 0.000 7.166 ( 0.000 0.000 0.000) 0.000 7.503 ( 0.000 0.000 0.000) 0.000 7.686 ( 0.000 0.000 0.000) 0.000 7.708 ( 0.000 0.000 0.000) 0.000 7.730 ( 0.000 0.000 0.000) 0.000 7.878 ( 0.000 0.000 0.000) 0.000 8.187 ( 0.000 0.000 0.000) 0.000 13.277 ( 0.000 0.000 0.000) 0.000 13.507 ( 0.000 0.000 0.000) 0.000 13.574 ( 0.000 0.000 0.000) 0.000 13.777 ( 0.000 0.000 0.000) 0.000 14.145 ( 0.000 0.000 0.000) 0.000 14.161 ( 0.000 0.000 0.000) 0.000 14.258 ( 0.000 0.000 0.000) 0.000 14.297 ( 0.000 0.000 0.000) 0.000 16.406 ( 0.000 0.000 0.000) 0.000 16.471 ( 0.000 0.000 0.000) 0.000 16.947 ( 0.000 0.000 0.000) 0.000 17.173 ( 0.000 0.000 0.000) 0.000 27.813 ( 0.000 0.000 0.000) 0.000 28.030 ( 0.000 0.000 0.000) 0.000 28.121 ( 0.000 0.000 0.000) 0.000 28.230 ( 0.000 0.000 0.000) 0.000 28.740 ( 0.000 0.000 0.000) 0.000 28.791 ( 0.000 0.000 0.000) 0.000 28.799 ( 0.000 0.000 0.000) 0.000 28.811 ( 0.000 0.000 0.000) 0.000 28.994 ( 0.000 0.000 0.000) 0.000 28.995 ( 0.000 0.000 0.000) 0.000 29.038 ( 0.000 0.000 0.000) 0.000 29.122 ( 0.000 0.000 0.000) 0.000 31.139 ( 0.000 0.000 0.000) 0.000 31.397 ( 0.000 0.000 0.000) 0.000 31.569 ( 0.000 0.000 0.000) 0.000 31.593 ( 0.000 0.000 0.000) 0.000 31.657 ( 0.000 0.000 0.000) 0.000 31.668 ( 0.000 0.000 0.000) 0.000 32.091 ( 0.000 0.000 0.000) 0.000 33.469 ( 0.000 0.000 0.000) 0.000 70.057 ( 0.000 0.000 0.000) 0.000 70.184 ( 0.000 0.000 0.000) 0.000 70.208 ( 0.000 0.000 0.000) 0.000 70.327 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/112) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.422 ( 30.525 0.000 -12.768) 33.088 0.481 ( 21.385 0.000 11.526) 24.294 0.943 ( 33.322 0.000 37.291) 50.009 1.650 ( 13.378 0.000 9.517) 16.417 2.488 ( 3.194 0.000 -14.643) 14.987 2.682 ( -1.844 0.000 16.557) 16.659 2.843 ( -5.126 0.000 -5.152) 7.268 3.241 ( 1.123 0.000 6.695) 6.788 3.275 ( 13.513 0.000 -7.263) 15.341 3.306 ( 3.645 0.000 -2.893) 4.654 3.492 ( -3.408 0.000 -1.603) 3.766 3.686 ( -6.894 0.000 -4.244) 8.095 3.786 ( -6.131 0.000 1.835) 6.400 3.923 ( -9.893 0.000 9.037) 13.400 4.364 ( -0.940 0.000 -1.045) 1.406 4.394 ( -0.767 0.000 3.729) 3.807 4.598 ( -0.235 0.000 -9.170) 9.173 4.603 ( -17.408 0.000 0.762) 17.424 4.720 ( 2.945 0.000 2.226) 3.692 4.819 ( -11.881 0.000 -4.199) 12.601 4.915 ( 2.772 0.000 -3.418) 4.401 4.924 ( 6.080 0.000 -14.442) 15.670 5.005 ( 1.049 0.000 -7.266) 7.342 5.228 ( 6.619 0.000 -3.972) 7.719 5.271 ( -4.099 0.000 -1.342) 4.313 5.318 ( -8.514 0.000 3.076) 9.053 5.446 ( -3.300 0.000 -1.558) 3.649 5.480 ( -2.344 0.000 -3.390) 4.122 5.538 ( -5.662 0.000 0.110) 5.663 5.551 ( 4.790 0.000 -1.918) 5.160 5.652 ( 2.568 0.000 2.648) 3.688 5.802 ( 4.554 0.000 4.336) 6.288 6.103 ( 9.989 0.000 2.493) 10.295 6.129 ( -1.068 0.000 6.534) 6.620 6.171 ( 0.459 0.000 5.903) 5.921 6.308 ( -3.600 0.000 3.609) 5.098 6.432 ( 2.079 0.000 -2.484) 3.239 6.644 ( 1.589 0.000 -1.576) 2.238 6.731 ( 1.102 0.000 4.344) 4.482 6.937 ( -1.204 0.000 1.788) 2.155 6.956 ( 13.278 0.000 -29.649) 32.486 7.165 ( 0.805 0.000 -2.069) 2.220 7.526 ( -5.262 0.000 -9.561) 10.913 7.628 ( 1.548 0.000 -10.932) 11.041 7.804 ( 1.116 0.000 5.380) 5.494 7.878 ( 0.324 0.000 -0.097) 0.338 8.207 ( 0.039 0.000 3.461) 3.461 8.405 ( -14.436 0.000 29.881) 33.186 13.277 ( 0.008 0.000 0.019) 0.020 13.521 ( -0.316 0.000 -5.733) 5.742 13.636 ( 5.013 0.000 -3.999) 6.412 13.778 ( 0.221 0.000 0.181) 0.285 14.157 ( 1.004 0.000 0.360) 1.067 14.253 ( 1.211 0.000 -3.227) 3.447 14.262 ( -3.840 0.000 13.050) 13.603 14.317 ( -0.055 0.000 3.655) 3.656 16.422 ( 1.894 0.000 -0.207) 1.905 16.806 ( 0.256 0.000 -5.561) 5.567 16.972 ( 0.898 0.000 2.627) 2.776 17.158 ( -1.034 0.000 -1.149) 1.545 27.811 ( 0.144 0.000 -0.641) 0.657 28.040 ( 1.072 0.000 -0.011) 1.072 28.158 ( -0.644 0.000 -0.532) 0.835 28.249 ( 1.793 0.000 0.457) 1.850 28.761 ( 0.683 0.000 -2.543) 2.633 28.771 ( -1.333 0.000 0.141) 1.341 28.810 ( 0.605 0.000 0.916) 1.097 28.828 ( 1.030 0.000 -0.193) 1.048 28.993 ( -0.176 0.000 -0.147) 0.230 28.997 ( 0.123 0.000 0.434) 0.451 29.051 ( -0.673 0.000 1.537) 1.678 29.119 ( -0.248 0.000 -0.126) 0.278 31.171 ( 2.386 0.000 2.171) 3.226 31.554 ( -1.383 0.000 -2.245) 2.637 31.591 ( -1.892 0.000 5.234) 5.565 31.665 ( 0.736 0.000 8.191) 8.225 31.696 ( 5.094 0.000 -3.358) 6.101 32.093 ( 0.593 0.000 -0.544) 0.805 33.179 ( -5.491 0.000 4.888) 7.351 33.434 ( -5.730 0.000 4.278) 7.150 70.060 ( 0.432 0.000 -0.261) 0.505 70.192 ( 0.511 0.000 0.783) 0.935 70.319 ( 1.614 0.000 -3.936) 4.254 70.334 ( 0.745 0.000 0.009) 0.745 ======================= Grid point 2 (3/112) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.890 ( 31.118 0.000 -8.238) 32.189 0.977 ( 23.050 0.000 10.613) 25.376 1.818 ( 28.127 0.000 32.786) 43.197 2.056 ( 20.262 0.000 12.751) 23.940 2.429 ( 2.365 0.000 -9.801) 10.083 2.733 ( -0.761 0.000 -7.451) 7.489 2.794 ( -0.310 0.000 13.402) 13.406 3.300 ( -9.363 0.000 5.997) 11.118 3.304 ( 1.596 0.000 2.285) 2.787 3.393 ( -0.077 0.000 -7.870) 7.871 3.466 ( 9.600 0.000 -3.717) 10.294 3.521 ( -4.232 0.000 -7.665) 8.755 3.652 ( -9.187 0.000 2.876) 9.626 3.867 ( -5.546 0.000 6.355) 8.434 4.266 ( -16.582 0.000 3.321) 16.912 4.329 ( -5.938 0.000 -2.487) 6.438 4.355 ( -2.793 0.000 0.970) 2.957 4.469 ( -1.958 0.000 -12.322) 12.476 4.500 ( -13.569 0.000 -9.773) 16.722 4.753 ( -1.340 0.000 2.167) 2.548 4.907 ( -0.090 0.000 -1.758) 1.761 4.943 ( -1.864 0.000 1.342) 2.297 5.011 ( 8.067 0.000 -9.749) 12.654 5.120 ( -12.435 0.000 1.934) 12.584 5.145 ( -7.501 0.000 -1.188) 7.594 5.316 ( 6.830 0.000 -9.934) 12.056 5.363 ( -6.510 0.000 4.658) 8.004 5.424 ( -1.767 0.000 -0.429) 1.818 5.516 ( 1.907 0.000 -0.608) 2.002 5.640 ( 5.746 0.000 -3.253) 6.603 5.724 ( 3.163 0.000 2.227) 3.868 5.874 ( -1.050 0.000 3.973) 4.109 6.139 ( -0.230 0.000 -2.375) 2.386 6.151 ( -5.598 0.000 1.516) 5.800 6.288 ( -4.969 0.000 10.828) 11.913 6.325 ( 10.423 0.000 5.481) 11.776 6.463 ( 4.230 0.000 -5.543) 6.973 6.643 ( 2.189 0.000 -7.673) 7.979 6.821 ( 1.742 0.000 7.411) 7.613 6.928 ( 1.321 0.000 -7.301) 7.420 6.944 ( -0.085 0.000 4.282) 4.283 7.162 ( 2.070 0.000 -4.546) 4.995 7.367 ( -3.896 0.000 -6.786) 7.825 7.547 ( -1.902 0.000 -5.725) 6.033 7.849 ( 1.040 0.000 2.096) 2.340 7.902 ( 2.613 0.000 0.011) 2.613 8.222 ( -2.171 0.000 3.139) 3.817 8.407 ( -4.336 0.000 10.163) 11.049 13.283 ( 0.812 0.000 0.140) 0.824 13.469 ( -0.708 0.000 -4.009) 4.071 13.690 ( 3.967 0.000 -2.383) 4.628 13.797 ( 1.472 0.000 0.929) 1.741 14.184 ( 1.397 0.000 0.681) 1.554 14.249 ( 1.350 0.000 -3.188) 3.462 14.320 ( 0.069 0.000 7.651) 7.651 14.341 ( -0.818 0.000 3.172) 3.276 16.471 ( 3.506 0.000 0.032) 3.507 16.759 ( -0.329 0.000 -4.664) 4.675 17.011 ( 0.716 0.000 2.847) 2.935 17.117 ( -1.886 0.000 -2.060) 2.793 27.811 ( 0.696 0.000 -0.815) 1.072 28.062 ( 1.591 0.000 -1.176) 1.978 28.143 ( -0.634 0.000 0.453) 0.779 28.295 ( 2.476 0.000 0.597) 2.547 28.752 ( 0.372 0.000 -1.736) 1.775 28.755 ( -0.538 0.000 0.247) 0.592 28.830 ( 0.645 0.000 0.972) 1.166 28.836 ( 0.079 0.000 -0.379) 0.387 28.986 ( -0.327 0.000 -0.282) 0.432 29.004 ( 0.127 0.000 0.687) 0.699 29.052 ( -0.164 0.000 0.485) 0.512 29.112 ( -0.322 0.000 -0.227) 0.394 31.253 ( 3.715 0.000 3.188) 4.895 31.476 ( -3.164 0.000 -5.441) 6.294 31.615 ( -0.818 0.000 5.654) 5.713 31.778 ( 5.188 0.000 5.626) 7.653 31.782 ( 7.630 0.000 -5.326) 9.305 32.107 ( 1.260 0.000 -0.230) 1.281 33.095 ( -5.550 0.000 -0.958) 5.632 33.349 ( -8.658 0.000 7.328) 11.343 70.068 ( 0.747 0.000 -0.349) 0.824 70.214 ( 0.709 0.000 1.523) 1.680 70.313 ( 1.051 0.000 -2.970) 3.150 70.353 ( 1.277 0.000 0.061) 1.278 ======================= Grid point 3 (4/112) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.394 ( 29.813 0.000 -3.820) 30.057 1.495 ( 24.306 0.000 9.605) 26.135 2.386 ( 17.527 0.000 6.807) 18.803 2.417 ( 2.880 0.000 -3.992) 4.923 2.638 ( 19.316 0.000 21.500) 28.903 2.702 ( 4.862 0.000 -2.021) 5.266 2.889 ( 0.753 0.000 6.795) 6.837 3.137 ( -13.514 0.000 8.592) 16.014 3.279 ( -2.699 0.000 -11.099) 11.422 3.280 ( -7.454 0.000 0.695) 7.486 3.392 ( -9.592 0.000 2.571) 9.931 3.413 ( -4.571 0.000 -4.967) 6.750 3.662 ( 3.326 0.000 -4.351) 5.477 3.801 ( -5.744 0.000 4.878) 7.536 4.056 ( -8.253 0.000 -3.779) 9.077 4.094 ( -10.496 0.000 7.178) 12.716 4.304 ( -1.347 0.000 -10.613) 10.698 4.341 ( -1.300 0.000 -3.368) 3.610 4.425 ( 7.762 0.000 -3.916) 8.694 4.751 ( -0.474 0.000 1.938) 1.995 4.874 ( -5.354 0.000 -8.027) 9.649 4.903 ( -10.265 0.000 8.787) 13.513 4.904 ( -4.140 0.000 3.034) 5.133 4.973 ( -6.200 0.000 -1.931) 6.494 5.068 ( 2.850 0.000 -7.264) 7.803 5.290 ( -5.959 0.000 4.345) 7.375 5.313 ( 2.442 0.000 -10.662) 10.938 5.397 ( 0.090 0.000 -2.535) 2.536 5.552 ( -0.111 0.000 3.666) 3.667 5.661 ( -3.950 0.000 0.727) 4.016 5.799 ( 1.473 0.000 4.153) 4.406 5.851 ( 0.108 0.000 -1.861) 1.864 6.038 ( -6.139 0.000 -1.309) 6.277 6.104 ( -1.877 0.000 -1.436) 2.364 6.295 ( -4.891 0.000 9.200) 10.420 6.446 ( 1.389 0.000 -2.351) 2.731 6.577 ( 0.703 0.000 -12.177) 12.197 6.578 ( 9.608 0.000 0.916) 9.651 6.884 ( 0.746 0.000 3.852) 3.924 6.899 ( -1.619 0.000 2.482) 2.964 7.011 ( 1.168 0.000 6.807) 6.906 7.160 ( 2.140 0.000 -4.806) 5.261 7.286 ( 0.119 0.000 -3.425) 3.427 7.486 ( 0.367 0.000 -4.724) 4.738 7.897 ( 2.556 0.000 1.434) 2.930 7.972 ( 4.248 0.000 1.316) 4.447 8.175 ( -4.401 0.000 0.149) 4.403 8.420 ( -1.061 0.000 3.736) 3.883 13.315 ( 2.375 0.000 0.676) 2.469 13.428 ( -0.574 0.000 -2.964) 3.019 13.737 ( 3.175 0.000 -1.871) 3.685 13.847 ( 2.625 0.000 1.854) 3.214 14.219 ( 1.743 0.000 0.782) 1.910 14.244 ( 0.877 0.000 -2.797) 2.931 14.335 ( -2.164 0.000 1.466) 2.614 14.385 ( 0.750 0.000 5.196) 5.249 16.547 ( 4.392 0.000 0.765) 4.458 16.717 ( -0.298 0.000 -3.676) 3.688 17.043 ( 0.349 0.000 2.296) 2.322 17.057 ( -2.465 0.000 -2.581) 3.569 27.822 ( 1.184 0.000 -0.624) 1.338 28.071 ( 1.463 0.000 -2.979) 3.319 28.150 ( -0.238 0.000 2.590) 2.601 28.342 ( 2.099 0.000 0.497) 2.157 28.746 ( 0.397 0.000 -1.261) 1.322 28.757 ( 0.338 0.000 0.384) 0.511 28.825 ( -0.685 0.000 -0.507) 0.852 28.847 ( 0.326 0.000 0.662) 0.738 28.976 ( -0.392 0.000 -0.363) 0.534 29.013 ( 0.065 0.000 0.743) 0.746 29.053 ( -0.011 0.000 0.020) 0.023 29.104 ( -0.252 0.000 -0.261) 0.362 31.349 ( 3.899 0.000 2.711) 4.749 31.362 ( -3.312 0.000 -6.654) 7.433 31.652 ( -0.802 0.000 5.794) 5.849 31.852 ( 5.333 0.000 -6.627) 8.506 31.946 ( 7.819 0.000 5.800) 9.736 32.130 ( 1.299 0.000 0.029) 1.299 32.965 ( -6.429 0.000 -3.977) 7.560 33.270 ( -7.060 0.000 8.422) 10.990 70.080 ( 0.829 0.000 -0.271) 0.872 70.241 ( 0.375 0.000 2.103) 2.137 70.308 ( 1.204 0.000 -2.905) 3.145 70.378 ( 1.387 0.000 0.142) 1.395 ======================= Grid point 4 (5/112) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.875 ( 24.600 0.000 -0.747) 24.611 2.007 ( 23.160 0.000 8.468) 24.659 2.454 ( 3.331 0.000 -1.274) 3.566 2.619 ( 10.814 0.000 -10.472) 15.054 2.744 ( -3.272 0.000 1.326) 3.531 2.913 ( -1.038 0.000 -3.603) 3.750 2.918 ( -1.237 0.000 9.867) 9.945 2.967 ( -9.195 0.000 2.137) 9.440 3.154 ( -6.422 0.000 1.271) 6.547 3.206 ( -0.788 0.000 3.355) 3.446 3.209 ( -12.615 0.000 -3.854) 13.190 3.372 ( -5.342 0.000 -1.164) 5.467 3.570 ( 3.080 0.000 8.739) 9.266 3.779 ( -1.305 0.000 3.525) 3.759 4.039 ( 5.229 0.000 0.426) 5.246 4.152 ( 3.769 0.000 11.136) 11.757 4.177 ( -2.482 0.000 -9.753) 10.063 4.308 ( -1.998 0.000 2.325) 3.065 4.572 ( 10.615 0.000 -5.220) 11.829 4.614 ( -9.698 0.000 -9.492) 13.570 4.772 ( 1.229 0.000 1.427) 1.883 4.843 ( -4.980 0.000 3.143) 5.889 4.867 ( -5.274 0.000 5.676) 7.748 4.891 ( -2.017 0.000 1.798) 2.702 5.036 ( 0.714 0.000 -7.889) 7.921 5.215 ( -6.839 0.000 4.652) 8.271 5.228 ( -2.296 0.000 -7.569) 7.910 5.375 ( 0.312 0.000 -4.402) 4.413 5.533 ( -7.868 0.000 -0.192) 7.871 5.581 ( -0.089 0.000 4.527) 4.528 5.830 ( -2.972 0.000 5.352) 6.122 5.872 ( 1.314 0.000 -0.023) 1.314 5.928 ( -3.213 0.000 -3.108) 4.470 6.018 ( -4.485 0.000 -4.998) 6.715 6.253 ( -3.247 0.000 0.505) 3.286 6.448 ( 1.708 0.000 -2.759) 3.246 6.519 ( 0.691 0.000 -3.493) 3.561 6.691 ( 2.990 0.000 -0.114) 2.992 6.890 ( -3.650 0.000 2.634) 4.501 6.910 ( -0.208 0.000 2.896) 2.903 7.132 ( 6.391 0.000 5.043) 8.141 7.156 ( 1.190 0.000 -3.103) 3.324 7.307 ( 3.669 0.000 -0.896) 3.777 7.471 ( 1.418 0.000 -3.272) 3.566 7.939 ( -0.498 0.000 0.470) 0.685 8.067 ( 4.165 0.000 2.227) 4.723 8.095 ( -2.268 0.000 -1.177) 2.555 8.427 ( -0.333 0.000 0.681) 0.758 13.375 ( 3.024 0.000 1.111) 3.221 13.398 ( -0.361 0.000 -1.862) 1.897 13.771 ( 2.080 0.000 -1.243) 2.423 13.916 ( 2.717 0.000 2.210) 3.502 14.233 ( 0.311 0.000 -2.088) 2.111 14.258 ( 1.730 0.000 0.618) 1.837 14.293 ( -2.811 0.000 -0.247) 2.821 14.431 ( 0.283 0.000 3.075) 3.088 16.636 ( 4.192 0.000 1.475) 4.444 16.687 ( -0.177 0.000 -2.372) 2.378 16.987 ( -2.667 0.000 -2.586) 3.715 17.064 ( 0.097 0.000 1.457) 1.460 27.840 ( 1.122 0.000 -0.336) 1.172 28.070 ( 1.294 0.000 -2.617) 2.920 28.169 ( -0.269 0.000 2.596) 2.610 28.375 ( 1.156 0.000 0.264) 1.186 28.744 ( 0.401 0.000 -0.798) 0.894 28.770 ( 0.575 0.000 0.331) 0.664 28.809 ( -0.596 0.000 -0.307) 0.671 28.853 ( -0.013 0.000 0.305) 0.306 28.967 ( -0.304 0.000 -0.307) 0.432 29.019 ( 0.017 0.000 0.620) 0.620 29.052 ( 0.007 0.000 -0.195) 0.195 29.099 ( -0.151 0.000 -0.212) 0.260 31.255 ( -2.414 0.000 -5.371) 5.888 31.433 ( 3.175 0.000 1.449) 3.490 31.681 ( -1.004 0.000 4.587) 4.695 31.858 ( 1.500 0.000 -5.571) 5.769 32.152 ( 8.868 0.000 6.436) 10.958 32.153 ( 1.142 0.000 -0.041) 1.143 32.798 ( -7.269 0.000 -5.775) 9.284 33.243 ( -3.333 0.000 6.676) 7.462 70.092 ( 0.641 0.000 -0.146) 0.657 70.260 ( -0.211 0.000 1.867) 1.878 70.309 ( 1.345 0.000 -2.283) 2.650 70.402 ( 1.030 0.000 0.160) 1.043 ======================= Grid point 5 (6/112) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.249 ( 17.109 0.000 -0.098) 17.110 2.460 ( 18.789 0.000 6.524) 19.890 2.503 ( 2.850 0.000 -0.506) 2.895 2.535 ( -13.971 0.000 0.263) 13.973 2.688 ( 4.093 0.000 -5.511) 6.865 2.778 ( -7.555 0.000 -4.306) 8.696 2.863 ( -7.500 0.000 -1.991) 7.760 2.971 ( -6.476 0.000 -0.158) 6.478 3.022 ( -1.030 0.000 7.383) 7.455 3.094 ( 1.565 0.000 -1.431) 2.120 3.166 ( -4.895 0.000 -6.157) 7.866 3.263 ( 1.527 0.000 3.167) 3.516 3.788 ( -0.228 0.000 1.100) 1.123 3.836 ( 7.569 0.000 11.968) 14.160 4.047 ( -5.346 0.000 -3.614) 6.453 4.066 ( -2.170 0.000 -3.900) 4.463 4.309 ( -1.191 0.000 4.881) 5.025 4.320 ( 3.771 0.000 0.515) 3.806 4.500 ( 5.299 0.000 1.985) 5.658 4.666 ( 3.367 0.000 -2.847) 4.409 4.762 ( -7.847 0.000 -3.031) 8.412 4.807 ( 2.053 0.000 -2.313) 3.093 4.825 ( 0.661 0.000 1.438) 1.583 4.909 ( -0.353 0.000 4.850) 4.862 4.973 ( -0.479 0.000 -4.305) 4.332 5.129 ( -5.205 0.000 2.338) 5.706 5.156 ( -0.489 0.000 -1.156) 1.255 5.319 ( -2.547 0.000 -2.277) 3.416 5.440 ( -1.542 0.000 -0.732) 1.707 5.632 ( 1.824 0.000 2.607) 3.182 5.780 ( -3.887 0.000 0.505) 3.919 5.828 ( -4.094 0.000 -0.672) 4.149 5.886 ( -0.380 0.000 -0.431) 0.574 5.950 ( 1.291 0.000 -3.075) 3.334 6.219 ( -0.597 0.000 -0.369) 0.702 6.460 ( 1.097 0.000 -0.953) 1.454 6.516 ( 0.090 0.000 -0.023) 0.093 6.715 ( 0.307 0.000 -0.255) 0.399 6.842 ( -1.996 0.000 0.538) 2.068 6.929 ( 0.166 0.000 1.027) 1.040 7.152 ( 0.378 0.000 -1.054) 1.120 7.251 ( 2.152 0.000 2.233) 3.101 7.383 ( 3.792 0.000 0.135) 3.795 7.471 ( 0.598 0.000 -1.139) 1.287 7.880 ( -3.129 0.000 -1.122) 3.324 8.092 ( 0.815 0.000 0.153) 0.829 8.143 ( 1.900 0.000 1.281) 2.292 8.422 ( -0.256 0.000 -0.269) 0.372 13.383 ( -0.125 0.000 -0.638) 0.650 13.427 ( 1.436 0.000 0.586) 1.551 13.790 ( 0.726 0.000 -0.436) 0.846 13.971 ( 1.320 0.000 1.181) 1.771 14.224 ( 0.388 0.000 -0.805) 0.894 14.243 ( -1.855 0.000 -0.574) 1.942 14.286 ( 0.794 0.000 0.234) 0.828 14.449 ( -0.040 0.000 1.018) 1.019 16.671 ( -0.057 0.000 -0.821) 0.823 16.711 ( 2.220 0.000 1.099) 2.477 16.926 ( -1.648 0.000 -1.455) 2.198 17.073 ( 0.009 0.000 0.497) 0.497 27.853 ( 0.460 0.000 -0.099) 0.471 28.072 ( 0.587 0.000 -1.025) 1.181 28.181 ( -0.192 0.000 1.078) 1.095 28.389 ( 0.302 0.000 0.058) 0.308 28.745 ( 0.190 0.000 -0.278) 0.336 28.779 ( 0.205 0.000 0.077) 0.219 28.801 ( -0.117 0.000 -0.013) 0.118 28.854 ( -0.073 0.000 0.073) 0.104 28.961 ( -0.110 0.000 -0.119) 0.162 29.023 ( 0.002 0.000 0.262) 0.262 29.051 ( -0.001 0.000 -0.128) 0.128 29.096 ( -0.051 0.000 -0.084) 0.098 31.191 ( -0.887 0.000 -2.062) 2.245 31.483 ( 1.311 0.000 0.363) 1.360 31.694 ( -0.540 0.000 1.806) 1.885 31.832 ( -0.029 0.000 -2.131) 2.132 32.168 ( 0.536 0.000 -0.045) 0.538 32.365 ( 7.940 0.000 6.186) 10.065 32.610 ( -7.271 0.000 -6.026) 9.443 33.249 ( -0.814 0.000 2.495) 2.624 70.099 ( 0.241 0.000 -0.043) 0.245 70.266 ( -0.173 0.000 0.624) 0.648 70.314 ( 0.588 0.000 -0.754) 0.956 70.416 ( 0.373 0.000 0.070) 0.380 ======================= Grid point 11 (7/112) ======================= q-point: ( 0.00 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.517 ( 0.000 24.815 0.000) 24.815 0.606 ( 0.000 29.184 0.000) 29.184 0.927 ( 0.000 43.379 0.000) 43.379 1.592 ( 0.000 10.842 0.000) 10.842 2.465 ( 0.000 -7.625 0.000) 7.625 2.656 ( 0.000 5.067 0.000) 5.067 3.010 ( 0.000 -7.018 0.000) 7.018 3.032 ( 0.000 5.072 0.000) 5.072 3.133 ( 0.000 -7.446 0.000) 7.446 3.304 ( 0.000 0.448 0.000) 0.448 3.556 ( 0.000 1.265 0.000) 1.265 3.722 ( 0.000 -4.759 0.000) 4.759 3.971 ( 0.000 -1.448 0.000) 1.448 4.171 ( 0.000 1.329 0.000) 1.329 4.265 ( 0.000 -5.289 0.000) 5.289 4.311 ( 0.000 3.013 0.000) 3.013 4.526 ( 0.000 -3.627 0.000) 3.627 4.745 ( 0.000 -3.570 0.000) 3.570 4.798 ( 0.000 4.552 0.000) 4.552 4.848 ( 0.000 -0.424 0.000) 0.424 4.971 ( 0.000 4.678 0.000) 4.678 5.026 ( 0.000 -1.656 0.000) 1.656 5.046 ( 0.000 -0.307 0.000) 0.307 5.112 ( 0.000 9.960 0.000) 9.960 5.275 ( 0.000 -6.073 0.000) 6.073 5.349 ( 0.000 1.464 0.000) 1.464 5.466 ( 0.000 4.814 0.000) 4.814 5.546 ( 0.000 -2.987 0.000) 2.987 5.579 ( 0.000 -0.878 0.000) 0.878 5.623 ( 0.000 -1.065 0.000) 1.065 5.687 ( 0.000 2.387 0.000) 2.387 5.804 ( 0.000 4.040 0.000) 4.040 5.862 ( 0.000 5.720 0.000) 5.720 5.933 ( 0.000 -3.676 0.000) 3.676 6.082 ( 0.000 -1.025 0.000) 1.025 6.144 ( 0.000 0.207 0.000) 0.207 6.461 ( 0.000 3.152 0.000) 3.152 6.550 ( 0.000 0.822 0.000) 0.822 6.624 ( 0.000 -0.872 0.000) 0.872 6.939 ( 0.000 -0.345 0.000) 0.345 7.143 ( 0.000 -1.030 0.000) 1.030 7.277 ( 0.000 2.754 0.000) 2.754 7.481 ( 0.000 -2.012 0.000) 2.012 7.658 ( 0.000 -3.906 0.000) 3.906 7.732 ( 0.000 -0.813 0.000) 0.813 7.856 ( 0.000 -2.210 0.000) 2.210 8.171 ( 0.000 -1.289 0.000) 1.289 8.396 ( 0.000 -2.594 0.000) 2.594 13.380 ( 0.000 0.959 0.000) 0.959 13.505 ( 0.000 -0.178 0.000) 0.178 13.584 ( 0.000 1.020 0.000) 1.020 13.768 ( 0.000 -0.872 0.000) 0.872 14.142 ( 0.000 -1.596 0.000) 1.596 14.148 ( 0.000 0.218 0.000) 0.218 14.278 ( 0.000 -1.377 0.000) 1.377 14.287 ( 0.000 -0.933 0.000) 0.933 16.497 ( 0.000 2.443 0.000) 2.443 16.922 ( 0.000 -2.395 0.000) 2.395 17.189 ( 0.000 1.430 0.000) 1.430 17.255 ( 0.000 0.732 0.000) 0.732 28.033 ( 0.000 0.296 0.000) 0.296 28.118 ( 0.000 -0.320 0.000) 0.320 28.228 ( 0.000 -0.101 0.000) 0.101 28.291 ( 0.000 -0.498 0.000) 0.498 28.742 ( 0.000 0.153 0.000) 0.153 28.792 ( 0.000 0.104 0.000) 0.104 28.796 ( 0.000 -0.278 0.000) 0.278 28.816 ( 0.000 -0.225 0.000) 0.225 28.992 ( 0.000 -0.028 0.000) 0.028 29.025 ( 0.000 -0.998 0.000) 0.998 29.025 ( 0.000 1.373 0.000) 1.373 29.131 ( 0.000 0.605 0.000) 0.605 31.139 ( 0.000 -0.042 0.000) 0.042 31.306 ( 0.000 -6.141 0.000) 6.141 31.585 ( 0.000 -0.633 0.000) 0.633 31.649 ( 0.000 -0.668 0.000) 0.668 31.801 ( 0.000 9.689 0.000) 9.689 32.117 ( 0.000 2.777 0.000) 2.777 32.228 ( 0.000 -1.293 0.000) 1.293 33.385 ( 0.000 -8.564 0.000) 8.564 70.187 ( 0.000 0.278 0.000) 0.278 70.210 ( 0.000 0.200 0.000) 0.200 70.327 ( 0.000 0.064 0.000) 0.064 70.353 ( 0.000 -0.154 0.000) 0.154 ======================= Grid point 12 (8/112) ======================= q-point: ( 0.09 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.711 ( 13.748 22.153 0.676) 26.081 0.815 ( 19.691 22.132 -0.082) 29.624 1.267 ( 22.057 28.378 26.624) 44.728 1.749 ( 12.252 9.283 8.484) 17.557 2.452 ( 4.355 -4.542 -11.875) 13.439 2.686 ( -3.518 0.895 11.827) 12.372 2.844 ( -5.686 0.875 -0.229) 5.758 3.148 ( 2.075 -7.647 -0.621) 7.948 3.227 ( 9.025 -0.452 3.619) 9.734 3.333 ( 5.901 -0.407 -6.741) 8.968 3.492 ( -7.760 -1.349 2.595) 8.293 3.720 ( -1.121 -2.209 -0.162) 2.482 3.825 ( -7.126 7.639 -3.466) 11.007 4.034 ( -10.753 2.622 4.025) 11.777 4.269 ( -3.928 -1.616 1.663) 4.561 4.337 ( 1.937 -6.908 -1.106) 7.259 4.557 ( -7.470 -1.283 -2.670) 8.036 4.600 ( -4.870 -0.631 -2.508) 5.514 4.727 ( -2.697 -0.684 0.430) 2.815 4.872 ( -9.614 4.493 5.342) 11.881 4.951 ( 0.617 1.122 -8.707) 8.800 4.978 ( 2.523 6.261 -6.499) 9.370 5.022 ( 0.717 1.123 -5.426) 5.587 5.167 ( 5.900 -3.053 -0.976) 6.714 5.232 ( -2.932 -4.777 -2.768) 6.252 5.311 ( -7.770 -1.178 2.900) 8.377 5.429 ( -5.417 -0.602 -2.236) 5.891 5.468 ( 0.057 2.700 -5.790) 6.389 5.550 ( -1.609 1.421 -0.214) 2.158 5.594 ( -2.100 2.657 1.279) 3.621 5.681 ( 6.414 1.435 -3.768) 7.576 5.843 ( 2.958 2.403 2.105) 4.354 6.009 ( 3.485 -7.647 1.514) 8.539 6.087 ( 3.721 -3.877 9.805) 11.181 6.172 ( 6.603 0.821 -1.844) 6.905 6.209 ( 5.904 -3.745 2.028) 7.280 6.471 ( 2.542 3.407 -2.023) 4.708 6.588 ( 5.099 -1.343 -2.345) 5.770 6.658 ( 1.216 0.213 4.553) 4.717 6.932 ( -1.458 -0.419 1.566) 2.180 7.098 ( -1.534 3.208 -4.761) 5.942 7.211 ( 0.352 4.191 -5.525) 6.944 7.472 ( -2.078 -3.041 -4.349) 5.699 7.604 ( -0.881 -2.737 -6.693) 7.285 7.743 ( -2.529 -2.454 6.276) 7.197 7.905 ( 2.459 -1.041 2.595) 3.723 8.185 ( 0.026 -1.817 2.613) 3.183 8.378 ( -7.066 -2.572 12.679) 14.741 13.324 ( -2.166 2.847 -1.010) 3.717 13.503 ( -0.241 -1.102 -3.013) 3.217 13.633 ( 4.732 0.292 -2.025) 5.156 13.774 ( 0.453 -0.542 0.416) 0.820 14.151 ( 0.724 -0.878 0.371) 1.197 14.187 ( 1.459 -1.876 3.748) 4.438 14.281 ( 0.278 -0.761 0.593) 1.004 14.302 ( -0.020 -1.378 2.780) 3.103 16.462 ( -1.882 2.817 -0.366) 3.408 16.870 ( -3.456 -1.242 -3.391) 4.998 17.118 ( -3.831 10.166 -2.764) 11.210 17.183 ( -0.439 2.144 -1.126) 2.461 27.985 ( -7.058 8.252 -5.585) 12.211 28.045 ( 0.525 0.550 1.117) 1.351 28.170 ( -1.646 1.323 -2.109) 2.985 28.251 ( 1.683 0.098 0.281) 1.709 28.750 ( 0.463 -0.567 -1.191) 1.398 28.777 ( -1.031 0.228 -0.284) 1.094 28.806 ( 0.636 -0.299 0.634) 0.946 28.825 ( 0.841 -0.257 -0.139) 0.891 28.983 ( -0.172 -0.157 -0.032) 0.235 29.022 ( 0.087 1.460 -0.237) 1.481 29.041 ( -0.445 -0.789 1.852) 2.062 29.129 ( -0.241 0.699 -0.082) 0.743 31.171 ( 2.541 -0.025 1.952) 3.205 31.490 ( 3.857 -10.809 10.913) 15.837 31.579 ( -0.784 -0.053 1.432) 1.633 31.667 ( -0.223 4.881 -1.369) 5.074 31.698 ( 2.493 1.362 -5.110) 5.847 32.126 ( 1.560 3.168 -0.668) 3.594 32.700 ( 18.033 -21.948 8.975) 29.790 33.362 ( -4.612 -8.114 4.997) 10.587 70.139 ( -3.511 3.608 -1.398) 5.225 70.195 ( 0.272 0.237 1.093) 1.151 70.333 ( 0.703 0.141 -1.000) 1.230 70.336 ( 0.788 0.813 -2.266) 2.534 ======================= Grid point 13 (9/112) ======================= q-point: ( 0.18 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.027 ( 20.128 14.179 0.830) 24.634 1.214 ( 23.564 18.035 1.764) 29.726 1.951 ( 22.400 11.197 24.192) 34.819 2.142 ( 20.941 8.765 14.711) 27.051 2.430 ( 4.612 -0.284 -10.573) 11.538 2.691 ( -0.877 -1.814 1.181) 2.335 2.840 ( -0.645 3.032 9.441) 9.936 3.176 ( -0.758 -6.797 2.135) 7.165 3.282 ( -8.299 -7.441 -1.342) 11.227 3.368 ( 2.397 2.414 1.851) 3.873 3.493 ( 9.390 1.093 -1.335) 9.547 3.620 ( -3.511 5.308 -9.525) 11.456 3.732 ( -5.751 7.763 1.295) 9.747 3.882 ( -9.693 -0.431 4.712) 10.787 4.224 ( -3.980 0.050 3.679) 5.420 4.262 ( -11.297 -3.956 -2.191) 12.169 4.362 ( -0.430 -4.416 -5.486) 7.055 4.455 ( -4.503 -0.694 -8.778) 9.890 4.556 ( -19.173 6.573 -3.998) 20.659 4.738 ( -1.369 -0.875 2.569) 3.039 4.931 ( -0.257 0.421 -1.729) 1.798 4.964 ( -2.874 1.118 0.215) 3.091 5.025 ( -1.928 -0.297 -2.362) 3.063 5.112 ( -5.311 -0.133 -2.503) 5.873 5.156 ( -1.499 -0.312 -3.594) 3.907 5.250 ( -1.681 -3.897 -0.336) 4.257 5.347 ( -3.763 0.760 -0.665) 3.896 5.406 ( 1.257 -2.040 -1.025) 2.606 5.519 ( -1.702 1.076 0.061) 2.015 5.638 ( 4.659 1.139 -5.837) 7.555 5.771 ( 4.756 0.444 -0.826) 4.847 5.879 ( -1.333 1.136 3.417) 3.840 6.045 ( 0.387 -7.026 -1.190) 7.136 6.158 ( -2.223 0.349 -1.647) 2.789 6.225 ( 1.673 -3.999 7.531) 8.690 6.332 ( 4.902 -1.325 3.846) 6.370 6.502 ( 3.410 3.089 -4.624) 6.523 6.647 ( 5.027 -0.167 -8.728) 10.073 6.743 ( 1.910 -1.168 8.182) 8.483 6.920 ( -1.226 -0.193 1.940) 2.303 7.066 ( -1.091 6.220 2.513) 6.796 7.184 ( 0.673 1.963 -4.600) 5.046 7.367 ( -3.976 0.055 -3.962) 5.613 7.535 ( -0.867 -1.536 -5.256) 5.544 7.757 ( 0.872 -4.376 2.440) 5.086 7.964 ( 1.691 1.314 2.328) 3.163 8.198 ( -1.241 -1.980 2.025) 3.092 8.374 ( -3.100 -3.013 7.564) 8.713 13.301 ( -0.006 1.553 -0.250) 1.573 13.463 ( -0.760 -0.535 -3.267) 3.397 13.695 ( 4.080 0.506 -2.086) 4.610 13.797 ( 1.587 -0.077 0.911) 1.831 14.174 ( 1.393 -0.898 0.396) 1.704 14.235 ( 1.812 -0.843 -0.412) 2.041 14.308 ( 0.386 -1.403 3.797) 4.066 14.323 ( -0.165 -1.477 2.893) 3.252 16.456 ( 1.328 -0.013 -0.124) 1.334 16.784 ( -2.470 -0.721 -3.288) 4.175 17.079 ( -0.853 6.679 -0.072) 6.734 17.163 ( -0.582 3.567 -1.306) 3.843 27.883 ( -1.437 5.657 -2.465) 6.335 28.070 ( 1.293 0.789 0.316) 1.547 28.140 ( -0.576 -0.153 -0.790) 0.990 28.292 ( 2.237 -0.322 0.484) 2.311 28.745 ( 0.268 -0.367 -0.999) 1.098 28.760 ( -0.421 0.281 -0.273) 0.575 28.823 ( 0.481 -0.617 0.319) 0.845 28.834 ( 0.167 -0.249 0.142) 0.332 28.982 ( -0.063 -0.101 0.070) 0.138 29.022 ( 0.005 1.329 0.062) 1.330 29.046 ( -0.211 -0.512 0.906) 1.061 29.121 ( -0.392 0.686 -0.324) 0.854 31.254 ( 3.943 0.123 2.991) 4.950 31.486 ( -4.631 -0.474 -1.171) 4.800 31.637 ( 0.047 2.531 2.499) 3.557 31.686 ( 6.865 -5.022 -0.516) 8.521 31.785 ( 6.765 -1.389 -0.200) 6.909 32.162 ( 2.618 4.873 -0.031) 5.532 32.865 ( 0.212 -16.323 -0.549) 16.333 33.313 ( -6.965 -5.682 7.942) 11.994 70.097 ( -0.593 2.231 -0.788) 2.440 70.214 ( 0.429 -0.039 1.684) 1.738 70.323 ( 0.896 0.786 -2.906) 3.140 70.355 ( 1.366 0.195 0.129) 1.386 ======================= Grid point 14 (10/112) ======================= q-point: ( 0.27 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.437 ( 23.311 6.864 1.883) 24.374 1.680 ( 24.361 14.196 3.998) 28.477 2.348 ( 9.997 -1.605 1.005) 10.175 2.484 ( 10.293 4.941 -2.250) 11.637 2.631 ( 8.084 -2.520 5.197) 9.935 2.800 ( 11.691 9.378 13.590) 20.232 2.920 ( 1.099 2.945 7.144) 7.805 3.113 ( -9.917 -2.640 12.404) 16.099 3.151 ( -3.113 -4.494 -3.618) 6.555 3.383 ( -1.031 4.204 -2.410) 4.955 3.427 ( -7.177 6.969 -6.977) 12.196 3.561 ( -10.540 7.966 -1.568) 13.304 3.682 ( 6.091 1.165 -2.263) 6.601 3.793 ( -3.159 0.268 5.508) 6.355 4.021 ( -9.934 -2.329 -3.506) 10.789 4.150 ( -13.019 3.705 2.300) 13.730 4.255 ( -0.992 -3.259 -1.196) 3.610 4.325 ( -0.908 -0.819 -9.507) 9.586 4.417 ( 6.834 -0.906 -2.051) 7.192 4.734 ( -2.293 -1.316 4.207) 4.969 4.847 ( -9.571 -2.500 -2.988) 10.333 4.892 ( -3.090 -0.448 -1.948) 3.680 4.922 ( -5.154 -0.109 4.572) 6.890 4.991 ( -6.878 0.645 0.080) 6.909 5.126 ( 1.640 4.826 -7.974) 9.464 5.191 ( -4.909 -5.630 2.298) 7.815 5.327 ( 2.042 -0.231 -4.472) 4.922 5.415 ( -0.035 1.012 -2.621) 2.810 5.490 ( -3.459 -5.733 4.231) 7.920 5.613 ( -1.622 -1.631 -4.121) 4.720 5.829 ( 1.240 -1.471 0.411) 1.967 5.870 ( -1.611 3.073 0.966) 3.602 6.000 ( -1.522 -2.292 -4.353) 5.149 6.102 ( -3.151 -0.525 -0.294) 3.208 6.288 ( -1.846 -1.467 8.899) 9.206 6.466 ( 5.068 -2.617 2.716) 6.318 6.522 ( 3.995 0.431 -6.562) 7.695 6.609 ( 0.967 2.008 -9.542) 9.799 6.836 ( 0.086 -1.818 7.484) 7.702 6.919 ( -0.464 1.864 0.978) 2.156 7.089 ( -0.281 4.725 5.244) 7.064 7.150 ( 0.267 -0.669 -3.935) 4.000 7.297 ( -0.692 0.996 -1.491) 1.922 7.496 ( 1.093 0.358 -4.122) 4.279 7.825 ( 4.378 -4.185 1.456) 6.229 8.006 ( 0.197 0.475 2.477) 2.530 8.176 ( -1.116 0.353 -0.633) 1.331 8.389 ( -0.533 -2.840 2.992) 4.160 13.317 ( 1.633 0.263 0.378) 1.697 13.425 ( -0.632 -0.315 -2.578) 2.673 13.746 ( 3.304 0.820 -1.682) 3.797 13.848 ( 2.653 0.008 1.696) 3.148 14.204 ( 1.580 -1.040 -0.245) 1.907 14.252 ( 1.255 0.500 -1.149) 1.773 14.312 ( -1.675 -2.002 1.010) 2.799 14.374 ( 1.140 -1.097 4.416) 4.691 16.498 ( 3.062 -2.657 0.039) 4.054 16.723 ( -1.770 -1.587 -1.950) 3.075 17.058 ( -0.977 4.235 -1.347) 4.550 17.144 ( -0.781 5.012 -0.053) 5.072 27.862 ( 0.452 3.501 -1.267) 3.750 28.085 ( 1.214 1.363 -2.323) 2.954 28.141 ( -0.083 -0.793 2.315) 2.448 28.332 ( 1.686 -0.951 0.417) 1.980 28.744 ( 0.479 -0.143 -1.032) 1.147 28.759 ( 0.258 0.170 0.260) 0.404 28.819 ( -0.566 -0.589 -0.543) 0.981 28.842 ( 0.215 -0.429 0.630) 0.792 28.979 ( -0.164 0.319 -0.147) 0.387 29.023 ( 0.024 0.971 0.253) 1.004 29.050 ( -0.012 -0.274 0.427) 0.507 29.111 ( -0.379 0.490 -0.419) 0.748 31.353 ( 4.061 0.310 1.226) 4.253 31.381 ( -3.325 1.509 -4.205) 5.569 31.658 ( -1.026 0.889 4.638) 4.832 31.793 ( 5.514 -4.793 -3.319) 8.025 31.922 ( 7.430 -1.653 2.307) 7.954 32.214 ( 2.581 6.879 0.831) 7.394 32.802 ( -3.692 -12.974 -3.463) 13.926 33.253 ( -6.715 -3.337 7.569) 10.654 70.091 ( 0.374 1.054 -0.465) 1.211 70.236 ( 0.058 -0.578 1.931) 2.016 70.318 ( 1.217 0.957 -2.653) 3.072 70.383 ( 1.437 0.329 0.257) 1.497 ======================= Grid point 15 (11/112) ======================= q-point: ( 0.36 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.876 ( 22.424 2.265 2.152) 22.641 2.133 ( 20.457 10.142 5.438) 23.472 2.450 ( 4.702 -0.449 -0.959) 4.819 2.653 ( 8.621 -0.299 -7.946) 11.729 2.691 ( -2.791 -2.233 2.745) 4.506 2.872 ( -3.417 -1.042 0.310) 3.586 2.934 ( -1.468 2.531 -4.794) 5.616 3.055 ( -5.531 6.263 5.699) 10.114 3.181 ( -6.497 3.476 3.326) 8.085 3.280 ( -1.632 6.643 -0.748) 6.882 3.337 ( -10.094 8.562 1.877) 13.369 3.427 ( -1.394 6.528 -0.094) 6.675 3.619 ( -0.966 4.179 4.631) 6.312 3.836 ( -0.298 4.683 4.509) 6.508 3.956 ( 5.740 -6.671 -0.687) 8.827 4.130 ( 2.410 -2.211 4.427) 5.504 4.206 ( -2.405 1.580 2.294) 3.680 4.271 ( 0.016 -2.171 -1.666) 2.737 4.562 ( 9.112 -1.105 -4.405) 10.181 4.608 ( -7.778 -1.092 -9.035) 11.972 4.744 ( -3.427 -1.788 5.343) 6.595 4.819 ( -5.902 -2.889 5.317) 8.453 4.869 ( -0.525 -0.424 0.737) 0.999 4.917 ( -3.981 1.949 1.021) 4.549 5.063 ( 0.103 0.810 -8.883) 8.921 5.118 ( -5.600 -3.036 2.093) 6.705 5.284 ( -3.687 0.512 -1.693) 4.089 5.367 ( -0.854 -0.395 -4.262) 4.364 5.459 ( -3.475 -4.292 2.486) 6.056 5.575 ( -0.006 -1.044 0.231) 1.069 5.807 ( -3.253 -4.051 -1.450) 5.394 5.833 ( -1.564 0.129 -0.166) 1.578 5.974 ( 0.602 2.753 -1.456) 3.172 6.011 ( -5.105 -1.103 -2.467) 5.777 6.313 ( -2.589 3.620 5.196) 6.841 6.470 ( 0.732 -1.076 -7.409) 7.522 6.544 ( 2.594 5.467 -1.620) 6.265 6.630 ( 3.863 -6.718 0.360) 7.758 6.853 ( -2.816 -1.399 3.508) 4.711 6.914 ( -1.941 2.663 1.416) 3.587 7.100 ( 1.299 -1.955 -2.423) 3.374 7.189 ( 2.637 -0.994 3.375) 4.397 7.314 ( 3.015 1.914 0.090) 3.573 7.492 ( 1.367 1.073 -2.732) 3.238 7.914 ( 3.030 -2.611 0.833) 4.086 7.989 ( -2.577 -2.810 0.378) 3.831 8.185 ( 2.307 4.161 0.373) 4.773 8.399 ( -0.043 -2.530 0.305) 2.548 13.359 ( 2.143 -1.135 0.373) 2.454 13.399 ( -0.288 -0.242 -1.226) 1.282 13.785 ( 2.294 1.240 -1.023) 2.801 13.915 ( 2.658 -0.152 2.011) 3.337 14.218 ( 0.714 -0.958 -1.366) 1.815 14.271 ( 0.863 0.608 0.122) 1.062 14.277 ( -1.719 -1.041 -0.356) 2.041 14.422 ( 0.569 -0.886 2.857) 3.045 16.557 ( 3.168 -4.410 -0.094) 5.431 16.685 ( -1.366 -2.646 -0.436) 3.010 17.024 ( -0.995 4.406 -2.122) 4.990 17.133 ( -0.754 4.779 0.673) 4.884 27.867 ( 0.834 2.521 -0.610) 2.724 28.084 ( 1.149 1.320 -2.326) 2.911 28.163 ( -0.202 -0.643 2.631) 2.716 28.357 ( 0.760 -1.708 0.198) 1.880 28.744 ( 0.422 0.033 -0.722) 0.837 28.770 ( 0.574 0.065 0.341) 0.671 28.803 ( -0.524 -0.456 -0.370) 0.787 28.848 ( -0.018 -0.512 0.345) 0.617 28.974 ( -0.171 0.697 -0.235) 0.755 29.027 ( 0.041 0.683 0.313) 0.752 29.052 ( 0.046 -0.013 0.083) 0.095 29.101 ( -0.287 0.206 -0.330) 0.484 31.278 ( -2.244 2.127 -5.122) 5.983 31.444 ( 3.560 1.010 1.417) 3.963 31.675 ( -1.495 -0.464 4.172) 4.456 31.821 ( 1.724 -3.349 -4.408) 5.798 32.084 ( 6.999 -2.358 3.478) 8.163 32.269 ( 2.327 6.986 2.232) 7.694 32.693 ( -4.146 -9.151 -5.277) 11.348 33.212 ( -4.034 -3.529 5.812) 7.906 70.097 ( 0.491 0.532 -0.238) 0.762 70.247 ( -0.291 -1.183 1.291) 1.775 70.322 ( 1.234 1.256 -1.688) 2.439 70.408 ( 1.045 0.426 0.248) 1.156 ======================= Grid point 16 (12/112) ======================= q-point: ( 0.45 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.248 ( 16.372 0.277 1.058) 16.408 2.474 ( 5.602 -0.094 3.358) 6.532 2.519 ( -7.117 -1.245 0.305) 7.231 2.548 ( 8.497 5.456 0.732) 10.124 2.729 ( 0.437 -0.878 -1.435) 1.738 2.799 ( -6.574 2.878 -1.463) 7.324 2.831 ( -1.519 3.400 -6.851) 7.798 2.986 ( -4.731 3.468 0.345) 5.876 3.113 ( -3.098 5.977 3.814) 7.738 3.208 ( -2.488 4.780 -2.358) 5.882 3.264 ( -1.528 11.306 -3.380) 11.899 3.338 ( 0.703 7.671 3.304) 8.382 3.774 ( 2.644 0.010 4.400) 5.133 3.880 ( 2.036 2.483 5.405) 6.287 4.005 ( -1.807 -3.792 -2.093) 4.693 4.089 ( -2.100 1.120 -1.725) 2.940 4.271 ( -0.105 -2.702 2.204) 3.489 4.329 ( 1.737 1.022 1.403) 2.455 4.500 ( 6.048 -0.131 2.611) 6.588 4.651 ( 5.222 -1.974 -5.407) 7.772 4.705 ( -5.287 -4.871 3.953) 8.204 4.778 ( -6.631 -3.596 0.255) 7.547 4.806 ( -1.263 -0.946 -3.246) 3.609 4.933 ( 3.893 1.738 1.791) 4.624 5.005 ( -1.853 2.727 -2.286) 4.012 5.035 ( -3.205 -3.061 0.221) 4.437 5.235 ( -0.306 1.500 1.857) 2.406 5.303 ( -2.936 -0.379 -2.948) 4.178 5.424 ( -1.070 -0.657 0.100) 1.260 5.603 ( 1.711 -2.469 0.902) 3.137 5.733 ( -1.911 -3.249 -1.891) 4.217 5.823 ( -1.598 -1.663 3.759) 4.410 5.868 ( -3.458 -0.140 -5.333) 6.358 6.000 ( 0.866 2.681 -0.380) 2.843 6.295 ( -1.182 7.455 0.546) 7.568 6.452 ( 0.613 -5.624 -1.236) 5.790 6.573 ( 1.496 9.127 -0.500) 9.262 6.679 ( 0.763 -6.213 0.418) 6.273 6.826 ( -1.527 -4.648 0.970) 4.988 6.887 ( -1.042 4.298 0.011) 4.423 7.110 ( 0.889 -3.360 -0.776) 3.561 7.242 ( 0.870 -3.615 1.244) 3.921 7.381 ( 2.525 1.138 0.721) 2.862 7.493 ( 0.553 0.903 -1.026) 1.474 7.894 ( -2.090 1.186 -0.956) 2.587 8.001 ( 1.308 -4.829 0.638) 5.043 8.234 ( 1.549 4.664 0.869) 4.991 8.394 ( -0.211 -2.474 -0.484) 2.530 13.375 ( 0.153 -0.726 -0.606) 0.958 13.406 ( 0.774 -1.727 0.457) 1.947 13.809 ( 0.863 1.650 -0.316) 1.889 13.967 ( 1.240 -0.421 1.057) 1.683 14.217 ( 0.463 -0.590 -0.622) 0.974 14.234 ( -1.543 -0.733 -0.603) 1.812 14.296 ( 0.706 0.828 0.191) 1.105 14.443 ( 0.075 -0.652 0.970) 1.171 16.600 ( 1.562 -4.689 -0.394) 4.958 16.666 ( -0.727 -4.300 0.436) 4.383 16.995 ( -0.467 5.516 -1.031) 5.631 17.128 ( -0.311 4.159 0.335) 4.184 27.876 ( 0.386 2.139 -0.178) 2.181 28.086 ( 0.550 1.327 -0.924) 1.708 28.175 ( -0.199 -0.590 1.105) 1.269 28.366 ( 0.147 -2.225 0.029) 2.230 28.746 ( 0.193 0.100 -0.250) 0.331 28.781 ( 0.253 0.141 0.116) 0.312 28.796 ( -0.134 -0.479 -0.077) 0.503 28.849 ( -0.056 -0.463 0.108) 0.479 28.970 ( -0.067 0.876 -0.107) 0.885 29.029 ( 0.022 0.564 0.161) 0.587 29.053 ( 0.011 0.153 -0.051) 0.162 29.096 ( -0.106 -0.003 -0.112) 0.154 31.218 ( -0.818 2.525 -1.993) 3.319 31.501 ( 1.635 1.698 0.268) 2.372 31.677 ( -0.903 -1.622 1.681) 2.504 31.804 ( 0.060 -2.579 -1.749) 3.117 32.194 ( 2.380 1.872 0.849) 3.145 32.356 ( 3.754 -0.473 4.387) 5.794 32.566 ( -4.091 -3.609 -5.139) 7.495 33.202 ( -1.140 -4.521 2.244) 5.174 70.102 ( 0.207 0.345 -0.070) 0.408 70.250 ( -0.152 -1.458 0.386) 1.516 70.329 ( 0.502 1.359 -0.513) 1.537 70.423 ( 0.376 0.471 0.101) 0.611 ======================= Grid point 22 (13/112) ======================= q-point: ( 0.00 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.009 ( 0.000 22.973 0.000) 22.973 1.185 ( 0.000 26.773 0.000) 26.773 1.673 ( 0.000 22.791 0.000) 22.791 1.892 ( 0.000 17.842 0.000) 17.842 2.307 ( 0.000 -3.740 0.000) 3.740 2.798 ( 0.000 8.249 0.000) 8.249 2.885 ( 0.000 -4.740 0.000) 4.740 2.959 ( 0.000 -7.168 0.000) 7.168 3.125 ( 0.000 3.051 0.000) 3.051 3.292 ( 0.000 -1.368 0.000) 1.368 3.501 ( 0.000 -6.842 0.000) 6.842 3.597 ( 0.000 -8.857 0.000) 8.857 3.865 ( 0.000 -8.835 0.000) 8.835 4.112 ( 0.000 -9.795 0.000) 9.795 4.166 ( 0.000 7.095 0.000) 7.095 4.489 ( 0.000 -0.876 0.000) 0.876 4.573 ( 0.000 14.901 0.000) 14.901 4.674 ( 0.000 -2.828 0.000) 2.828 4.794 ( 0.000 -5.133 0.000) 5.133 4.840 ( 0.000 -0.207 0.000) 0.207 5.024 ( 0.000 3.658 0.000) 3.658 5.054 ( 0.000 0.260 0.000) 0.260 5.099 ( 0.000 6.975 0.000) 6.975 5.162 ( 0.000 -4.898 0.000) 4.898 5.274 ( 0.000 5.067 0.000) 5.067 5.424 ( 0.000 5.471 0.000) 5.471 5.463 ( 0.000 -4.952 0.000) 4.952 5.544 ( 0.000 0.541 0.000) 0.541 5.575 ( 0.000 -0.022 0.000) 0.022 5.611 ( 0.000 2.248 0.000) 2.248 5.771 ( 0.000 5.942 0.000) 5.942 5.773 ( 0.000 -8.892 0.000) 8.892 5.916 ( 0.000 6.324 0.000) 6.324 5.971 ( 0.000 0.869 0.000) 0.869 6.066 ( 0.000 -0.300 0.000) 0.300 6.132 ( 0.000 -0.745 0.000) 0.745 6.494 ( 0.000 -1.205 0.000) 1.205 6.594 ( 0.000 -2.141 0.000) 2.141 6.636 ( 0.000 7.876 0.000) 7.876 6.924 ( 0.000 -1.201 0.000) 1.201 7.150 ( 0.000 1.954 0.000) 1.954 7.332 ( 0.000 2.551 0.000) 2.551 7.427 ( 0.000 -3.189 0.000) 3.189 7.560 ( 0.000 -5.290 0.000) 5.290 7.691 ( 0.000 -2.780 0.000) 2.780 7.790 ( 0.000 -4.048 0.000) 4.048 8.154 ( 0.000 0.127 0.000) 0.127 8.327 ( 0.000 -3.934 0.000) 3.934 13.408 ( 0.000 1.679 0.000) 1.679 13.498 ( 0.000 -0.606 0.000) 0.606 13.613 ( 0.000 1.705 0.000) 1.705 13.741 ( 0.000 -1.804 0.000) 1.804 14.112 ( 0.000 -0.920 0.000) 0.920 14.153 ( 0.000 0.180 0.000) 0.180 14.241 ( 0.000 -2.012 0.000) 2.012 14.261 ( 0.000 -1.448 0.000) 1.448 16.567 ( 0.000 4.172 0.000) 4.172 16.855 ( 0.000 -3.983 0.000) 3.983 17.224 ( 0.000 1.853 0.000) 1.853 17.270 ( 0.000 0.564 0.000) 0.564 28.043 ( 0.000 0.707 0.000) 0.707 28.107 ( 0.000 -0.807 0.000) 0.807 28.229 ( 0.000 0.224 0.000) 0.224 28.277 ( 0.000 -0.857 0.000) 0.857 28.747 ( 0.000 0.377 0.000) 0.377 28.787 ( 0.000 -0.611 0.000) 0.611 28.795 ( 0.000 0.192 0.000) 0.192 28.811 ( 0.000 -0.294 0.000) 0.294 28.993 ( 0.000 0.066 0.000) 0.066 29.006 ( 0.000 -0.721 0.000) 0.721 29.060 ( 0.000 1.907 0.000) 1.907 29.138 ( 0.000 -0.030 0.000) 0.030 31.135 ( 0.000 -0.358 0.000) 0.358 31.197 ( 0.000 -4.132 0.000) 4.132 31.575 ( 0.000 -0.208 0.000) 0.208 31.630 ( 0.000 -1.164 0.000) 1.164 31.981 ( 0.000 6.527 0.000) 6.527 32.190 ( 0.000 -2.295 0.000) 2.295 32.237 ( 0.000 9.844 0.000) 9.844 33.145 ( 0.000 -14.156 0.000) 14.156 70.195 ( 0.000 0.429 0.000) 0.429 70.213 ( 0.000 0.050 0.000) 0.050 70.330 ( 0.000 0.216 0.000) 0.216 70.349 ( 0.000 -0.266 0.000) 0.266 ======================= Grid point 23 (14/112) ======================= q-point: ( 0.09 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.163 ( 10.465 20.944 4.345) 23.812 1.295 ( 12.941 24.136 -0.125) 27.386 1.832 ( 10.694 18.081 12.337) 24.361 2.013 ( 9.587 13.852 6.782) 18.160 2.344 ( 5.319 0.251 -1.410) 5.509 2.754 ( -4.693 4.684 -0.328) 6.639 2.856 ( -1.032 0.967 4.314) 4.540 2.990 ( 2.448 -6.443 0.216) 6.896 3.243 ( 7.023 1.516 3.879) 8.164 3.283 ( -0.480 -4.660 -5.126) 6.944 3.413 ( -4.952 -5.604 3.828) 8.401 3.651 ( 3.674 -6.137 -1.710) 7.354 3.840 ( -2.149 -7.301 -1.387) 7.736 4.057 ( -4.372 2.191 1.918) 5.252 4.189 ( 1.950 -2.085 -2.251) 3.636 4.386 ( -8.887 6.868 1.141) 11.290 4.550 ( -12.123 -0.610 0.681) 12.158 4.621 ( 0.255 4.004 -4.533) 6.054 4.698 ( -3.766 -1.702 -1.157) 4.292 4.845 ( 1.398 -4.546 0.388) 4.772 5.024 ( -1.494 -1.672 -3.695) 4.322 5.048 ( -12.241 6.533 2.339) 14.071 5.099 ( -2.237 2.076 0.527) 3.097 5.134 ( 2.842 0.073 0.295) 2.859 5.176 ( -0.905 1.897 -8.164) 8.431 5.287 ( -10.135 -1.369 3.407) 10.779 5.421 ( -6.254 -0.432 -2.767) 6.852 5.524 ( 3.704 1.305 -0.693) 3.988 5.597 ( 0.460 3.884 -1.389) 4.150 5.642 ( -3.504 1.793 -2.093) 4.458 5.760 ( 5.650 5.184 -9.955) 12.565 5.809 ( 6.250 -6.035 -1.601) 8.834 5.879 ( -3.678 -2.034 6.104) 7.411 6.055 ( 5.284 -0.615 2.156) 5.740 6.138 ( 5.064 -3.510 0.998) 6.242 6.188 ( 4.037 0.150 -2.263) 4.630 6.512 ( 2.112 0.459 0.514) 2.222 6.636 ( 4.704 1.959 -1.857) 5.423 6.681 ( 2.027 4.402 4.820) 6.835 6.916 ( -1.235 -1.199 0.987) 1.984 7.149 ( -0.538 2.962 2.011) 3.620 7.290 ( -1.373 3.402 -3.924) 5.372 7.419 ( -1.024 -2.570 -0.832) 2.889 7.525 ( -1.593 -4.437 -3.464) 5.851 7.696 ( -2.356 -2.330 4.756) 5.797 7.842 ( 2.877 -4.632 4.205) 6.886 8.155 ( -0.328 -0.584 1.068) 1.260 8.308 ( -3.374 -3.908 4.170) 6.636 13.376 ( -1.938 2.345 -1.188) 3.266 13.484 ( -0.837 -0.907 -1.504) 1.946 13.650 ( 3.745 1.204 -1.026) 4.065 13.754 ( 1.110 -1.452 0.554) 1.910 14.126 ( 0.946 -0.879 0.851) 1.547 14.175 ( 1.435 -0.062 1.915) 2.394 14.248 ( 0.878 -2.030 -0.233) 2.224 14.269 ( 0.363 -1.610 0.933) 1.896 16.534 ( -2.981 4.108 0.011) 5.076 16.811 ( -3.539 -3.815 -1.412) 5.392 17.229 ( 0.903 2.350 -0.928) 2.683 17.248 ( -1.017 3.091 -1.899) 3.768 28.048 ( 0.032 0.711 -0.777) 1.054 28.074 ( -2.774 0.940 0.306) 2.945 28.205 ( -2.017 1.628 -3.759) 4.566 28.252 ( 1.172 -0.065 -0.694) 1.363 28.745 ( 0.023 0.097 -0.589) 0.597 28.778 ( -0.834 -0.221 -0.019) 0.863 28.800 ( 0.546 -0.164 0.048) 0.572 28.818 ( 0.555 -0.384 0.083) 0.680 28.985 ( -0.173 0.298 -0.118) 0.364 29.020 ( 0.247 -0.844 1.095) 1.405 29.059 ( -0.203 1.878 0.235) 1.904 29.137 ( -0.141 -0.046 -0.051) 0.157 31.169 ( 2.776 -0.220 1.805) 3.318 31.296 ( 5.300 -7.145 6.532) 11.037 31.575 ( -0.410 0.104 1.563) 1.619 31.657 ( 2.686 -1.698 0.638) 3.241 31.862 ( -3.243 9.303 -7.902) 12.629 32.204 ( 4.620 2.799 -4.562) 7.070 32.451 ( 9.304 -3.727 8.530) 13.161 33.131 ( -3.189 -13.663 4.302) 14.675 70.184 ( -2.082 1.225 -0.830) 2.555 70.200 ( -0.189 0.225 1.240) 1.274 70.334 ( 0.709 0.126 -0.399) 0.823 70.346 ( 0.704 0.130 -1.723) 1.866 ======================= Grid point 24 (15/112) ======================= q-point: ( 0.18 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.393 ( 12.124 19.420 3.212) 23.118 1.614 ( 20.058 19.962 1.184) 28.323 2.159 ( 11.921 7.283 6.157) 15.266 2.287 ( 12.263 -3.300 6.202) 14.133 2.521 ( 11.964 14.523 2.061) 18.929 2.722 ( 1.364 4.722 8.626) 9.928 2.900 ( 0.175 3.639 7.053) 7.939 3.049 ( 2.603 -5.099 2.479) 6.239 3.129 ( -9.534 -6.736 2.695) 11.980 3.404 ( 4.553 0.865 0.188) 4.638 3.485 ( 10.350 -1.390 -0.386) 10.450 3.671 ( 1.764 -2.489 -5.383) 6.187 3.762 ( -5.177 -2.725 -1.451) 6.028 4.003 ( -6.691 9.141 3.233) 11.781 4.177 ( -0.841 -3.596 -4.421) 5.760 4.236 ( -5.441 0.167 -1.788) 5.730 4.323 ( -10.382 2.177 -0.509) 10.620 4.462 ( -6.747 2.862 -5.292) 9.040 4.715 ( -20.632 7.754 0.161) 22.041 4.727 ( -0.498 -0.407 2.086) 2.183 4.838 ( -0.207 -8.078 -3.118) 8.662 4.945 ( -5.319 -3.701 0.951) 6.550 5.008 ( -10.646 -0.193 0.074) 10.648 5.062 ( -4.789 -4.138 2.302) 6.735 5.188 ( 0.121 0.090 -6.277) 6.278 5.201 ( -0.742 1.682 1.381) 2.299 5.332 ( -2.081 -2.282 0.938) 3.228 5.500 ( -3.147 8.838 -3.901) 10.160 5.548 ( -3.544 0.070 -2.179) 4.161 5.617 ( 2.005 -0.805 -2.249) 3.119 5.769 ( 3.308 -0.492 -7.020) 7.776 5.896 ( 3.388 -1.415 -1.594) 4.003 5.913 ( 4.648 -2.498 0.627) 5.314 6.114 ( -1.390 -4.782 -1.085) 5.097 6.186 ( 2.641 -0.608 0.237) 2.721 6.269 ( 4.506 -4.245 0.615) 6.221 6.555 ( 2.309 2.738 -0.803) 3.671 6.697 ( 4.371 5.011 -5.193) 8.436 6.767 ( 1.537 1.637 6.980) 7.332 6.907 ( -0.657 -1.179 2.038) 2.444 7.174 ( -0.819 4.561 5.014) 6.828 7.234 ( -1.582 2.775 -3.591) 4.806 7.367 ( -4.192 -0.373 0.035) 4.208 7.475 ( 0.298 -4.039 -3.676) 5.470 7.702 ( 0.437 -0.977 2.863) 3.056 7.929 ( 1.625 -4.348 4.914) 6.759 8.163 ( 0.510 -0.969 0.404) 1.167 8.298 ( -1.385 -4.069 3.741) 5.698 13.339 ( -1.007 2.084 -0.741) 2.430 13.448 ( -1.057 -0.956 -2.221) 2.639 13.711 ( 4.008 1.019 -1.419) 4.372 13.789 ( 2.129 -0.805 0.777) 2.405 14.156 ( 1.590 -0.555 0.512) 1.761 14.225 ( 1.853 -0.251 1.599) 2.461 14.264 ( 0.521 -2.408 0.375) 2.492 14.292 ( 1.154 -1.552 1.741) 2.602 16.486 ( -1.729 2.737 -0.121) 3.240 16.728 ( -3.790 -3.831 -1.456) 5.583 17.209 ( -1.269 4.699 -1.979) 5.254 17.238 ( 0.531 3.378 -0.713) 3.493 27.988 ( -2.016 3.910 -3.062) 5.360 28.084 ( 0.231 0.125 3.233) 3.244 28.152 ( -0.397 1.718 -3.520) 3.937 28.279 ( 1.669 -0.982 -0.020) 1.937 28.741 ( 0.211 0.002 -0.658) 0.691 28.764 ( -0.428 0.030 -0.137) 0.451 28.810 ( 0.318 -0.564 -0.152) 0.665 28.826 ( 0.108 -0.496 0.280) 0.579 28.986 ( 0.129 0.464 0.219) 0.529 29.030 ( 0.266 -0.657 0.362) 0.795 29.057 ( -0.391 1.718 0.468) 1.823 29.130 ( -0.416 0.020 -0.362) 0.552 31.256 ( 4.311 0.039 2.741) 5.109 31.412 ( 0.701 -5.794 4.297) 7.248 31.609 ( 3.712 -0.846 0.698) 3.871 31.713 ( 1.185 -0.657 -0.725) 1.537 31.798 ( 3.878 6.620 -4.166) 8.731 32.270 ( 5.953 3.623 -2.739) 7.488 32.582 ( 0.283 -8.687 1.430) 8.809 33.121 ( -3.651 -12.040 7.636) 14.717 70.142 ( -1.475 1.973 -0.761) 2.578 70.210 ( -0.139 -0.397 1.426) 1.486 70.338 ( 0.988 0.624 -2.061) 2.369 70.359 ( 1.436 0.106 -0.071) 1.442 ======================= Grid point 25 (16/112) ======================= q-point: ( 0.27 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.671 ( 15.445 14.781 3.422) 21.650 2.011 ( 21.173 17.132 2.575) 27.357 2.327 ( 7.732 -0.943 -3.123) 8.392 2.526 ( 8.843 -3.274 -0.943) 9.477 2.624 ( 0.915 2.953 2.377) 3.900 2.850 ( -0.389 -3.413 6.578) 7.421 3.047 ( 0.296 3.677 1.630) 4.033 3.108 ( 1.131 -1.952 8.095) 8.404 3.168 ( 10.255 13.170 17.283) 24.027 3.447 ( 3.764 2.552 -4.183) 6.179 3.595 ( -4.257 7.267 -8.382) 11.882 3.654 ( -4.178 1.036 -2.435) 4.946 3.688 ( 7.259 -0.319 1.805) 7.487 3.843 ( -6.706 2.682 5.100) 8.842 4.032 ( -10.935 4.293 -5.920) 13.155 4.106 ( -5.769 -4.314 -5.101) 8.827 4.292 ( -0.488 2.449 -1.807) 3.082 4.352 ( -3.615 4.908 1.709) 6.330 4.410 ( -4.638 1.751 2.234) 5.437 4.696 ( -6.893 -2.966 2.050) 7.779 4.794 ( -3.538 -2.865 -2.163) 5.040 4.834 ( -4.731 -5.162 -2.011) 7.285 4.872 ( -4.576 -4.595 4.250) 7.754 4.976 ( -6.488 -1.896 0.020) 6.759 5.079 ( -5.704 -3.875 1.645) 7.089 5.205 ( -2.288 -1.173 -2.292) 3.444 5.311 ( -2.448 -2.348 2.155) 4.019 5.427 ( -2.558 3.628 -0.338) 4.452 5.460 ( -0.383 3.067 -6.424) 7.128 5.603 ( 0.870 1.329 -6.030) 6.236 5.771 ( -0.574 -3.342 -0.283) 3.402 5.904 ( 0.363 0.195 -6.142) 6.156 5.987 ( 2.624 0.572 0.931) 2.843 6.051 ( -2.973 -4.019 -2.350) 5.524 6.237 ( 0.497 -3.703 3.891) 5.394 6.339 ( 4.110 -7.061 -0.645) 8.196 6.581 ( 1.749 3.990 -2.880) 5.222 6.695 ( 1.423 5.852 -5.364) 8.065 6.838 ( -0.419 1.231 6.694) 6.819 6.946 ( 2.587 -0.497 2.248) 3.463 7.154 ( -3.524 1.753 -3.866) 5.517 7.171 ( -3.680 3.768 3.832) 6.514 7.318 ( -0.779 0.571 1.274) 1.598 7.473 ( 1.724 -2.865 -2.152) 3.977 7.769 ( 4.093 -0.919 1.874) 4.594 7.969 ( -1.164 -3.681 3.038) 4.913 8.187 ( 2.526 0.581 -0.480) 2.636 8.318 ( 0.882 -3.680 1.291) 3.999 13.329 ( 0.244 0.944 -0.183) 0.992 13.412 ( -0.908 -0.940 -1.856) 2.270 13.768 ( 3.500 1.294 -1.141) 3.902 13.843 ( 2.845 -0.546 1.233) 3.148 14.187 ( 1.526 -0.447 -0.257) 1.611 14.260 ( 0.579 -0.641 0.739) 1.136 14.267 ( 0.395 -1.180 -0.537) 1.355 14.343 ( 1.804 -1.720 3.034) 3.926 16.474 ( 0.422 0.361 -0.186) 0.586 16.656 ( -3.027 -4.125 -0.813) 5.181 17.168 ( -1.283 5.202 -1.897) 5.684 17.234 ( -0.551 3.396 -0.196) 3.446 27.946 ( -0.323 4.282 -1.932) 4.708 28.117 ( 0.138 -1.294 2.865) 3.147 28.126 ( 0.550 2.428 -2.330) 3.410 28.303 ( 0.763 -1.943 0.184) 2.096 28.742 ( 0.525 0.059 -0.633) 0.824 28.762 ( 0.159 0.066 0.147) 0.226 28.805 ( -0.339 -0.557 -0.542) 0.848 28.830 ( 0.022 -0.741 0.434) 0.859 28.990 ( 0.188 0.744 0.126) 0.778 29.038 ( 0.550 -0.262 -0.426) 0.744 29.054 ( -0.548 1.265 0.866) 1.628 29.117 ( -0.524 -0.002 -0.557) 0.764 31.358 ( 4.496 0.123 0.614) 4.540 31.404 ( -1.617 0.281 -0.446) 1.701 31.688 ( -0.906 0.118 3.651) 3.764 31.703 ( 3.487 -1.678 -2.858) 4.811 31.905 ( 7.887 0.974 -0.208) 7.949 32.366 ( 6.195 4.848 -1.151) 7.950 32.535 ( -3.951 -9.234 -1.288) 10.126 33.114 ( -4.204 -9.685 6.705) 12.508 70.120 ( -0.369 1.641 -0.559) 1.772 70.217 ( -0.401 -1.198 1.142) 1.703 70.343 ( 1.274 1.287 -1.659) 2.456 70.387 ( 1.494 0.038 0.274) 1.520 ======================= Grid point 26 (17/112) ======================= q-point: ( 0.36 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.995 ( 16.521 9.052 3.077) 19.088 2.366 ( 10.904 9.919 4.164) 15.318 2.440 ( 8.446 0.192 -1.565) 8.592 2.579 ( 0.911 -2.314 0.161) 2.492 2.645 ( 0.319 -4.428 1.406) 4.657 2.927 ( 5.580 4.664 -4.340) 8.469 3.024 ( -1.116 5.114 -4.136) 6.671 3.175 ( -1.924 4.328 4.927) 6.834 3.269 ( -7.177 4.581 6.177) 10.519 3.444 ( -6.874 7.366 -2.998) 10.512 3.486 ( -2.634 7.680 -2.628) 8.534 3.622 ( 6.897 6.060 4.221) 10.105 3.704 ( -9.605 4.757 -4.608) 11.667 3.832 ( 6.954 -1.712 0.002) 7.162 3.954 ( -1.335 5.674 4.335) 7.265 4.065 ( 2.912 -2.112 8.214) 8.967 4.208 ( 0.520 -0.132 -2.439) 2.497 4.290 ( -3.793 2.932 2.678) 5.491 4.533 ( 4.542 -1.740 -2.971) 5.699 4.550 ( -4.559 -4.252 -4.200) 7.517 4.703 ( -6.770 -6.134 6.942) 11.474 4.726 ( -7.785 -2.272 1.339) 8.219 4.855 ( 2.526 -0.983 0.124) 2.713 4.920 ( -1.940 -1.804 2.451) 3.609 5.012 ( -2.783 -3.413 -0.910) 4.497 5.096 ( -5.987 -3.726 -0.037) 7.051 5.275 ( -3.071 1.286 1.278) 3.566 5.377 ( -1.206 1.188 -4.362) 4.679 5.441 ( -0.135 2.332 -0.133) 2.339 5.569 ( 1.374 1.548 -5.311) 5.700 5.725 ( -3.262 -3.914 -1.261) 5.248 5.840 ( -1.143 0.959 -4.545) 4.784 5.951 ( -5.795 -4.929 -1.124) 7.690 6.031 ( 1.669 2.880 -0.598) 3.382 6.269 ( -0.403 -6.911 3.483) 7.750 6.411 ( 3.632 -10.691 -0.190) 11.293 6.548 ( -1.088 7.754 -4.330) 8.947 6.703 ( 3.203 6.745 -2.212) 7.787 6.869 ( -2.430 1.725 5.500) 6.255 7.002 ( 1.509 3.310 1.011) 3.776 7.069 ( -1.226 -0.016 -4.367) 4.536 7.135 ( -2.628 -1.043 2.637) 3.866 7.345 ( 1.678 -0.161 1.495) 2.253 7.482 ( 0.799 -2.413 -1.451) 2.926 7.859 ( 3.864 -1.879 1.158) 4.450 7.949 ( -2.113 -1.852 0.486) 2.851 8.243 ( 3.198 1.533 0.612) 3.599 8.340 ( 1.111 -2.691 -0.702) 2.995 13.341 ( 0.980 -0.456 -0.102) 1.086 13.385 ( -0.730 -1.006 -0.909) 1.540 13.817 ( 2.602 1.732 -0.531) 3.170 13.906 ( 2.596 -0.703 1.464) 3.062 14.203 ( 0.790 -0.422 -0.881) 1.256 14.244 ( -1.138 -1.558 -0.648) 2.035 14.293 ( 1.468 1.106 0.386) 1.878 14.395 ( 1.132 -1.674 2.291) 3.055 16.492 ( 1.535 -1.756 -0.241) 2.345 16.604 ( -2.254 -4.306 -0.150) 4.863 17.132 ( -0.937 5.245 -1.559) 5.552 17.218 ( -1.035 3.083 0.132) 3.254 27.936 ( 0.404 3.994 -1.000) 4.138 28.119 ( 1.181 1.410 -2.324) 2.964 28.145 ( -0.495 -0.639 3.135) 3.237 28.309 ( -0.145 -2.884 0.092) 2.889 28.747 ( 0.487 0.244 -0.484) 0.729 28.771 ( 0.478 -0.105 0.299) 0.573 28.794 ( -0.321 -0.279 -0.397) 0.581 28.833 ( -0.021 -0.911 0.313) 0.964 28.994 ( 0.136 1.131 -0.045) 1.140 29.042 ( 0.570 0.459 -0.810) 1.092 29.053 ( -0.441 0.399 1.024) 1.184 29.103 ( -0.491 -0.135 -0.502) 0.716 31.336 ( -1.154 3.299 -4.285) 5.529 31.464 ( 4.325 0.577 1.297) 4.552 31.670 ( -2.990 0.074 3.032) 4.258 31.740 ( 1.465 -3.899 -1.953) 4.600 32.057 ( 7.797 -0.059 1.985) 8.046 32.431 ( -3.514 5.396 1.759) 6.675 32.479 ( 4.409 -7.430 -4.336) 9.667 33.089 ( -3.670 -8.342 4.512) 10.169 70.115 ( 0.110 1.193 -0.317) 1.239 70.216 ( -0.406 -1.718 0.566) 1.854 70.354 ( 1.087 1.678 -0.871) 2.181 70.414 ( 1.069 0.023 0.289) 1.108 ======================= Grid point 27 (18/112) ======================= q-point: ( 0.45 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.281 ( 11.415 3.096 1.379) 11.907 2.440 ( -2.997 -1.567 1.864) 3.862 2.501 ( 0.090 -1.257 1.335) 1.836 2.639 ( -0.473 -4.320 -0.441) 4.368 2.731 ( 9.796 10.057 0.388) 14.045 2.924 ( -1.594 7.948 -5.007) 9.528 2.979 ( 0.952 8.158 -2.495) 8.584 3.086 ( -6.468 5.222 0.931) 8.365 3.227 ( -1.960 3.513 2.496) 4.735 3.294 ( -5.561 5.096 -2.393) 7.914 3.520 ( 4.966 11.043 -1.747) 12.233 3.552 ( -2.067 12.167 2.349) 12.563 3.791 ( 4.676 0.329 1.868) 5.046 3.884 ( -2.663 -2.216 -0.737) 3.542 3.942 ( 0.126 -0.311 1.702) 1.735 4.073 ( -3.014 -2.039 1.594) 3.973 4.243 ( 1.146 -0.436 -1.748) 2.135 4.362 ( -1.799 1.730 0.011) 2.496 4.460 ( 5.017 -4.763 6.884) 9.759 4.532 ( 0.317 -7.415 -5.065) 8.985 4.647 ( -2.428 -0.326 4.483) 5.109 4.699 ( -1.951 -3.385 4.345) 5.843 4.817 ( -5.149 1.898 -7.173) 9.031 4.948 ( 2.658 -0.398 1.756) 3.211 4.988 ( 0.140 -1.954 -0.824) 2.125 5.059 ( 0.756 0.915 2.573) 2.833 5.244 ( -1.678 0.970 3.840) 4.302 5.302 ( -2.449 0.120 -5.175) 5.726 5.429 ( -0.644 0.205 0.040) 0.678 5.570 ( 2.097 0.599 -2.552) 3.357 5.659 ( -2.560 -4.060 -0.417) 4.818 5.805 ( 0.448 0.660 -2.233) 2.371 5.840 ( -4.195 -2.960 -0.475) 5.156 6.050 ( 0.709 2.538 -0.226) 2.645 6.283 ( -0.343 -9.419 1.467) 9.538 6.454 ( 1.112 -12.361 0.032) 12.411 6.504 ( -0.574 10.758 -1.603) 10.892 6.759 ( 4.359 6.211 -1.220) 7.685 6.832 ( -4.912 4.581 2.307) 7.102 7.022 ( 0.429 8.173 0.043) 8.184 7.042 ( 0.622 -2.290 -1.776) 2.964 7.125 ( -0.712 -6.568 1.272) 6.728 7.382 ( 0.885 -2.041 0.704) 2.333 7.480 ( 0.166 -2.450 -0.665) 2.544 7.912 ( 1.033 -0.657 -0.801) 1.463 7.923 ( -0.455 -1.709 1.003) 2.033 8.300 ( 1.802 1.483 1.390) 2.716 8.341 ( -0.010 -1.915 -1.472) 2.415 13.356 ( 0.774 -1.047 -0.422) 1.369 13.371 ( -0.541 -1.485 0.139) 1.587 13.848 ( 1.021 2.053 -0.099) 2.295 13.952 ( 1.114 -1.002 0.747) 1.675 14.206 ( 0.422 -0.357 -0.377) 0.669 14.219 ( -0.860 -0.681 -0.572) 1.237 14.316 ( 0.639 1.207 0.225) 1.384 14.421 ( 0.318 -1.495 0.820) 1.734 16.518 ( 1.264 -3.007 -0.237) 3.270 16.571 ( -1.333 -4.309 0.168) 4.513 17.111 ( -0.339 5.254 -0.634) 5.303 17.204 ( -0.503 2.784 0.109) 2.831 27.938 ( 0.261 3.788 -0.305) 3.809 28.123 ( 0.724 2.047 -1.051) 2.413 28.155 ( -0.471 -1.413 1.441) 2.073 28.304 ( -0.223 -3.505 -0.010) 3.512 28.751 ( 0.212 0.370 -0.170) 0.459 28.781 ( 0.302 -0.390 0.194) 0.530 28.788 ( -0.144 0.048 -0.180) 0.236 28.835 ( -0.015 -0.903 0.129) 0.912 28.995 ( 0.049 1.415 -0.057) 1.417 29.045 ( 0.185 0.831 -0.270) 0.893 29.054 ( -0.102 -0.038 0.322) 0.340 29.093 ( -0.222 -0.315 -0.191) 0.430 31.292 ( -0.495 4.591 -1.807) 4.959 31.542 ( 3.467 1.717 -0.298) 3.880 31.633 ( -2.973 -2.367 1.511) 4.089 31.738 ( 0.006 -3.456 -0.543) 3.499 32.209 ( 6.380 -0.511 2.634) 6.921 32.343 ( -4.901 -2.437 -1.695) 5.730 32.529 ( 2.126 2.557 -1.052) 3.488 33.068 ( -1.415 -8.329 1.706) 8.619 70.115 ( 0.096 0.944 -0.100) 0.955 70.214 ( -0.160 -1.908 0.151) 1.920 70.363 ( 0.418 1.802 -0.253) 1.867 70.429 ( 0.382 0.020 0.118) 0.400 ======================= Grid point 33 (19/112) ======================= q-point: ( 0.00 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.449 ( 0.000 19.522 0.000) 19.522 1.675 ( 0.000 20.032 0.000) 20.032 1.777 ( 0.000 -10.003 0.000) 10.003 1.957 ( 0.000 -7.077 0.000) 7.077 2.569 ( 0.000 16.745 0.000) 16.745 2.781 ( 0.000 -6.148 0.000) 6.148 2.932 ( 0.000 6.171 0.000) 6.171 2.970 ( 0.000 6.040 0.000) 6.040 3.181 ( 0.000 3.118 0.000) 3.118 3.258 ( 0.000 -2.014 0.000) 2.014 3.339 ( 0.000 -6.299 0.000) 6.299 3.391 ( 0.000 -9.305 0.000) 9.305 3.717 ( 0.000 -2.637 0.000) 2.637 3.848 ( 0.000 -13.837 0.000) 13.837 4.392 ( 0.000 10.450 0.000) 10.450 4.479 ( 0.000 -0.388 0.000) 0.388 4.627 ( 0.000 0.428 0.000) 0.428 4.697 ( 0.000 -4.121 0.000) 4.121 4.845 ( 0.000 5.867 0.000) 5.867 4.867 ( 0.000 7.622 0.000) 7.622 4.976 ( 0.000 -8.336 0.000) 8.336 5.017 ( 0.000 -4.350 0.000) 4.350 5.191 ( 0.000 6.128 0.000) 6.128 5.222 ( 0.000 4.085 0.000) 4.085 5.326 ( 0.000 0.039 0.000) 0.039 5.360 ( 0.000 -4.322 0.000) 4.322 5.518 ( 0.000 1.124 0.000) 1.124 5.528 ( 0.000 2.780 0.000) 2.780 5.562 ( 0.000 -1.626 0.000) 1.626 5.609 ( 0.000 -6.179 0.000) 6.179 5.732 ( 0.000 7.999 0.000) 7.999 5.893 ( 0.000 -6.798 0.000) 6.798 5.903 ( 0.000 6.263 0.000) 6.263 6.015 ( 0.000 -4.519 0.000) 4.519 6.050 ( 0.000 6.333 0.000) 6.333 6.140 ( 0.000 -1.251 0.000) 1.251 6.476 ( 0.000 0.958 0.000) 0.958 6.534 ( 0.000 -3.557 0.000) 3.557 6.793 ( 0.000 6.305 0.000) 6.305 6.884 ( 0.000 -2.874 0.000) 2.874 7.225 ( 0.000 5.085 0.000) 5.085 7.340 ( 0.000 -5.455 0.000) 5.455 7.387 ( 0.000 3.009 0.000) 3.009 7.461 ( 0.000 -4.184 0.000) 4.184 7.653 ( 0.000 0.103 0.000) 0.103 7.702 ( 0.000 -4.013 0.000) 4.013 8.181 ( 0.000 2.397 0.000) 2.397 8.246 ( 0.000 -3.730 0.000) 3.730 13.445 ( 0.000 1.822 0.000) 1.822 13.478 ( 0.000 -1.308 0.000) 1.308 13.652 ( 0.000 2.100 0.000) 2.100 13.698 ( 0.000 -2.259 0.000) 2.259 14.114 ( 0.000 1.028 0.000) 1.028 14.143 ( 0.000 -1.347 0.000) 1.347 14.215 ( 0.000 -0.064 0.000) 0.064 14.231 ( 0.000 -1.337 0.000) 1.337 16.662 ( 0.000 4.942 0.000) 4.942 16.763 ( 0.000 -4.828 0.000) 4.828 17.258 ( 0.000 1.272 0.000) 1.272 17.274 ( 0.000 -0.273 0.000) 0.273 28.062 ( 0.000 1.107 0.000) 1.107 28.086 ( 0.000 -1.186 0.000) 1.186 28.239 ( 0.000 0.743 0.000) 0.743 28.257 ( 0.000 -0.978 0.000) 0.978 28.757 ( 0.000 0.642 0.000) 0.642 28.772 ( 0.000 -0.770 0.000) 0.770 28.800 ( 0.000 0.246 0.000) 0.246 28.805 ( 0.000 -0.276 0.000) 0.276 28.994 ( 0.000 0.054 0.000) 0.054 28.997 ( 0.000 -0.231 0.000) 0.231 29.099 ( 0.000 1.726 0.000) 1.726 29.127 ( 0.000 -0.992 0.000) 0.992 31.128 ( 0.000 -0.130 0.000) 0.130 31.140 ( 0.000 -1.514 0.000) 1.514 31.581 ( 0.000 0.796 0.000) 0.796 31.604 ( 0.000 -1.306 0.000) 1.306 32.074 ( 0.000 3.397 0.000) 3.397 32.137 ( 0.000 -2.846 0.000) 2.846 32.504 ( 0.000 15.125 0.000) 15.125 32.829 ( 0.000 -16.119 0.000) 16.119 70.204 ( 0.000 0.426 0.000) 0.426 70.211 ( 0.000 -0.254 0.000) 0.254 70.336 ( 0.000 0.333 0.000) 0.333 70.343 ( 0.000 -0.332 0.000) 0.332 ======================= Grid point 34 (20/112) ======================= q-point: ( 0.09 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.565 ( 8.858 18.093 4.256) 20.590 1.752 ( 8.750 18.526 0.196) 20.489 1.891 ( 7.729 -11.020 7.185) 15.258 2.019 ( 5.983 -5.443 2.532) 8.476 2.641 ( 5.216 13.853 4.693) 15.529 2.789 ( 0.222 -2.261 0.514) 2.329 2.930 ( -4.504 5.092 4.333) 8.062 2.973 ( 3.609 4.411 -0.137) 5.701 3.164 ( -5.362 -1.573 -4.025) 6.887 3.271 ( 6.775 -1.746 1.944) 7.262 3.333 ( 3.112 0.563 0.384) 3.185 3.475 ( 4.770 -10.162 0.765) 11.252 3.723 ( 0.179 -1.303 0.733) 1.506 3.857 ( 1.707 -13.114 -1.430) 13.302 4.385 ( -2.236 10.018 1.396) 10.359 4.470 ( -4.635 0.910 4.051) 6.222 4.527 ( -8.696 1.993 -2.468) 9.256 4.637 ( -2.932 -3.855 -1.168) 4.982 4.740 ( -7.905 5.526 -3.390) 10.223 4.859 ( -0.610 4.228 -0.609) 4.315 4.920 ( -4.073 -6.912 -4.050) 8.987 5.015 ( -0.822 -6.118 -1.461) 6.343 5.162 ( -8.129 2.624 -0.362) 8.550 5.176 ( -6.294 2.071 -2.053) 6.936 5.245 ( -4.430 2.698 1.927) 5.533 5.270 ( -7.795 -0.125 4.518) 9.010 5.428 ( -6.110 2.108 -1.028) 6.544 5.515 ( -5.068 -4.185 2.260) 6.950 5.623 ( 7.713 0.241 -5.100) 9.250 5.670 ( 7.395 -1.823 -3.749) 8.489 5.735 ( 0.129 5.130 -0.383) 5.146 5.848 ( -2.774 -3.293 1.646) 4.610 5.924 ( 3.541 7.933 -10.858) 13.906 6.037 ( 2.211 -1.675 -1.777) 3.294 6.070 ( 4.845 -1.026 0.423) 4.971 6.146 ( 0.540 -4.641 -1.466) 4.897 6.545 ( 5.020 3.150 2.915) 6.604 6.614 ( 5.680 -2.751 3.353) 7.147 6.804 ( 0.943 5.250 -0.114) 5.335 6.880 ( -0.586 -2.434 0.218) 2.513 7.231 ( -0.174 4.905 2.496) 5.506 7.334 ( -1.294 -3.735 1.210) 4.134 7.368 ( -1.091 2.350 -1.680) 3.088 7.442 ( -1.818 -3.738 -0.812) 4.235 7.671 ( 0.304 0.884 3.191) 3.325 7.738 ( 2.235 -4.899 3.093) 6.210 8.170 ( -1.257 1.985 0.854) 2.500 8.229 ( -2.158 -3.578 1.732) 4.523 13.422 ( -1.528 2.108 -1.186) 2.861 13.460 ( -1.210 -1.490 -1.236) 2.283 13.680 ( 2.775 1.713 -0.255) 3.271 13.718 ( 1.903 -1.916 0.314) 2.718 14.128 ( 1.044 1.077 0.968) 1.785 14.161 ( 1.108 -1.588 1.473) 2.433 14.222 ( 0.954 -0.013 -0.338) 1.012 14.239 ( 0.755 -1.291 0.109) 1.500 16.626 ( -3.490 4.743 0.004) 5.889 16.723 ( -3.689 -4.616 -0.503) 5.930 17.268 ( 1.251 1.318 -0.872) 2.016 17.279 ( 0.895 0.292 -1.060) 1.417 28.062 ( -0.398 0.739 0.583) 1.022 28.076 ( -1.226 -0.478 0.679) 1.481 28.231 ( -0.180 0.927 -2.700) 2.861 28.246 ( 0.666 -0.527 -1.826) 2.014 28.753 ( -0.269 0.591 -0.351) 0.738 28.767 ( -0.447 -0.727 -0.134) 0.864 28.802 ( 0.272 0.296 -0.003) 0.402 28.810 ( 0.329 -0.407 0.140) 0.542 28.993 ( 0.048 0.504 0.193) 0.542 29.005 ( 0.238 -0.648 0.712) 0.992 29.097 ( -0.151 1.716 -0.004) 1.722 29.126 ( -0.126 -1.018 -0.075) 1.028 31.168 ( 3.116 0.370 2.215) 3.841 31.197 ( 3.885 -2.802 3.614) 6.001 31.589 ( 0.416 1.199 1.248) 1.780 31.621 ( 1.417 -1.781 1.021) 2.494 32.034 ( 0.130 7.344 -6.795) 10.006 32.165 ( 4.976 -5.281 -6.280) 9.596 32.552 ( 1.025 11.325 6.638) 13.167 32.831 ( -1.551 -14.860 4.301) 15.548 70.200 ( -1.046 0.406 0.011) 1.122 70.203 ( -0.605 0.019 0.799) 1.003 70.339 ( 0.714 0.279 -0.659) 1.011 70.344 ( 0.751 -0.245 -1.045) 1.310 ======================= Grid point 35 (21/112) ======================= q-point: ( 0.18 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.772 ( 10.096 16.866 2.987) 19.883 1.989 ( 15.433 11.842 0.486) 19.459 2.099 ( 9.642 -7.275 4.139) 12.768 2.240 ( 12.818 -3.542 6.183) 14.665 2.721 ( -2.802 3.939 -0.179) 4.838 2.774 ( -3.172 -1.098 0.671) 3.423 2.949 ( 0.068 0.260 10.488) 10.491 3.002 ( -0.941 -4.094 8.381) 9.375 3.197 ( 11.724 17.462 1.719) 21.103 3.405 ( 8.206 -1.811 -5.904) 10.270 3.463 ( 9.255 0.504 3.799) 10.017 3.563 ( 5.799 -6.838 -1.808) 9.147 3.730 ( -0.437 1.163 1.197) 1.726 3.888 ( 3.335 -12.634 -2.016) 13.222 4.227 ( -13.040 3.850 -3.563) 14.056 4.305 ( -12.009 -2.925 -4.037) 13.003 4.431 ( -2.602 13.946 2.694) 14.440 4.578 ( -8.244 6.828 1.282) 10.781 4.636 ( 1.207 -5.746 1.068) 5.967 4.775 ( -9.586 -5.827 3.302) 11.694 4.823 ( -2.052 0.655 -5.408) 5.821 4.869 ( -17.122 3.733 -0.213) 17.525 4.959 ( -6.982 -4.308 0.045) 8.205 4.991 ( -10.507 -2.891 -0.631) 10.916 5.174 ( -5.508 0.091 -0.388) 5.523 5.201 ( -5.623 -2.290 2.530) 6.578 5.343 ( -1.981 3.678 -0.361) 4.193 5.446 ( -2.635 -6.023 -1.490) 6.741 5.670 ( 1.827 5.012 -6.987) 8.791 5.694 ( 0.339 4.251 -3.396) 5.451 5.761 ( 0.650 1.138 0.208) 1.327 5.847 ( 2.978 -3.464 0.545) 4.600 5.928 ( 5.981 3.570 -8.799) 11.223 6.036 ( 2.652 -3.436 -7.910) 9.023 6.139 ( 1.326 -2.138 0.448) 2.556 6.176 ( 2.918 -4.282 0.207) 5.186 6.647 ( 2.750 5.705 2.572) 6.836 6.747 ( 4.579 -2.812 3.914) 6.648 6.812 ( 0.642 3.989 -1.483) 4.303 6.874 ( -0.017 -2.019 0.505) 2.082 7.261 ( -0.542 3.963 4.313) 5.882 7.297 ( -2.659 2.996 -1.197) 4.181 7.340 ( -2.513 -1.967 1.677) 3.605 7.387 ( -1.653 -4.221 -1.705) 4.843 7.720 ( 1.997 2.926 3.259) 4.813 7.816 ( 2.211 -5.824 4.316) 7.579 8.168 ( 0.612 1.468 0.611) 1.704 8.219 ( -0.214 -3.371 1.638) 3.754 13.383 ( -1.451 2.110 -1.118) 2.794 13.422 ( -1.402 -1.615 -1.562) 2.648 13.736 ( 3.587 1.371 -0.551) 3.879 13.765 ( 2.906 -1.404 0.273) 3.239 14.161 ( 1.517 1.138 0.870) 2.087 14.199 ( 1.170 -2.229 1.538) 2.950 14.243 ( 1.645 0.474 -0.108) 1.716 14.262 ( 1.566 -1.250 0.715) 2.128 16.557 ( -3.519 3.978 -0.160) 5.314 16.643 ( -4.153 -4.280 -0.592) 5.993 17.272 ( 0.053 1.781 -1.419) 2.277 17.283 ( 0.479 0.795 -1.018) 1.378 28.044 ( -0.963 1.844 -0.940) 2.283 28.073 ( -0.440 -1.051 1.549) 1.923 28.202 ( -0.020 2.679 -2.519) 3.678 28.250 ( 0.878 -1.875 -1.062) 2.327 28.746 ( -0.003 0.504 -0.359) 0.619 28.758 ( -0.233 -0.579 -0.142) 0.640 28.806 ( 0.098 0.211 -0.177) 0.293 28.815 ( 0.032 -0.552 0.093) 0.561 28.999 ( 0.273 0.771 0.377) 0.901 29.015 ( 0.315 -0.792 0.533) 1.005 29.093 ( -0.343 1.632 -0.076) 1.670 29.120 ( -0.363 -0.974 -0.301) 1.082 31.263 ( 4.466 0.962 2.919) 5.421 31.308 ( 4.012 -3.681 3.720) 6.594 31.623 ( 2.145 1.731 1.187) 3.001 31.669 ( 2.403 -2.534 1.193) 3.690 31.986 ( 1.836 10.228 -7.373) 12.742 32.193 ( 4.723 -9.242 -7.816) 12.993 32.613 ( -0.754 9.372 6.122) 11.220 32.855 ( -1.242 -13.125 6.646) 14.764 70.176 ( -1.314 1.355 -0.110) 1.891 70.198 ( -0.771 -0.824 0.706) 1.331 70.349 ( 1.278 0.465 -1.095) 1.746 70.357 ( 1.418 -0.253 -0.493) 1.523 ======================= Grid point 36 (22/112) ======================= q-point: ( 0.27 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.990 ( 11.439 15.030 2.556) 19.060 2.230 ( 11.795 -5.998 -2.087) 13.396 2.361 ( 13.962 10.518 1.568) 17.550 2.464 ( 6.233 -1.922 1.296) 6.650 2.626 ( -7.646 0.832 2.932) 8.231 2.768 ( 4.207 -7.601 10.034) 13.273 3.062 ( 3.387 0.731 3.351) 4.820 3.090 ( 2.048 -0.176 4.892) 5.306 3.437 ( 6.934 8.307 -0.109) 10.821 3.494 ( 8.899 1.186 -6.932) 11.342 3.662 ( 5.868 0.604 0.733) 5.944 3.682 ( 5.293 -0.355 1.689) 5.567 3.718 ( 0.467 7.071 1.753) 7.300 3.869 ( -5.205 -2.138 2.362) 6.103 3.994 ( -6.726 -0.233 -7.125) 9.801 4.103 ( -1.613 -5.182 -2.441) 5.951 4.401 ( -2.301 10.152 4.229) 11.236 4.456 ( -9.200 6.329 2.269) 11.395 4.528 ( -15.955 5.420 3.445) 17.199 4.588 ( -8.396 -6.645 0.015) 10.707 4.701 ( -4.144 -4.881 5.813) 8.648 4.729 ( -8.586 -6.229 -5.432) 11.918 4.811 ( -0.192 1.170 0.349) 1.236 4.898 ( -2.358 -5.609 -0.661) 6.120 5.043 ( -8.476 0.308 1.878) 8.687 5.096 ( -8.207 -5.236 2.917) 10.162 5.334 ( 0.523 2.979 -0.312) 3.041 5.405 ( 0.705 -3.381 -4.161) 5.408 5.606 ( -2.200 6.273 -4.440) 7.994 5.661 ( -0.575 1.433 -3.803) 4.104 5.746 ( -1.929 3.059 -1.237) 3.822 5.877 ( -1.415 -7.119 -0.163) 7.260 5.942 ( 3.052 3.665 -7.441) 8.838 6.054 ( 5.382 -1.571 -5.095) 7.576 6.134 ( -2.031 -2.231 0.643) 3.085 6.208 ( 1.747 -5.637 -2.158) 6.284 6.700 ( 1.255 6.954 2.380) 7.456 6.804 ( 0.480 2.801 -0.407) 2.871 6.832 ( 1.344 -1.704 1.959) 2.923 6.893 ( 1.551 -3.473 0.093) 3.805 7.222 ( -2.909 4.331 -1.991) 5.584 7.268 ( -3.010 5.532 2.821) 6.901 7.300 ( -1.579 -2.525 1.053) 3.159 7.384 ( 0.493 -5.415 0.446) 5.455 7.790 ( 2.744 2.906 2.439) 4.682 7.875 ( 0.770 -4.892 3.000) 5.790 8.205 ( 3.100 1.407 -0.112) 3.406 8.249 ( 2.409 -2.840 0.182) 3.729 13.355 ( -0.781 1.514 -0.710) 1.846 13.387 ( -1.116 -1.488 -1.233) 2.232 13.797 ( 3.488 1.440 -0.349) 3.790 13.825 ( 3.210 -1.225 0.506) 3.472 14.190 ( 1.177 0.810 -0.063) 1.430 14.219 ( 0.387 -1.856 -0.044) 1.897 14.280 ( 1.937 1.090 0.748) 2.345 14.308 ( 2.064 -1.623 1.773) 3.169 16.506 ( -1.873 2.566 -0.230) 3.185 16.573 ( -3.049 -3.798 -0.402) 4.887 17.250 ( -1.019 2.636 -1.319) 3.118 17.274 ( -0.699 0.378 -0.707) 1.064 28.025 ( -0.093 3.236 -1.086) 3.415 28.080 ( 0.217 -2.214 0.611) 2.308 28.188 ( -0.176 3.280 -0.566) 3.333 28.253 ( -0.055 -2.875 -0.150) 2.879 28.747 ( 0.406 0.432 -0.263) 0.649 28.758 ( 0.210 -0.471 -0.003) 0.516 28.802 ( -0.186 0.289 -0.314) 0.465 28.814 ( -0.115 -0.754 0.073) 0.766 29.008 ( 0.414 0.921 0.265) 1.044 29.026 ( 0.499 -0.756 0.211) 0.931 29.084 ( -0.505 1.437 -0.119) 1.528 29.108 ( -0.534 -0.866 -0.485) 1.127 31.364 ( 4.326 0.679 0.982) 4.488 31.388 ( 2.507 -1.455 1.338) 3.193 31.672 ( 1.651 0.715 0.705) 1.932 31.700 ( -0.556 -1.282 0.950) 1.690 32.000 ( 5.509 8.204 -3.856) 10.608 32.211 ( 4.193 -11.663 -5.717) 13.649 32.639 ( -1.057 11.186 4.282) 12.024 32.883 ( -1.722 -12.141 5.445) 13.417 70.155 ( -0.748 1.715 -0.246) 1.887 70.188 ( -0.709 -1.525 0.349) 1.717 70.367 ( 1.417 1.002 -0.691) 1.868 70.382 ( 1.500 -0.518 -0.040) 1.587 ======================= Grid point 37 (23/112) ======================= q-point: ( 0.36 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.219 ( 10.799 11.780 2.335) 16.150 2.400 ( 7.417 -2.530 -0.547) 7.856 2.448 ( -0.070 -1.165 0.181) 1.181 2.485 ( -2.952 -7.430 2.430) 8.356 2.758 ( 13.082 13.600 4.690) 19.444 2.973 ( 7.875 -3.716 1.503) 8.837 3.094 ( 0.016 2.614 -1.555) 3.042 3.165 ( 3.192 -3.995 3.785) 6.362 3.393 ( -8.297 7.096 -1.360) 11.002 3.505 ( -10.304 -2.538 -2.440) 10.889 3.613 ( 5.509 4.030 -6.088) 9.147 3.656 ( 4.809 1.281 -6.293) 8.023 3.796 ( -2.106 3.257 -1.604) 4.197 3.847 ( 2.670 -0.577 -0.066) 2.733 4.079 ( -2.154 6.513 2.668) 7.361 4.129 ( 8.816 4.787 11.400) 15.185 4.236 ( -8.841 3.359 -2.528) 9.789 4.319 ( -11.258 -2.283 2.076) 11.673 4.470 ( -5.129 -0.846 0.085) 5.199 4.514 ( 5.519 -1.055 5.394) 7.789 4.548 ( -6.720 -4.323 -1.076) 8.062 4.649 ( -4.694 -7.062 4.153) 9.442 4.849 ( 1.378 1.466 1.878) 2.752 4.893 ( 1.070 -1.143 2.077) 2.601 4.947 ( -3.899 -1.360 2.109) 4.637 4.995 ( -4.416 -4.585 3.858) 7.444 5.327 ( -0.966 2.925 -1.600) 3.471 5.377 ( -0.037 -1.493 -5.306) 5.512 5.529 ( -2.919 4.984 -3.048) 6.531 5.608 ( -0.509 -1.638 -5.625) 5.881 5.684 ( -3.751 3.278 0.091) 4.982 5.809 ( -4.301 -7.032 -1.276) 8.341 5.915 ( -0.145 5.997 -3.962) 7.189 6.090 ( -0.258 -9.659 -1.093) 9.724 6.105 ( 0.869 4.342 -0.852) 4.509 6.222 ( 1.880 -7.241 -1.784) 7.690 6.726 ( -0.325 8.754 1.006) 8.817 6.815 ( 1.683 4.197 -2.175) 5.018 6.867 ( 0.168 -2.651 4.034) 4.830 6.921 ( 1.848 -6.690 -0.259) 6.946 7.163 ( -2.045 6.628 -1.988) 7.216 7.234 ( -2.266 7.977 1.545) 8.435 7.291 ( -0.487 -4.929 0.405) 4.969 7.389 ( -0.140 -6.448 0.107) 6.451 7.853 ( 2.230 1.322 1.274) 2.888 7.900 ( 0.163 -2.770 1.246) 3.041 8.264 ( 3.138 1.097 -0.060) 3.324 8.295 ( 2.658 -1.831 -0.839) 3.335 13.342 ( -0.129 0.600 -0.420) 0.744 13.362 ( -0.756 -1.177 -0.672) 1.551 13.853 ( 2.710 1.714 0.069) 3.207 13.885 ( 2.653 -1.368 0.751) 3.077 14.202 ( 0.535 0.373 -0.629) 0.906 14.217 ( -0.105 -1.035 -0.669) 1.237 14.320 ( 1.561 1.563 0.891) 2.382 14.357 ( 1.494 -1.924 1.569) 2.898 16.484 ( -0.429 0.950 -0.191) 1.060 16.527 ( -1.821 -3.068 -0.146) 3.570 17.219 ( -1.153 2.999 -0.929) 3.344 17.251 ( -1.157 0.004 -0.378) 1.217 28.021 ( 0.446 3.991 -0.759) 4.087 28.092 ( 0.776 -2.787 -0.004) 2.893 28.181 ( -0.645 2.864 0.508) 2.979 28.245 ( -0.801 -3.221 0.199) 3.325 28.754 ( 0.485 0.448 -0.173) 0.682 28.764 ( 0.383 -0.480 0.060) 0.617 28.797 ( -0.097 0.536 -0.152) 0.565 28.813 ( -0.037 -0.959 0.115) 0.967 29.018 ( 0.427 1.112 0.101) 1.195 29.037 ( 0.610 -0.703 -0.057) 0.932 29.073 ( -0.563 1.153 -0.041) 1.284 29.094 ( -0.568 -0.773 -0.477) 1.071 31.404 ( 1.517 3.127 -2.638) 4.363 31.455 ( 3.968 -1.613 -0.172) 4.287 31.672 ( -3.158 0.092 1.569) 3.527 31.683 ( -0.889 -1.371 1.196) 2.025 32.100 ( 6.776 4.647 -0.760) 8.252 32.248 ( 3.504 -9.404 -3.112) 10.507 32.655 ( -0.262 11.072 2.299) 11.311 32.885 ( -2.094 -11.011 3.322) 11.690 70.144 ( -0.257 1.635 -0.204) 1.667 70.180 ( -0.430 -1.789 0.092) 1.843 70.386 ( 1.070 1.338 -0.280) 1.735 70.407 ( 1.081 -0.695 0.113) 1.290 ======================= Grid point 38 (24/112) ======================= q-point: ( 0.45 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.365 ( 2.279 4.398 0.960) 5.045 2.425 ( -0.627 -0.910 1.145) 1.591 2.476 ( 1.839 0.165 1.864) 2.624 2.540 ( 3.441 -4.862 0.042) 5.957 2.931 ( 3.249 8.322 -1.553) 9.068 3.044 ( 1.699 -1.657 -1.605) 2.865 3.111 ( 4.859 7.994 -1.255) 9.438 3.184 ( -3.268 2.716 -1.388) 4.470 3.279 ( -5.776 2.898 2.094) 6.793 3.351 ( -2.338 -1.645 1.808) 3.382 3.669 ( 4.649 3.840 -2.489) 6.524 3.715 ( 2.078 -0.602 -0.789) 2.303 3.797 ( 4.859 5.507 0.314) 7.351 3.876 ( -0.533 -1.596 -1.340) 2.151 4.005 ( -5.880 7.547 1.021) 9.621 4.069 ( -5.133 2.498 -1.445) 5.889 4.187 ( -1.818 -5.073 -1.466) 5.584 4.261 ( -2.255 -9.998 -0.096) 10.250 4.444 ( -2.321 2.076 6.482) 7.191 4.451 ( -2.193 -0.105 -0.686) 2.301 4.637 ( 3.576 -0.111 5.310) 6.402 4.667 ( 2.499 -1.041 -0.668) 2.788 4.871 ( -3.478 2.864 3.775) 5.878 4.934 ( 0.836 -3.214 1.700) 3.731 4.942 ( 2.871 1.367 -0.676) 3.251 5.018 ( 2.249 -4.314 2.986) 5.708 5.281 ( -1.662 2.095 -1.140) 2.908 5.306 ( -2.079 -0.205 -4.853) 5.284 5.456 ( -2.136 3.415 -1.121) 4.181 5.553 ( -1.015 -5.136 -2.878) 5.975 5.635 ( -1.453 4.037 0.279) 4.300 5.739 ( -1.775 -5.571 -0.898) 5.916 5.888 ( -0.251 6.872 -0.957) 6.943 6.073 ( -0.513 -10.183 0.236) 10.198 6.117 ( 0.628 3.975 -0.723) 4.088 6.237 ( 0.723 -8.028 -0.575) 8.081 6.718 ( -0.489 9.244 0.015) 9.257 6.816 ( 0.050 0.555 -0.705) 0.899 6.902 ( 0.508 0.057 1.609) 1.688 6.959 ( 1.812 -6.756 0.317) 7.002 7.109 ( -1.781 8.188 -1.143) 8.457 7.220 ( -0.346 9.326 0.397) 9.341 7.284 ( -0.405 -7.306 0.068) 7.317 7.388 ( 0.041 -6.548 -0.134) 6.550 7.889 ( 0.909 0.061 0.307) 0.962 7.908 ( -0.005 -1.217 0.348) 1.266 8.307 ( 1.236 0.410 0.237) 1.323 8.323 ( 1.062 -0.756 -0.712) 1.485 13.341 ( 0.259 -0.222 -0.223) 0.408 13.347 ( -0.487 -0.772 -0.123) 0.921 13.889 ( 1.069 1.919 0.129) 2.200 13.926 ( 1.071 -1.571 0.406) 1.945 14.203 ( 0.184 0.066 -0.308) 0.365 14.208 ( -0.226 -0.363 -0.427) 0.604 14.346 ( 0.597 1.698 0.371) 1.838 14.385 ( 0.507 -1.955 0.593) 2.105 16.483 ( 0.221 -0.363 -0.109) 0.439 16.502 ( -0.804 -2.249 0.017) 2.388 17.198 ( -0.486 3.064 -0.344) 3.122 17.232 ( -0.545 -0.175 -0.109) 0.583 28.024 ( 0.281 4.357 -0.268) 4.374 28.105 ( 0.539 -3.222 -0.090) 3.268 28.174 ( -0.484 2.549 0.357) 2.619 28.233 ( -0.495 -3.240 0.107) 3.279 28.760 ( 0.212 0.481 -0.062) 0.529 28.770 ( 0.170 -0.517 0.017) 0.544 28.796 ( 0.017 0.673 -0.004) 0.673 28.814 ( 0.017 -1.023 0.080) 1.027 29.024 ( 0.210 1.330 0.011) 1.346 29.046 ( 0.393 -0.697 -0.121) 0.809 29.065 ( -0.346 0.916 0.065) 0.982 29.082 ( -0.303 -0.741 -0.215) 0.829 31.399 ( 0.394 5.660 -1.562) 5.885 31.511 ( 2.616 -4.688 -1.324) 5.529 31.629 ( -2.537 1.969 1.547) 3.565 31.676 ( -0.681 -2.538 0.905) 2.780 32.206 ( 4.379 0.987 0.843) 4.568 32.261 ( -0.146 -4.121 -1.855) 4.522 32.668 ( 0.158 9.328 0.666) 9.353 32.874 ( -1.033 -10.216 1.160) 10.334 70.141 ( -0.044 1.492 -0.075) 1.495 70.175 ( -0.137 -1.822 0.008) 1.827 70.398 ( 0.394 1.470 -0.066) 1.524 70.421 ( 0.389 -0.771 0.061) 0.866 ======================= Grid point 77 (25/112) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.609 ( -6.922 0.000 29.357) 30.162 0.625 ( -4.509 0.000 29.524) 29.867 1.295 ( -7.002 0.000 60.912) 61.313 1.616 ( 4.318 0.000 9.547) 10.478 2.217 ( 3.286 0.000 -19.114) 19.394 2.948 ( -2.023 0.000 -6.964) 7.252 2.962 ( -2.475 0.000 21.236) 21.379 3.002 ( 4.295 0.000 3.235) 5.377 3.268 ( -3.570 0.000 -1.396) 3.833 3.372 ( -4.948 0.000 5.735) 7.574 3.460 ( -0.524 0.000 -5.626) 5.650 3.734 ( -3.722 0.000 -4.975) 6.213 3.854 ( -0.074 0.000 1.421) 1.423 4.017 ( 14.686 0.000 -1.657) 14.779 4.290 ( 9.325 0.000 -5.739) 10.949 4.442 ( 1.147 0.000 4.916) 5.048 4.546 ( -2.972 0.000 -11.200) 11.588 4.624 ( -4.822 0.000 -11.827) 12.772 4.683 ( -7.879 0.000 -3.629) 8.674 4.778 ( -9.974 0.000 -6.621) 11.971 4.808 ( -3.279 0.000 -0.038) 3.280 4.832 ( 9.103 0.000 1.063) 9.165 5.081 ( -5.237 0.000 3.784) 6.461 5.255 ( -0.749 0.000 -3.957) 4.027 5.290 ( -8.607 0.000 4.867) 9.888 5.347 ( 3.019 0.000 -4.217) 5.187 5.388 ( 4.073 0.000 -3.556) 5.407 5.426 ( -5.157 0.000 0.393) 5.172 5.521 ( 13.982 0.000 -6.936) 15.608 5.625 ( 1.612 0.000 -0.458) 1.675 5.683 ( 1.096 0.000 2.642) 2.860 5.698 ( -8.964 0.000 2.074) 9.201 5.865 ( 12.142 0.000 0.377) 12.147 5.983 ( 1.508 0.000 0.249) 1.528 6.228 ( 2.730 0.000 8.180) 8.623 6.337 ( 1.199 0.000 -5.249) 5.384 6.453 ( 5.729 0.000 -2.244) 6.153 6.511 ( -3.998 0.000 -4.193) 5.794 6.797 ( -9.880 0.000 8.319) 12.916 6.823 ( -1.449 0.000 7.885) 8.017 6.984 ( -0.166 0.000 3.617) 3.621 7.141 ( 0.019 0.000 -2.288) 2.288 7.503 ( 3.774 0.000 -2.543) 4.551 7.504 ( -4.900 0.000 -8.500) 9.812 7.844 ( 1.667 0.000 4.456) 4.758 7.882 ( 0.317 0.000 0.359) 0.479 8.278 ( 0.952 0.000 8.699) 8.751 8.983 ( -7.068 0.000 -7.149) 10.053 13.293 ( -0.713 0.000 1.512) 1.671 13.474 ( 1.310 0.000 -3.257) 3.511 13.616 ( -4.675 0.000 2.791) 5.445 13.764 ( 0.689 0.000 -1.233) 1.412 14.145 ( 0.468 0.000 -0.021) 0.469 14.208 ( -0.197 0.000 -2.635) 2.642 14.357 ( 0.419 0.000 3.550) 3.575 14.499 ( -2.849 0.000 -0.774) 2.953 16.414 ( -0.763 0.000 0.775) 1.088 16.504 ( 11.020 0.000 -1.374) 11.105 16.975 ( 1.005 0.000 2.504) 2.698 17.156 ( -0.538 0.000 -1.648) 1.733 27.816 ( -0.919 0.000 0.370) 0.990 27.967 ( 2.642 0.000 -4.288) 5.036 28.174 ( -1.120 0.000 2.479) 2.720 28.229 ( 0.646 0.000 -0.064) 0.649 28.746 ( -0.937 0.000 0.559) 1.091 28.787 ( 0.476 0.000 -0.357) 0.595 28.803 ( 0.911 0.000 0.357) 0.979 28.814 ( -0.499 0.000 0.168) 0.526 28.994 ( 0.431 0.000 -0.002) 0.431 28.995 ( -0.173 0.000 -0.005) 0.173 29.081 ( 0.088 0.000 0.612) 0.618 29.119 ( -0.013 0.000 -0.262) 0.262 31.188 ( 1.459 0.000 4.601) 4.827 31.527 ( 10.436 0.000 -0.463) 10.446 31.561 ( -0.690 0.000 -0.847) 1.092 31.617 ( -2.704 0.000 -4.676) 5.401 31.659 ( -0.843 0.000 5.176) 5.244 32.047 ( 1.215 0.000 -4.117) 4.292 33.502 ( 3.361 0.000 2.970) 4.485 33.724 ( -14.730 0.000 -2.076) 14.875 70.065 ( -0.685 0.000 0.722) 0.996 70.155 ( 2.252 0.000 -1.826) 2.899 70.238 ( -0.425 0.000 1.713) 1.765 70.320 ( 0.318 0.000 -0.649) 0.723 ======================= Grid point 78 (26/112) ======================= q-point: ( 0.09 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.757 ( -1.724 0.000 29.046) 29.097 0.901 ( 7.774 0.000 23.904) 25.137 1.815 ( 12.373 0.000 12.141) 17.335 1.938 ( 16.666 0.000 41.826) 45.024 2.145 ( 6.994 0.000 -19.283) 20.512 2.781 ( -9.304 0.000 2.257) 9.574 3.086 ( -4.840 0.000 22.331) 22.850 3.195 ( -0.214 0.000 -8.151) 8.153 3.212 ( 11.527 0.000 2.724) 11.844 3.371 ( -0.238 0.000 5.132) 5.138 3.417 ( 0.843 0.000 -4.772) 4.846 3.596 ( -5.421 0.000 -5.980) 8.071 3.838 ( -4.262 0.000 1.163) 4.417 4.011 ( -4.297 0.000 -6.374) 7.687 4.331 ( -5.255 0.000 -1.528) 5.473 4.370 ( -4.795 0.000 -5.705) 7.453 4.457 ( -4.312 0.000 -11.990) 12.742 4.473 ( -7.688 0.000 -18.267) 19.819 4.615 ( 10.772 0.000 -3.772) 11.413 4.636 ( -6.874 0.000 1.218) 6.981 4.784 ( 3.201 0.000 3.478) 4.727 4.912 ( 0.159 0.000 2.425) 2.430 5.029 ( -3.808 0.000 3.945) 5.483 5.128 ( -7.176 0.000 -2.389) 7.564 5.188 ( -0.948 0.000 -5.113) 5.201 5.349 ( -3.791 0.000 -0.319) 3.804 5.431 ( 8.601 0.000 -2.724) 9.022 5.464 ( 3.206 0.000 1.217) 3.429 5.543 ( -8.588 0.000 0.817) 8.627 5.559 ( -6.981 0.000 3.062) 7.623 5.705 ( 0.126 0.000 2.506) 2.510 5.771 ( 14.923 0.000 -5.872) 16.036 6.013 ( 6.382 0.000 -6.001) 8.760 6.130 ( 12.457 0.000 -2.573) 12.720 6.259 ( -3.652 0.000 1.482) 3.941 6.372 ( 3.488 0.000 1.236) 3.701 6.445 ( -0.346 0.000 0.376) 0.511 6.502 ( 0.073 0.000 -6.272) 6.273 6.827 ( 2.430 0.000 7.670) 8.046 6.897 ( 1.197 0.000 8.465) 8.549 6.998 ( -0.788 0.000 3.233) 3.328 7.119 ( -0.289 0.000 -2.562) 2.579 7.362 ( -3.729 0.000 -5.345) 6.517 7.529 ( 1.578 0.000 -2.810) 3.223 7.871 ( -0.626 0.000 1.348) 1.487 7.883 ( -0.595 0.000 0.155) 0.615 8.353 ( -2.891 0.000 9.971) 10.381 8.671 ( -15.378 0.000 -0.412) 15.384 13.291 ( -0.712 0.000 1.368) 1.542 13.458 ( -1.007 0.000 -2.287) 2.499 13.617 ( 1.669 0.000 1.307) 2.120 13.773 ( 1.441 0.000 -0.633) 1.574 14.163 ( 1.368 0.000 0.240) 1.389 14.192 ( 0.827 0.000 -2.420) 2.558 14.393 ( -0.173 0.000 3.440) 3.444 14.420 ( -3.302 0.000 2.887) 4.386 16.425 ( 1.544 0.000 0.462) 1.612 16.635 ( 5.968 0.000 -7.070) 9.252 17.025 ( 1.396 0.000 2.896) 3.215 17.119 ( -1.386 0.000 -2.556) 2.907 27.804 ( -0.459 0.000 0.178) 0.492 27.979 ( 2.633 0.000 -4.193) 4.951 28.177 ( -0.568 0.000 1.570) 1.670 28.258 ( 2.158 0.000 0.313) 2.181 28.739 ( -0.418 0.000 0.086) 0.427 28.773 ( -1.092 0.000 -0.011) 1.092 28.822 ( 0.791 0.000 -0.406) 0.889 28.826 ( 0.982 0.000 0.614) 1.158 28.989 ( -0.336 0.000 -0.165) 0.375 29.003 ( 0.464 0.000 0.108) 0.477 29.076 ( -0.947 0.000 0.982) 1.364 29.114 ( -0.273 0.000 -0.390) 0.476 31.264 ( 1.820 0.000 6.319) 6.576 31.480 ( -4.557 0.000 -5.208) 6.920 31.605 ( 4.892 0.000 -4.507) 6.652 31.652 ( 2.825 0.000 2.117) 3.530 31.730 ( 5.446 0.000 2.261) 5.897 32.045 ( 2.509 0.000 -4.049) 4.763 33.375 ( -19.263 0.000 5.738) 20.100 33.540 ( -3.267 0.000 5.527) 6.420 70.063 ( -0.090 0.000 0.537) 0.544 70.190 ( 2.740 0.000 -1.698) 3.223 70.259 ( 1.049 0.000 -0.242) 1.076 70.327 ( 1.112 0.000 -0.577) 1.253 ======================= Grid point 79 (27/112) ======================= q-point: ( 0.18 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.077 ( 12.081 0.000 21.943) 25.049 1.285 ( 15.060 0.000 16.429) 22.287 2.065 ( 15.318 0.000 -9.825) 18.198 2.142 ( 10.300 0.000 -17.193) 20.042 2.613 ( 11.923 0.000 25.779) 28.403 2.735 ( 3.444 0.000 19.782) 20.079 3.075 ( -3.337 0.000 -8.482) 9.115 3.165 ( -5.995 0.000 12.511) 13.874 3.354 ( -0.661 0.000 3.339) 3.404 3.415 ( 0.634 0.000 -2.084) 2.179 3.470 ( -5.100 0.000 3.068) 5.952 3.489 ( 7.744 0.000 5.140) 9.295 3.709 ( -10.223 0.000 1.438) 10.323 3.883 ( -0.345 0.000 -11.455) 11.461 4.137 ( -10.553 0.000 -15.414) 18.680 4.257 ( -9.074 0.000 -5.118) 10.418 4.263 ( -0.498 0.000 -5.939) 5.960 4.275 ( -0.130 0.000 -3.646) 3.648 4.438 ( -15.124 0.000 7.575) 16.915 4.607 ( 3.894 0.000 -11.790) 12.416 4.896 ( -4.155 0.000 -3.000) 5.125 4.934 ( 0.937 0.000 -0.723) 1.183 5.007 ( -0.522 0.000 4.220) 4.252 5.053 ( 2.062 0.000 -2.738) 3.428 5.137 ( -4.461 0.000 1.360) 4.664 5.256 ( -7.677 0.000 2.483) 8.068 5.404 ( -4.488 0.000 -1.796) 4.834 5.464 ( -6.756 0.000 4.533) 8.136 5.538 ( 4.141 0.000 2.117) 4.651 5.574 ( 8.324 0.000 -3.376) 8.982 5.776 ( 4.886 0.000 3.993) 6.310 5.911 ( 0.004 0.000 0.593) 0.593 6.017 ( 4.198 0.000 -9.281) 10.187 6.154 ( -5.642 0.000 -1.381) 5.809 6.325 ( 7.191 0.000 -4.842) 8.669 6.402 ( -1.235 0.000 -10.367) 10.441 6.466 ( 6.412 0.000 5.955) 8.751 6.471 ( -0.274 0.000 3.847) 3.857 6.922 ( 1.731 0.000 3.839) 4.211 6.932 ( -2.032 0.000 3.562) 4.101 7.071 ( 2.925 0.000 5.829) 6.521 7.088 ( -0.507 0.000 -2.454) 2.506 7.278 ( -2.497 0.000 -1.341) 2.834 7.501 ( -3.008 0.000 -0.347) 3.028 7.877 ( 0.994 0.000 0.838) 1.300 7.892 ( 3.171 0.000 -1.146) 3.372 8.324 ( -7.907 0.000 6.135) 10.008 8.482 ( -5.102 0.000 -1.908) 5.447 13.301 ( 0.649 0.000 1.693) 1.813 13.417 ( -1.222 0.000 -1.828) 2.199 13.666 ( 2.782 0.000 0.148) 2.786 13.812 ( 2.908 0.000 0.519) 2.954 14.192 ( 1.175 0.000 -2.247) 2.536 14.194 ( 1.669 0.000 0.313) 1.698 14.396 ( -2.228 0.000 1.703) 2.804 14.422 ( 0.255 0.000 2.327) 2.341 16.481 ( 3.896 0.000 1.072) 4.040 16.647 ( 2.205 0.000 -5.231) 5.676 17.065 ( -1.952 0.000 -2.917) 3.509 17.066 ( 0.460 0.000 2.511) 2.553 27.806 ( 0.373 0.000 0.436) 0.574 27.988 ( 2.241 0.000 -4.039) 4.619 28.188 ( 0.077 0.000 2.286) 2.287 28.305 ( 2.514 0.000 0.312) 2.533 28.733 ( -0.170 0.000 -0.163) 0.236 28.760 ( -0.300 0.000 0.282) 0.411 28.825 ( 0.012 0.000 -0.729) 0.729 28.846 ( 0.591 0.000 0.458) 0.748 28.980 ( -0.438 0.000 -0.273) 0.516 29.011 ( 0.409 0.000 -0.036) 0.411 29.069 ( -0.791 0.000 1.025) 1.294 29.104 ( -0.271 0.000 -0.501) 0.570 31.347 ( -3.989 0.000 -6.729) 7.823 31.355 ( 1.985 0.000 6.314) 6.619 31.670 ( 6.205 0.000 -5.041) 7.994 31.712 ( 0.956 0.000 4.357) 4.461 31.874 ( 7.532 0.000 3.674) 8.380 32.064 ( 3.215 0.000 -3.946) 5.090 33.121 ( -13.270 0.000 1.395) 13.343 33.489 ( -7.133 0.000 5.668) 9.110 70.071 ( 0.385 0.000 0.613) 0.724 70.224 ( 2.669 0.000 -1.931) 3.294 70.269 ( 0.177 0.000 0.332) 0.376 70.349 ( 1.670 0.000 -0.343) 1.704 ======================= Grid point 80 (28/112) ======================= q-point: ( 0.27 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( 19.394 0.000 15.361) 24.741 1.719 ( 20.133 0.000 9.320) 22.186 2.209 ( 14.489 0.000 -17.085) 22.402 2.220 ( 11.945 0.000 -12.161) 17.046 2.736 ( 1.995 0.000 4.276) 4.719 2.931 ( -2.604 0.000 -10.222) 10.549 3.114 ( -9.097 0.000 8.571) 12.499 3.137 ( -1.010 0.000 16.947) 16.977 3.301 ( -6.153 0.000 0.098) 6.154 3.362 ( -3.958 0.000 4.649) 6.105 3.438 ( -9.418 0.000 5.933) 11.132 3.527 ( -8.338 0.000 4.021) 9.257 3.639 ( 1.051 0.000 9.227) 9.287 3.817 ( 3.328 0.000 -7.862) 8.537 3.942 ( 3.100 0.000 -2.817) 4.189 4.049 ( -6.071 0.000 -7.839) 9.915 4.270 ( -0.470 0.000 -3.503) 3.535 4.289 ( 8.484 0.000 -7.173) 11.110 4.316 ( -4.539 0.000 11.367) 12.240 4.614 ( 7.762 0.000 -12.209) 14.468 4.725 ( -9.084 0.000 -5.401) 10.568 4.847 ( -4.204 0.000 -6.224) 7.511 5.019 ( -4.460 0.000 -0.807) 4.533 5.062 ( -3.960 0.000 8.986) 9.820 5.087 ( -6.389 0.000 8.368) 10.528 5.143 ( -0.044 0.000 -3.946) 3.946 5.336 ( -0.608 0.000 -3.743) 3.792 5.394 ( -4.996 0.000 4.343) 6.620 5.620 ( 1.754 0.000 2.786) 3.292 5.648 ( -0.614 0.000 -2.055) 2.145 5.812 ( -3.103 0.000 -2.356) 3.896 5.911 ( 2.642 0.000 7.218) 7.687 6.009 ( -0.235 0.000 -9.318) 9.321 6.018 ( -7.988 0.000 -0.795) 8.027 6.286 ( -2.799 0.000 -4.642) 5.421 6.358 ( 3.140 0.000 -4.752) 5.696 6.508 ( 0.816 0.000 2.693) 2.814 6.639 ( 4.791 0.000 3.341) 5.841 6.951 ( -0.866 0.000 1.639) 1.854 6.958 ( 0.751 0.000 3.876) 3.949 7.074 ( 1.704 0.000 -2.583) 3.094 7.134 ( 0.250 0.000 5.034) 5.040 7.263 ( 1.441 0.000 0.914) 1.707 7.448 ( -1.720 0.000 -0.040) 1.720 7.927 ( 2.811 0.000 1.408) 3.143 7.976 ( 6.352 0.000 -1.110) 6.448 8.194 ( -8.967 0.000 1.213) 9.049 8.418 ( -0.448 0.000 -2.906) 2.940 13.349 ( 2.325 0.000 2.729) 3.585 13.387 ( -0.526 0.000 -1.345) 1.444 13.716 ( 2.708 0.000 -0.033) 2.709 13.881 ( 3.533 0.000 1.246) 3.747 14.194 ( 1.038 0.000 -1.906) 2.170 14.228 ( 1.846 0.000 0.163) 1.853 14.343 ( -3.552 0.000 -1.073) 3.711 14.449 ( 0.664 0.000 1.059) 1.250 16.578 ( 4.770 0.000 2.334) 5.310 16.641 ( 1.414 0.000 -3.356) 3.642 17.002 ( -2.281 0.000 -2.642) 3.490 17.085 ( -0.285 0.000 1.769) 1.792 27.824 ( 0.895 0.000 0.848) 1.232 27.993 ( 2.124 0.000 -3.597) 4.177 28.214 ( 0.103 0.000 2.872) 2.874 28.347 ( 1.956 0.000 -0.116) 1.960 28.731 ( 0.183 0.000 -0.194) 0.267 28.766 ( 0.380 0.000 0.517) 0.641 28.814 ( -0.414 0.000 -0.567) 0.702 28.855 ( 0.142 0.000 0.094) 0.171 28.970 ( -0.393 0.000 -0.219) 0.450 29.016 ( 0.312 0.000 -0.332) 0.455 29.065 ( -0.627 0.000 0.985) 1.168 29.097 ( -0.094 0.000 -0.488) 0.497 31.235 ( -2.355 0.000 -5.101) 5.618 31.437 ( 1.422 0.000 5.404) 5.588 31.728 ( 4.861 0.000 -5.241) 7.148 31.753 ( -0.767 0.000 4.230) 4.299 32.066 ( 9.213 0.000 5.473) 10.716 32.087 ( 3.177 0.000 -4.176) 5.247 32.899 ( -10.801 0.000 -2.851) 11.171 33.401 ( -6.615 0.000 3.796) 7.627 70.085 ( 0.486 0.000 0.776) 0.916 70.244 ( 1.779 0.000 -3.145) 3.613 70.284 ( 0.521 0.000 2.008) 2.074 70.378 ( 1.637 0.000 -0.092) 1.640 ======================= Grid point 81 (29/112) ======================= q-point: ( 0.36 0.00 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.992 ( 17.358 0.000 10.587) 20.332 2.151 ( 21.455 0.000 2.468) 21.597 2.338 ( 15.493 0.000 -14.319) 21.097 2.360 ( 10.929 0.000 -3.238) 11.398 2.727 ( -4.791 0.000 -2.970) 5.637 2.819 ( -2.698 0.000 -4.957) 5.643 2.993 ( -9.983 0.000 2.998) 10.423 3.062 ( -6.343 0.000 -0.581) 6.369 3.189 ( -4.973 0.000 -0.064) 4.974 3.207 ( -16.763 0.000 1.619) 16.841 3.331 ( -12.461 0.000 8.655) 15.172 3.374 ( -1.666 0.000 7.517) 7.700 3.825 ( -2.025 0.000 0.808) 2.180 3.891 ( 5.276 0.000 15.474) 16.348 3.949 ( 5.621 0.000 -11.590) 12.882 4.052 ( 4.527 0.000 0.110) 4.529 4.169 ( -2.969 0.000 -11.437) 11.816 4.394 ( 9.378 0.000 -8.343) 12.552 4.414 ( 1.934 0.000 7.323) 7.574 4.572 ( -4.467 0.000 7.341) 8.593 4.658 ( 7.636 0.000 -11.633) 13.915 4.712 ( -2.321 0.000 -8.111) 8.436 4.915 ( -11.853 0.000 -1.446) 11.941 4.944 ( -1.788 0.000 -1.103) 2.100 5.087 ( -2.998 0.000 10.167) 10.600 5.205 ( 1.125 0.000 6.545) 6.641 5.316 ( 1.117 0.000 -2.067) 2.350 5.348 ( -5.444 0.000 5.538) 7.766 5.514 ( -7.879 0.000 -0.526) 7.897 5.658 ( -0.023 0.000 3.394) 3.394 5.800 ( -0.283 0.000 -13.190) 13.193 5.846 ( -7.861 0.000 -3.515) 8.611 5.882 ( 0.112 0.000 -0.701) 0.709 5.974 ( -2.901 0.000 6.612) 7.220 6.246 ( -1.214 0.000 1.452) 1.893 6.384 ( 3.785 0.000 -3.467) 5.132 6.538 ( 0.160 0.000 2.086) 2.092 6.696 ( 1.172 0.000 0.259) 1.200 6.931 ( -4.976 0.000 1.595) 5.225 6.938 ( -0.888 0.000 -0.360) 0.958 7.097 ( 2.707 0.000 -2.166) 3.467 7.243 ( 2.935 0.000 4.133) 5.069 7.336 ( 4.967 0.000 5.430) 7.359 7.445 ( 1.050 0.000 0.007) 1.050 7.944 ( -3.601 0.000 -0.098) 3.602 8.074 ( 5.161 0.000 -1.785) 5.461 8.084 ( -1.302 0.000 -0.206) 1.319 8.399 ( 0.741 0.000 -2.655) 2.756 13.376 ( 0.169 0.000 -0.507) 0.534 13.417 ( 1.950 0.000 3.018) 3.593 13.761 ( 2.088 0.000 0.269) 2.105 13.948 ( 2.539 0.000 0.688) 2.631 14.198 ( 1.003 0.000 -1.176) 1.546 14.261 ( 1.662 0.000 -0.236) 1.678 14.267 ( -2.639 0.000 -2.286) 3.492 14.457 ( -0.125 0.000 -0.383) 0.403 16.644 ( 1.343 0.000 -1.627) 2.110 16.679 ( 3.624 0.000 2.646) 4.487 16.942 ( -1.998 0.000 -1.593) 2.555 17.087 ( -0.685 0.000 0.826) 1.073 27.848 ( 0.726 0.000 1.181) 1.387 28.005 ( 2.407 0.000 -3.118) 3.939 28.233 ( -0.967 0.000 3.043) 3.193 28.371 ( 1.152 0.000 -0.771) 1.386 28.736 ( 0.476 0.000 0.008) 0.476 28.777 ( 0.301 0.000 0.428) 0.523 28.805 ( -0.229 0.000 -0.011) 0.230 28.854 ( -0.096 0.000 -0.275) 0.292 28.964 ( -0.216 0.000 -0.000) 0.216 29.017 ( 0.208 0.000 -0.660) 0.692 29.063 ( -0.496 0.000 0.979) 1.098 29.093 ( 0.073 0.000 -0.342) 0.350 31.182 ( -0.332 0.000 -1.334) 1.375 31.498 ( 0.589 0.000 4.336) 4.376 31.751 ( -2.666 0.000 2.460) 3.627 31.760 ( 3.480 0.000 -3.917) 5.240 32.110 ( 3.173 0.000 -3.871) 5.006 32.292 ( 9.673 0.000 6.768) 11.805 32.678 ( -9.503 0.000 -5.653) 11.057 33.319 ( -4.615 0.000 0.427) 4.634 70.100 ( 0.268 0.000 0.879) 0.919 70.242 ( 1.007 0.000 -2.704) 2.886 70.313 ( 0.681 0.000 1.901) 2.019 70.403 ( 1.080 0.000 -0.068) 1.082 ======================= Grid point 82 (30/112) ======================= q-point: ( 0.45 0.00 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.311 ( 11.128 0.000 4.546) 12.021 2.493 ( 9.605 0.000 1.724) 9.759 2.513 ( 12.828 0.000 -8.595) 15.442 2.559 ( 12.005 0.000 0.238) 12.007 2.564 ( -10.102 0.000 2.240) 10.347 2.713 ( -8.148 0.000 -0.900) 8.197 2.810 ( -5.409 0.000 -2.833) 6.106 2.980 ( -7.509 0.000 2.024) 7.777 3.013 ( 3.262 0.000 -5.895) 6.737 3.116 ( -3.334 0.000 2.732) 4.311 3.275 ( -6.192 0.000 13.797) 15.123 3.376 ( -4.977 0.000 5.215) 7.209 3.777 ( -1.569 0.000 -1.919) 2.479 3.876 ( -11.448 0.000 -12.105) 16.661 4.011 ( 6.817 0.000 -2.790) 7.366 4.027 ( 1.427 0.000 4.308) 4.538 4.147 ( 3.964 0.000 -5.381) 6.684 4.416 ( -5.353 0.000 -3.346) 6.312 4.472 ( 8.550 0.000 -10.780) 13.759 4.617 ( 3.916 0.000 -13.040) 13.615 4.638 ( -3.022 0.000 8.185) 8.725 4.725 ( 6.932 0.000 -7.063) 9.896 4.750 ( -2.404 0.000 5.468) 5.973 4.928 ( -0.450 0.000 1.458) 1.525 5.121 ( -4.421 0.000 10.844) 11.711 5.244 ( -3.716 0.000 5.862) 6.940 5.279 ( -7.067 0.000 6.355) 9.505 5.312 ( 0.777 0.000 0.471) 0.909 5.452 ( -0.989 0.000 3.187) 3.337 5.660 ( -4.460 0.000 -2.416) 5.072 5.696 ( 4.609 0.000 -9.002) 10.113 5.706 ( -0.119 0.000 -2.403) 2.406 5.949 ( 3.377 0.000 1.935) 3.892 5.956 ( -3.421 0.000 4.403) 5.575 6.239 ( -1.275 0.000 1.471) 1.946 6.429 ( 3.570 0.000 -2.200) 4.194 6.555 ( -0.723 0.000 3.802) 3.870 6.707 ( 0.384 0.000 -0.307) 0.491 6.869 ( -2.997 0.000 1.815) 3.504 6.915 ( -0.514 0.000 -2.226) 2.285 7.130 ( 2.436 0.000 -1.080) 2.664 7.256 ( -1.087 0.000 -2.132) 2.393 7.470 ( -0.381 0.000 8.135) 8.144 7.478 ( 1.786 0.000 1.366) 2.249 7.871 ( -1.222 0.000 0.138) 1.230 8.095 ( 0.579 0.000 0.232) 0.624 8.113 ( 1.608 0.000 -3.710) 4.044 8.396 ( 1.139 0.000 -2.242) 2.515 13.385 ( 0.699 0.000 0.725) 1.008 13.453 ( -0.609 0.000 1.758) 1.861 13.795 ( 1.017 0.000 0.868) 1.337 13.968 ( -0.115 0.000 -1.537) 1.542 14.213 ( 1.408 0.000 -0.337) 1.448 14.231 ( 0.162 0.000 -0.237) 0.287 14.279 ( 0.697 0.000 -0.819) 1.075 14.438 ( -0.774 0.000 -1.967) 2.113 16.662 ( 1.408 0.000 -0.034) 1.408 16.730 ( -0.215 0.000 0.562) 0.601 16.921 ( 0.537 0.000 1.112) 1.235 17.076 ( -0.812 0.000 -0.198) 0.836 27.866 ( -0.032 0.000 1.357) 1.357 28.025 ( 2.555 0.000 -2.858) 3.833 28.230 ( -2.226 0.000 2.933) 3.682 28.379 ( 0.685 0.000 -1.124) 1.316 28.747 ( 0.447 0.000 0.403) 0.602 28.782 ( -0.070 0.000 0.270) 0.279 28.803 ( -0.150 0.000 0.163) 0.222 28.849 ( 0.017 0.000 -0.513) 0.513 28.963 ( -0.013 0.000 0.253) 0.253 29.013 ( 0.135 0.000 -0.898) 0.908 29.063 ( -0.395 0.000 0.936) 1.016 29.093 ( 0.179 0.000 -0.158) 0.239 31.200 ( 1.457 0.000 2.979) 3.316 31.531 ( -0.857 0.000 3.722) 3.819 31.701 ( -3.573 0.000 -0.859) 3.674 31.802 ( 3.872 0.000 -1.059) 4.015 32.132 ( 2.392 0.000 -3.043) 3.871 32.455 ( -9.139 0.000 -4.469) 10.173 32.528 ( 9.255 0.000 5.151) 10.592 33.234 ( -3.255 0.000 -3.838) 5.032 70.109 ( -0.140 0.000 0.946) 0.957 70.236 ( 0.764 0.000 -2.435) 2.552 70.337 ( 0.140 0.000 1.870) 1.875 70.415 ( 0.339 0.000 -0.228) 0.409 ======================= Grid point 83 (31/112) ======================= q-point: (-0.45 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.330 ( -16.940 0.000 6.800) 18.254 2.336 ( -20.935 0.000 -3.957) 21.306 2.481 ( -4.777 0.000 -3.551) 5.952 2.542 ( 11.486 0.000 0.640) 11.504 2.704 ( 10.102 0.000 -1.069) 10.158 2.793 ( 4.528 0.000 -3.705) 5.850 2.917 ( 7.695 0.000 1.798) 7.902 2.921 ( -9.777 0.000 -3.731) 10.465 3.009 ( 10.473 0.000 7.097) 12.651 3.156 ( 1.501 0.000 2.320) 2.763 3.316 ( -4.998 0.000 6.978) 8.583 3.333 ( 1.458 0.000 8.620) 8.743 3.555 ( -9.275 0.000 -12.376) 15.465 3.734 ( -0.695 0.000 -3.951) 4.011 4.063 ( 1.527 0.000 -2.892) 3.271 4.138 ( 8.024 0.000 0.496) 8.039 4.140 ( -2.462 0.000 -4.965) 5.542 4.215 ( -4.673 0.000 -4.492) 6.482 4.522 ( 6.671 0.000 -10.249) 12.229 4.600 ( 6.589 0.000 -14.331) 15.773 4.638 ( -2.403 0.000 2.275) 3.309 4.796 ( 5.799 0.000 -3.783) 6.925 4.828 ( 1.841 0.000 10.166) 10.331 4.940 ( -2.732 0.000 5.066) 5.755 5.066 ( -6.907 0.000 7.057) 9.875 5.249 ( 1.133 0.000 4.178) 4.329 5.272 ( -1.310 0.000 7.850) 7.959 5.388 ( 5.777 0.000 1.058) 5.873 5.466 ( -0.091 0.000 2.152) 2.154 5.535 ( -2.714 0.000 -7.396) 7.879 5.719 ( 1.765 0.000 -2.268) 2.874 5.791 ( 7.852 0.000 -0.982) 7.913 5.952 ( -0.431 0.000 3.573) 3.599 6.014 ( 1.778 0.000 1.855) 2.569 6.218 ( -1.386 0.000 -0.983) 1.699 6.465 ( 1.846 0.000 -0.959) 2.080 6.596 ( 0.249 0.000 7.913) 7.917 6.715 ( 0.543 0.000 0.029) 0.543 6.845 ( -1.196 0.000 0.503) 1.297 6.878 ( -0.801 0.000 -3.601) 3.689 7.164 ( 1.879 0.000 0.009) 1.880 7.179 ( -4.323 0.000 -4.567) 6.289 7.437 ( -7.002 0.000 4.275) 8.204 7.530 ( 1.315 0.000 4.353) 4.547 7.917 ( 2.613 0.000 2.230) 3.435 8.076 ( -1.481 0.000 -4.440) 4.680 8.101 ( -0.082 0.000 1.698) 1.700 8.389 ( 0.642 0.000 -3.978) 4.029 13.413 ( 0.988 0.000 2.225) 2.434 13.426 ( -3.001 0.000 0.264) 3.012 13.812 ( -0.345 0.000 1.606) 1.642 13.927 ( -1.870 0.000 -2.760) 3.333 14.241 ( 1.558 0.000 0.330) 1.593 14.258 ( 1.624 0.000 1.540) 2.238 14.269 ( -0.723 0.000 -1.293) 1.481 14.397 ( -0.994 0.000 -3.795) 3.923 16.691 ( -3.237 0.000 -0.809) 3.336 16.693 ( 1.442 0.000 1.263) 1.917 16.972 ( 2.467 0.000 2.657) 3.625 17.055 ( -0.804 0.000 -1.245) 1.482 27.869 ( -0.924 0.000 1.416) 1.691 28.044 ( 2.243 0.000 -3.054) 3.789 28.208 ( -2.762 0.000 3.034) 4.103 28.377 ( 0.163 0.000 -1.096) 1.108 28.758 ( 0.128 0.000 0.845) 0.854 28.778 ( -0.571 0.000 -0.114) 0.582 28.804 ( 0.199 0.000 0.337) 0.391 28.846 ( 0.170 0.000 -0.653) 0.675 28.967 ( 0.167 0.000 0.427) 0.458 29.007 ( 0.110 0.000 -1.015) 1.021 29.064 ( -0.371 0.000 0.815) 0.895 29.096 ( 0.244 0.000 -0.052) 0.250 31.279 ( 2.577 0.000 6.075) 6.599 31.523 ( -4.296 0.000 4.120) 5.953 31.620 ( -1.648 0.000 -5.442) 5.686 31.884 ( 4.367 0.000 2.033) 4.817 32.140 ( 0.804 0.000 -1.824) 1.993 32.241 ( -8.907 0.000 -5.845) 10.654 32.742 ( 7.825 0.000 7.150) 10.600 33.137 ( -1.599 0.000 -8.061) 8.218 70.111 ( -0.601 0.000 1.030) 1.193 70.227 ( 0.543 0.000 -2.354) 2.416 70.351 ( -0.463 0.000 1.954) 2.008 70.412 ( -0.371 0.000 -0.412) 0.555 ======================= Grid point 84 (32/112) ======================= q-point: (-0.36 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.883 ( -25.489 0.000 -2.517) 25.613 2.031 ( -24.950 0.000 12.827) 28.054 2.391 ( 0.075 0.000 -4.775) 4.775 2.580 ( -18.250 0.000 -11.161) 21.392 2.708 ( -3.336 0.000 -6.339) 7.163 2.803 ( 1.047 0.000 1.065) 1.493 2.814 ( 5.945 0.000 -8.772) 10.597 2.930 ( -3.836 0.000 -2.699) 4.691 3.136 ( 0.065 0.000 0.122) 0.138 3.281 ( 3.501 0.000 -1.219) 3.707 3.336 ( 10.879 0.000 12.959) 16.920 3.408 ( 5.912 0.000 12.450) 13.782 3.681 ( 12.838 0.000 10.605) 16.652 3.683 ( -0.321 0.000 -5.359) 5.369 3.946 ( -4.392 0.000 -7.984) 9.112 4.039 ( -4.350 0.000 0.976) 4.458 4.265 ( 6.781 0.000 -0.943) 6.846 4.278 ( 7.294 0.000 -4.404) 8.520 4.508 ( -0.137 0.000 -4.980) 4.982 4.605 ( 5.965 0.000 -10.874) 12.402 4.634 ( 5.490 0.000 -6.415) 8.444 4.872 ( 4.924 0.000 -0.360) 4.937 4.906 ( -3.672 0.000 7.188) 8.072 4.959 ( 0.875 0.000 12.382) 12.413 5.098 ( 3.807 0.000 1.639) 4.144 5.306 ( -2.903 0.000 7.564) 8.102 5.331 ( 3.671 0.000 2.169) 4.264 5.452 ( 1.360 0.000 -7.977) 8.092 5.467 ( 2.316 0.000 -3.797) 4.448 5.541 ( 5.943 0.000 6.063) 8.490 5.727 ( 2.323 0.000 -4.122) 4.732 5.897 ( 1.963 0.000 3.088) 3.659 5.998 ( 1.933 0.000 3.007) 3.575 6.042 ( 2.104 0.000 -3.164) 3.800 6.179 ( -0.939 0.000 -1.974) 2.186 6.472 ( -0.215 0.000 -2.112) 2.123 6.703 ( 1.591 0.000 10.522) 10.641 6.707 ( -3.033 0.000 1.740) 3.496 6.823 ( -0.036 0.000 -3.517) 3.517 6.834 ( 0.612 0.000 -3.773) 3.823 7.034 ( -6.540 0.000 -3.741) 7.534 7.197 ( 1.336 0.000 0.783) 1.548 7.364 ( -3.838 0.000 3.872) 5.452 7.599 ( -0.041 0.000 8.780) 8.780 7.929 ( -2.038 0.000 -0.220) 2.050 7.998 ( -2.571 0.000 -4.314) 5.022 8.146 ( 1.781 0.000 3.807) 4.203 8.343 ( -0.241 0.000 -7.519) 7.523 13.365 ( -3.386 0.000 -0.033) 3.386 13.457 ( 1.040 0.000 3.659) 3.804 13.809 ( -1.783 0.000 2.337) 2.939 13.865 ( -2.288 0.000 -2.535) 3.415 14.235 ( -1.489 0.000 -1.423) 2.059 14.268 ( 1.074 0.000 0.179) 1.089 14.300 ( 1.073 0.000 1.883) 2.167 14.335 ( -1.403 0.000 -5.672) 5.843 16.617 ( -4.043 0.000 -0.503) 4.074 16.734 ( 1.403 0.000 1.937) 2.392 17.026 ( -0.793 0.000 -2.266) 2.401 17.041 ( 2.581 0.000 2.396) 3.522 27.859 ( -1.455 0.000 1.457) 2.059 28.048 ( 1.416 0.000 -3.935) 4.182 28.190 ( -2.293 0.000 3.826) 4.460 28.362 ( -0.894 0.000 -0.971) 1.320 28.762 ( -0.742 0.000 -0.398) 0.842 28.767 ( -0.080 0.000 1.230) 1.232 28.817 ( 0.729 0.000 0.490) 0.878 28.841 ( -0.044 0.000 -0.830) 0.831 28.975 ( 0.286 0.000 0.481) 0.560 29.000 ( 0.108 0.000 -1.038) 1.044 29.063 ( -0.443 0.000 0.625) 0.766 29.101 ( 0.312 0.000 -0.034) 0.314 31.387 ( 2.905 0.000 6.937) 7.521 31.437 ( -6.765 0.000 0.645) 6.796 31.565 ( 0.383 0.000 -5.374) 5.388 31.971 ( 1.697 0.000 3.576) 3.958 32.036 ( -8.695 0.000 -4.504) 9.792 32.130 ( -0.880 0.000 -0.265) 0.919 32.930 ( 6.032 0.000 7.373) 9.526 33.058 ( 2.718 0.000 -10.778) 11.116 70.105 ( -0.977 0.000 1.150) 1.509 70.214 ( 0.242 0.000 -2.305) 2.317 70.356 ( -0.808 0.000 1.966) 2.126 70.395 ( -0.922 0.000 -0.540) 1.068 ======================= Grid point 85 (33/112) ======================= q-point: (-0.27 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.393 ( -27.091 0.000 0.572) 27.097 1.672 ( -29.507 0.000 19.512) 35.375 2.008 ( -27.209 0.000 -21.016) 34.380 2.347 ( -23.330 0.000 -3.111) 23.537 2.412 ( 4.805 0.000 -1.911) 5.171 2.801 ( -6.302 0.000 -2.744) 6.874 2.825 ( -1.196 0.000 3.023) 3.251 2.900 ( 13.048 0.000 -10.208) 16.566 3.287 ( 4.183 0.000 0.319) 4.195 3.400 ( 10.389 0.000 3.699) 11.028 3.567 ( 1.520 0.000 8.191) 8.330 3.596 ( -0.926 0.000 12.499) 12.534 3.692 ( 8.133 0.000 -1.765) 8.323 3.781 ( -9.468 0.000 4.422) 10.449 3.961 ( 9.269 0.000 -0.580) 9.287 4.130 ( 14.193 0.000 0.280) 14.195 4.254 ( 1.250 0.000 -12.214) 12.278 4.381 ( 7.476 0.000 -0.169) 7.478 4.546 ( 3.234 0.000 4.755) 5.751 4.623 ( 5.725 0.000 -8.051) 9.879 4.737 ( 11.580 0.000 -6.284) 13.175 4.942 ( 0.647 0.000 4.693) 4.738 4.977 ( 5.969 0.000 1.432) 6.139 5.061 ( 1.053 0.000 7.864) 7.934 5.168 ( 2.725 0.000 0.036) 2.725 5.301 ( -3.187 0.000 4.695) 5.675 5.387 ( 1.769 0.000 -1.714) 2.463 5.458 ( 5.750 0.000 -5.606) 8.030 5.463 ( 0.415 0.000 -1.679) 1.729 5.688 ( 2.774 0.000 5.545) 6.200 5.725 ( -0.022 0.000 -2.412) 2.412 5.888 ( -4.901 0.000 0.749) 4.958 6.053 ( 2.671 0.000 -1.256) 2.952 6.080 ( 6.153 0.000 -1.896) 6.439 6.161 ( -0.228 0.000 -0.922) 0.950 6.399 ( -4.228 0.000 -4.913) 6.481 6.617 ( -7.582 0.000 -0.200) 7.585 6.726 ( -2.446 0.000 -0.047) 2.447 6.788 ( -0.784 0.000 -1.573) 1.758 6.928 ( 6.583 0.000 6.122) 8.990 6.930 ( -2.569 0.000 -0.250) 2.581 7.223 ( 0.504 0.000 1.122) 1.231 7.384 ( 1.968 0.000 5.044) 5.415 7.676 ( -1.702 0.000 11.893) 12.015 7.871 ( -3.415 0.000 -0.847) 3.518 7.927 ( -0.979 0.000 -2.936) 3.095 8.196 ( 0.499 0.000 2.147) 2.204 8.252 ( -0.653 0.000 -11.278) 11.297 13.315 ( -2.243 0.000 0.525) 2.303 13.511 ( 0.982 0.000 4.155) 4.270 13.789 ( -2.964 0.000 3.192) 4.355 13.808 ( -1.736 0.000 -1.920) 2.589 14.197 ( -1.356 0.000 -1.201) 1.812 14.251 ( -1.892 0.000 -6.608) 6.874 14.280 ( 0.670 0.000 -1.097) 1.285 14.323 ( -0.632 0.000 2.332) 2.417 16.542 ( -3.988 0.000 0.198) 3.993 16.772 ( 1.178 0.000 1.103) 1.614 16.988 ( -0.805 0.000 -2.993) 3.100 17.102 ( 2.202 0.000 1.642) 2.747 27.845 ( -1.441 0.000 1.491) 2.074 28.028 ( 0.630 0.000 -4.763) 4.805 28.193 ( -1.523 0.000 4.462) 4.715 28.328 ( -1.980 0.000 -0.909) 2.178 28.749 ( -0.238 0.000 -0.393) 0.460 28.776 ( -0.093 0.000 1.347) 1.350 28.829 ( -0.457 0.000 -0.960) 1.063 28.835 ( 0.628 0.000 0.414) 0.752 28.985 ( 0.285 0.000 0.421) 0.509 28.993 ( 0.111 0.000 -0.975) 0.982 29.059 ( -0.554 0.000 0.427) 0.700 29.107 ( 0.384 0.000 -0.061) 0.389 31.314 ( -5.643 0.000 -2.321) 6.102 31.492 ( 2.452 0.000 5.532) 6.051 31.527 ( -0.168 0.000 -4.236) 4.239 31.854 ( -7.980 0.000 -2.396) 8.332 31.976 ( -4.994 0.000 3.459) 6.076 32.106 ( -1.156 0.000 -0.557) 1.283 33.076 ( 9.254 0.000 -9.655) 13.374 33.089 ( 4.236 0.000 8.256) 9.279 70.096 ( -1.191 0.000 1.259) 1.733 70.197 ( 0.002 0.000 -2.140) 2.140 70.356 ( -0.865 0.000 1.583) 1.804 70.371 ( -1.159 0.000 -0.608) 1.309 ======================= Grid point 86 (34/112) ======================= q-point: (-0.18 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.940 ( -26.080 0.000 7.744) 27.206 1.221 ( -33.299 0.000 -5.528) 33.754 1.413 ( -29.270 0.000 20.477) 35.722 1.910 ( -23.340 0.000 2.096) 23.434 2.466 ( 3.025 0.000 -9.130) 9.618 2.710 ( -3.475 0.000 8.185) 8.892 2.836 ( 1.232 0.000 0.450) 1.312 3.116 ( 18.886 0.000 -8.147) 20.568 3.239 ( -4.755 0.000 -2.575) 5.408 3.517 ( -5.160 0.000 2.160) 5.594 3.611 ( -13.088 0.000 5.391) 14.155 3.655 ( 9.902 0.000 5.823) 11.488 3.716 ( -3.083 0.000 4.611) 5.547 3.756 ( 3.132 0.000 0.964) 3.277 4.211 ( 18.568 0.000 -3.316) 18.862 4.240 ( 6.588 0.000 -8.467) 10.728 4.291 ( 5.312 0.000 -4.780) 7.146 4.588 ( 13.969 0.000 -0.661) 13.985 4.622 ( 4.386 0.000 -2.607) 5.102 4.693 ( 4.140 0.000 0.629) 4.187 4.927 ( 13.041 0.000 -2.406) 13.261 4.972 ( -1.911 0.000 3.698) 4.163 5.094 ( 4.559 0.000 0.944) 4.656 5.156 ( 4.534 0.000 3.571) 5.771 5.204 ( 1.557 0.000 -0.030) 1.557 5.304 ( 3.091 0.000 0.275) 3.103 5.352 ( -2.848 0.000 -3.831) 4.773 5.474 ( 1.184 0.000 0.938) 1.511 5.543 ( 5.081 0.000 0.193) 5.084 5.655 ( -5.318 0.000 -3.624) 6.435 5.697 ( -2.178 0.000 -4.360) 4.874 5.784 ( -8.507 0.000 6.143) 10.493 6.056 ( 2.435 0.000 -7.347) 7.740 6.117 ( -4.300 0.000 -1.656) 4.608 6.218 ( 7.638 0.000 1.597) 7.803 6.286 ( -6.757 0.000 2.484) 7.199 6.453 ( -5.485 0.000 -7.155) 9.016 6.684 ( -1.665 0.000 -0.482) 1.734 6.782 ( -2.059 0.000 5.710) 6.070 6.917 ( 0.090 0.000 1.235) 1.238 7.088 ( 5.162 0.000 3.934) 6.490 7.233 ( -0.174 0.000 0.940) 0.956 7.518 ( 6.788 0.000 6.421) 9.344 7.687 ( -2.770 0.000 -4.848) 5.583 7.791 ( -3.867 0.000 -2.907) 4.838 7.935 ( -0.862 0.000 3.014) 3.135 8.183 ( 3.776 0.000 1.179) 3.955 8.204 ( -0.799 0.000 1.349) 1.567 13.293 ( -1.008 0.000 1.087) 1.482 13.553 ( 0.683 0.000 0.844) 1.086 13.765 ( -3.161 0.000 4.314) 5.348 13.773 ( -0.469 0.000 -1.407) 1.483 14.166 ( -1.175 0.000 -2.006) 2.324 14.174 ( -0.956 0.000 -1.190) 1.527 14.273 ( 0.265 0.000 -2.806) 2.818 14.322 ( -1.782 0.000 3.321) 3.769 16.479 ( -3.376 0.000 0.826) 3.476 16.774 ( -0.494 0.000 -4.790) 4.815 16.953 ( -0.425 0.000 -1.661) 1.714 17.146 ( 1.489 0.000 0.655) 1.627 27.835 ( -1.104 0.000 1.374) 1.763 27.995 ( 0.605 0.000 -5.073) 5.108 28.204 ( -1.534 0.000 4.025) 4.307 28.280 ( -2.293 0.000 -0.869) 2.452 28.750 ( 0.686 0.000 -0.271) 0.737 28.783 ( -0.154 0.000 0.400) 0.429 28.811 ( -0.581 0.000 -0.560) 0.808 28.842 ( -0.206 0.000 0.254) 0.327 28.988 ( 0.173 0.000 -0.753) 0.773 28.992 ( 0.172 0.000 0.299) 0.345 29.052 ( -0.584 0.000 0.528) 0.788 29.113 ( 0.405 0.000 -0.111) 0.420 31.204 ( -3.656 0.000 -3.064) 4.770 31.481 ( -1.435 0.000 -3.485) 3.769 31.562 ( 1.171 0.000 2.625) 2.874 31.716 ( -6.200 0.000 0.740) 6.244 31.864 ( -8.884 0.000 1.984) 9.103 32.084 ( -0.076 0.000 -2.018) 2.019 33.209 ( 11.825 0.000 -5.611) 13.089 33.242 ( 3.902 0.000 12.627) 13.216 70.085 ( -1.233 0.000 1.252) 1.757 70.179 ( 0.047 0.000 -1.903) 1.904 70.346 ( -0.979 0.000 -0.641) 1.170 70.348 ( -1.028 0.000 0.120) 1.035 ======================= Grid point 87 (35/112) ======================= q-point: (-0.09 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.628 ( -20.419 0.000 21.393) 29.574 0.629 ( -25.949 0.000 12.207) 28.677 1.197 ( -28.630 0.000 47.480) 55.444 1.603 ( -12.150 0.000 6.179) 13.631 2.352 ( -0.309 0.000 -17.223) 17.226 2.814 ( -0.391 0.000 18.259) 18.263 2.882 ( 5.371 0.000 -4.292) 6.875 3.112 ( -6.592 0.000 -2.568) 7.075 3.322 ( 2.001 0.000 -1.107) 2.287 3.440 ( -9.626 0.000 5.918) 11.300 3.497 ( 1.858 0.000 -0.165) 1.865 3.701 ( 11.612 0.000 -7.095) 13.608 3.802 ( -0.443 0.000 0.580) 0.730 3.824 ( 3.618 0.000 3.504) 5.037 4.274 ( 3.985 0.000 -7.678) 8.650 4.319 ( 3.818 0.000 -2.531) 4.580 4.522 ( 19.028 0.000 -5.186) 19.722 4.652 ( 1.316 0.000 -6.315) 6.451 4.738 ( 0.033 0.000 1.596) 1.596 4.774 ( 8.126 0.000 -6.827) 10.613 4.920 ( -6.702 0.000 1.743) 6.925 5.124 ( -2.481 0.000 3.354) 4.172 5.143 ( 1.136 0.000 -5.856) 5.965 5.164 ( 2.222 0.000 -5.315) 5.761 5.238 ( 3.249 0.000 -1.986) 3.808 5.313 ( 3.041 0.000 3.044) 4.303 5.444 ( 7.509 0.000 -6.342) 9.829 5.491 ( -0.588 0.000 -2.777) 2.838 5.501 ( 0.352 0.000 -0.948) 1.011 5.596 ( -7.489 0.000 -0.911) 7.545 5.636 ( 2.753 0.000 1.635) 3.202 5.697 ( -3.985 0.000 7.306) 8.322 5.937 ( -13.029 0.000 -4.782) 13.879 6.046 ( -1.136 0.000 -2.174) 2.454 6.166 ( -6.508 0.000 5.236) 8.353 6.350 ( 5.515 0.000 1.016) 5.608 6.363 ( 0.902 0.000 -5.639) 5.711 6.644 ( -2.685 0.000 -2.205) 3.475 6.798 ( -2.616 0.000 7.460) 7.905 6.946 ( 0.957 0.000 2.711) 2.875 7.122 ( -6.429 0.000 -11.370) 13.062 7.175 ( -5.309 0.000 -6.401) 8.316 7.488 ( -3.059 0.000 -8.615) 9.142 7.656 ( -1.933 0.000 -7.015) 7.277 7.723 ( 3.657 0.000 7.373) 8.230 7.888 ( -1.584 0.000 -0.779) 1.766 8.212 ( -0.046 0.000 3.745) 3.745 8.609 ( 26.508 0.000 27.168) 37.957 13.291 ( -0.552 0.000 1.408) 1.513 13.528 ( -0.810 0.000 -6.386) 6.437 13.720 ( -5.138 0.000 -0.670) 5.182 13.764 ( 0.522 0.000 -1.261) 1.365 14.146 ( -0.351 0.000 -0.346) 0.493 14.242 ( -0.660 0.000 -2.990) 3.062 14.276 ( 9.685 0.000 15.104) 17.942 14.328 ( -0.668 0.000 3.432) 3.496 16.435 ( -2.335 0.000 1.057) 2.563 16.610 ( -9.667 0.000 -13.792) 16.842 16.951 ( 0.263 0.000 0.958) 0.994 17.165 ( 0.507 0.000 -0.487) 0.703 27.827 ( -0.921 0.000 0.939) 1.315 27.968 ( 1.274 0.000 -4.782) 4.949 28.195 ( -2.930 0.000 2.703) 3.986 28.239 ( -1.302 0.000 -0.595) 1.431 28.767 ( 1.389 0.000 -0.244) 1.410 28.771 ( -0.982 0.000 -0.935) 1.356 28.799 ( -0.383 0.000 -0.479) 0.613 28.831 ( -1.084 0.000 0.190) 1.100 28.988 ( 0.358 0.000 -0.307) 0.472 28.996 ( 0.007 0.000 0.154) 0.154 29.056 ( 0.394 0.000 1.760) 1.804 29.119 ( 0.279 0.000 -0.176) 0.329 31.143 ( -0.593 0.000 -0.142) 0.610 31.424 ( -2.076 0.000 1.380) 2.493 31.578 ( -0.439 0.000 -0.110) 0.452 31.653 ( -3.278 0.000 4.419) 5.502 31.724 ( -6.655 0.000 -0.538) 6.677 32.065 ( 0.438 0.000 -3.233) 3.263 33.377 ( 9.176 0.000 -1.128) 9.245 33.531 ( 14.816 0.000 19.873) 24.788 70.073 ( -1.085 0.000 1.044) 1.506 70.165 ( 0.170 0.000 -2.257) 2.263 70.300 ( -3.807 0.000 -2.706) 4.671 70.327 ( -0.434 0.000 -0.653) 0.784 ======================= Grid point 88 (36/112) ======================= q-point: ( 0.00 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.797 ( -6.982 17.241 20.178) 27.444 0.806 ( 0.318 15.822 22.106) 27.187 1.584 ( -3.844 20.885 41.389) 46.519 1.712 ( 2.157 12.165 13.964) 18.644 2.209 ( 2.782 -0.700 -16.918) 17.159 2.884 ( -3.197 -3.069 -2.008) 4.865 2.923 ( 3.663 -3.247 10.829) 11.884 3.086 ( -0.076 4.924 7.811) 9.234 3.223 ( -0.084 -6.087 3.426) 6.985 3.290 ( -5.244 -2.504 0.114) 5.812 3.510 ( 0.666 0.653 -3.719) 3.835 3.785 ( 0.844 -2.915 4.327) 5.285 3.807 ( -1.987 2.427 -11.373) 11.798 4.159 ( 14.741 5.591 -0.919) 15.792 4.262 ( 0.733 -0.253 -3.703) 3.784 4.332 ( -5.360 -5.523 4.835) 9.089 4.485 ( 0.062 -2.305 -11.949) 12.170 4.641 ( 4.167 1.857 -12.297) 13.116 4.729 ( -9.048 -0.741 -9.115) 12.865 4.782 ( 4.724 -0.277 -0.247) 4.739 4.820 ( -1.865 5.109 -2.863) 6.146 4.914 ( -0.215 4.550 -0.630) 4.599 5.089 ( -4.004 0.623 3.011) 5.049 5.236 ( 2.097 -4.532 -0.288) 5.002 5.275 ( -4.102 -1.042 -0.188) 4.237 5.363 ( -2.233 3.560 -0.947) 4.308 5.401 ( -1.642 1.558 -5.047) 5.531 5.453 ( -0.896 1.357 0.753) 1.792 5.534 ( 0.633 1.776 -2.942) 3.494 5.634 ( 3.009 0.188 -1.362) 3.308 5.666 ( -4.812 -0.543 0.187) 4.847 5.755 ( 1.852 3.286 -1.026) 3.909 5.918 ( 3.977 4.297 1.111) 5.959 5.989 ( 3.534 0.597 2.540) 4.393 6.214 ( -1.539 -4.994 5.318) 7.456 6.231 ( 0.341 -8.569 4.831) 9.842 6.393 ( 2.094 4.890 -3.505) 6.370 6.505 ( 0.291 -0.120 -3.131) 3.147 6.747 ( -0.822 -0.871 8.700) 8.782 6.978 ( -0.313 -0.500 3.121) 3.176 7.076 ( -2.739 8.249 -2.454) 9.032 7.174 ( -0.851 3.902 -2.381) 4.650 7.447 ( -0.315 -2.109 -3.546) 4.138 7.550 ( -1.481 0.578 -6.247) 6.446 7.837 ( -0.177 -0.960 3.844) 3.966 7.895 ( 2.226 0.953 2.252) 3.306 8.225 ( 1.191 -4.845 7.551) 9.050 8.675 ( -2.276 -17.655 8.263) 19.626 13.338 ( -0.956 2.759 -1.056) 3.105 13.476 ( 1.135 0.198 -2.796) 3.024 13.611 ( -3.438 -0.045 2.322) 4.149 13.757 ( 0.963 -0.858 -1.311) 1.839 14.144 ( 0.335 -0.129 0.066) 0.365 14.186 ( -0.108 -1.909 -0.625) 2.012 14.315 ( 1.206 -5.067 4.368) 6.797 14.344 ( -0.479 -4.076 3.438) 5.354 16.496 ( -0.915 3.161 0.075) 3.292 16.780 ( 2.481 9.573 -14.431) 17.494 17.037 ( 2.789 7.380 -2.258) 8.207 17.172 ( -0.421 1.460 -1.679) 2.264 27.959 ( 0.277 3.537 -5.511) 6.554 28.018 ( 0.161 7.938 -8.644) 11.737 28.167 ( -0.567 -0.730 2.129) 2.321 28.227 ( 0.386 -0.208 -0.175) 0.472 28.747 ( -0.876 0.089 0.502) 1.014 28.787 ( 0.582 -0.020 -0.418) 0.717 28.801 ( 0.462 -0.222 0.350) 0.621 28.812 ( -0.269 -0.166 0.023) 0.317 28.984 ( -0.002 -0.171 0.122) 0.211 29.013 ( 0.350 0.896 -0.409) 1.045 29.071 ( 0.082 -0.664 1.450) 1.597 29.128 ( 0.081 0.632 -0.337) 0.721 31.175 ( 1.473 -0.950 3.992) 4.360 31.397 ( 6.826 -8.026 1.758) 10.682 31.580 ( 2.315 0.583 -0.211) 2.397 31.636 ( -2.174 1.735 -0.356) 2.804 31.770 ( -5.172 7.627 -0.278) 9.219 32.064 ( 1.626 1.667 -3.966) 4.599 33.001 ( -10.648 -36.198 33.843) 50.686 33.405 ( 4.463 -9.800 1.650) 10.894 70.160 ( -0.188 1.313 -1.654) 2.120 70.216 ( 0.359 6.501 -5.998) 8.852 70.237 ( 0.274 -0.049 1.467) 1.493 70.320 ( 0.170 0.041 -0.725) 0.746 ======================= Grid point 89 (37/112) ======================= q-point: ( 0.09 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.935 ( 2.645 16.202 21.051) 26.695 1.076 ( 7.954 14.388 19.178) 25.260 1.875 ( 11.419 5.302 4.029) 13.219 2.108 ( 11.967 15.913 40.933) 45.519 2.145 ( 7.210 -0.151 -16.561) 18.063 2.766 ( -7.208 -0.592 3.496) 8.033 3.077 ( -0.397 -3.967 13.769) 14.335 3.180 ( 2.177 -0.558 6.992) 7.344 3.190 ( -0.846 -0.379 -4.521) 4.615 3.334 ( 6.266 -1.248 5.187) 8.229 3.484 ( 0.050 2.899 -2.742) 3.991 3.632 ( -5.923 0.662 -10.028) 11.665 3.820 ( -1.966 0.983 4.496) 5.005 4.116 ( -6.480 6.722 -5.136) 10.656 4.209 ( -3.394 -6.323 -4.415) 8.426 4.285 ( -4.222 -6.759 -1.357) 8.084 4.416 ( -4.506 -1.852 -18.930) 19.547 4.484 ( -8.267 0.429 -6.833) 10.734 4.695 ( 8.337 7.124 -10.231) 14.997 4.735 ( 0.895 3.883 3.314) 5.182 4.798 ( -1.895 2.774 -0.622) 3.417 4.928 ( -0.157 -0.739 -0.246) 0.795 5.060 ( -1.693 2.348 3.793) 4.771 5.135 ( -10.024 2.945 2.180) 10.673 5.249 ( -3.015 4.326 -5.961) 7.959 5.323 ( 5.373 -7.644 1.295) 9.432 5.356 ( -2.442 0.028 -1.930) 3.113 5.425 ( -2.555 -2.360 1.080) 3.642 5.543 ( -4.393 -0.501 -0.284) 4.430 5.578 ( -3.717 1.314 0.176) 3.947 5.673 ( 6.265 -2.152 -0.253) 6.629 5.812 ( 7.182 2.027 -3.492) 8.239 5.998 ( 2.569 -1.363 -1.098) 3.109 6.139 ( 9.564 0.316 -0.405) 9.577 6.203 ( -2.839 -4.335 1.214) 5.322 6.298 ( 3.434 -7.115 2.484) 8.282 6.442 ( 2.716 2.597 -0.180) 3.762 6.488 ( 1.330 1.113 -4.951) 5.246 6.825 ( 0.467 0.246 8.858) 8.874 6.983 ( -1.864 -0.854 2.422) 3.173 7.063 ( 1.867 8.973 1.557) 9.296 7.155 ( -0.075 3.177 -0.901) 3.303 7.373 ( -2.665 1.180 -3.886) 4.857 7.508 ( 0.343 -1.988 -3.195) 3.779 7.827 ( -3.457 -1.648 2.442) 4.542 7.945 ( 1.980 2.853 0.468) 3.504 8.292 ( -2.263 -5.571 8.379) 10.313 8.566 ( -10.041 -8.475 1.600) 13.236 13.312 ( -1.111 1.760 0.448) 2.129 13.458 ( -1.109 -0.063 -2.025) 2.309 13.619 ( 2.017 0.384 0.806) 2.206 13.770 ( 1.664 -0.441 -0.752) 1.878 14.153 ( 0.747 -0.877 -0.214) 1.172 14.191 ( 1.497 0.015 -1.060) 1.834 14.356 ( 0.199 -4.112 3.319) 5.288 14.359 ( -0.564 -3.376 2.526) 4.255 16.456 ( -1.719 3.094 -0.120) 3.542 16.733 ( 1.969 4.723 -7.431) 9.023 17.069 ( 1.192 4.668 -0.096) 4.819 17.147 ( -0.103 2.357 -2.072) 3.140 27.882 ( -2.078 5.800 -3.087) 6.891 28.004 ( 2.418 2.452 -3.672) 5.034 28.167 ( -0.784 -0.882 1.377) 1.813 28.254 ( 2.265 -0.383 0.151) 2.302 28.738 ( -0.507 -0.006 0.152) 0.529 28.774 ( -1.005 0.139 -0.066) 1.017 28.813 ( 0.700 -0.672 -0.156) 0.982 28.826 ( 0.919 -0.127 0.312) 0.979 28.985 ( -0.125 -0.115 0.232) 0.287 29.014 ( 0.281 0.792 -0.486) 0.971 29.073 ( -0.781 -0.127 1.333) 1.550 29.123 ( -0.277 0.644 -0.563) 0.899 31.247 ( 2.234 -1.183 4.793) 5.419 31.500 ( 2.482 -4.716 -6.077) 8.083 31.572 ( -0.085 3.967 -1.401) 4.208 31.642 ( 1.914 -0.708 2.339) 3.104 31.741 ( 2.318 0.372 3.102) 3.890 32.077 ( 3.414 2.761 -3.568) 5.658 33.027 ( -9.832 -22.924 13.552) 28.387 33.468 ( -0.999 -9.285 4.392) 10.319 70.110 ( -1.888 3.208 -0.997) 3.854 70.213 ( 1.640 1.660 -0.300) 2.353 70.264 ( 1.315 0.587 -1.576) 2.135 70.327 ( 1.273 -0.022 -0.569) 1.395 ======================= Grid point 90 (38/112) ======================= q-point: ( 0.18 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.229 ( 10.138 13.511 18.679) 25.184 1.426 ( 15.078 12.599 14.252) 24.274 2.082 ( 13.410 1.003 -9.126) 16.252 2.148 ( 11.102 2.042 -16.814) 20.252 2.627 ( 4.007 0.354 15.627) 16.137 2.815 ( 8.995 7.289 21.402) 24.333 3.091 ( 0.568 1.266 -6.758) 6.899 3.161 ( -6.835 0.203 17.225) 18.533 3.308 ( 2.285 -4.080 6.573) 8.066 3.425 ( -5.358 2.090 -7.138) 9.167 3.480 ( -2.001 -0.086 2.235) 3.002 3.530 ( 8.112 2.308 4.858) 9.733 3.773 ( -7.148 5.479 2.634) 9.384 3.941 ( -6.134 3.990 -6.778) 9.974 4.118 ( -10.364 -1.528 -15.078) 18.360 4.162 ( 1.000 -3.948 -4.269) 5.900 4.206 ( 0.554 -4.022 -4.648) 6.172 4.285 ( -5.840 0.412 -4.592) 7.440 4.521 ( -15.005 5.596 -0.141) 16.015 4.673 ( 1.799 4.781 -6.942) 8.619 4.877 ( -4.224 -1.482 -3.355) 5.594 4.961 ( 3.629 1.469 -0.215) 3.921 5.007 ( -4.716 1.127 3.481) 5.968 5.096 ( -0.002 1.131 2.876) 3.091 5.155 ( -3.309 2.638 -3.036) 5.208 5.240 ( -8.178 -0.880 1.873) 8.436 5.372 ( -4.227 -2.716 -0.108) 5.025 5.396 ( 0.316 -5.655 1.279) 5.807 5.519 ( 2.109 -1.217 0.232) 2.446 5.550 ( 1.359 -1.576 -0.976) 2.299 5.786 ( 5.421 -0.417 1.531) 5.649 5.910 ( 3.589 -1.222 -1.174) 3.969 5.961 ( -2.525 -3.740 -4.508) 6.378 6.134 ( -2.945 -1.213 -1.198) 3.403 6.323 ( 7.887 -3.595 -0.112) 8.668 6.380 ( 3.024 -3.293 1.461) 4.703 6.447 ( 0.763 3.756 -3.651) 5.293 6.482 ( 2.407 1.116 -1.949) 3.292 6.904 ( 0.661 -0.097 6.403) 6.437 6.960 ( -2.100 0.610 1.709) 2.775 7.102 ( 0.490 3.132 -1.628) 3.564 7.170 ( 0.358 5.780 4.318) 7.224 7.304 ( -2.238 2.356 -1.526) 3.590 7.485 ( -1.457 -1.731 -0.671) 2.360 7.796 ( -0.248 -2.808 1.706) 3.295 7.987 ( 3.010 4.101 -0.442) 5.106 8.268 ( -6.598 -5.065 4.637) 9.523 8.431 ( -3.992 -4.606 -1.863) 6.374 13.310 ( 0.162 0.853 1.272) 1.540 13.419 ( -1.220 0.090 -1.469) 1.912 13.671 ( 3.114 0.564 -0.091) 3.166 13.810 ( 2.965 -0.271 0.339) 2.997 14.168 ( 1.321 -1.067 -0.960) 1.951 14.214 ( 1.650 0.839 -0.502) 1.918 14.356 ( -1.699 -3.408 0.852) 3.902 14.393 ( 1.202 -2.520 2.330) 3.637 16.455 ( 1.480 -0.377 0.038) 1.528 16.709 ( 0.379 2.268 -3.084) 3.847 17.059 ( -1.155 3.003 -1.750) 3.662 17.146 ( 0.582 4.296 0.026) 4.335 27.847 ( -0.268 3.596 -0.721) 3.677 28.014 ( 1.956 2.470 -3.410) 4.643 28.176 ( 0.128 -1.132 2.256) 2.528 28.300 ( 2.332 -0.519 0.261) 2.403 28.732 ( -0.162 -0.002 -0.057) 0.171 28.762 ( -0.310 0.164 0.235) 0.422 28.817 ( 0.024 -0.681 -0.660) 0.948 28.842 ( 0.505 -0.342 0.371) 0.714 28.982 ( -0.280 0.242 -0.017) 0.370 29.016 ( 0.340 0.388 -0.473) 0.700 29.071 ( -0.747 0.206 1.247) 1.468 29.111 ( -0.350 0.509 -0.634) 0.885 31.313 ( 0.924 -1.267 -0.621) 1.687 31.411 ( -2.435 2.617 -1.081) 3.735 31.642 ( 5.795 -1.733 -2.525) 6.554 31.698 ( 1.645 -0.876 3.181) 3.687 31.856 ( 5.895 -1.540 4.358) 7.491 32.122 ( 4.782 4.813 -3.438) 7.606 32.914 ( -9.716 -15.754 3.254) 18.793 33.440 ( -5.521 -6.439 3.847) 9.314 70.088 ( -0.318 1.575 0.011) 1.607 70.247 ( 1.964 1.457 0.261) 2.459 70.262 ( 0.212 -0.198 -1.549) 1.576 70.353 ( 1.825 0.312 -0.177) 1.860 ======================= Grid point 91 (39/112) ======================= q-point: ( 0.27 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.605 ( 15.523 7.540 13.930) 22.178 1.852 ( 19.606 11.369 9.279) 24.490 2.217 ( 12.299 -0.031 -11.002) 16.502 2.256 ( 15.453 4.209 -15.218) 22.093 2.707 ( 0.910 -2.222 2.616) 3.551 2.932 ( -1.092 -0.490 -6.025) 6.142 3.096 ( -9.664 -1.945 8.796) 13.211 3.173 ( -6.724 4.218 2.048) 8.197 3.343 ( -5.005 3.748 4.638) 7.785 3.431 ( -2.004 5.274 8.187) 9.943 3.450 ( 2.255 2.885 9.242) 9.941 3.598 ( -11.866 5.138 1.579) 13.027 3.672 ( 0.381 1.930 3.353) 3.888 3.848 ( 1.459 -0.636 -5.376) 5.607 3.882 ( 0.701 0.145 -2.279) 2.388 4.073 ( -4.177 0.056 -5.784) 7.135 4.226 ( 0.490 -3.209 -2.615) 4.169 4.280 ( 6.283 1.466 0.738) 6.494 4.355 ( -1.385 2.560 1.467) 3.260 4.626 ( -1.160 -0.268 -10.275) 10.344 4.746 ( -3.777 2.967 -3.427) 5.900 4.895 ( -5.014 3.451 -4.568) 7.610 5.001 ( -1.746 -3.749 4.346) 5.999 5.030 ( -6.657 -0.027 0.793) 6.704 5.101 ( -8.143 -0.489 5.653) 9.925 5.161 ( 0.778 1.663 -0.800) 2.003 5.312 ( -1.099 -1.184 -1.348) 2.104 5.380 ( -2.485 -1.148 1.396) 3.073 5.548 ( -2.699 -7.593 0.358) 8.066 5.566 ( 1.525 -4.768 -0.123) 5.007 5.807 ( -1.510 -0.530 -2.328) 2.825 5.877 ( -3.606 -5.029 -3.070) 6.908 5.968 ( 2.078 1.886 4.417) 5.233 6.063 ( -3.599 0.186 -3.651) 5.130 6.352 ( -0.416 4.573 -6.068) 7.610 6.417 ( 0.939 -0.301 1.957) 2.191 6.470 ( 3.505 2.871 -0.808) 4.602 6.574 ( 4.912 -6.363 3.668) 8.836 6.917 ( -2.130 -0.305 0.304) 2.173 6.981 ( 0.607 1.284 4.639) 4.852 7.065 ( -1.957 -0.075 -2.766) 3.389 7.207 ( 0.090 3.474 4.497) 5.684 7.285 ( 0.888 2.386 0.913) 2.705 7.457 ( -0.429 0.531 -0.436) 0.810 7.856 ( 4.212 -3.475 1.532) 5.671 8.038 ( 1.187 2.171 0.001) 2.474 8.165 ( -4.341 -1.919 -0.556) 4.779 8.381 ( 0.003 -3.490 -2.842) 4.501 13.338 ( 1.275 -0.598 1.482) 2.044 13.395 ( -0.333 0.394 -0.221) 0.561 13.726 ( 3.052 0.962 -0.110) 3.202 13.878 ( 3.542 -0.344 1.057) 3.712 14.181 ( 1.231 -0.772 -1.353) 1.986 14.242 ( 1.723 0.980 -0.138) 1.987 14.312 ( -2.684 -2.652 -1.302) 3.991 14.431 ( 1.120 -1.630 1.091) 2.259 16.499 ( 3.018 -3.274 0.076) 4.453 16.695 ( -0.241 0.251 -0.367) 0.505 17.018 ( -1.174 3.672 -2.122) 4.400 17.153 ( -0.351 4.530 0.733) 4.602 27.851 ( 0.659 2.496 0.310) 2.600 28.018 ( 1.702 2.277 -3.032) 4.156 28.204 ( 0.283 -0.943 2.807) 2.975 28.336 ( 1.526 -1.036 -0.122) 1.849 28.732 ( 0.200 0.099 -0.114) 0.251 28.767 ( 0.361 0.099 0.510) 0.633 28.807 ( -0.369 -0.610 -0.585) 0.922 28.850 ( 0.118 -0.454 0.132) 0.487 28.976 ( -0.278 0.576 -0.139) 0.654 29.018 ( 0.382 0.197 -0.498) 0.658 29.068 ( -0.615 0.301 0.975) 1.191 29.101 ( -0.227 0.320 -0.470) 0.612 31.252 ( -1.697 1.476 -5.137) 5.608 31.444 ( 1.396 0.432 4.557) 4.786 31.706 ( 3.625 -1.550 -2.718) 4.789 31.746 ( 0.509 -0.399 2.699) 2.776 32.012 ( 6.316 -2.703 4.704) 8.326 32.189 ( 5.969 6.783 -2.938) 9.501 32.754 ( -8.379 -12.089 -1.597) 14.795 33.356 ( -6.015 -5.075 2.039) 8.130 70.091 ( 0.291 0.665 0.452) 0.855 70.249 ( 0.299 -0.328 -2.131) 2.177 70.286 ( 1.516 0.974 1.206) 2.168 70.385 ( 1.640 0.505 0.053) 1.717 ======================= Grid point 92 (40/112) ======================= q-point: ( 0.36 0.14 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.004 ( 16.553 2.480 9.019) 19.013 2.239 ( 16.878 7.495 1.036) 18.496 2.364 ( 12.119 1.980 -5.380) 13.406 2.445 ( 16.322 6.785 -7.432) 19.175 2.684 ( -4.509 -2.668 -2.765) 5.924 2.854 ( -3.083 2.766 -3.160) 5.210 2.944 ( -9.876 -6.059 4.184) 12.319 3.059 ( -6.547 4.822 0.242) 8.135 3.244 ( -6.482 6.873 -7.194) 11.875 3.294 ( -8.266 3.199 3.584) 9.561 3.369 ( -12.451 5.151 5.257) 14.463 3.496 ( -4.564 8.780 8.613) 13.119 3.785 ( 0.489 -2.391 3.615) 4.362 3.904 ( 8.832 -3.471 -6.714) 11.625 3.956 ( -0.991 2.940 7.642) 8.248 4.045 ( 5.082 1.088 -2.003) 5.569 4.170 ( -1.534 -0.915 -8.852) 9.030 4.401 ( 2.289 0.088 -0.724) 2.403 4.417 ( 3.624 0.444 -1.660) 4.011 4.501 ( 0.920 -2.743 3.219) 4.328 4.701 ( 1.534 2.397 -9.185) 9.615 4.782 ( -2.265 4.127 -1.326) 4.891 4.878 ( -9.074 -1.032 -2.531) 9.477 5.006 ( -2.820 3.444 -1.847) 4.819 5.041 ( -1.731 -3.891 10.582) 11.407 5.167 ( -3.239 -3.601 5.331) 7.203 5.299 ( -0.125 -1.229 -2.189) 2.513 5.345 ( -3.521 0.312 5.371) 6.430 5.465 ( -3.827 -4.531 -1.033) 6.020 5.570 ( 0.026 -6.636 -2.268) 7.013 5.772 ( -3.760 -1.677 -1.452) 4.366 5.791 ( 0.073 -2.414 -3.637) 4.366 5.932 ( -4.413 1.147 -2.732) 5.315 6.021 ( -1.704 2.972 4.782) 5.883 6.292 ( -0.961 4.263 -3.240) 5.440 6.463 ( 1.905 1.861 2.071) 3.374 6.519 ( 2.095 3.282 0.062) 3.894 6.670 ( 2.284 -5.079 2.573) 6.135 6.871 ( -2.655 -1.650 -0.394) 3.151 6.961 ( -4.597 2.531 1.452) 5.445 7.057 ( 2.629 -3.030 -1.084) 4.156 7.247 ( 0.431 -1.550 1.647) 2.303 7.362 ( 4.015 2.153 5.375) 7.046 7.460 ( 1.012 0.945 -0.713) 1.557 7.922 ( -0.303 -2.158 -0.149) 2.184 7.988 ( -1.391 -3.283 -0.718) 3.637 8.176 ( 3.836 4.049 -1.638) 5.813 8.368 ( 0.945 -2.814 -2.444) 3.845 13.362 ( 0.696 -1.119 -0.101) 1.321 13.411 ( 0.621 -0.647 2.308) 2.476 13.777 ( 2.384 1.426 0.255) 2.790 13.943 ( 2.516 -0.481 0.569) 2.624 14.191 ( 1.100 -0.474 -0.942) 1.524 14.249 ( -1.710 -1.339 -2.167) 3.068 14.273 ( 1.302 0.850 -0.255) 1.576 14.447 ( 0.165 -1.029 -0.343) 1.097 16.554 ( 2.848 -4.530 -0.135) 5.352 16.690 ( -0.794 -2.574 0.904) 2.841 16.989 ( -0.301 5.149 -0.895) 5.235 17.146 ( -0.949 4.239 0.479) 4.371 27.869 ( 0.698 2.018 0.898) 2.317 28.027 ( 2.000 1.971 -2.719) 3.908 28.225 ( -0.847 -0.797 2.880) 3.106 28.352 ( 0.744 -1.764 -0.767) 2.062 28.738 ( 0.462 0.156 0.056) 0.491 28.779 ( 0.332 0.115 0.455) 0.575 28.798 ( -0.186 -0.579 -0.093) 0.615 28.850 ( -0.099 -0.411 -0.183) 0.461 28.972 ( -0.129 0.783 0.004) 0.794 29.020 ( 0.319 0.304 -0.646) 0.782 29.066 ( -0.449 0.248 0.813) 0.961 29.095 ( -0.093 0.151 -0.209) 0.274 31.205 ( -0.061 2.189 -1.488) 2.648 31.504 ( 1.149 0.371 3.633) 3.829 31.728 ( -0.018 -1.459 0.149) 1.466 31.759 ( 0.163 -0.406 -0.282) 0.520 32.128 ( 4.181 0.858 -0.545) 4.303 32.315 ( 7.914 2.942 3.197) 9.028 32.587 ( -7.088 -8.211 -4.836) 11.877 33.268 ( -4.444 -5.046 -0.552) 6.747 70.102 ( 0.269 0.311 0.706) 0.817 70.237 ( 0.373 -0.694 -2.021) 2.169 70.320 ( 1.019 0.915 1.349) 1.922 70.410 ( 1.033 0.529 -0.014) 1.161 ======================= Grid point 93 (41/112) ======================= q-point: ( 0.45 0.14 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.310 ( 10.330 -0.124 3.432) 10.885 2.484 ( 6.750 0.383 -2.761) 7.303 2.526 ( -4.544 -2.119 2.084) 5.430 2.556 ( 9.632 4.575 -1.203) 10.731 2.673 ( 4.139 6.896 -4.684) 9.307 2.731 ( -0.934 1.817 1.631) 2.614 2.827 ( -6.381 2.071 2.423) 7.133 2.965 ( -3.263 1.762 -0.810) 3.796 3.134 ( -0.320 8.382 -2.281) 8.692 3.185 ( -1.037 6.112 -2.252) 6.596 3.308 ( -4.311 3.957 10.505) 12.025 3.473 ( -6.417 7.911 6.642) 12.161 3.757 ( -1.991 -0.717 -4.903) 5.341 3.892 ( -6.204 -0.045 -5.868) 8.540 4.015 ( 1.780 -1.291 2.812) 3.570 4.052 ( 3.712 3.473 -4.893) 7.056 4.109 ( 1.805 -3.028 -5.708) 6.709 4.387 ( -1.707 -2.493 -2.408) 3.864 4.449 ( 6.288 -2.461 -9.475) 11.635 4.565 ( -0.661 -1.263 -5.338) 5.525 4.681 ( -0.859 1.285 -2.224) 2.708 4.756 ( 2.771 0.994 4.307) 5.217 4.769 ( -0.796 2.070 1.433) 2.640 4.964 ( -0.444 3.411 -1.608) 3.797 5.088 ( -5.433 -4.271 9.559) 11.795 5.136 ( -2.924 -4.454 6.426) 8.347 5.274 ( -0.948 -3.133 -0.539) 3.318 5.328 ( -3.573 0.736 4.773) 6.007 5.419 ( -0.705 -2.201 -0.757) 2.432 5.577 ( 3.097 -4.683 -1.890) 5.924 5.702 ( -0.073 0.333 -7.757) 7.765 5.744 ( -0.436 0.664 2.316) 2.448 5.920 ( 0.168 -1.267 3.942) 4.144 6.017 ( -1.287 3.735 1.924) 4.394 6.260 ( -0.149 2.106 -2.389) 3.188 6.516 ( 1.063 0.703 3.953) 4.153 6.546 ( 1.282 5.845 -0.771) 6.033 6.698 ( -0.621 -2.934 1.409) 3.314 6.824 ( -1.918 -4.150 -0.566) 4.606 6.914 ( -1.922 3.572 1.704) 4.400 7.093 ( 2.173 -3.034 -0.812) 3.819 7.245 ( -0.862 -2.332 -1.271) 2.792 7.449 ( -1.789 -1.305 5.590) 6.013 7.486 ( 2.413 -0.102 0.493) 2.465 7.882 ( -0.190 0.881 -0.202) 0.924 8.001 ( 0.573 -4.301 -0.605) 4.381 8.210 ( 1.575 4.474 -2.605) 5.411 8.371 ( 1.277 -2.145 -1.732) 3.039 13.376 ( 0.841 -0.791 0.623) 1.312 13.430 ( -0.874 -1.939 1.668) 2.703 13.813 ( 1.032 1.584 0.695) 2.014 13.964 ( -0.016 -0.421 -1.400) 1.462 14.209 ( 1.338 -0.377 -0.220) 1.407 14.221 ( 0.284 -0.730 -0.332) 0.850 14.289 ( 0.645 0.872 -0.696) 1.288 14.432 ( -0.626 -0.621 -1.894) 2.089 16.598 ( 2.015 -4.472 0.244) 4.911 16.674 ( -1.606 -4.656 0.241) 4.931 16.996 ( 0.839 5.775 1.148) 5.947 17.130 ( -0.852 4.071 -0.184) 4.164 27.887 ( 0.092 1.950 1.238) 2.312 28.042 ( 2.200 1.580 -2.672) 3.805 28.222 ( -2.135 -0.784 2.694) 3.526 28.355 ( 0.560 -2.217 -1.082) 2.529 28.748 ( 0.401 0.128 0.410) 0.588 28.784 ( -0.076 0.134 0.198) 0.251 28.797 ( -0.056 -0.520 0.200) 0.560 28.845 ( -0.050 -0.388 -0.466) 0.608 28.972 ( 0.020 0.890 0.247) 0.924 29.018 ( 0.219 0.500 -0.839) 1.001 29.066 ( -0.367 0.231 0.899) 0.998 29.094 ( 0.096 0.014 -0.099) 0.138 31.225 ( 1.547 2.376 2.756) 3.954 31.544 ( -0.135 1.064 3.158) 3.335 31.691 ( -3.955 -0.793 0.095) 4.035 31.782 ( 3.067 -1.933 -0.717) 3.695 32.169 ( 2.228 3.293 -2.922) 4.934 32.408 ( -7.038 -4.255 -3.367) 8.887 32.510 ( 8.018 -1.365 3.812) 8.982 33.182 ( -2.947 -5.000 -4.104) 7.108 70.111 ( -0.076 0.239 0.862) 0.898 70.228 ( 0.485 -0.821 -1.991) 2.207 70.345 ( 0.296 0.817 1.523) 1.754 70.421 ( 0.293 0.484 -0.246) 0.617 ======================= Grid point 94 (42/112) ======================= q-point: (-0.45 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.274 ( -18.506 -1.608 2.566) 18.752 2.382 ( -11.320 1.317 -3.583) 11.946 2.501 ( 8.172 -2.387 -2.111) 8.771 2.561 ( -8.988 6.026 1.883) 10.984 2.737 ( 7.385 0.724 -0.759) 7.459 2.828 ( 3.606 3.753 2.949) 5.982 2.904 ( 5.335 5.646 -3.935) 8.707 3.011 ( 1.434 2.356 7.071) 7.590 3.070 ( 3.480 5.322 -1.061) 6.447 3.257 ( 1.800 9.592 -0.305) 9.764 3.322 ( -1.112 2.161 4.896) 5.466 3.426 ( -1.222 7.001 7.908) 10.633 3.581 ( -6.336 3.320 -9.899) 12.213 3.795 ( -0.890 4.642 -4.349) 6.423 4.020 ( -0.831 -3.680 -2.055) 4.296 4.078 ( -0.539 -5.087 -3.201) 6.035 4.121 ( 4.109 -1.094 -5.205) 6.721 4.257 ( -2.175 3.133 -2.301) 4.455 4.489 ( 6.754 -4.252 -9.730) 12.585 4.548 ( 4.083 -1.120 -10.746) 11.550 4.680 ( -1.793 0.932 6.224) 6.544 4.756 ( 1.704 -2.372 0.029) 2.921 4.884 ( 4.278 2.272 2.901) 5.646 4.934 ( -4.422 0.165 3.469) 5.623 5.066 ( -2.301 -0.105 5.732) 6.177 5.159 ( -0.210 -5.588 6.024) 8.219 5.265 ( 1.383 -4.545 1.996) 5.153 5.353 ( 1.657 -0.722 0.415) 1.855 5.415 ( 0.977 -2.355 -1.155) 2.799 5.560 ( 0.179 1.225 -2.915) 3.167 5.761 ( 5.453 -2.337 -0.012) 5.933 5.772 ( 2.314 3.591 1.061) 4.402 5.961 ( 1.244 -1.051 3.216) 3.605 6.021 ( 0.113 2.126 1.023) 2.362 6.236 ( -0.474 1.102 -2.354) 2.643 6.551 ( 0.450 6.490 -2.182) 6.862 6.580 ( 1.227 -0.556 7.122) 7.248 6.691 ( -1.751 -4.025 1.871) 4.772 6.788 ( -1.121 -2.657 -1.611) 3.303 6.908 ( -0.494 3.521 1.031) 3.702 7.118 ( 0.665 -2.342 -0.378) 2.464 7.198 ( -1.838 -1.236 -2.949) 3.688 7.409 ( -5.662 -1.769 3.107) 6.696 7.533 ( 1.359 -0.468 2.798) 3.145 7.921 ( 2.154 0.285 1.601) 2.699 7.979 ( -1.675 -4.618 -1.316) 5.085 8.198 ( -0.414 4.526 -1.415) 4.760 8.370 ( 0.566 -1.564 -3.298) 3.693 13.400 ( -0.848 -1.260 1.396) 2.063 13.411 ( -0.638 -1.220 0.993) 1.697 13.826 ( -0.538 1.229 1.280) 1.855 13.927 ( -1.755 -0.031 -2.503) 3.057 14.230 ( 0.814 -0.851 0.359) 1.231 14.246 ( 1.486 -0.765 0.588) 1.772 14.285 ( -0.294 0.944 -0.446) 1.084 14.394 ( -0.980 -0.374 -3.542) 3.694 16.611 ( -2.143 -4.773 0.536) 5.260 16.660 ( 1.359 -4.056 -0.052) 4.278 17.032 ( 1.141 4.964 2.280) 5.581 17.115 ( -0.048 4.510 -0.907) 4.601 27.893 ( -0.648 2.213 1.432) 2.714 28.057 ( 1.970 1.147 -3.026) 3.789 28.200 ( -2.599 -0.769 2.759) 3.868 28.355 ( 0.341 -2.119 -1.006) 2.370 28.758 ( 0.076 0.025 0.808) 0.812 28.778 ( -0.570 0.026 -0.171) 0.595 28.801 ( 0.221 -0.332 0.414) 0.574 28.841 ( 0.104 -0.468 -0.643) 0.802 28.976 ( 0.081 0.836 0.398) 0.929 29.014 ( 0.211 0.703 -0.944) 1.196 29.065 ( -0.541 0.104 0.792) 0.965 29.098 ( 0.378 0.106 0.029) 0.394 31.301 ( 2.401 2.114 5.723) 6.557 31.541 ( -4.449 1.679 4.032) 6.235 31.611 ( -1.432 -0.830 -4.854) 5.128 31.851 ( 3.408 -3.107 2.125) 5.078 32.150 ( -2.649 0.506 -2.410) 3.617 32.260 ( -3.622 2.336 -5.086) 6.667 32.685 ( 5.478 -5.078 6.695) 10.031 33.094 ( -0.646 -4.119 -7.865) 8.902 70.113 ( -0.486 0.316 0.988) 1.146 70.220 ( 0.473 -0.745 -2.037) 2.220 70.358 ( -0.375 0.720 1.734) 1.915 70.417 ( -0.415 0.410 -0.475) 0.752 ======================= Grid point 95 (43/112) ======================= q-point: (-0.36 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.881 ( -24.460 1.941 1.156) 24.564 2.134 ( -19.260 7.899 6.406) 21.780 2.414 ( -3.413 2.226 -2.605) 4.837 2.600 ( -5.709 -0.859 -4.469) 7.301 2.659 ( -4.277 -1.885 -6.361) 7.893 2.881 ( -2.151 8.548 -6.004) 10.665 2.901 ( 0.467 5.804 -7.536) 9.523 2.945 ( -6.255 1.148 0.456) 6.376 3.134 ( -0.282 0.389 2.861) 2.901 3.336 ( 2.607 5.197 -2.700) 6.410 3.404 ( 10.475 5.828 9.130) 15.068 3.455 ( 5.810 5.039 10.070) 12.670 3.701 ( 4.047 2.931 -1.927) 5.356 3.754 ( 6.573 5.432 5.774) 10.298 3.935 ( -1.625 -2.223 -5.961) 6.566 4.004 ( -3.321 -2.961 0.628) 4.493 4.172 ( 4.474 -3.513 -2.272) 6.125 4.331 ( 7.552 1.274 -3.690) 8.501 4.490 ( -0.968 -2.639 -6.150) 6.762 4.529 ( 6.126 -3.298 -7.301) 10.085 4.682 ( 2.883 1.395 -4.483) 5.510 4.852 ( 5.445 -1.582 1.823) 5.956 4.882 ( -0.969 -1.434 4.653) 4.964 4.995 ( 0.541 1.112 7.811) 7.908 5.107 ( 1.578 -0.094 3.851) 4.163 5.238 ( 1.516 -4.052 6.185) 7.548 5.333 ( 5.446 -7.643 -3.459) 10.002 5.362 ( 0.705 -1.388 -0.419) 1.612 5.427 ( 1.815 0.171 -1.812) 2.570 5.605 ( 4.245 3.079 2.734) 5.913 5.776 ( 1.249 1.858 -3.933) 4.526 5.865 ( 2.550 -0.089 2.701) 3.716 6.011 ( 2.523 -2.736 -3.096) 4.841 6.047 ( 1.450 2.954 4.552) 5.617 6.201 ( -1.449 1.525 -1.674) 2.688 6.515 ( -2.182 2.635 -3.615) 4.977 6.646 ( -2.823 -3.675 3.442) 5.772 6.700 ( 2.720 -2.737 4.265) 5.752 6.760 ( -0.972 0.903 0.897) 1.602 6.907 ( 0.139 3.317 -0.414) 3.345 7.061 ( -3.773 1.673 -4.868) 6.382 7.187 ( 1.147 -1.166 1.642) 2.318 7.342 ( -3.578 -1.555 2.855) 4.834 7.586 ( 0.126 -1.632 6.179) 6.392 7.890 ( -4.351 -3.127 -1.453) 5.552 7.974 ( 0.607 -1.582 -1.129) 2.036 8.190 ( -0.336 2.833 1.395) 3.176 8.329 ( -0.391 -1.171 -6.395) 6.513 13.356 ( -2.714 -0.667 0.127) 2.798 13.448 ( 1.088 -0.950 3.104) 3.424 13.817 ( -1.923 0.719 2.029) 2.887 13.868 ( -2.284 0.275 -2.288) 3.244 14.226 ( -1.187 -0.827 -0.787) 1.647 14.261 ( 0.591 -0.630 -1.171) 1.456 14.296 ( 0.479 -0.273 2.082) 2.153 14.337 ( -1.241 0.026 -4.642) 4.805 16.557 ( -3.393 -3.919 -0.040) 5.184 16.702 ( 2.360 -3.575 1.014) 4.402 17.059 ( 0.141 4.556 0.653) 4.605 17.123 ( 1.485 5.056 -0.001) 5.270 27.891 ( -0.861 2.886 1.605) 3.413 28.056 ( 1.132 0.703 -3.917) 4.137 28.184 ( -2.008 -0.593 3.517) 4.093 28.346 ( -0.499 -1.540 -0.854) 1.830 28.763 ( -0.697 -0.012 -0.123) 0.707 28.766 ( -0.152 -0.036 0.903) 0.916 28.813 ( 0.649 -0.367 0.546) 0.924 28.836 ( -0.029 -0.482 -0.787) 0.923 28.980 ( 0.029 0.502 0.309) 0.590 29.011 ( 0.292 0.983 -0.902) 1.365 29.060 ( -0.663 -0.217 0.522) 0.872 29.107 ( 0.491 0.422 0.127) 0.659 31.393 ( 1.796 0.650 5.414) 5.741 31.444 ( -6.627 0.406 -0.311) 6.647 31.581 ( 1.223 1.595 -2.935) 3.557 31.897 ( -1.899 -4.739 1.422) 5.299 32.050 ( -5.674 -0.318 1.812) 5.964 32.196 ( -0.176 5.993 -4.543) 7.522 32.811 ( 2.558 -9.586 5.850) 11.518 33.048 ( 4.116 -2.455 -8.963) 10.163 70.111 ( -0.723 0.555 1.107) 1.434 70.209 ( 0.299 -0.509 -2.073) 2.155 70.363 ( -0.744 0.645 1.867) 2.111 70.399 ( -0.973 0.315 -0.631) 1.202 ======================= Grid point 96 (44/112) ======================= q-point: (-0.27 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.451 ( -24.113 6.941 2.819) 25.250 1.795 ( -26.652 9.968 12.402) 31.040 2.130 ( -22.485 10.010 -15.372) 29.019 2.431 ( -18.740 6.927 -2.857) 20.182 2.450 ( 0.736 4.105 -1.840) 4.559 2.754 ( -4.441 -3.047 -0.716) 5.433 2.818 ( -0.926 -1.166 -3.807) 4.088 2.920 ( 5.711 1.930 -5.090) 7.890 3.232 ( 3.066 -5.094 2.188) 6.335 3.440 ( 4.318 3.621 4.434) 7.170 3.596 ( 1.680 -0.307 -2.446) 2.983 3.653 ( 0.932 6.862 3.923) 7.959 3.677 ( 6.301 3.199 9.181) 11.586 3.838 ( -6.262 0.441 8.106) 10.253 3.966 ( 10.436 0.481 -3.832) 11.128 4.135 ( 6.349 1.376 -2.554) 6.980 4.228 ( 13.244 -0.573 -4.800) 14.098 4.373 ( 3.725 -1.175 -4.025) 5.609 4.506 ( 2.514 -3.450 5.083) 6.637 4.603 ( 7.197 -1.471 -4.711) 8.726 4.740 ( 9.375 -0.258 -6.698) 11.525 4.940 ( 2.630 0.127 4.181) 4.941 4.981 ( 6.562 -0.051 0.770) 6.607 5.037 ( -0.103 -2.843 2.268) 3.639 5.175 ( 1.979 -1.479 4.285) 4.946 5.289 ( -1.310 0.078 5.827) 5.973 5.354 ( 3.855 -4.472 -5.187) 7.859 5.413 ( 1.348 -3.929 -0.668) 4.207 5.458 ( 2.783 3.023 0.311) 4.121 5.700 ( -0.034 -0.393 2.271) 2.305 5.764 ( 3.179 2.643 -4.436) 6.064 5.890 ( -0.525 -0.116 0.593) 0.800 6.053 ( 4.598 -1.418 -0.370) 4.826 6.085 ( -2.212 2.323 -0.294) 3.221 6.174 ( 0.594 1.575 0.537) 1.767 6.406 ( -5.801 -0.509 -2.938) 6.522 6.608 ( -2.569 1.297 -0.522) 2.925 6.702 ( -1.811 -4.000 -1.132) 4.534 6.796 ( -2.487 2.073 4.250) 5.343 6.910 ( -0.854 -0.078 0.310) 0.912 6.991 ( 2.593 3.708 -1.235) 4.690 7.230 ( 1.200 0.550 2.119) 2.497 7.353 ( 1.884 -2.489 4.263) 5.284 7.646 ( -1.045 -3.417 10.045) 10.661 7.785 ( -4.848 -4.175 -3.093) 7.106 7.953 ( -0.664 -0.256 -2.340) 2.445 8.186 ( -1.541 -0.675 -1.317) 2.137 8.262 ( 0.377 0.276 -6.395) 6.412 13.319 ( -1.484 0.494 0.469) 1.633 13.495 ( 0.900 -1.369 3.417) 3.790 13.792 ( -3.113 0.288 2.821) 4.211 13.811 ( -1.911 0.275 -1.803) 2.642 14.191 ( -1.468 -0.664 -1.124) 1.965 14.232 ( -1.429 -1.017 -4.499) 4.829 14.289 ( -0.100 0.165 -2.415) 2.423 14.317 ( -0.651 -0.545 2.486) 2.627 16.498 ( -2.956 -2.428 0.038) 3.826 16.758 ( 2.753 -2.892 1.070) 4.134 17.054 ( 0.173 6.460 -1.829) 6.716 17.157 ( 1.463 4.156 1.007) 4.519 27.895 ( -0.083 4.300 1.780) 4.654 28.031 ( 0.383 0.339 -4.556) 4.585 28.189 ( -1.175 -0.323 3.995) 4.177 28.320 ( -1.568 -0.722 -0.751) 1.882 28.750 ( -0.280 0.099 -0.309) 0.429 28.773 ( -0.124 -0.260 1.220) 1.253 28.825 ( -0.397 -0.370 -0.798) 0.964 28.830 ( 0.586 -0.430 0.389) 0.824 28.981 ( -0.059 0.046 -0.003) 0.075 29.010 ( 0.364 1.185 -0.700) 1.424 29.051 ( -0.670 -0.423 0.361) 0.871 29.116 ( 0.464 0.660 0.065) 0.809 31.316 ( -5.632 0.108 -2.520) 6.171 31.436 ( 0.114 -2.942 -0.770) 3.043 31.606 ( 1.867 4.652 1.839) 5.340 31.808 ( -6.423 -2.438 0.224) 6.874 31.975 ( -7.922 -1.668 5.235) 9.641 32.155 ( -0.171 5.309 -4.369) 6.878 32.910 ( 3.798 -11.684 5.488) 13.456 33.078 ( 5.916 -4.317 -7.012) 10.139 70.109 ( -0.555 1.097 1.137) 1.675 70.195 ( 0.108 -0.174 -1.884) 1.895 70.364 ( -0.780 0.634 1.616) 1.904 70.373 ( -1.223 0.200 -0.732) 1.440 ======================= Grid point 97 (45/112) ======================= q-point: (-0.18 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.083 ( -20.936 13.146 7.463) 25.823 1.342 ( -29.641 10.985 -1.483) 31.646 1.654 ( -23.007 19.347 9.996) 31.679 2.004 ( -23.396 9.662 4.075) 25.638 2.495 ( 1.256 1.216 -11.471) 11.604 2.669 ( -3.040 -3.767 11.726) 12.686 2.801 ( 0.155 -0.717 -1.132) 1.349 3.081 ( 14.343 -3.272 -5.713) 15.782 3.234 ( -1.306 -1.603 -1.322) 2.455 3.410 ( -6.167 -7.419 0.276) 9.651 3.585 ( -10.281 -0.230 5.362) 11.598 3.692 ( 6.481 4.843 -1.265) 8.189 3.774 ( -1.133 5.120 4.227) 6.735 3.884 ( 3.872 2.214 3.561) 5.707 4.155 ( 7.240 1.715 -1.020) 7.510 4.201 ( 12.577 -3.543 -6.570) 14.625 4.368 ( 6.601 4.004 -3.829) 8.618 4.542 ( 10.688 -2.222 -0.584) 10.932 4.615 ( 6.980 -1.488 -0.549) 7.158 4.685 ( 4.490 -0.303 -0.998) 4.609 4.896 ( 11.627 -2.202 -4.050) 12.507 5.001 ( 0.707 2.090 3.531) 4.163 5.062 ( 2.489 -4.487 -1.250) 5.282 5.091 ( 3.986 -1.616 0.565) 4.338 5.259 ( 3.716 -0.352 2.786) 4.657 5.311 ( 0.927 -0.450 2.303) 2.524 5.381 ( 0.190 3.010 -1.902) 3.566 5.429 ( 2.888 -4.321 3.064) 6.034 5.506 ( 2.502 2.295 -0.692) 3.465 5.628 ( -4.605 -2.029 -3.729) 6.264 5.748 ( -1.364 3.176 -6.856) 7.678 5.908 ( -3.792 6.817 8.359) 11.433 5.986 ( -1.799 -3.841 -6.274) 7.573 6.139 ( -0.356 -3.814 1.185) 4.010 6.171 ( -0.205 2.531 -1.192) 2.805 6.314 ( -2.978 0.451 1.738) 3.478 6.526 ( -4.088 6.514 -4.631) 8.977 6.649 ( -3.832 -4.660 0.410) 6.048 6.747 ( -4.094 -0.798 2.794) 5.020 6.908 ( 0.526 -0.340 1.483) 1.610 7.081 ( 4.001 -0.357 2.147) 4.555 7.259 ( 0.557 1.934 1.341) 2.419 7.471 ( 4.995 -3.547 5.032) 7.928 7.662 ( -3.484 -4.152 -7.391) 9.166 7.714 ( -1.458 -3.258 9.349) 10.007 7.922 ( -1.601 -1.755 -1.124) 2.628 8.117 ( -0.115 -2.083 -4.848) 5.278 8.267 ( 2.658 0.928 1.567) 3.222 13.313 ( 0.115 1.669 0.806) 1.857 13.529 ( 0.291 -1.833 1.000) 2.109 13.753 ( -4.078 -0.639 3.148) 5.192 13.772 ( -0.927 -0.218 -1.433) 1.721 14.159 ( -0.982 -1.200 -0.652) 1.682 14.169 ( -1.241 0.172 -2.391) 2.699 14.270 ( -0.065 -0.304 -2.218) 2.240 14.320 ( -1.391 -0.636 2.790) 3.182 16.459 ( -1.199 -0.127 0.106) 1.210 16.816 ( 3.242 -1.287 -0.607) 3.541 17.039 ( 0.968 9.203 -3.855) 10.024 17.184 ( 0.637 3.063 0.548) 3.176 27.928 ( 2.465 6.967 1.390) 7.520 27.999 ( 0.575 0.332 -4.682) 4.729 28.202 ( -1.111 -0.112 3.223) 3.411 28.280 ( -2.093 0.007 -0.582) 2.172 28.750 ( 0.530 0.033 -0.157) 0.554 28.779 ( -0.186 -0.343 0.493) 0.629 28.809 ( -0.507 -0.193 -0.622) 0.825 28.837 ( -0.204 -0.465 0.275) 0.577 28.980 ( 0.037 -0.117 -0.095) 0.155 29.010 ( 0.288 0.924 -0.663) 1.173 29.044 ( -0.587 -0.309 0.616) 0.905 29.124 ( 0.374 0.721 -0.079) 0.816 31.205 ( -3.685 0.054 -3.019) 4.764 31.399 ( -1.804 -5.031 -3.463) 6.368 31.623 ( -2.571 0.676 0.466) 2.699 31.744 ( -2.042 5.948 5.033) 8.055 31.848 ( -8.944 -2.296 3.484) 9.869 32.115 ( -0.164 3.550 -4.065) 5.399 33.009 ( -4.495 -16.930 12.966) 21.793 33.143 ( 9.854 -7.338 -7.655) 14.476 70.115 ( 0.473 2.144 0.763) 2.325 70.183 ( 0.164 0.295 -1.268) 1.312 70.345 ( -1.058 0.093 -0.910) 1.399 70.360 ( -0.808 0.751 0.450) 1.192 ======================= Grid point 98 (46/112) ======================= q-point: (-0.09 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.819 ( -19.081 15.934 11.183) 27.259 0.872 ( -17.801 19.730 10.503) 28.574 1.471 ( -18.296 21.693 33.010) 43.531 1.714 ( -13.399 11.928 9.187) 20.155 2.342 ( -1.769 -2.092 -15.706) 15.943 2.779 ( 2.765 -2.953 7.413) 8.446 2.846 ( 2.990 0.369 6.135) 6.835 3.116 ( -5.072 0.658 -0.042) 5.115 3.235 ( -2.627 -7.434 1.010) 7.949 3.390 ( -0.876 -3.067 -1.808) 3.666 3.477 ( 1.480 -3.257 2.342) 4.276 3.724 ( 2.450 0.516 -2.380) 3.455 3.833 ( 4.340 7.076 1.020) 8.363 3.963 ( 6.184 1.826 -6.282) 9.002 4.243 ( 3.469 1.832 0.882) 4.021 4.319 ( 3.366 -1.464 -0.960) 3.794 4.527 ( 13.884 0.841 -7.813) 15.954 4.628 ( -1.002 -4.641 -1.891) 5.111 4.678 ( 4.814 1.772 -4.673) 6.939 4.764 ( 4.766 -1.342 -1.284) 5.115 4.948 ( -3.400 2.338 -3.071) 5.144 5.042 ( -4.430 -2.387 -3.738) 6.269 5.116 ( 0.200 -0.073 2.439) 2.449 5.130 ( 7.888 -3.975 -0.600) 8.854 5.287 ( 0.250 -0.815 0.790) 1.162 5.361 ( 2.288 3.376 -1.680) 4.411 5.449 ( 2.280 -2.710 0.479) 3.574 5.491 ( 0.548 -0.154 -0.803) 0.984 5.529 ( 2.109 1.447 -2.831) 3.815 5.586 ( 6.969 3.971 1.099) 8.096 5.641 ( -1.603 2.774 -6.217) 6.994 5.854 ( -10.062 6.747 6.134) 13.579 5.925 ( -3.160 -0.467 -2.774) 4.231 6.018 ( -6.285 -1.184 -0.472) 6.413 6.185 ( -2.238 -0.522 3.634) 4.300 6.271 ( -4.420 -6.155 1.774) 7.783 6.424 ( -1.173 6.749 -5.234) 8.621 6.564 ( -4.429 -4.588 -1.958) 6.671 6.718 ( -3.217 -2.078 6.461) 7.510 6.944 ( 1.005 -0.156 2.751) 2.933 7.128 ( 0.500 -0.267 -1.414) 1.524 7.254 ( -2.112 4.207 -4.233) 6.330 7.467 ( -1.543 -1.680 -4.793) 5.308 7.631 ( 0.653 -2.692 -3.409) 4.393 7.757 ( 1.820 1.563 5.767) 6.246 7.871 ( -1.528 -1.675 0.001) 2.267 8.147 ( 1.788 -4.736 3.962) 6.428 8.451 ( 10.556 -8.493 14.047) 19.516 13.333 ( 1.380 2.822 0.280) 3.154 13.510 ( -0.944 -1.175 -3.737) 4.030 13.687 ( -5.817 -1.442 2.072) 6.341 13.755 ( 0.416 -0.853 -1.364) 1.661 14.145 ( -0.320 -0.065 -0.388) 0.507 14.175 ( 0.477 -3.500 4.305) 5.569 14.256 ( 0.815 -0.533 -0.165) 0.987 14.324 ( -0.663 -1.418 2.901) 3.296 16.468 ( 2.163 2.533 0.095) 3.332 16.846 ( 2.983 3.459 -7.728) 8.977 17.026 ( 2.396 11.060 -5.982) 12.800 17.188 ( -0.229 1.941 -0.526) 2.024 27.975 ( 1.322 0.684 -4.280) 4.531 28.014 ( 7.184 10.091 -4.027) 13.025 28.190 ( -2.520 -0.101 0.903) 2.679 28.242 ( -1.586 0.282 -0.148) 1.617 28.761 ( -0.056 -0.349 0.084) 0.364 28.774 ( 0.298 0.079 -0.597) 0.672 28.798 ( -0.242 -0.091 -0.437) 0.507 28.828 ( -0.942 -0.383 0.134) 1.026 28.983 ( 0.257 -0.024 -0.086) 0.272 29.009 ( 0.278 0.554 -0.428) 0.753 29.048 ( 0.147 -0.206 1.783) 1.801 29.128 ( 0.195 0.641 -0.197) 0.698 31.143 ( -0.842 -0.047 -0.429) 0.946 31.335 ( -2.409 -5.820 1.058) 6.387 31.575 ( -1.845 -0.559 0.515) 1.995 31.699 ( -6.062 0.995 2.373) 6.585 31.810 ( 0.045 8.990 2.479) 9.326 32.081 ( 0.367 1.974 -4.001) 4.477 32.968 ( -15.612 -31.056 26.075) 43.452 33.286 ( 8.802 -8.481 -1.882) 12.367 70.143 ( 2.490 2.418 -0.946) 3.598 70.186 ( 1.254 1.771 -0.264) 2.186 70.313 ( -1.644 0.783 -2.699) 3.256 70.335 ( -1.236 0.881 -1.119) 1.886 ======================= Grid point 99 (47/112) ======================= q-point: ( 0.00 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.167 ( 0.718 18.760 13.815) 23.309 1.244 ( -2.119 23.287 8.104) 24.747 1.862 ( 3.637 10.003 7.007) 12.743 2.050 ( 0.631 1.641 5.303) 5.587 2.320 ( -2.608 21.791 14.236) 26.160 2.844 ( 3.837 -2.515 1.591) 4.856 2.862 ( -5.376 -1.000 2.308) 5.935 3.034 ( 0.351 -6.606 4.402) 7.946 3.188 ( 2.933 0.263 2.796) 4.061 3.276 ( -4.564 0.962 3.924) 6.095 3.439 ( 1.757 -7.157 -3.340) 8.090 3.645 ( 2.567 -8.537 -0.616) 8.936 3.852 ( -2.772 -1.488 2.086) 3.775 4.155 ( 0.645 -1.917 3.585) 4.116 4.207 ( -3.735 1.019 2.789) 4.772 4.477 ( 4.894 10.819 -4.333) 12.640 4.501 ( -0.437 3.210 -10.434) 10.926 4.654 ( 2.906 0.201 -1.264) 3.176 4.723 ( -6.854 -0.691 -7.773) 10.386 4.787 ( 4.123 -0.275 -3.654) 5.516 4.879 ( 0.258 1.039 -6.513) 6.600 4.968 ( 2.178 -0.130 -6.116) 6.494 5.082 ( 4.600 -0.448 -3.063) 5.544 5.141 ( -4.025 -0.991 0.541) 4.180 5.321 ( -2.802 2.553 2.458) 4.518 5.391 ( 4.380 -1.734 -4.022) 6.194 5.432 ( -1.807 0.297 -2.072) 2.766 5.491 ( 1.088 3.710 -1.711) 4.228 5.590 ( -3.189 1.254 0.097) 3.428 5.619 ( -2.119 0.897 0.390) 2.334 5.674 ( -4.813 2.019 -4.193) 6.695 5.797 ( 0.551 -0.328 -1.011) 1.197 5.955 ( 1.033 1.287 3.182) 3.585 6.040 ( -1.453 -5.948 4.249) 7.453 6.069 ( 2.280 2.632 0.820) 3.578 6.139 ( -0.603 -3.417 -0.123) 3.472 6.467 ( 2.061 -0.129 -1.835) 2.762 6.569 ( -0.706 6.879 -2.597) 7.386 6.726 ( 1.107 -0.542 7.424) 7.526 6.957 ( -0.793 -1.636 2.369) 2.986 7.168 ( 0.650 3.411 1.604) 3.825 7.276 ( -1.795 4.845 -2.569) 5.770 7.413 ( 0.339 -1.496 -1.055) 1.861 7.520 ( -2.096 -3.052 -3.103) 4.831 7.798 ( -1.079 -2.738 4.284) 5.198 7.887 ( 1.555 -2.920 9.241) 9.816 8.131 ( 2.189 -2.325 0.252) 3.203 8.407 ( 0.579 -9.461 4.062) 10.313 13.389 ( -1.126 2.297 -1.055) 2.767 13.478 ( 0.327 -0.170 -1.904) 1.940 13.620 ( -1.586 0.912 0.838) 2.013 13.728 ( 1.236 -1.868 -1.307) 2.594 14.131 ( -0.325 -0.834 1.188) 1.487 14.164 ( 1.224 -0.030 0.632) 1.377 14.242 ( 0.580 -2.352 0.937) 2.597 14.282 ( -0.300 -2.831 1.260) 3.114 16.576 ( -0.243 4.392 0.967) 4.504 16.817 ( -0.269 -1.896 -4.076) 4.503 17.176 ( 1.688 4.438 -5.320) 7.131 17.207 ( -0.157 1.799 -1.988) 2.686 28.003 ( 1.752 2.108 -2.477) 3.694 28.135 ( -3.025 0.182 -0.159) 3.034 28.155 ( 1.287 2.040 -6.386) 6.827 28.222 ( -0.309 -0.289 -0.718) 0.833 28.751 ( -0.748 0.311 0.386) 0.897 28.786 ( 0.899 -0.167 -0.263) 0.952 28.794 ( -0.586 -0.302 0.088) 0.665 28.807 ( 0.304 -0.274 -0.144) 0.434 28.986 ( -0.030 0.284 0.118) 0.309 29.019 ( 0.613 -0.377 0.067) 0.722 29.073 ( -0.095 1.036 1.167) 1.563 29.136 ( 0.070 -0.028 -0.306) 0.316 31.158 ( 1.489 -0.650 2.791) 3.230 31.257 ( 3.345 -5.297 2.868) 6.890 31.590 ( 1.483 0.625 1.499) 2.199 31.654 ( -0.323 -0.108 1.393) 1.434 31.934 ( -9.018 7.437 -2.269) 11.907 32.114 ( 0.255 2.866 -3.860) 4.814 32.561 ( -1.941 -9.368 21.284) 23.335 33.143 ( 4.141 -14.871 -0.502) 15.445 70.185 ( 0.602 1.186 -0.379) 1.383 70.232 ( -0.354 -0.323 1.357) 1.439 70.295 ( 0.125 1.833 -3.849) 4.265 70.322 ( -0.208 0.113 -1.039) 1.066 ======================= Grid point 100 (48/112) ======================= q-point: ( 0.09 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.330 ( 4.930 19.738 11.726) 23.481 1.420 ( 9.734 18.672 11.993) 24.233 2.009 ( 8.335 6.425 -2.049) 10.722 2.125 ( 7.906 -1.986 -6.993) 10.740 2.510 ( 2.592 20.055 24.332) 31.639 2.790 ( -2.050 3.441 6.609) 7.728 2.952 ( 2.797 -6.346 7.033) 9.877 3.097 ( 3.404 -4.952 0.355) 6.019 3.222 ( -3.140 -0.350 6.644) 7.357 3.338 ( 7.631 0.639 3.847) 8.570 3.425 ( -1.360 -7.315 -0.271) 7.445 3.622 ( -1.527 -0.490 -5.719) 5.940 3.836 ( -3.558 -2.612 6.758) 8.072 4.105 ( -4.380 -5.264 1.758) 7.070 4.204 ( -1.580 6.747 2.439) 7.346 4.299 ( -7.528 6.178 -9.474) 13.587 4.409 ( -5.947 1.174 -17.598) 18.612 4.534 ( -7.297 5.326 -6.758) 11.281 4.742 ( 1.132 -1.102 6.125) 6.325 4.807 ( 3.753 -3.025 -1.722) 5.119 4.874 ( 4.020 1.682 -3.738) 5.742 4.893 ( -2.799 4.200 -10.929) 12.038 5.083 ( -0.518 -1.066 0.688) 1.370 5.176 ( 3.827 -5.409 -0.671) 6.660 5.217 ( -11.176 2.884 4.114) 12.254 5.334 ( -6.772 3.156 -2.159) 7.777 5.362 ( -1.928 -0.391 -2.245) 2.985 5.427 ( -6.605 3.822 -2.295) 7.969 5.548 ( 1.890 2.369 -1.950) 3.603 5.588 ( -0.677 -0.640 -2.833) 2.983 5.651 ( 2.129 0.543 0.381) 2.230 5.797 ( 2.913 -3.650 -1.719) 4.977 5.952 ( -3.581 -2.764 1.984) 4.940 6.096 ( 5.375 -3.346 1.079) 6.423 6.121 ( -0.913 -6.441 -1.573) 6.693 6.200 ( 6.306 -0.821 2.226) 6.738 6.512 ( 2.839 3.063 -0.312) 4.188 6.565 ( 3.167 6.738 -3.946) 8.426 6.825 ( 1.838 -0.345 7.376) 7.609 6.951 ( -1.128 -2.308 1.268) 2.865 7.208 ( 1.047 5.421 2.039) 5.885 7.233 ( -0.599 4.223 -0.404) 4.285 7.405 ( -0.998 1.405 -0.589) 1.822 7.453 ( -1.728 -3.029 -2.489) 4.285 7.796 ( -3.495 -1.572 4.303) 5.762 7.972 ( 1.072 -1.260 5.421) 5.668 8.162 ( -0.067 -5.147 1.812) 5.457 8.387 ( -4.213 -8.244 0.819) 9.295 13.354 ( -1.486 2.228 -0.331) 2.699 13.453 ( -1.338 -0.503 -1.469) 2.049 13.636 ( 2.436 1.280 -0.096) 2.753 13.750 ( 2.241 -1.508 -0.846) 2.831 14.138 ( 0.525 -0.268 0.320) 0.671 14.196 ( 1.883 0.427 -0.031) 1.931 14.272 ( 0.855 -3.790 2.031) 4.384 14.292 ( 0.526 -3.021 0.918) 3.201 16.539 ( -3.721 4.531 0.493) 5.884 16.759 ( -1.931 -1.289 -3.292) 4.029 17.176 ( 1.265 4.334 -3.388) 5.645 17.199 ( 1.605 2.412 -1.622) 3.320 27.984 ( -1.717 3.893 -3.227) 5.340 28.075 ( 1.228 3.968 -3.088) 5.175 28.143 ( -1.126 -1.452 0.453) 1.892 28.239 ( 2.316 -1.142 -0.369) 2.609 28.741 ( -0.612 0.298 0.206) 0.711 28.777 ( -0.926 -0.013 -0.018) 0.926 28.799 ( 0.617 -0.573 -0.237) 0.874 28.820 ( 0.734 -0.434 0.103) 0.859 28.988 ( -0.007 0.406 0.399) 0.569 29.024 ( 0.237 -0.013 -0.551) 0.600 29.078 ( -0.484 0.747 1.335) 1.605 29.130 ( -0.234 0.001 -0.624) 0.666 31.225 ( 2.884 -0.844 3.025) 4.264 31.360 ( 5.524 -6.610 -0.794) 8.651 31.632 ( 0.475 0.189 3.512) 3.549 31.693 ( 2.666 2.741 -0.706) 3.888 31.764 ( -5.524 4.872 0.898) 7.420 32.130 ( 3.981 1.194 -2.492) 4.846 32.675 ( -2.985 -9.416 10.780) 14.621 33.202 ( 1.729 -15.201 1.883) 15.414 70.166 ( -2.055 2.233 -0.742) 3.124 70.230 ( -0.190 0.025 1.481) 1.493 70.287 ( 1.403 1.319 -2.863) 3.450 70.326 ( 1.528 -0.134 -0.681) 1.678 ======================= Grid point 101 (49/112) ======================= q-point: ( 0.18 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.559 ( 8.107 16.945 12.655) 22.650 1.742 ( 15.378 16.779 9.865) 24.807 2.099 ( 8.720 0.917 -9.422) 12.871 2.239 ( 12.469 5.501 -11.108) 17.582 2.635 ( -0.849 1.190 5.779) 5.961 2.905 ( 1.630 -1.348 2.264) 3.099 3.143 ( 7.036 -0.450 14.698) 16.302 3.218 ( -0.212 6.457 7.873) 10.185 3.227 ( 3.771 -0.244 13.979) 14.481 3.361 ( -2.692 -6.878 -4.455) 8.626 3.501 ( 3.976 0.512 -4.186) 5.796 3.606 ( 4.525 5.196 7.258) 10.008 3.814 ( -5.729 -2.724 6.551) 9.119 4.003 ( -8.138 1.115 -3.316) 8.858 4.087 ( -8.712 -2.277 -11.332) 14.474 4.135 ( -6.687 1.852 -5.318) 8.742 4.231 ( 3.821 8.185 -0.685) 9.059 4.360 ( -2.954 7.992 -8.496) 12.033 4.651 ( -13.199 6.822 -5.281) 15.768 4.717 ( -2.672 -1.014 -3.169) 4.268 4.828 ( -3.224 -3.645 5.315) 7.206 4.952 ( -1.286 -2.686 0.266) 2.990 5.051 ( -5.597 -1.328 -0.070) 5.753 5.093 ( 0.048 3.126 -1.095) 3.312 5.132 ( -8.897 -5.474 4.896) 11.536 5.255 ( -4.980 -1.631 1.867) 5.563 5.310 ( 3.014 -1.066 -4.927) 5.873 5.354 ( 1.168 3.199 -7.280) 8.037 5.505 ( -5.934 -2.089 0.814) 6.343 5.538 ( -0.592 3.403 -1.351) 3.709 5.745 ( 4.264 -2.827 1.331) 5.287 5.834 ( 2.358 -4.699 -4.984) 7.244 5.928 ( 1.198 0.000 1.835) 2.192 6.079 ( -1.882 -5.571 -1.218) 6.005 6.200 ( 4.903 -5.100 0.180) 7.077 6.305 ( 3.231 -5.293 2.213) 6.585 6.539 ( 1.062 6.671 -0.529) 6.775 6.597 ( 3.306 7.822 -3.678) 9.254 6.902 ( 0.632 -0.851 4.336) 4.464 6.953 ( 0.199 -1.486 2.393) 2.824 7.173 ( -2.569 3.781 -2.252) 5.096 7.277 ( -0.544 4.198 4.357) 6.075 7.354 ( -2.453 1.703 -1.410) 3.302 7.436 ( 0.293 -2.622 0.051) 2.639 7.773 ( -1.541 0.372 3.789) 4.107 8.030 ( 0.891 -1.090 3.329) 3.614 8.150 ( -1.495 -4.558 -0.688) 4.846 8.315 ( -1.837 -6.136 -2.529) 6.887 13.335 ( -0.743 1.528 0.532) 1.781 13.417 ( -1.338 -0.404 -0.843) 1.632 13.690 ( 3.601 1.326 -0.450) 3.864 13.796 ( 3.255 -1.152 -0.020) 3.453 14.155 ( 1.245 -0.052 -0.422) 1.316 14.229 ( 1.895 0.734 -0.093) 2.034 14.278 ( -0.702 -3.809 -0.218) 3.879 14.335 ( 2.264 -2.856 1.806) 4.067 16.485 ( -1.949 2.872 -0.021) 3.471 16.698 ( -2.613 -2.459 -1.032) 3.734 17.156 ( -0.224 5.052 -2.513) 5.647 17.224 ( 1.342 2.960 -0.412) 3.276 27.933 ( -0.887 4.355 -1.908) 4.837 28.079 ( 1.051 3.279 -2.694) 4.372 28.146 ( 0.436 -1.442 2.304) 2.753 28.280 ( 1.973 -1.467 0.164) 2.464 28.735 ( -0.172 0.293 0.125) 0.362 28.766 ( -0.335 0.081 0.218) 0.408 28.802 ( 0.052 -0.619 -0.563) 0.838 28.831 ( 0.322 -0.747 0.152) 0.827 28.991 ( -0.007 0.611 0.256) 0.662 29.022 ( 0.275 0.141 -0.764) 0.824 29.079 ( -0.659 0.633 1.228) 1.530 29.118 ( -0.422 0.046 -0.735) 0.849 31.294 ( 2.600 -0.592 -0.570) 2.727 31.406 ( 1.693 -3.186 -2.592) 4.443 31.656 ( -0.650 2.376 4.670) 5.280 31.712 ( 3.198 3.766 -1.026) 5.046 31.817 ( 4.187 -2.089 4.785) 6.693 32.205 ( 6.376 0.752 -2.408) 6.856 32.637 ( -6.334 -7.566 2.390) 10.153 33.224 ( -1.398 -13.564 1.729) 13.745 70.128 ( -1.243 2.195 -0.406) 2.555 70.236 ( -0.549 -1.204 0.719) 1.506 70.295 ( 1.802 1.934 -1.527) 3.053 70.357 ( 1.995 -0.051 -0.030) 1.996 ======================= Grid point 102 (50/112) ======================= q-point: ( 0.27 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.830 ( 10.380 13.231 11.229) 20.221 2.121 ( 17.223 13.117 6.001) 22.466 2.213 ( 12.392 -0.191 -7.822) 14.655 2.375 ( 13.533 7.286 -9.988) 18.330 2.656 ( -0.104 -2.701 1.304) 3.001 2.913 ( 0.170 -1.212 -1.484) 1.923 3.101 ( -9.582 3.161 -0.301) 10.094 3.232 ( -3.107 -0.126 1.181) 3.327 3.387 ( 2.509 -2.615 6.740) 7.652 3.461 ( 1.185 -0.235 -2.682) 2.942 3.610 ( 5.834 8.606 14.492) 17.835 3.679 ( -11.517 1.156 -1.160) 11.633 3.701 ( 1.127 2.626 -0.015) 2.857 3.806 ( -9.196 1.157 -5.936) 11.006 3.988 ( 7.117 5.101 5.718) 10.458 4.042 ( -1.845 -0.717 -2.277) 3.017 4.208 ( -4.374 3.662 -2.668) 6.298 4.373 ( 3.679 6.713 -2.014) 7.915 4.439 ( -3.017 5.800 0.916) 6.601 4.598 ( -6.451 -1.924 -5.926) 8.969 4.792 ( -3.904 -0.276 0.856) 4.006 4.879 ( -5.398 -6.911 4.216) 9.730 4.940 ( -5.971 -1.337 -0.015) 6.119 5.045 ( -5.499 -2.993 3.383) 7.116 5.064 ( -2.778 1.471 -0.149) 3.147 5.177 ( -3.553 -0.226 -1.607) 3.906 5.302 ( -0.765 -1.556 -2.079) 2.707 5.352 ( 3.995 -5.557 -6.853) 9.685 5.409 ( -5.236 0.686 2.950) 6.049 5.510 ( -1.339 0.806 -1.572) 2.217 5.768 ( -1.535 -4.903 -1.822) 5.452 5.808 ( -0.098 1.175 -1.438) 1.859 6.001 ( -0.550 -1.894 -0.519) 2.039 6.030 ( -0.273 -0.952 1.772) 2.030 6.262 ( 2.122 -7.109 -1.292) 7.531 6.385 ( 3.115 -9.448 4.826) 11.057 6.553 ( -0.312 9.648 1.344) 9.746 6.620 ( 2.950 7.654 -2.458) 8.563 6.919 ( 0.031 -0.942 0.499) 1.066 7.005 ( 1.734 0.202 2.850) 3.342 7.081 ( -4.589 2.163 -2.846) 5.817 7.249 ( -5.243 1.947 3.477) 6.586 7.334 ( 0.832 0.964 0.615) 1.414 7.452 ( 1.007 -1.397 -0.333) 1.754 7.815 ( 2.482 -0.343 2.444) 3.500 8.012 ( -4.436 -3.799 0.410) 5.855 8.160 ( 4.728 0.956 -2.271) 5.332 8.290 ( 1.435 -4.801 -3.131) 5.909 13.334 ( -0.000 0.311 0.619) 0.693 13.395 ( -0.796 -0.532 0.279) 0.997 13.754 ( 3.621 1.669 -0.171) 3.990 13.863 ( 3.624 -1.116 0.614) 3.841 14.172 ( 1.192 -0.042 -0.855) 1.467 14.252 ( -1.005 -2.553 -1.589) 3.171 14.264 ( 1.790 0.890 0.095) 2.001 14.387 ( 1.923 -2.512 0.950) 3.303 16.471 ( 0.358 0.367 -0.047) 0.515 16.648 ( -2.539 -3.705 0.144) 4.494 17.130 ( -0.674 5.828 -1.429) 6.038 17.233 ( -0.212 2.868 0.134) 2.879 27.919 ( 0.341 3.922 -0.587) 3.981 28.073 ( 0.814 2.385 -2.064) 3.257 28.180 ( 0.571 -0.989 2.515) 2.762 28.305 ( 0.623 -1.975 0.010) 2.071 28.736 ( 0.237 0.374 0.068) 0.448 28.769 ( 0.247 -0.033 0.478) 0.539 28.794 ( -0.220 -0.429 -0.539) 0.723 28.835 ( 0.075 -0.945 0.108) 0.955 28.992 ( 0.030 0.944 0.019) 0.945 29.023 ( 0.493 0.204 -0.681) 0.865 29.076 ( -0.642 0.478 0.865) 1.178 29.105 ( -0.426 -0.021 -0.460) 0.627 31.288 ( 0.304 1.903 -4.596) 4.984 31.436 ( 2.430 -1.595 1.110) 3.112 31.696 ( 0.526 1.108 2.851) 3.103 31.755 ( 0.553 1.643 1.809) 2.506 31.957 ( 6.503 -2.389 4.810) 8.434 32.307 ( 7.372 -0.036 -3.453) 8.141 32.525 ( -6.085 -4.280 -0.784) 7.481 33.185 ( -3.301 -11.195 -0.171) 11.673 70.114 ( -0.267 1.548 0.049) 1.572 70.226 ( -0.546 -1.604 -0.499) 1.767 70.322 ( 1.711 1.992 -0.065) 2.627 70.392 ( 1.647 0.001 0.189) 1.658 ======================= Grid point 103 (51/112) ======================= q-point: ( 0.36 0.29 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.116 ( 11.531 8.098 7.447) 15.938 2.376 ( 11.088 2.766 -3.796) 12.041 2.412 ( 11.500 2.529 -1.482) 11.868 2.588 ( 12.415 8.545 1.948) 15.197 2.642 ( -1.507 -2.330 -2.299) 3.604 2.867 ( -4.666 0.165 -0.184) 4.673 2.952 ( -2.376 6.500 -3.874) 7.931 3.171 ( -3.184 3.359 -2.222) 5.134 3.350 ( -7.112 3.621 0.082) 7.981 3.407 ( -5.636 7.111 -4.008) 9.920 3.497 ( -6.558 4.900 5.177) 9.686 3.658 ( -4.643 6.701 3.113) 8.727 3.709 ( 4.891 -5.546 2.372) 7.765 3.844 ( 6.215 -1.421 -1.352) 6.517 3.992 ( -2.773 3.312 -0.483) 4.347 4.116 ( -2.501 -2.217 -3.604) 4.915 4.141 ( 3.948 5.561 -1.217) 6.928 4.400 ( -5.852 -1.867 -4.119) 7.396 4.424 ( -0.848 2.176 -2.710) 3.577 4.501 ( 5.361 1.846 8.810) 10.477 4.718 ( -2.060 -1.550 -4.276) 4.993 4.800 ( -5.399 -2.109 -1.008) 5.883 4.904 ( -6.466 2.037 3.960) 7.851 4.967 ( -0.368 -1.577 4.978) 5.235 5.049 ( -1.341 -2.378 4.262) 5.061 5.092 ( -3.553 -0.227 -2.322) 4.250 5.273 ( -0.646 -2.359 -3.145) 3.984 5.309 ( -2.954 -6.118 0.560) 6.817 5.411 ( 3.365 2.259 -3.894) 5.621 5.464 ( -1.510 -2.352 -1.774) 3.311 5.727 ( -1.809 -2.530 0.690) 3.186 5.784 ( -2.202 2.236 -0.392) 3.162 5.910 ( -3.627 -3.252 -1.575) 5.120 6.074 ( -0.629 2.485 4.366) 5.063 6.263 ( 0.487 -7.022 -3.070) 7.679 6.478 ( 1.212 -11.161 5.448) 12.479 6.557 ( -1.739 9.629 4.677) 10.845 6.667 ( 3.891 7.064 -1.841) 8.272 6.916 ( -1.751 3.135 -0.803) 3.679 6.989 ( -0.314 -0.558 -2.863) 2.934 7.043 ( -0.565 2.508 2.238) 3.409 7.192 ( -3.539 -2.006 2.563) 4.808 7.375 ( 1.879 -1.620 1.836) 3.086 7.455 ( 0.340 -1.892 -1.310) 2.327 7.874 ( 2.014 -1.804 0.065) 2.705 7.945 ( -1.620 -1.395 -0.861) 2.305 8.237 ( 4.817 1.785 -1.979) 5.506 8.299 ( 1.915 -3.307 -2.000) 4.313 13.342 ( 0.475 -0.567 0.203) 0.767 13.391 ( -0.639 -1.302 1.389) 2.008 13.813 ( 2.757 1.983 0.189) 3.401 13.926 ( 2.546 -1.201 0.312) 2.832 14.185 ( 1.045 -0.082 -0.633) 1.224 14.219 ( -0.673 -1.324 -1.723) 2.275 14.295 ( 1.508 1.261 -0.231) 1.979 14.415 ( 0.804 -1.989 -0.311) 2.168 16.489 ( 1.447 -1.670 0.029) 2.210 16.608 ( -2.179 -4.424 0.470) 4.954 17.112 ( -0.398 5.844 -0.183) 5.860 17.222 ( -1.017 2.712 0.207) 2.904 27.928 ( 0.692 3.592 0.292) 3.669 28.075 ( 1.251 2.222 -1.904) 3.182 28.202 ( -0.605 -1.303 2.320) 2.729 28.304 ( -0.265 -2.714 -0.563) 2.784 28.744 ( 0.439 0.438 0.145) 0.637 28.779 ( 0.306 -0.329 0.485) 0.661 28.788 ( -0.070 -0.088 -0.197) 0.227 28.836 ( -0.056 -0.918 -0.057) 0.921 28.994 ( 0.111 1.272 0.033) 1.277 29.027 ( 0.543 0.366 -0.584) 0.877 29.072 ( -0.454 0.319 0.580) 0.803 29.095 ( -0.370 -0.177 -0.048) 0.413 31.267 ( 0.919 3.681 -1.814) 4.205 31.495 ( 2.958 -1.654 0.922) 3.512 31.712 ( -1.332 0.325 2.697) 3.026 31.755 ( -2.278 0.286 1.932) 3.001 32.118 ( 6.810 -1.445 3.496) 7.790 32.381 ( 0.892 -9.735 -4.513) 10.767 32.439 ( 1.016 7.771 -1.147) 7.920 33.114 ( -3.188 -9.696 -2.120) 10.424 70.115 ( 0.081 1.030 0.392) 1.105 70.212 ( -0.199 -1.588 -0.901) 1.837 70.350 ( 1.148 1.756 0.496) 2.156 70.417 ( 0.999 0.022 0.050) 1.001 ======================= Grid point 104 (52/112) ======================= q-point: ( 0.45 0.29 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.324 ( 5.319 1.855 1.596) 5.854 2.478 ( -3.976 -0.445 -1.258) 4.194 2.496 ( 2.256 -1.185 1.604) 3.011 2.630 ( 2.213 -1.180 -1.129) 2.750 2.764 ( 3.822 6.386 2.331) 7.798 2.853 ( 7.747 9.357 -0.181) 12.149 2.937 ( 2.025 6.961 0.149) 7.251 3.070 ( -4.979 6.859 -2.521) 8.843 3.227 ( -4.575 1.610 -1.882) 5.202 3.331 ( -1.845 6.614 4.585) 8.257 3.492 ( 2.605 11.795 -0.859) 12.110 3.639 ( -3.750 6.989 4.680) 9.210 3.764 ( 1.376 1.216 -4.499) 4.860 3.867 ( -1.703 -1.689 -1.459) 2.808 3.965 ( -0.413 -2.287 0.643) 2.411 4.051 ( -1.082 -2.063 -3.700) 4.372 4.120 ( 0.710 1.758 -6.738) 7.000 4.342 ( 2.431 -1.119 -1.969) 3.323 4.374 ( 0.802 -3.966 -5.383) 6.734 4.571 ( -3.666 0.319 -4.677) 5.951 4.657 ( -3.729 -3.372 -1.695) 5.306 4.775 ( 0.225 0.156 6.794) 6.800 4.799 ( -2.936 1.255 3.909) 5.048 4.990 ( -3.386 -2.415 1.545) 4.437 5.048 ( 0.938 2.751 -0.266) 2.919 5.090 ( -0.564 -0.235 4.988) 5.025 5.191 ( -4.687 -5.087 -3.304) 7.666 5.294 ( 1.785 -3.072 -0.807) 3.643 5.417 ( 0.738 1.287 -2.867) 3.228 5.489 ( 5.153 -3.261 -0.236) 6.103 5.694 ( -1.533 -1.083 -0.644) 1.985 5.765 ( 0.760 1.981 2.284) 3.118 5.883 ( -1.215 -2.188 3.642) 4.419 6.089 ( -1.202 3.367 3.393) 4.929 6.240 ( 0.209 -5.405 -3.307) 6.340 6.512 ( -1.540 -10.274 3.782) 11.055 6.571 ( -1.674 6.629 5.779) 8.953 6.717 ( 3.715 5.866 -3.101) 7.604 6.847 ( -3.821 5.001 0.363) 6.304 7.013 ( 2.512 1.195 -0.410) 2.812 7.046 ( -0.182 3.290 1.252) 3.525 7.156 ( -2.639 -5.272 1.312) 6.040 7.402 ( -1.220 -3.838 1.524) 4.306 7.461 ( 1.954 -2.619 -1.171) 3.470 7.890 ( 1.240 -0.494 -1.084) 1.719 7.936 ( -0.318 -1.861 0.115) 1.891 8.274 ( 1.688 1.567 -2.896) 3.700 8.328 ( 1.973 -1.517 -0.382) 2.518 13.357 ( 0.861 -0.911 0.532) 1.362 13.387 ( -1.143 -1.927 1.321) 2.601 13.851 ( 1.010 1.948 0.317) 2.217 13.950 ( 0.271 -0.969 -1.029) 1.440 14.202 ( 1.026 -0.251 -0.093) 1.060 14.208 ( 0.556 -0.505 -0.263) 0.796 14.310 ( 0.558 1.182 -0.707) 1.486 14.411 ( -0.252 -1.449 -1.682) 2.234 16.519 ( 1.477 -2.933 0.316) 3.299 16.575 ( -1.723 -4.401 0.184) 4.729 17.115 ( 0.278 5.302 1.002) 5.403 17.205 ( -0.717 2.784 -0.053) 2.875 27.944 ( 0.364 3.523 0.897) 3.654 28.082 ( 1.468 2.006 -2.227) 3.337 28.198 ( -1.805 -1.406 2.105) 3.109 28.295 ( 0.142 -3.369 -0.900) 3.490 28.753 ( 0.305 0.369 0.361) 0.599 28.783 ( -0.113 -0.557 -0.024) 0.569 28.789 ( 0.094 0.168 0.345) 0.396 28.833 ( -0.102 -0.819 -0.334) 0.890 28.997 ( 0.079 1.452 0.244) 1.475 29.031 ( 0.430 0.654 -0.665) 1.027 29.071 ( -0.409 0.179 0.818) 0.932 29.091 ( -0.023 -0.313 0.010) 0.314 31.295 ( 1.925 4.321 2.138) 5.191 31.556 ( 2.589 -0.637 1.021) 2.855 31.678 ( -5.735 -0.078 3.197) 6.566 31.735 ( 0.261 -2.138 -0.094) 2.156 32.233 ( 2.499 1.654 -1.534) 3.366 32.306 ( -1.873 -4.917 -0.969) 5.350 32.508 ( 4.440 2.502 -0.200) 5.100 33.037 ( -2.018 -8.806 -4.543) 10.112 70.121 ( -0.017 0.784 0.627) 1.004 70.203 ( 0.140 -1.466 -1.059) 1.814 70.370 ( 0.405 1.491 0.791) 1.736 70.428 ( 0.259 0.051 -0.221) 0.345 ======================= Grid point 105 (53/112) ======================= q-point: (-0.45 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.279 ( -11.487 1.936 0.774) 11.674 2.398 ( -6.830 0.957 -1.665) 7.095 2.447 ( 2.416 -2.553 -3.413) 4.900 2.669 ( 0.746 -1.159 1.900) 2.347 2.768 ( -12.077 8.321 3.937) 15.185 2.989 ( 7.168 9.271 2.040) 11.895 3.030 ( 6.107 5.344 -2.681) 8.546 3.063 ( 4.947 2.953 4.605) 7.376 3.166 ( -2.748 3.628 -2.914) 5.404 3.378 ( -1.242 2.945 3.500) 4.740 3.511 ( 6.398 12.820 -2.265) 14.506 3.592 ( -1.151 8.865 4.633) 10.069 3.702 ( -5.270 7.283 -5.879) 10.741 3.864 ( 4.791 1.636 -2.941) 5.855 3.948 ( -3.956 -2.840 3.528) 6.013 3.992 ( -2.317 -1.067 -7.445) 7.870 4.106 ( 5.121 -0.406 -7.775) 9.319 4.306 ( -3.050 1.059 -1.489) 3.556 4.385 ( 5.073 -5.220 -6.769) 9.940 4.527 ( 3.731 -1.704 -7.750) 8.769 4.652 ( 2.008 -5.717 6.232) 8.692 4.704 ( -5.055 0.609 7.204) 8.822 4.863 ( -0.978 -5.356 -3.131) 6.281 4.951 ( -1.514 0.536 0.738) 1.768 5.026 ( -3.305 -6.406 1.666) 7.398 5.064 ( 0.167 -0.156 1.803) 1.817 5.192 ( 2.800 -0.974 1.198) 3.198 5.337 ( 3.176 -0.248 -0.778) 3.279 5.421 ( 2.694 1.890 -2.682) 4.246 5.573 ( 3.919 0.371 -0.239) 3.944 5.709 ( 1.692 -2.689 1.950) 3.728 5.835 ( 4.346 1.650 2.302) 5.188 5.905 ( -0.107 -2.488 4.181) 4.867 6.090 ( -1.202 3.804 2.049) 4.485 6.220 ( -0.201 -3.482 -1.015) 3.633 6.497 ( -2.981 -9.642 2.407) 10.376 6.604 ( 0.108 3.918 5.115) 6.444 6.732 ( 1.951 5.984 -5.904) 8.630 6.808 ( -2.409 3.812 3.754) 5.867 7.024 ( -0.841 7.615 -0.087) 7.661 7.081 ( 1.839 -1.179 0.628) 2.273 7.119 ( -1.648 -5.155 1.096) 5.522 7.368 ( -2.691 -2.871 -0.239) 3.942 7.492 ( 1.497 -3.721 0.517) 4.044 7.902 ( -1.076 -2.618 -0.749) 2.928 7.920 ( 0.147 -0.805 -0.105) 0.825 8.264 ( -0.573 1.901 -1.451) 2.459 8.341 ( 0.222 -1.031 -1.802) 2.088 13.370 ( -1.589 -1.347 0.770) 2.221 13.384 ( 1.087 -1.332 1.294) 2.152 13.855 ( -0.830 1.555 0.620) 1.868 13.924 ( -1.505 -0.377 -1.827) 2.397 14.215 ( 0.329 -0.519 0.320) 0.693 14.230 ( 1.161 -0.721 0.537) 1.468 14.304 ( -0.448 0.971 -0.690) 1.272 14.380 ( -0.926 -1.019 -2.910) 3.219 16.527 ( -1.566 -3.151 0.516) 3.556 16.570 ( 1.614 -4.114 0.029) 4.419 17.137 ( 0.724 4.725 1.685) 5.069 17.200 ( 0.430 3.195 -0.412) 3.250 27.955 ( -0.146 3.679 1.317) 3.910 28.086 ( 1.276 1.507 -2.873) 3.486 28.179 ( -2.036 -1.107 2.157) 3.166 28.296 ( 0.707 -3.387 -0.767) 3.544 28.760 ( -0.062 0.172 0.625) 0.651 28.777 ( -0.464 -0.187 -0.183) 0.533 28.794 ( 0.173 -0.150 0.449) 0.505 28.828 ( 0.004 -0.785 -0.523) 0.944 28.999 ( -0.171 1.318 0.307) 1.364 29.032 ( 0.450 0.956 -0.756) 1.299 29.067 ( -0.803 0.008 0.782) 1.121 29.098 ( 0.593 -0.186 0.186) 0.649 31.363 ( 1.747 3.878 4.771) 6.392 31.576 ( -7.151 0.238 1.234) 7.260 31.595 ( 1.611 0.543 -0.952) 1.948 31.767 ( 1.984 -4.703 2.001) 5.483 32.158 ( -5.272 0.755 -1.766) 5.611 32.333 ( 3.234 3.302 -3.156) 5.596 32.571 ( 0.323 -4.262 3.942) 5.814 32.971 ( 0.720 -7.701 -7.346) 10.667 70.125 ( -0.227 0.787 0.783) 1.133 70.198 ( 0.355 -1.248 -1.212) 1.775 70.379 ( -0.302 1.202 1.072) 1.639 70.423 ( -0.454 0.095 -0.453) 0.649 ======================= Grid point 106 (54/112) ======================= q-point: (-0.36 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.994 ( -19.138 8.821 2.415) 21.211 2.296 ( -5.178 6.494 -1.466) 8.434 2.493 ( -11.933 5.824 -0.515) 13.288 2.505 ( 3.338 -4.967 -0.084) 5.985 2.657 ( -7.164 -2.989 1.292) 7.869 2.905 ( -14.723 -0.997 -9.347) 17.467 3.018 ( 0.900 5.766 -4.360) 7.284 3.136 ( -1.385 2.898 1.740) 3.653 3.181 ( 0.489 11.750 0.735) 11.783 3.495 ( 6.701 9.233 -0.407) 11.416 3.511 ( 0.098 4.695 -0.612) 4.736 3.623 ( 4.382 9.510 6.608) 12.382 3.758 ( -0.952 1.754 -7.043) 7.320 3.866 ( 2.571 3.348 9.155) 10.081 3.903 ( 1.873 -2.500 2.317) 3.889 3.947 ( 5.117 4.109 -3.335) 7.361 4.169 ( 4.662 2.320 -3.066) 6.044 4.314 ( 5.446 -2.931 -5.027) 7.970 4.405 ( 2.179 -4.190 -4.741) 6.692 4.485 ( 0.419 -2.173 -3.991) 4.564 4.683 ( 2.197 -1.064 -1.474) 2.851 4.814 ( 3.377 -3.284 0.898) 4.796 4.856 ( 5.336 -1.877 5.151) 7.651 4.933 ( -2.639 -6.218 4.602) 8.173 5.027 ( 0.680 -6.666 0.935) 6.765 5.120 ( 5.453 -7.036 0.870) 8.944 5.240 ( 2.145 0.008 -1.270) 2.493 5.384 ( 2.379 3.166 -0.419) 3.982 5.469 ( 4.090 3.049 -1.118) 5.223 5.647 ( 3.516 1.588 1.743) 4.233 5.738 ( 0.725 -3.922 -0.549) 4.026 5.914 ( 3.157 -0.783 -3.789) 4.993 5.963 ( 2.476 1.794 5.173) 6.009 6.100 ( -0.296 2.361 4.727) 5.292 6.213 ( -0.999 -0.865 1.298) 1.852 6.444 ( -4.611 -7.294 1.180) 8.709 6.643 ( -0.330 0.369 2.480) 2.529 6.705 ( 1.359 4.752 -5.939) 7.726 6.819 ( -1.260 3.776 6.611) 7.717 6.983 ( -3.236 2.794 -1.071) 4.407 7.076 ( 1.058 1.038 -3.317) 3.633 7.163 ( 2.212 -0.157 3.811) 4.409 7.315 ( -2.234 -1.391 -0.589) 2.697 7.519 ( 0.220 -5.053 1.849) 5.385 7.836 ( -4.408 -1.701 -0.918) 4.813 7.931 ( 0.466 -2.709 -1.003) 2.926 8.232 ( -2.136 1.252 -0.285) 2.492 8.305 ( -1.247 -1.126 -3.908) 4.254 13.347 ( -1.280 -0.091 0.388) 1.341 13.420 ( 1.205 -1.674 2.075) 2.926 13.835 ( -2.197 0.974 1.283) 2.725 13.872 ( -2.329 0.054 -1.651) 2.855 14.209 ( -1.016 -0.582 -0.416) 1.243 14.244 ( 0.274 -0.971 -0.974) 1.402 14.293 ( -0.638 0.058 0.961) 1.155 14.332 ( -1.266 -0.567 -3.135) 3.428 16.497 ( -1.665 -1.691 0.171) 2.379 16.613 ( 2.644 -4.491 0.542) 5.239 17.164 ( 0.912 4.799 1.127) 5.013 17.215 ( 1.394 3.525 -0.168) 3.794 27.965 ( -0.027 3.913 1.612) 4.232 28.074 ( 0.326 0.858 -3.486) 3.605 28.171 ( -0.995 -0.369 2.606) 2.814 28.302 ( 0.413 -2.662 -0.528) 2.745 28.761 ( -0.536 -0.105 0.541) 0.768 28.767 ( -0.341 0.035 0.064) 0.349 28.804 ( 0.439 -0.366 0.586) 0.818 28.823 ( 0.023 -0.694 -0.609) 0.924 28.995 ( -0.382 0.931 0.098) 1.011 29.033 ( 0.282 0.857 -0.828) 1.225 29.058 ( -0.663 0.298 0.640) 0.969 29.112 ( 0.672 -0.036 0.267) 0.724 31.411 ( -0.578 0.895 2.224) 2.466 31.447 ( -6.667 -0.122 -1.499) 6.835 31.626 ( 2.444 2.431 0.565) 3.493 31.806 ( -1.313 -3.992 3.624) 5.549 32.053 ( -6.246 1.553 1.991) 6.737 32.343 ( 2.282 7.596 -6.235) 10.088 32.590 ( -2.055 -10.866 6.143) 12.650 32.944 ( 3.585 -7.389 -8.660) 11.935 70.127 ( -0.205 0.991 0.862) 1.330 70.194 ( 0.401 -0.894 -1.369) 1.684 70.379 ( -0.749 0.854 1.335) 1.752 70.405 ( -1.016 0.167 -0.578) 1.181 ======================= Grid point 107 (55/112) ======================= q-point: (-0.27 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.677 ( -17.979 14.116 3.395) 23.109 2.036 ( -22.064 13.007 3.269) 25.821 2.318 ( -13.241 7.016 -5.795) 16.066 2.479 ( -8.591 -4.921 -1.061) 9.957 2.543 ( -0.177 3.865 -1.232) 4.060 2.723 ( 6.907 -7.084 -5.467) 11.303 2.859 ( -16.179 11.642 -4.664) 20.470 2.999 ( -4.886 5.268 -3.333) 7.920 3.150 ( -2.661 0.748 4.335) 5.141 3.526 ( -5.906 3.881 2.112) 7.376 3.585 ( 3.701 0.268 -3.018) 4.783 3.748 ( 1.159 -0.204 -0.073) 1.179 3.764 ( -1.623 -1.425 2.424) 3.247 3.839 ( 6.370 5.292 9.371) 12.506 4.024 ( 7.068 8.472 -2.117) 11.235 4.180 ( 6.099 1.944 -1.685) 6.619 4.272 ( 11.922 1.387 2.766) 12.317 4.337 ( 7.076 0.270 -4.880) 8.600 4.435 ( 3.159 -2.224 4.638) 6.037 4.570 ( 10.360 -2.337 -5.068) 11.768 4.730 ( 6.238 -0.119 -4.666) 7.791 4.882 ( 0.040 -10.334 1.319) 10.418 4.951 ( 5.353 -2.514 2.955) 6.611 4.968 ( 2.060 -1.445 1.139) 2.762 5.095 ( 4.590 -3.396 3.826) 6.873 5.252 ( 3.239 -3.459 -2.826) 5.518 5.260 ( 5.213 -5.562 2.391) 7.989 5.414 ( 2.179 3.211 -1.784) 4.272 5.533 ( 3.285 4.003 -0.252) 5.184 5.673 ( -2.970 -1.084 1.268) 3.406 5.779 ( 5.260 -1.004 -1.616) 5.594 5.894 ( -0.033 0.220 -4.924) 4.929 6.050 ( 3.081 1.402 0.867) 3.494 6.128 ( -5.292 1.591 7.540) 9.348 6.209 ( 0.459 1.070 2.416) 2.682 6.364 ( -4.942 -3.372 1.275) 6.117 6.623 ( -2.681 -1.700 0.119) 3.177 6.686 ( 1.036 4.580 -3.733) 5.999 6.849 ( -3.666 2.806 5.339) 7.058 6.907 ( -2.481 -0.619 -0.343) 2.579 7.077 ( 2.573 4.741 -4.702) 7.156 7.242 ( 2.606 0.688 3.158) 4.152 7.305 ( 1.842 -1.884 1.501) 3.032 7.534 ( -0.764 -6.895 2.958) 7.541 7.742 ( -4.767 -0.444 -0.523) 4.816 7.911 ( -1.129 -3.509 -2.137) 4.261 8.175 ( -3.021 -0.261 -2.549) 3.961 8.248 ( -0.619 -1.528 -3.470) 3.842 13.337 ( -0.047 1.294 0.456) 1.372 13.460 ( 1.096 -1.988 2.169) 3.140 13.799 ( -3.326 0.370 1.879) 3.838 13.815 ( -2.423 0.060 -1.413) 2.806 14.175 ( -1.686 -0.524 -1.198) 2.134 14.218 ( -1.109 -0.591 -3.013) 3.265 14.283 ( -0.976 -0.568 -0.818) 1.394 14.301 ( -0.969 -0.943 1.231) 1.829 16.477 ( -0.436 0.446 0.068) 0.628 16.673 ( 3.464 -4.649 0.656) 5.835 17.189 ( 1.444 5.551 -0.372) 5.748 17.239 ( 0.934 3.333 0.335) 3.477 27.988 ( 1.115 3.877 1.706) 4.380 28.043 ( -0.189 0.755 -3.555) 3.639 28.186 ( -0.056 0.348 2.717) 2.740 28.298 ( -0.534 -1.452 -0.267) 1.570 28.752 ( -0.380 0.095 0.041) 0.394 28.768 ( -0.120 -0.272 0.725) 0.784 28.815 ( -0.172 -0.535 -0.061) 0.565 28.820 ( 0.387 -0.507 -0.101) 0.646 28.988 ( -0.365 0.594 -0.076) 0.701 29.026 ( -0.226 0.009 -0.843) 0.872 29.056 ( -0.132 1.219 0.465) 1.311 29.125 ( 0.539 0.027 0.121) 0.553 31.315 ( -5.489 -0.137 -2.939) 6.228 31.380 ( -2.366 -2.508 -2.253) 4.118 31.665 ( -1.069 0.957 1.319) 1.949 31.800 ( -2.124 -0.049 6.148) 6.505 31.955 ( -7.506 2.761 4.211) 9.039 32.303 ( -0.455 8.616 -6.453) 10.774 32.642 ( 0.773 -13.680 8.316) 16.028 32.931 ( 3.612 -9.321 -9.893) 14.064 70.135 ( 0.303 1.314 0.742) 1.539 70.189 ( 0.351 -0.408 -1.273) 1.382 70.374 ( -1.084 0.341 0.718) 1.344 70.380 ( -1.040 0.394 -0.022) 1.112 ======================= Grid point 108 (56/112) ======================= q-point: (-0.18 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.410 ( -15.614 17.094 4.639) 23.612 1.632 ( -22.251 16.163 -0.611) 27.509 1.996 ( -14.106 11.580 -2.522) 18.424 2.245 ( -15.272 2.796 4.637) 16.203 2.502 ( -11.977 9.465 -2.474) 15.465 2.689 ( 3.812 4.864 8.524) 10.529 2.797 ( 1.139 -0.722 -3.471) 3.724 3.004 ( 7.452 -3.573 -3.298) 8.898 3.149 ( 1.085 -3.720 4.013) 5.579 3.356 ( -9.010 0.602 -3.504) 9.686 3.549 ( -10.149 -2.868 4.024) 11.288 3.709 ( -1.948 -5.205 -3.864) 6.769 3.790 ( 4.662 -3.707 1.372) 6.113 3.991 ( 1.131 12.181 3.847) 12.824 4.189 ( 11.317 2.547 -2.447) 11.855 4.278 ( 4.426 4.977 2.643) 7.166 4.353 ( 3.960 -3.103 3.765) 6.284 4.573 ( 7.316 0.543 3.785) 8.255 4.595 ( 14.761 4.217 -9.947) 18.292 4.691 ( 5.115 0.491 -1.246) 5.288 4.842 ( 10.994 -2.745 -5.067) 12.413 4.910 ( 2.861 -10.060 2.049) 10.658 5.012 ( 4.298 -3.600 -1.848) 5.903 5.077 ( 4.030 3.133 2.008) 5.485 5.217 ( 3.576 -2.255 4.483) 6.162 5.289 ( 4.933 -1.844 -2.391) 5.784 5.335 ( -0.637 -4.589 3.391) 5.741 5.455 ( 6.161 0.307 -5.736) 8.423 5.580 ( 2.574 4.181 -1.714) 5.200 5.626 ( -1.170 3.695 0.756) 3.949 5.788 ( -0.537 0.144 -6.830) 6.852 5.872 ( -3.241 -2.880 2.191) 4.858 6.041 ( -1.113 0.996 -1.413) 2.056 6.088 ( -5.110 1.230 5.896) 7.899 6.234 ( -1.683 2.393 1.231) 3.174 6.287 ( -5.820 -2.867 2.564) 6.976 6.559 ( -3.996 -1.861 -0.951) 4.509 6.668 ( -0.978 5.118 -0.925) 5.292 6.759 ( -6.011 2.099 -0.105) 6.368 6.909 ( -0.164 0.174 2.404) 2.416 7.095 ( 2.793 2.256 -1.570) 3.918 7.293 ( 1.698 1.153 1.073) 2.316 7.404 ( 3.963 -2.773 3.918) 6.224 7.535 ( -0.574 -6.822 -0.267) 6.852 7.686 ( -1.927 -0.508 4.004) 4.472 7.863 ( -2.345 -3.820 -1.092) 4.614 8.097 ( -0.567 0.011 -5.563) 5.592 8.240 ( 1.776 -2.892 -0.483) 3.427 13.354 ( 1.355 2.258 0.522) 2.685 13.491 ( 0.602 -1.839 0.966) 2.163 13.745 ( -4.379 -0.169 1.716) 4.706 13.764 ( -1.801 -0.542 -1.530) 2.425 14.138 ( -1.298 -0.613 -0.654) 1.577 14.172 ( -1.090 0.046 -2.015) 2.291 14.259 ( -0.754 -0.687 -0.970) 1.408 14.293 ( -1.504 -1.723 1.856) 2.945 16.488 ( 1.724 2.733 0.032) 3.231 16.747 ( 4.108 -4.390 0.179) 6.014 17.207 ( 1.723 5.855 -2.435) 6.571 17.248 ( -0.287 2.768 0.213) 2.791 28.010 ( 0.466 0.836 -3.578) 3.704 28.040 ( 2.728 2.960 1.454) 4.280 28.210 ( 0.449 1.191 1.611) 2.053 28.279 ( -1.446 -0.206 -0.014) 1.461 28.751 ( 0.192 0.117 0.217) 0.313 28.772 ( -0.014 -0.344 0.401) 0.529 28.805 ( -0.346 -0.188 -0.587) 0.707 28.824 ( -0.160 -0.712 0.149) 0.744 28.983 ( -0.052 0.392 -0.001) 0.396 29.013 ( -0.363 -0.414 -0.734) 0.917 29.059 ( 0.031 1.620 0.396) 1.668 29.133 ( 0.335 0.016 -0.084) 0.346 31.205 ( -3.785 -0.083 -2.798) 4.708 31.301 ( -3.649 -4.253 -2.649) 6.199 31.614 ( -4.024 -0.018 1.240) 4.211 31.776 ( -7.202 -4.129 3.951) 9.194 31.934 ( 0.600 10.967 7.828) 13.488 32.232 ( -0.813 7.626 -6.372) 9.971 32.676 ( -9.030 -14.457 10.344) 19.939 32.941 ( 8.216 -11.883 -8.719) 16.874 70.152 ( 1.270 1.443 -0.040) 1.923 70.188 ( 0.456 0.121 -0.363) 0.595 70.349 ( -1.125 0.353 -0.675) 1.358 70.371 ( -0.851 0.194 0.520) 1.016 ======================= Grid point 109 (57/112) ======================= q-point: (-0.09 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.186 ( -12.999 18.483 7.091) 23.683 1.320 ( -11.909 22.211 3.660) 25.467 1.820 ( -6.378 11.345 5.951) 14.310 2.067 ( -10.396 8.825 10.031) 16.928 2.333 ( -6.457 11.271 2.946) 13.320 2.770 ( 3.079 0.181 -1.739) 3.540 2.861 ( 2.143 2.029 7.188) 7.770 3.040 ( -1.703 -7.155 2.741) 7.850 3.177 ( -6.169 1.803 -0.351) 6.437 3.314 ( 8.687 -4.083 -1.714) 9.751 3.404 ( -6.410 -3.561 3.905) 8.307 3.633 ( -0.460 -9.294 -5.213) 10.666 3.867 ( 0.218 -4.926 2.557) 5.555 4.053 ( 4.730 11.025 1.484) 12.088 4.255 ( -2.500 -3.576 2.893) 5.235 4.380 ( 4.710 6.258 1.089) 7.908 4.520 ( 10.680 -1.245 -2.336) 11.003 4.631 ( 0.822 4.809 -7.702) 9.117 4.725 ( 6.222 1.741 -3.782) 7.486 4.751 ( 4.187 -0.070 0.660) 4.240 4.964 ( 0.704 -5.389 -3.429) 6.426 4.985 ( 5.004 -1.793 -6.001) 8.017 5.035 ( 3.460 0.411 -6.768) 7.612 5.154 ( 2.140 2.404 2.441) 4.039 5.274 ( 2.881 -0.030 1.120) 3.091 5.329 ( 0.047 -5.778 4.005) 7.030 5.429 ( 7.516 0.218 -2.644) 7.971 5.511 ( 2.583 0.978 -0.136) 2.766 5.564 ( -1.114 2.353 -4.209) 4.949 5.687 ( 1.321 4.203 -0.644) 4.452 5.712 ( 3.847 4.077 -5.747) 8.028 5.802 ( -3.602 -5.750 1.238) 6.897 5.981 ( -10.004 3.600 5.096) 11.790 6.051 ( -0.701 0.136 1.446) 1.613 6.140 ( -8.617 -2.994 1.956) 9.330 6.194 ( -4.143 0.358 -2.325) 4.764 6.483 ( -1.712 -1.667 -2.510) 3.466 6.625 ( -2.986 7.814 -1.113) 8.439 6.687 ( -2.849 -0.203 4.226) 5.101 6.935 ( 0.484 -0.858 2.638) 2.816 7.139 ( 1.807 1.803 0.782) 2.669 7.317 ( 0.241 2.192 -1.228) 2.524 7.427 ( -1.038 -2.190 -1.627) 2.919 7.550 ( 1.287 -4.918 -0.545) 5.112 7.746 ( 0.978 -2.389 9.766) 10.102 7.818 ( -1.874 -3.421 1.691) 4.251 8.088 ( 3.206 -0.353 -2.831) 4.291 8.312 ( 4.675 -5.787 3.049) 8.040 13.388 ( 1.635 2.462 0.028) 2.955 13.492 ( -0.221 -0.733 -1.396) 1.592 13.674 ( -4.607 -0.081 1.225) 4.768 13.730 ( -0.221 -1.466 -1.604) 2.184 14.126 ( -0.521 -1.101 1.528) 1.954 14.150 ( -0.072 0.146 -0.423) 0.453 14.240 ( -0.420 -1.000 -0.659) 1.269 14.283 ( -1.129 -2.278 1.581) 2.994 16.537 ( 3.070 4.083 0.289) 5.117 16.813 ( 3.203 -3.590 -1.399) 5.010 17.203 ( 1.356 5.026 -5.354) 7.468 17.232 ( -1.104 2.075 -0.675) 2.445 27.996 ( 1.328 1.431 -3.101) 3.664 28.105 ( 2.990 -0.150 0.543) 3.043 28.216 ( 0.215 2.232 -3.208) 3.914 28.248 ( -1.778 0.309 -0.010) 1.805 28.758 ( -0.211 0.060 0.535) 0.578 28.774 ( 0.480 -0.057 -0.337) 0.589 28.796 ( -0.052 -0.060 -0.430) 0.437 28.817 ( -0.655 -0.648 -0.035) 0.922 28.986 ( 0.213 0.283 -0.170) 0.393 29.006 ( 0.178 -0.515 0.222) 0.589 29.064 ( 0.051 1.563 0.671) 1.702 29.136 ( 0.143 -0.005 -0.180) 0.230 31.141 ( -1.232 -0.126 -0.528) 1.346 31.230 ( -2.548 -4.131 1.400) 5.052 31.573 ( -1.220 0.561 1.080) 1.723 31.685 ( -4.831 -1.794 2.475) 5.716 32.012 ( -0.447 8.838 4.848) 10.090 32.175 ( 0.648 8.036 -7.433) 10.965 32.532 ( -14.746 -13.646 15.915) 25.631 33.051 ( 7.718 -13.807 -2.880) 16.078 70.172 ( 1.325 1.060 -1.023) 1.981 70.207 ( 1.292 0.288 0.958) 1.634 70.326 ( -0.596 0.537 -1.370) 1.588 70.350 ( -1.292 0.286 -1.060) 1.696 ======================= Grid point 110 (58/112) ======================= q-point: ( 0.00 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( 2.055 16.011 7.081) 17.627 1.662 ( 1.975 12.837 1.351) 13.058 1.911 ( 0.576 -5.222 8.042) 9.606 1.989 ( 0.679 -2.986 2.946) 4.250 2.768 ( -2.552 9.556 16.771) 19.470 2.806 ( 5.203 7.590 -4.822) 10.389 2.881 ( -5.226 -1.387 6.518) 8.469 2.940 ( 2.911 -2.210 -5.256) 6.402 3.155 ( 0.907 -1.713 -2.127) 2.877 3.208 ( -1.960 -7.166 -5.558) 9.278 3.390 ( -1.142 4.037 9.643) 10.516 3.497 ( 2.316 -5.859 8.005) 10.187 3.810 ( -5.148 1.894 8.458) 10.081 3.983 ( -6.698 -11.718 10.250) 16.948 4.400 ( 1.281 10.406 -0.555) 10.499 4.537 ( 2.303 -3.882 0.264) 4.522 4.566 ( 1.576 4.476 -3.703) 6.020 4.669 ( -0.875 -4.333 -2.006) 4.854 4.784 ( 1.980 4.685 -3.843) 6.375 4.793 ( -3.933 8.940 -6.027) 11.477 4.899 ( -0.655 -3.994 -6.918) 8.015 4.934 ( 4.331 -2.701 -8.398) 9.828 5.089 ( 5.598 1.262 -9.006) 10.679 5.122 ( -0.401 -1.442 -6.698) 6.863 5.289 ( 1.948 -1.373 -1.562) 2.850 5.338 ( 2.070 -4.131 -3.424) 5.750 5.497 ( -1.534 3.907 -0.858) 4.284 5.547 ( -1.024 -1.579 -2.372) 3.027 5.567 ( 1.612 4.008 3.050) 5.288 5.669 ( 2.019 -4.016 4.274) 6.202 5.738 ( -6.223 7.293 1.034) 9.643 5.824 ( -3.613 5.491 -4.786) 8.131 5.898 ( -3.930 -7.447 -0.089) 8.421 5.956 ( 1.106 -5.436 -3.198) 6.404 6.062 ( 0.573 3.460 -0.340) 3.524 6.138 ( -1.131 -1.875 -0.832) 2.343 6.498 ( 2.417 4.042 2.373) 5.273 6.593 ( 0.169 -3.846 3.847) 5.443 6.803 ( 0.081 6.343 0.984) 6.419 6.906 ( -0.972 -3.540 1.258) 3.881 7.252 ( 0.934 4.920 2.385) 5.547 7.355 ( 0.787 -3.870 1.499) 4.224 7.373 ( -1.249 3.927 -0.855) 4.209 7.453 ( -0.845 -3.240 -0.945) 3.480 7.749 ( -1.154 -0.889 6.399) 6.563 7.791 ( 0.143 -4.632 9.718) 10.766 8.152 ( 2.092 3.525 -2.621) 4.865 8.252 ( 1.450 -6.069 -0.408) 6.254 13.433 ( -1.015 1.956 -0.871) 2.370 13.465 ( -0.579 -1.128 -1.140) 1.705 13.647 ( 0.016 1.655 -0.384) 1.699 13.686 ( 0.978 -2.085 -1.059) 2.535 14.132 ( 0.129 0.950 1.535) 1.810 14.159 ( 0.995 -1.050 1.258) 1.917 14.211 ( -0.167 -0.129 -0.243) 0.322 14.233 ( -0.101 -1.856 0.043) 1.859 16.669 ( -0.169 4.522 0.709) 4.580 16.755 ( -0.273 -3.791 -0.823) 3.889 17.229 ( 0.506 1.232 -2.881) 3.174 17.235 ( 0.250 0.625 -2.575) 2.662 28.051 ( 1.453 2.458 -0.590) 2.915 28.100 ( 0.536 -2.252 0.982) 2.514 28.198 ( -1.307 1.282 -4.695) 5.040 28.214 ( -1.021 -0.479 -2.111) 2.393 28.761 ( -0.576 0.615 0.306) 0.897 28.775 ( -0.194 -0.737 0.257) 0.804 28.795 ( 0.183 0.251 -0.417) 0.520 28.801 ( 0.471 -0.327 -0.302) 0.648 28.995 ( 0.121 0.529 0.317) 0.629 29.007 ( 0.398 -0.662 0.494) 0.917 29.101 ( -0.058 1.448 0.245) 1.469 29.126 ( -0.004 -0.902 -0.163) 0.917 31.153 ( 1.389 0.371 2.365) 2.768 31.180 ( 1.674 -2.402 2.601) 3.917 31.610 ( 0.538 1.276 2.542) 2.895 31.638 ( 0.063 -1.279 2.626) 2.921 32.054 ( -7.047 4.567 -1.275) 8.494 32.128 ( -5.205 -2.191 -1.144) 5.762 32.568 ( 4.131 8.774 5.742) 11.270 32.829 ( 4.108 -15.026 -0.323) 15.580 70.207 ( 0.460 0.927 0.482) 1.142 70.223 ( 0.110 -0.616 0.999) 1.179 70.316 ( -0.149 0.542 -2.042) 2.119 70.322 ( -0.365 -0.113 -1.467) 1.516 ======================= Grid point 111 (59/112) ======================= q-point: ( 0.09 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.679 ( 6.571 13.978 5.652) 16.447 1.786 ( 9.162 11.598 2.889) 15.060 2.009 ( 5.083 -2.293 2.703) 6.197 2.115 ( 8.233 -2.882 4.989) 10.049 2.764 ( -1.675 5.065 -4.935) 7.267 2.820 ( -4.047 0.088 7.428) 8.459 2.957 ( 4.379 1.095 -0.360) 4.529 3.013 ( 6.624 -5.259 3.438) 9.130 3.161 ( 3.804 3.236 4.064) 6.439 3.276 ( 7.320 -3.760 4.310) 9.289 3.434 ( -2.022 5.250 8.392) 10.103 3.572 ( -1.739 -5.901 8.372) 10.389 3.790 ( -4.046 2.929 7.032) 8.625 3.953 ( -5.019 -9.531 8.245) 13.565 4.385 ( -10.311 2.093 -8.988) 13.838 4.388 ( -4.412 3.269 -8.665) 10.259 4.491 ( -4.099 9.724 -1.960) 10.733 4.642 ( 0.187 -3.535 0.998) 3.678 4.719 ( -3.486 7.327 -0.473) 8.128 4.757 ( -0.365 1.791 -2.252) 2.901 4.870 ( 1.128 -3.936 -1.479) 4.353 4.921 ( 0.476 -5.807 -6.494) 8.725 5.047 ( -1.628 0.468 -7.376) 7.568 5.087 ( 0.388 -3.154 -6.294) 7.051 5.250 ( -2.315 2.495 -2.295) 4.105 5.316 ( -0.851 -2.791 -2.813) 4.054 5.435 ( -11.205 5.268 1.461) 12.468 5.513 ( -3.836 1.501 -1.178) 4.284 5.543 ( -0.581 -1.709 -2.131) 2.792 5.597 ( -1.848 -1.774 -0.808) 2.686 5.736 ( 1.497 7.556 -3.897) 8.633 5.754 ( 1.428 3.902 0.591) 4.197 5.872 ( -0.227 -5.565 -0.277) 5.576 5.943 ( -0.040 -9.562 -2.791) 9.962 6.090 ( 2.723 2.198 0.391) 3.521 6.159 ( 2.239 -3.491 0.470) 4.174 6.606 ( 5.379 5.339 3.117) 8.195 6.668 ( 5.052 1.134 0.671) 5.221 6.826 ( 0.302 1.560 2.528) 2.986 6.890 ( -0.978 -3.505 -0.054) 3.640 7.297 ( 1.392 3.835 3.321) 5.260 7.333 ( -2.441 5.122 -1.192) 5.798 7.375 ( -0.252 -3.512 1.767) 3.940 7.416 ( -2.171 -2.038 -1.107) 3.176 7.783 ( -1.545 1.468 6.730) 7.060 7.872 ( -0.230 -6.409 8.845) 10.925 8.148 ( 0.492 2.852 -3.042) 4.199 8.241 ( -1.310 -5.886 -1.651) 6.252 13.399 ( -1.602 2.045 -0.654) 2.679 13.435 ( -1.537 -1.323 -0.981) 2.253 13.670 ( 2.641 1.926 -0.625) 3.328 13.712 ( 2.615 -2.090 -0.813) 3.445 14.150 ( 0.653 1.479 0.922) 1.862 14.195 ( 1.279 -2.304 1.373) 2.972 14.216 ( 0.967 0.296 -0.201) 1.031 14.242 ( 1.221 -1.837 0.220) 2.217 16.631 ( -4.087 4.257 0.453) 5.919 16.709 ( -3.523 -3.268 -0.797) 4.871 17.232 ( 1.584 1.335 -2.583) 3.311 17.236 ( 2.259 0.897 -2.037) 3.171 28.051 ( -1.151 2.843 -1.060) 3.245 28.102 ( -1.101 -2.023 0.910) 2.476 28.153 ( 1.137 3.028 -3.449) 4.728 28.206 ( 1.953 -2.081 -1.472) 3.212 28.751 ( -0.620 0.691 0.207) 0.951 28.767 ( -0.666 -0.809 0.185) 1.065 28.798 ( 0.410 0.418 -0.362) 0.689 28.809 ( 0.503 -0.595 -0.162) 0.796 29.000 ( 0.128 0.725 0.422) 0.849 29.016 ( 0.214 -0.681 0.170) 0.734 29.100 ( -0.312 1.192 0.319) 1.273 29.122 ( -0.239 -0.810 -0.357) 0.917 31.219 ( 3.426 0.511 2.039) 4.019 31.257 ( 4.278 -3.318 1.214) 5.548 31.649 ( 0.595 1.394 3.941) 4.222 31.682 ( 1.506 -1.643 3.823) 4.426 31.925 ( -4.014 8.447 -2.728) 9.742 32.079 ( 0.136 -5.920 -1.629) 6.142 32.661 ( 1.285 6.953 3.506) 7.892 32.891 ( 2.590 -14.171 0.910) 14.435 70.202 ( -1.502 1.346 0.193) 2.027 70.223 ( -0.885 -0.671 0.975) 1.478 70.308 ( 1.283 0.788 -1.828) 2.368 70.321 ( 1.489 -0.417 -1.074) 1.883 ======================= Grid point 112 (60/112) ======================= q-point: ( 0.18 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.862 ( 8.918 11.502 4.691) 15.291 1.992 ( 11.784 1.336 -1.605) 11.967 2.168 ( 9.829 9.532 2.928) 14.002 2.311 ( 9.835 -0.571 0.816) 9.886 2.692 ( -2.121 4.201 -3.213) 5.698 2.809 ( -0.231 -6.549 2.312) 6.949 3.048 ( 5.857 -2.360 1.780) 6.561 3.128 ( 6.536 -8.435 -0.866) 10.706 3.333 ( -3.726 3.567 0.179) 5.161 3.375 ( 5.511 1.819 5.025) 7.676 3.544 ( 6.649 5.818 7.583) 11.643 3.664 ( 3.923 -3.389 15.180) 16.041 3.795 ( -1.643 5.922 6.422) 8.889 3.951 ( -3.708 -6.183 5.904) 9.318 4.092 ( -11.495 2.036 -8.687) 14.551 4.134 ( -7.914 -1.643 -9.811) 12.711 4.482 ( -1.638 12.274 0.937) 12.418 4.571 ( -1.088 9.376 -7.972) 12.355 4.667 ( -4.393 -1.764 -0.534) 4.764 4.726 ( -5.536 -0.668 0.039) 5.576 4.812 ( -6.526 3.165 -1.005) 7.322 4.854 ( -4.787 -6.315 4.016) 8.884 4.937 ( -4.399 -6.367 -2.698) 8.196 4.984 ( -8.091 -6.991 1.298) 10.771 5.201 ( -2.934 4.613 -0.846) 5.533 5.248 ( -6.004 0.601 1.925) 6.334 5.284 ( -1.164 -0.072 -4.666) 4.809 5.350 ( -6.513 -4.440 -3.969) 8.825 5.541 ( 1.408 3.973 -5.480) 6.914 5.598 ( 1.105 -0.663 -4.596) 4.773 5.734 ( 1.160 5.161 -1.357) 5.461 5.816 ( 3.854 3.621 0.472) 5.309 5.896 ( 2.601 -5.920 -1.839) 6.722 5.925 ( 0.740 -6.678 1.878) 6.976 6.143 ( 2.324 -0.374 -0.431) 2.393 6.191 ( 0.386 -4.734 0.916) 4.837 6.700 ( 2.516 7.873 1.912) 8.484 6.753 ( 3.358 6.338 -0.811) 7.218 6.850 ( 0.393 -3.893 1.757) 4.289 6.891 ( 0.598 -4.503 2.013) 4.969 7.262 ( -3.796 4.751 -1.822) 6.348 7.344 ( -0.680 1.993 3.114) 3.759 7.345 ( -2.992 -2.144 -1.503) 3.976 7.390 ( -0.266 -2.043 1.892) 2.797 7.813 ( -0.686 3.804 5.092) 6.393 7.926 ( -1.061 -6.663 5.494) 8.701 8.137 ( 2.103 1.894 -3.579) 4.563 8.202 ( 0.387 -4.438 -3.531) 5.684 13.369 ( -1.358 1.701 -0.025) 2.176 13.400 ( -1.494 -1.215 -0.407) 1.968 13.724 ( 3.767 1.888 -0.502) 4.243 13.764 ( 3.610 -1.889 -0.317) 4.086 14.168 ( 0.915 1.354 -0.154) 1.641 14.210 ( 0.224 -2.690 -0.354) 2.722 14.249 ( 2.185 1.255 0.319) 2.539 14.283 ( 2.441 -2.136 0.988) 3.391 16.556 ( -3.806 3.802 0.048) 5.380 16.633 ( -3.955 -3.622 -0.237) 5.368 17.236 ( 0.705 2.521 -1.690) 3.115 17.258 ( 1.315 0.329 -1.009) 1.689 28.016 ( -0.823 3.701 -1.479) 4.070 28.082 ( -0.610 -2.552 -0.859) 2.761 28.173 ( 1.606 3.414 0.259) 3.782 28.238 ( 1.663 -2.667 0.056) 3.144 28.745 ( -0.217 0.674 0.231) 0.745 28.760 ( -0.296 -0.659 0.251) 0.765 28.799 ( 0.072 0.430 -0.404) 0.595 28.814 ( 0.143 -0.859 -0.142) 0.882 29.006 ( 0.190 0.759 0.219) 0.813 29.019 ( 0.262 -0.447 -0.219) 0.562 29.095 ( -0.550 0.881 0.350) 1.096 29.112 ( -0.456 -0.633 -0.448) 0.899 31.294 ( 3.601 0.778 -0.617) 3.736 31.333 ( 3.879 -3.049 -1.182) 5.074 31.699 ( 0.311 2.302 5.615) 6.077 31.751 ( 1.296 -2.415 5.359) 6.019 31.880 ( 1.654 9.390 -2.228) 9.792 32.088 ( 2.258 -9.927 -1.695) 10.321 32.679 ( -0.480 9.327 0.098) 9.340 32.930 ( 0.891 -14.102 0.288) 14.133 70.172 ( -1.466 1.966 -0.237) 2.464 70.208 ( -1.138 -1.556 0.145) 1.933 70.328 ( 1.881 1.332 -0.631) 2.389 70.349 ( 1.994 -0.715 -0.164) 2.124 ======================= Grid point 113 (61/112) ======================= q-point: ( 0.27 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.081 ( 10.432 9.261 4.789) 14.748 2.185 ( 12.440 -2.071 -3.217) 13.015 2.346 ( 7.240 8.447 -1.123) 11.182 2.498 ( 8.066 -3.007 2.196) 8.884 2.659 ( 2.402 9.915 0.592) 10.219 2.877 ( 5.647 -5.104 -1.205) 7.706 3.139 ( -1.514 -1.733 0.824) 2.444 3.187 ( -3.431 -3.195 2.642) 5.382 3.303 ( 7.822 1.366 -3.239) 8.575 3.403 ( 5.096 -5.137 -5.853) 9.307 3.714 ( -10.540 2.141 0.686) 10.777 3.733 ( -11.880 0.916 2.276) 12.131 3.761 ( 5.276 4.402 2.642) 7.362 3.822 ( -1.810 -1.198 -2.207) 3.096 4.071 ( 7.924 4.600 8.907) 12.779 4.095 ( 2.246 2.328 4.054) 5.187 4.370 ( -8.016 10.080 -5.366) 13.952 4.494 ( -6.025 1.804 -6.064) 8.737 4.544 ( -6.864 2.435 1.437) 7.423 4.583 ( -4.292 -0.144 2.304) 4.873 4.710 ( -7.645 -2.240 4.111) 8.964 4.806 ( -1.652 1.611 1.753) 2.898 4.832 ( -5.382 -8.229 1.900) 10.015 4.923 ( -2.034 -7.241 4.089) 8.561 5.117 ( -6.737 2.145 3.577) 7.924 5.169 ( -5.854 -1.561 2.268) 6.470 5.238 ( 1.959 -1.865 -8.783) 9.190 5.257 ( 0.205 -1.999 -5.894) 6.227 5.501 ( -0.005 4.356 -5.158) 6.751 5.549 ( -1.337 0.199 -5.675) 5.834 5.731 ( -0.836 3.205 -0.400) 3.336 5.862 ( -0.668 -5.070 -1.420) 5.307 5.888 ( -0.370 3.434 2.032) 4.008 6.025 ( 4.579 -4.051 2.654) 6.665 6.153 ( -1.183 -1.673 0.808) 2.203 6.210 ( 0.710 -6.124 3.113) 6.906 6.752 ( 2.386 7.619 0.552) 8.003 6.770 ( -0.767 8.131 1.086) 8.239 6.864 ( 0.941 -3.998 -0.865) 4.198 6.939 ( 0.845 -6.457 4.070) 7.679 7.175 ( -3.135 6.229 -2.652) 7.461 7.291 ( -1.199 -3.180 -0.953) 3.529 7.321 ( -3.660 2.856 1.614) 4.915 7.400 ( -0.515 -3.492 0.442) 3.558 7.843 ( 0.498 2.953 2.054) 3.631 7.924 ( -1.589 -4.488 0.974) 4.859 8.178 ( 4.886 0.852 -2.320) 5.475 8.210 ( 3.538 -2.633 -3.422) 5.582 13.350 ( -0.885 1.128 0.286) 1.462 13.376 ( -1.140 -1.214 0.259) 1.686 13.792 ( 3.863 1.987 -0.062) 4.344 13.832 ( 3.787 -1.828 0.202) 4.210 14.180 ( 0.833 0.812 -0.750) 1.384 14.206 ( 0.098 -1.725 -1.134) 2.067 14.292 ( 2.202 1.731 0.237) 2.811 14.335 ( 2.293 -2.421 0.593) 3.387 16.504 ( -1.947 2.575 0.047) 3.228 16.569 ( -2.965 -3.671 0.130) 4.720 17.226 ( -0.545 3.293 -0.722) 3.415 17.262 ( -0.307 -0.137 -0.284) 0.440 28.002 ( 0.351 4.032 -0.864) 4.139 28.073 ( 0.492 -2.436 -0.883) 2.638 28.197 ( 0.203 2.609 1.139) 2.854 28.256 ( 0.036 -2.764 0.410) 2.794 28.747 ( 0.216 0.647 0.217) 0.716 28.761 ( 0.130 -0.641 0.292) 0.717 28.796 ( -0.025 0.606 -0.241) 0.653 28.814 ( 0.027 -1.052 -0.034) 1.053 29.012 ( 0.350 0.834 -0.003) 0.904 29.023 ( 0.517 -0.253 -0.395) 0.698 29.087 ( -0.652 0.592 0.334) 0.942 29.099 ( -0.561 -0.506 -0.262) 0.799 31.330 ( 2.512 2.285 -3.202) 4.668 31.384 ( 3.458 -2.948 -1.669) 4.841 31.743 ( -1.743 2.944 6.518) 7.361 31.788 ( -2.477 -0.276 5.228) 5.792 31.958 ( 7.330 4.377 0.047) 8.538 32.130 ( 4.111 -10.942 -2.019) 11.862 32.663 ( -0.151 11.744 -1.989) 11.912 32.926 ( -0.669 -13.325 -1.494) 13.425 70.151 ( -0.704 1.903 -0.140) 2.034 70.190 ( -0.770 -1.856 -0.242) 2.024 70.359 ( 1.655 1.544 -0.007) 2.264 70.383 ( 1.655 -0.827 0.150) 1.856 ======================= Grid point 114 (62/112) ======================= q-point: ( 0.36 0.43 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.301 ( 8.316 8.344 4.651) 12.665 2.386 ( 10.950 -1.020 -0.863) 11.031 2.433 ( 3.221 1.563 -0.289) 3.592 2.541 ( -2.095 -6.972 1.898) 7.524 2.815 ( 8.203 11.210 0.101) 13.891 2.926 ( 4.127 2.110 -4.559) 6.502 3.064 ( -1.726 3.680 -3.773) 5.546 3.157 ( 1.690 -3.996 -3.922) 5.849 3.413 ( -2.975 1.857 0.865) 3.613 3.465 ( -2.749 -3.309 2.581) 5.017 3.539 ( 2.750 3.552 -1.757) 4.824 3.610 ( 1.950 -3.283 0.897) 3.923 3.783 ( -1.875 4.318 1.512) 4.944 3.836 ( 0.738 -0.713 -1.113) 1.514 4.104 ( -0.489 6.668 0.112) 6.687 4.152 ( -8.890 5.813 -3.295) 11.121 4.214 ( -3.092 0.073 -4.557) 5.507 4.319 ( -6.932 -6.313 0.704) 9.402 4.486 ( -2.834 4.656 -0.852) 5.517 4.587 ( 2.603 5.581 6.294) 8.806 4.628 ( -3.858 -5.911 1.227) 7.164 4.728 ( -7.410 -5.070 0.491) 8.992 4.903 ( 5.243 -0.039 6.330) 8.219 4.948 ( 0.870 -3.241 3.543) 4.880 5.025 ( -6.615 3.383 3.185) 8.084 5.105 ( -3.365 -1.880 4.132) 5.651 5.197 ( -0.345 -2.403 -8.289) 8.638 5.208 ( 2.608 -2.485 -7.803) 8.594 5.464 ( -0.698 1.406 -3.671) 3.992 5.471 ( -0.367 1.370 -5.728) 5.901 5.707 ( -2.043 1.716 1.543) 3.082 5.794 ( -3.912 -5.238 -0.647) 6.569 5.905 ( -0.698 7.360 2.886) 7.937 6.084 ( 0.112 -7.944 1.234) 8.040 6.148 ( -0.975 2.937 4.007) 5.063 6.267 ( 0.380 -8.372 5.995) 10.304 6.756 ( -1.911 7.874 1.475) 8.236 6.786 ( 1.300 4.586 -1.001) 4.870 6.892 ( 2.394 -2.023 0.131) 3.137 6.972 ( -0.605 -6.518 3.380) 7.367 7.115 ( -1.097 8.443 -2.504) 8.874 7.256 ( -2.935 6.256 0.501) 6.928 7.285 ( -0.054 -6.925 -0.642) 6.955 7.381 ( -0.681 -5.160 -1.087) 5.317 7.867 ( 1.242 1.224 -0.196) 1.755 7.909 ( -0.123 -2.290 -0.480) 2.343 8.252 ( 4.642 -0.018 -1.953) 5.036 8.255 ( 3.587 -0.813 -1.557) 3.994 13.342 ( -0.306 0.562 0.398) 0.754 13.362 ( -0.837 -1.303 0.747) 1.719 13.855 ( 2.832 2.035 0.123) 3.489 13.895 ( 2.700 -1.799 0.141) 3.247 14.188 ( 0.768 0.326 -0.633) 1.048 14.198 ( 0.260 -0.715 -1.068) 1.312 14.327 ( 1.515 1.843 -0.293) 2.403 14.370 ( 1.311 -2.290 -0.323) 2.659 16.484 ( -0.481 1.052 0.149) 1.166 16.528 ( -1.839 -3.169 0.278) 3.675 17.209 ( -0.862 3.386 0.072) 3.494 17.247 ( -1.007 -0.297 0.117) 1.056 28.010 ( 0.836 4.129 -0.197) 4.217 28.082 ( 1.071 -2.181 -0.719) 2.534 28.199 ( -0.931 1.586 0.888) 2.042 28.248 ( -1.021 -2.730 0.013) 2.915 28.755 ( 0.370 0.593 0.191) 0.725 28.767 ( 0.240 -0.626 0.206) 0.701 28.796 ( 0.061 0.705 0.037) 0.708 28.815 ( 0.015 -1.065 0.017) 1.065 29.019 ( 0.450 1.029 -0.020) 1.124 29.031 ( 0.669 -0.130 -0.342) 0.762 29.078 ( -0.571 0.364 0.333) 0.754 29.088 ( -0.566 -0.503 0.059) 0.759 31.350 ( 2.552 4.232 -1.915) 5.300 31.435 ( 3.729 -3.878 -1.334) 5.543 31.741 ( -4.153 1.869 5.457) 7.108 31.763 ( -4.675 -0.037 4.375) 6.403 32.105 ( 7.438 1.128 1.406) 7.653 32.192 ( 4.196 -7.315 -2.198) 8.714 32.645 ( 0.686 11.372 -3.114) 11.811 32.888 ( -1.200 -11.880 -3.046) 12.323 70.143 ( -0.201 1.567 0.072) 1.581 70.177 ( -0.330 -1.751 -0.304) 1.808 70.385 ( 1.089 1.507 0.183) 1.869 70.409 ( 1.030 -0.814 0.093) 1.316 ======================= Grid point 115 (63/112) ======================= q-point: ( 0.45 0.43 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.384 ( -1.776 3.629 -0.063) 4.041 2.454 ( -2.560 -2.767 -1.224) 3.964 2.496 ( 1.711 2.026 2.597) 3.711 2.561 ( 2.756 -3.987 2.041) 5.259 2.917 ( 5.267 6.840 0.375) 8.641 2.999 ( 5.841 0.416 -2.289) 6.288 3.068 ( 4.728 7.273 -1.069) 8.740 3.154 ( 1.565 -0.410 -1.509) 2.212 3.297 ( -7.797 6.691 -0.015) 10.275 3.408 ( -5.362 -1.128 2.947) 6.221 3.629 ( 7.366 2.462 -2.931) 8.301 3.693 ( 2.446 -3.003 -2.739) 4.744 3.825 ( 5.700 4.984 1.738) 7.769 3.862 ( 1.206 0.512 1.597) 2.065 3.974 ( -5.708 3.054 -3.250) 7.244 4.081 ( -2.675 -4.558 -4.605) 7.010 4.086 ( -1.772 6.246 0.609) 6.521 4.255 ( -2.284 -7.178 1.746) 7.733 4.415 ( -1.606 6.699 -3.655) 7.798 4.536 ( -7.351 -3.521 -0.996) 8.211 4.602 ( -2.097 -0.185 -3.928) 4.457 4.690 ( 2.221 -7.380 -0.849) 7.754 4.879 ( -7.954 6.338 0.999) 10.219 4.998 ( -0.688 -0.345 3.649) 3.729 5.024 ( -4.121 -1.916 2.860) 5.370 5.072 ( -2.604 -4.249 2.183) 5.440 5.159 ( 5.213 3.587 -4.952) 8.035 5.228 ( 5.569 -3.173 -4.470) 7.814 5.431 ( 1.008 1.020 -1.031) 1.766 5.463 ( 3.848 -1.021 -3.239) 5.132 5.688 ( -1.804 1.499 2.470) 3.407 5.752 ( -0.730 -3.655 1.276) 3.940 5.920 ( -0.766 6.596 4.344) 7.935 6.086 ( -0.636 -8.511 1.722) 8.707 6.170 ( -1.258 4.880 4.792) 6.954 6.306 ( -1.808 -8.628 6.036) 10.684 6.733 ( -1.310 7.008 0.284) 7.135 6.792 ( 1.217 1.433 -1.954) 2.712 6.916 ( -0.780 0.716 0.629) 1.231 6.990 ( -0.204 -5.440 2.105) 5.837 7.096 ( 0.519 7.688 0.215) 7.708 7.223 ( -0.995 8.163 -0.269) 8.228 7.279 ( -0.237 -8.118 -0.357) 8.129 7.373 ( 0.856 -5.969 -1.310) 6.171 7.881 ( 0.784 0.359 -0.883) 1.234 7.905 ( -0.062 -1.577 -0.632) 1.700 8.290 ( 1.916 0.779 -1.438) 2.519 8.310 ( 2.341 -0.836 -0.640) 2.566 13.346 ( 0.205 -0.063 0.627) 0.663 13.356 ( -0.668 -1.059 0.876) 1.528 13.890 ( 0.882 1.825 -0.102) 2.029 13.924 ( 0.623 -1.498 -0.554) 1.714 14.199 ( 0.742 0.005 -0.078) 0.746 14.201 ( 0.713 -0.179 -0.114) 0.743 14.339 ( 0.418 1.617 -0.968) 1.930 14.376 ( 0.148 -1.883 -1.351) 2.322 16.485 ( 0.252 -0.322 0.286) 0.499 16.505 ( -0.960 -2.290 0.228) 2.494 17.201 ( -0.236 2.992 0.664) 3.074 17.234 ( -0.521 -0.092 0.256) 0.588 28.025 ( 0.596 4.113 0.370) 4.173 28.094 ( 0.869 -1.827 -0.791) 2.172 28.185 ( -1.131 0.960 0.547) 1.581 28.229 ( -0.558 -2.880 -0.502) 2.976 28.762 ( 0.187 0.457 0.231) 0.545 28.772 ( 0.066 -0.516 0.129) 0.536 28.797 ( -0.019 0.625 0.091) 0.632 28.814 ( -0.073 -0.945 -0.129) 0.956 29.026 ( 0.203 1.233 0.167) 1.261 29.040 ( 0.535 0.011 -0.290) 0.608 29.073 ( -0.467 0.166 0.577) 0.761 29.081 ( -0.124 -0.561 0.133) 0.589 31.396 ( 2.779 5.295 1.265) 6.112 31.500 ( 3.795 -4.447 0.377) 5.858 31.690 ( -5.932 0.871 3.803) 7.100 31.706 ( -3.641 -0.808 1.426) 3.993 32.225 ( 1.482 -1.067 -1.176) 2.172 32.234 ( 4.175 -1.900 1.917) 4.971 32.633 ( 1.043 8.870 -3.733) 9.680 32.836 ( -0.675 -10.367 -4.599) 11.362 70.142 ( -0.022 1.284 0.247) 1.308 70.172 ( -0.003 -1.536 -0.298) 1.565 70.400 ( 0.368 1.325 0.248) 1.397 70.421 ( 0.296 -0.703 -0.071) 0.766 ======================= Grid point 116 (64/112) ======================= q-point: (-0.45 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.331 ( -1.897 2.684 -2.472) 4.112 2.388 ( -0.764 -2.846 -3.472) 4.554 2.460 ( -7.538 5.023 2.120) 9.303 2.582 ( -3.393 -5.910 3.776) 7.791 2.975 ( -9.115 9.179 1.824) 13.064 3.068 ( 2.276 -0.220 1.121) 2.546 3.109 ( 0.055 3.058 -0.350) 3.078 3.184 ( -4.320 -1.922 -3.784) 6.056 3.215 ( 7.318 8.448 0.114) 11.177 3.361 ( 3.694 -4.974 1.966) 6.501 3.729 ( 8.209 7.037 -0.642) 10.831 3.757 ( 0.939 4.844 5.118) 7.110 3.819 ( -3.532 4.971 0.282) 6.104 3.896 ( -2.927 -2.024 -0.630) 3.614 3.928 ( 6.430 3.963 -5.584) 9.393 4.026 ( -1.061 -0.812 -11.391) 11.469 4.105 ( 4.780 3.405 1.068) 5.965 4.248 ( -1.074 -7.286 2.622) 7.817 4.368 ( -0.789 5.260 -5.169) 7.417 4.464 ( 2.811 -3.489 -1.055) 4.603 4.557 ( 0.440 -1.622 -1.278) 2.112 4.661 ( -2.719 -9.639 -2.221) 10.258 4.776 ( -2.676 3.295 0.244) 4.251 4.877 ( -5.206 -5.665 -1.954) 7.938 4.997 ( -3.939 1.734 2.439) 4.947 5.039 ( -4.669 -2.089 2.484) 5.686 5.233 ( 6.057 4.071 -3.392) 8.048 5.314 ( 6.471 -2.878 -3.043) 7.708 5.479 ( 4.704 3.717 -0.776) 6.045 5.557 ( 6.571 -3.042 -0.480) 7.257 5.690 ( -0.657 2.333 2.711) 3.637 5.775 ( 1.664 -4.878 1.349) 5.328 5.962 ( 0.664 5.924 6.344) 8.705 6.102 ( 0.265 -6.924 3.052) 7.571 6.180 ( -2.244 4.957 4.810) 7.262 6.311 ( -2.728 -7.911 4.826) 9.660 6.716 ( -0.232 5.943 -1.164) 6.060 6.793 ( 1.316 -0.283 -4.330) 4.534 6.893 ( -2.545 3.461 3.064) 5.277 6.984 ( -2.229 -5.730 2.283) 6.558 7.135 ( 2.349 5.774 1.267) 6.361 7.208 ( -0.126 9.142 -0.875) 9.184 7.274 ( 0.109 -6.327 -0.706) 6.368 7.379 ( 0.769 -7.185 -0.918) 7.284 7.874 ( -1.068 -0.052 -0.834) 1.356 7.893 ( -0.419 -1.542 -1.016) 1.894 8.293 ( -0.604 1.374 -0.833) 1.717 8.321 ( -0.373 -1.162 -1.028) 1.596 13.353 ( -0.442 -0.228 0.790) 0.933 13.360 ( 0.606 -0.851 0.961) 1.420 13.886 ( -1.058 1.381 -0.118) 1.744 13.910 ( -1.267 -0.941 -0.955) 1.845 14.210 ( 0.277 0.106 0.337) 0.449 14.217 ( 0.623 -0.501 0.451) 0.918 14.326 ( -0.629 1.238 -1.292) 1.897 14.354 ( -0.796 -1.406 -2.096) 2.646 16.488 ( -0.343 -0.528 0.374) 0.732 16.505 ( 0.875 -2.073 0.200) 2.259 17.213 ( 0.678 2.533 0.970) 2.796 17.236 ( 0.621 0.311 0.229) 0.731 28.034 ( -0.063 3.773 0.726) 3.843 28.094 ( -0.060 -1.492 -1.058) 1.830 28.175 ( -0.250 1.309 0.435) 1.402 28.226 ( 0.729 -3.249 -0.542) 3.373 28.764 ( -0.199 0.274 0.325) 0.469 28.771 ( -0.269 -0.351 0.070) 0.447 28.798 ( 0.023 0.447 0.145) 0.470 28.811 ( -0.024 -0.798 -0.228) 0.831 29.026 ( -0.409 1.194 0.150) 1.271 29.043 ( -0.054 -0.260 -0.258) 0.370 29.072 ( -0.101 0.686 0.538) 0.878 29.088 ( 0.576 -0.715 0.304) 0.967 31.453 ( 0.200 4.650 3.283) 5.696 31.538 ( -2.720 -3.194 0.646) 4.245 31.631 ( -0.841 1.859 1.378) 2.462 31.679 ( 0.568 -3.324 1.243) 3.594 32.202 ( -3.165 3.778 0.764) 4.988 32.303 ( 0.994 -5.251 2.264) 5.804 32.611 ( 0.091 7.350 -4.136) 8.435 32.792 ( 1.149 -9.353 -6.398) 11.390 70.145 ( 0.034 1.172 0.337) 1.219 70.171 ( 0.225 -1.338 -0.347) 1.400 70.403 ( -0.348 1.039 0.356) 1.152 70.419 ( -0.424 -0.514 -0.175) 0.689 ======================= Grid point 117 (65/112) ======================= q-point: (-0.36 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.216 ( -12.064 11.857 2.029) 17.036 2.378 ( 3.679 2.036 -2.902) 5.109 2.405 ( 1.411 -4.026 -1.072) 4.399 2.504 ( -6.156 -9.676 2.688) 11.779 2.680 ( -18.557 10.458 -1.493) 21.353 2.860 ( -16.527 -5.607 -7.635) 19.049 3.107 ( -1.956 3.098 -1.090) 3.822 3.145 ( -3.134 -0.266 1.030) 3.309 3.420 ( 9.790 8.374 1.317) 12.950 3.520 ( 9.839 -2.067 0.201) 10.056 3.714 ( -4.514 7.453 -1.953) 8.930 3.764 ( -4.917 2.928 -8.618) 10.345 3.815 ( -4.727 3.635 5.480) 8.099 3.865 ( -7.181 0.357 4.985) 8.749 3.939 ( 11.005 4.709 3.350) 12.430 4.046 ( 8.991 -0.716 -2.508) 9.362 4.248 ( 10.557 4.157 -2.287) 11.574 4.267 ( 2.989 0.861 -1.350) 3.391 4.352 ( 4.584 -0.193 -3.508) 5.775 4.417 ( -4.015 -4.493 -3.831) 7.140 4.611 ( 4.158 -4.965 -2.967) 7.123 4.665 ( 3.977 -7.281 3.055) 8.841 4.824 ( 1.908 -1.861 1.163) 2.908 4.839 ( 3.189 -1.519 1.613) 3.883 4.956 ( 0.001 -0.066 2.478) 2.479 4.996 ( -0.634 -4.282 1.686) 4.645 5.290 ( 3.094 4.163 -3.225) 6.108 5.382 ( 3.640 -3.642 -3.192) 6.059 5.558 ( 4.830 4.980 -1.658) 7.133 5.651 ( 4.244 -4.012 -1.397) 6.005 5.712 ( 1.342 4.756 1.722) 5.233 5.826 ( 3.145 -5.594 -0.853) 6.474 6.056 ( 2.061 4.916 8.526) 10.055 6.146 ( 0.844 -2.039 3.083) 3.791 6.177 ( -3.001 2.435 6.774) 7.799 6.293 ( -3.176 -6.946 3.596) 8.442 6.693 ( -0.802 4.111 -2.278) 4.768 6.760 ( 0.193 -0.819 -5.168) 5.236 6.892 ( -1.835 3.168 4.907) 6.122 6.954 ( -3.333 -3.087 2.031) 4.976 7.177 ( 2.145 5.287 -1.799) 5.982 7.216 ( 1.522 6.698 1.039) 6.947 7.266 ( 0.183 -3.526 -1.478) 3.828 7.382 ( 0.339 -7.929 -0.639) 7.962 7.828 ( -2.983 0.967 -0.858) 3.251 7.870 ( -1.161 -2.877 -1.282) 3.357 8.253 ( -2.813 1.141 -1.030) 3.205 8.280 ( -2.474 -1.333 -2.107) 3.513 13.356 ( 0.117 0.973 0.703) 1.206 13.384 ( 0.986 -1.683 1.228) 2.305 13.855 ( -2.402 0.843 0.317) 2.566 13.868 ( -2.426 -0.463 -0.726) 2.574 14.207 ( -0.800 0.399 -0.299) 0.942 14.223 ( -0.252 -1.020 -0.323) 1.099 14.300 ( -1.188 0.609 -0.552) 1.445 14.316 ( -1.324 -0.869 -1.814) 2.408 16.490 ( 0.384 0.965 0.267) 1.072 16.533 ( 1.933 -3.123 0.368) 3.692 17.239 ( 1.296 2.358 0.793) 2.805 17.258 ( 1.393 0.603 0.215) 1.533 28.037 ( -0.261 2.833 0.655) 2.919 28.076 ( -0.649 -0.929 -1.311) 1.733 28.185 ( 0.791 1.963 0.762) 2.250 28.241 ( 1.165 -3.115 -0.097) 3.327 28.761 ( -0.498 0.120 0.366) 0.630 28.765 ( -0.382 -0.206 0.119) 0.450 28.802 ( 0.224 0.157 0.293) 0.401 28.810 ( 0.109 -0.579 -0.216) 0.627 29.016 ( -0.660 0.998 -0.042) 1.197 29.033 ( -0.633 -0.600 -0.275) 0.915 29.079 ( 0.374 1.345 0.348) 1.439 29.103 ( 0.651 -0.849 0.299) 1.111 31.427 ( -3.930 0.701 -0.733) 4.058 31.440 ( -5.838 -0.542 -1.321) 6.011 31.674 ( 2.079 2.484 2.545) 4.120 31.733 ( 0.865 -3.218 4.347) 5.477 32.141 ( -4.824 7.052 3.280) 9.152 32.323 ( -0.769 -9.773 3.692) 10.475 32.564 ( -0.609 8.849 -5.445) 10.408 32.763 ( 2.036 -9.760 -7.810) 12.665 70.150 ( 0.216 1.162 0.317) 1.224 70.173 ( 0.408 -1.103 -0.476) 1.268 70.395 ( -0.876 0.642 0.538) 1.212 70.404 ( -0.982 -0.245 -0.160) 1.025 ======================= Grid point 118 (66/112) ======================= q-point: (-0.27 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.988 ( -14.188 15.371 1.941) 21.008 2.270 ( -14.002 -5.686 -3.369) 15.484 2.315 ( -16.957 4.808 2.912) 17.865 2.416 ( -10.466 1.769 -3.268) 11.106 2.567 ( 3.416 -2.040 -1.808) 4.371 2.588 ( 9.819 -5.022 -3.881) 11.692 2.991 ( -8.465 2.786 -2.295) 9.203 3.023 ( -7.331 -0.650 -2.655) 7.825 3.414 ( -10.199 16.451 0.550) 19.364 3.571 ( -6.869 1.275 -5.219) 8.721 3.600 ( -3.336 -0.855 2.035) 4.000 3.661 ( -2.930 -6.722 -3.008) 7.926 3.779 ( -3.740 6.448 5.122) 9.044 3.925 ( 7.225 -0.281 6.793) 9.921 4.149 ( 3.687 -4.735 6.820) 9.084 4.172 ( 5.726 -3.048 4.358) 7.815 4.298 ( 5.382 10.873 -3.931) 12.753 4.406 ( 10.524 3.064 -3.697) 11.567 4.470 ( 12.294 0.648 -1.904) 12.457 4.511 ( 14.055 -1.213 -2.320) 14.297 4.649 ( 2.614 -3.783 -2.097) 5.054 4.776 ( 4.645 -1.151 -1.306) 4.960 4.823 ( 4.261 -4.563 -0.400) 6.256 4.923 ( 1.812 -6.457 3.975) 7.796 5.063 ( 6.168 0.035 2.255) 6.567 5.095 ( 7.664 -3.671 2.655) 8.903 5.304 ( 1.836 3.933 -2.139) 4.839 5.395 ( 1.782 -4.154 -3.666) 5.820 5.625 ( 4.536 4.665 -2.723) 7.054 5.692 ( 1.856 -0.003 -0.515) 1.926 5.764 ( 3.258 1.765 -1.040) 3.848 5.850 ( 0.909 -4.296 -2.701) 5.156 6.126 ( -1.969 5.184 0.606) 5.579 6.155 ( -3.240 1.342 8.853) 9.522 6.204 ( -1.714 -1.038 7.166) 7.441 6.267 ( -3.221 -5.709 4.329) 7.855 6.655 ( -1.380 3.998 -1.765) 4.583 6.729 ( 0.063 -1.537 -3.181) 3.534 6.894 ( -4.155 0.871 0.558) 4.282 6.898 ( -1.834 0.519 4.003) 4.434 7.186 ( 1.676 5.444 -4.110) 7.024 7.262 ( 1.314 -1.032 -1.108) 2.005 7.279 ( 3.315 1.700 2.026) 4.241 7.385 ( 0.516 -7.093 0.054) 7.112 7.759 ( -3.755 2.185 -0.302) 4.355 7.827 ( -2.311 -4.132 -1.129) 4.867 8.181 ( -3.226 0.870 -2.472) 4.156 8.210 ( -2.320 -1.879 -2.668) 4.004 13.372 ( 1.015 2.008 0.671) 2.348 13.416 ( 1.345 -2.230 1.222) 2.877 13.807 ( -3.335 0.346 0.652) 3.416 13.813 ( -3.010 -0.249 -0.557) 3.071 14.177 ( -1.566 0.733 -1.196) 2.103 14.200 ( -1.150 -1.177 -1.764) 2.413 14.275 ( -1.493 0.011 0.144) 1.500 14.283 ( -1.376 -0.701 0.066) 1.546 16.511 ( 1.835 2.703 0.188) 3.272 16.582 ( 3.167 -4.085 0.381) 5.183 17.268 ( 1.275 2.220 0.153) 2.565 17.283 ( 0.972 0.790 0.088) 1.256 28.039 ( 0.206 1.377 -0.169) 1.403 28.054 ( -0.414 -0.040 -1.153) 1.226 28.213 ( 1.158 2.173 1.357) 2.811 28.261 ( 0.661 -2.188 0.468) 2.333 28.755 ( -0.347 0.238 0.341) 0.542 28.762 ( -0.176 -0.339 0.359) 0.524 28.808 ( 0.041 -0.104 0.090) 0.144 28.811 ( 0.201 -0.341 -0.184) 0.436 29.003 ( -0.600 0.786 -0.179) 1.005 29.018 ( -0.670 -0.617 -0.408) 0.998 29.088 ( 0.363 1.592 0.188) 1.644 29.115 ( 0.503 -0.936 0.132) 1.071 31.315 ( -5.232 0.360 -2.885) 5.986 31.336 ( -4.547 -1.678 -2.565) 5.483 31.692 ( -3.062 2.180 2.533) 4.532 31.752 ( -3.361 -3.373 4.379) 6.469 32.115 ( -2.083 10.939 6.860) 13.079 32.365 ( -0.640 -13.068 8.508) 15.607 32.499 ( 0.249 10.294 -8.339) 13.250 32.719 ( 1.413 -10.902 -9.619) 14.608 70.159 ( 0.635 1.073 0.144) 1.255 70.178 ( 0.581 -0.721 -0.552) 1.078 70.381 ( -1.214 0.263 0.278) 1.273 70.384 ( -1.103 -0.016 0.279) 1.138 ======================= Grid point 119 (67/112) ======================= q-point: (-0.18 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.745 ( -13.494 15.005 0.060) 20.180 1.930 ( -14.737 7.370 -5.942) 17.516 2.072 ( -14.461 -3.534 3.556) 15.305 2.158 ( -11.297 -2.752 0.676) 11.647 2.706 ( 6.482 3.391 -2.550) 7.747 2.759 ( 7.157 -2.091 -2.873) 7.990 2.829 ( -6.907 6.513 5.736) 11.091 2.926 ( 0.138 -4.236 0.944) 4.342 3.253 ( -7.072 13.650 3.302) 15.724 3.389 ( -9.129 2.179 -2.558) 9.728 3.479 ( -9.395 -3.523 1.171) 10.102 3.536 ( -5.017 -9.862 -5.701) 12.447 3.799 ( -2.081 5.683 8.228) 10.214 4.020 ( -4.211 -11.733 9.553) 15.705 4.289 ( 8.091 2.529 3.735) 9.264 4.344 ( 8.134 -1.223 2.239) 8.524 4.373 ( 4.623 13.146 -3.324) 14.326 4.573 ( 8.898 -2.883 -2.235) 9.617 4.651 ( 3.514 -1.339 1.522) 4.057 4.718 ( 11.226 -1.047 -1.091) 11.327 4.760 ( 15.614 3.261 -8.297) 17.980 4.842 ( 6.579 2.445 -4.878) 8.547 4.948 ( 8.135 -2.994 1.021) 8.729 5.029 ( 6.415 -9.712 1.496) 11.735 5.178 ( 4.984 1.031 0.015) 5.090 5.209 ( 3.069 -1.847 1.135) 3.758 5.346 ( 3.613 2.776 0.549) 4.589 5.413 ( 3.922 -3.277 -3.004) 5.928 5.659 ( 1.916 3.961 -4.269) 6.130 5.727 ( 3.470 0.894 -3.191) 4.798 5.766 ( -1.364 1.281 -2.783) 3.354 5.836 ( -1.817 -2.246 2.807) 4.029 6.057 ( -3.157 2.993 -2.693) 5.116 6.124 ( -4.645 -0.659 1.759) 5.010 6.218 ( -6.264 -1.803 6.656) 9.316 6.238 ( -3.841 -1.829 5.881) 7.258 6.595 ( -3.927 4.244 -1.977) 6.111 6.677 ( -3.957 -2.779 -1.082) 4.956 6.843 ( -1.945 4.111 1.034) 4.664 6.899 ( -1.427 -1.417 3.118) 3.711 7.181 ( 1.822 5.688 -2.756) 6.578 7.286 ( 2.220 -3.002 -0.799) 3.818 7.365 ( 2.803 -0.226 2.792) 3.962 7.410 ( 1.970 -4.541 0.337) 4.961 7.701 ( -2.941 2.296 2.006) 4.236 7.775 ( -2.935 -4.421 0.597) 5.340 8.117 ( -0.052 1.940 -3.830) 4.293 8.172 ( 0.801 -3.271 -2.082) 3.959 13.403 ( 1.741 2.437 0.509) 3.038 13.451 ( 1.391 -2.157 0.721) 2.666 13.745 ( -3.865 0.180 0.315) 3.882 13.752 ( -2.926 -0.519 -0.877) 3.098 14.141 ( -1.324 0.872 -0.691) 1.730 14.163 ( -1.057 -0.975 -1.333) 1.961 14.249 ( -1.470 -0.044 0.105) 1.474 14.261 ( -1.547 -1.161 0.736) 2.069 16.561 ( 3.440 4.154 0.119) 5.394 16.652 ( 4.206 -4.664 0.195) 6.284 17.281 ( 0.311 1.713 -0.975) 1.995 17.288 ( -0.370 0.934 -0.406) 1.083 28.032 ( 0.435 1.246 -1.898) 2.312 28.055 ( 0.817 -0.702 0.060) 1.079 28.244 ( 0.867 1.646 0.942) 2.085 28.269 ( -0.348 -0.796 0.531) 1.019 28.756 ( 0.077 0.350 0.474) 0.594 28.765 ( 0.123 -0.406 0.373) 0.565 28.804 ( -0.182 0.126 -0.433) 0.487 28.811 ( -0.116 -0.540 -0.198) 0.586 28.993 ( -0.274 0.525 -0.113) 0.603 29.004 ( -0.473 -0.478 -0.391) 0.778 29.095 ( 0.234 1.664 0.093) 1.683 29.123 ( 0.295 -0.973 -0.038) 1.018 31.207 ( -4.061 0.503 -2.185) 4.639 31.234 ( -4.315 -2.250 -1.781) 5.182 31.636 ( -4.209 2.107 2.050) 5.134 31.695 ( -5.334 -3.529 2.969) 7.051 32.167 ( -1.658 11.495 9.516) 15.014 32.391 ( -5.404 -4.768 9.143) 11.642 32.443 ( 0.483 3.854 -8.277) 9.143 32.680 ( 5.119 -12.986 -9.405) 16.831 70.175 ( 1.085 0.806 -0.278) 1.380 70.186 ( 0.774 -0.309 -0.170) 0.851 70.359 ( -1.139 0.515 -0.163) 1.261 70.368 ( -1.047 -0.368 0.291) 1.147 ======================= Grid point 120 (68/112) ======================= q-point: (-0.09 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.542 ( -8.166 15.553 2.572) 17.754 1.700 ( -6.019 9.419 -2.573) 11.470 1.907 ( -8.160 -1.121 7.425) 11.089 2.018 ( -5.790 -4.539 2.058) 7.639 2.704 ( -4.149 11.873 9.255) 15.616 2.761 ( 1.808 0.554 -2.080) 2.811 2.918 ( 3.123 1.752 1.885) 4.047 2.943 ( -1.908 -2.599 -0.272) 3.236 3.211 ( -3.888 3.149 -3.133) 5.903 3.290 ( 0.418 0.560 6.607) 6.643 3.333 ( -5.363 -1.773 0.224) 5.653 3.431 ( -1.395 -8.240 -1.393) 8.472 3.819 ( -4.226 2.594 9.431) 10.655 4.010 ( -6.437 -12.656 11.309) 18.152 4.386 ( 1.054 11.140 -0.163) 11.191 4.442 ( 5.074 1.308 1.680) 5.503 4.507 ( 8.578 1.228 -2.836) 9.117 4.641 ( 3.182 -7.191 -2.079) 8.133 4.747 ( 5.508 5.951 -2.747) 8.561 4.846 ( 3.972 5.567 -2.385) 7.243 4.904 ( 6.622 -3.695 -8.074) 11.077 4.924 ( 7.541 -2.670 -6.974) 10.613 5.076 ( 4.613 2.294 -7.072) 8.750 5.130 ( 5.283 -3.829 -1.932) 6.805 5.243 ( 2.115 -0.028 0.750) 2.245 5.278 ( 4.287 -1.548 1.045) 4.676 5.439 ( 6.487 2.090 0.344) 6.824 5.500 ( 6.525 -2.518 0.762) 7.036 5.606 ( -3.488 1.884 -4.152) 5.741 5.658 ( -3.700 -3.476 -3.154) 5.976 5.809 ( -3.823 3.963 3.439) 6.492 5.816 ( 5.432 4.035 -1.883) 7.023 5.991 ( -2.236 -1.801 -2.460) 3.781 6.029 ( -5.897 -3.870 -1.385) 7.188 6.111 ( -7.296 4.017 1.718) 8.505 6.199 ( -3.707 -2.756 0.058) 4.620 6.503 ( -3.854 4.145 0.049) 5.660 6.603 ( -4.363 -4.397 3.341) 7.038 6.816 ( -1.978 6.341 0.636) 6.673 6.903 ( -0.625 -2.504 2.237) 3.415 7.212 ( 2.033 5.237 0.785) 5.672 7.323 ( 1.867 -3.699 0.382) 4.161 7.395 ( -0.501 0.999 0.162) 1.130 7.453 ( 1.378 -3.992 0.472) 4.249 7.706 ( -0.754 -0.294 7.047) 7.093 7.743 ( -2.076 -3.364 3.474) 5.263 8.122 ( 3.383 3.124 -3.175) 5.593 8.204 ( 3.594 -4.720 -0.912) 6.002 13.435 ( 1.236 2.135 -0.044) 2.468 13.472 ( 0.604 -1.353 -0.388) 1.532 13.680 ( -3.062 0.654 -0.181) 3.136 13.700 ( -1.469 -1.322 -1.246) 2.336 14.124 ( -0.540 0.799 0.815) 1.263 14.146 ( -0.189 -0.833 0.012) 0.854 14.225 ( -1.097 -0.065 -0.111) 1.105 14.242 ( -1.064 -1.529 0.418) 1.909 16.629 ( 3.477 4.770 0.280) 5.909 16.727 ( 3.530 -4.618 -0.218) 5.817 17.260 ( -0.845 1.206 -2.321) 2.749 17.264 ( -1.119 0.828 -1.506) 2.050 28.033 ( 1.275 2.028 -1.493) 2.823 28.076 ( 1.329 -2.043 0.070) 2.438 28.247 ( -0.493 0.763 -1.669) 1.900 28.253 ( -1.425 0.066 -0.608) 1.550 28.763 ( -0.032 0.391 0.562) 0.685 28.771 ( 0.280 -0.307 0.163) 0.446 28.797 ( -0.025 0.159 -0.509) 0.534 28.804 ( -0.279 -0.521 -0.376) 0.700 28.992 ( 0.068 0.262 -0.019) 0.271 28.998 ( 0.039 -0.321 0.236) 0.400 29.099 ( 0.105 1.611 0.131) 1.620 29.126 ( 0.125 -0.944 -0.096) 0.957 31.143 ( -1.705 0.492 0.159) 1.782 31.168 ( -2.198 -2.041 1.088) 3.190 31.598 ( -1.577 1.747 1.803) 2.965 31.641 ( -2.853 -2.306 2.429) 4.400 32.157 ( -5.675 6.334 3.784) 9.308 32.292 ( -10.495 -5.863 0.827) 12.050 32.445 ( 4.835 12.061 1.457) 13.075 32.745 ( 6.488 -15.427 -3.054) 17.012 70.191 ( 1.015 0.801 -0.268) 1.320 70.204 ( 0.982 -0.437 0.454) 1.167 70.337 ( -0.772 0.592 -0.802) 1.261 70.348 ( -1.066 -0.383 -0.674) 1.318 ======================= Grid point 154 (69/112) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.199 ( -5.277 0.000 25.108) 25.657 1.205 ( -5.935 0.000 27.942) 28.565 1.611 ( 5.347 0.000 -11.429) 12.619 1.762 ( 5.304 0.000 -24.646) 25.210 2.495 ( -5.705 0.000 52.160) 52.471 3.013 ( 4.038 0.000 14.473) 15.026 3.109 ( -1.925 0.000 6.584) 6.859 3.170 ( -6.616 0.000 -9.451) 11.536 3.263 ( 3.608 0.000 -8.291) 9.042 3.394 ( 0.501 0.000 -2.443) 2.494 3.464 ( -2.226 0.000 4.719) 5.218 3.605 ( -7.245 0.000 4.905) 8.749 3.787 ( 2.764 0.000 -31.305) 31.427 3.850 ( 1.948 0.000 -3.627) 4.117 4.005 ( 16.256 0.000 0.968) 16.285 4.218 ( 0.261 0.000 -20.066) 20.068 4.435 ( 5.848 0.000 4.119) 7.153 4.521 ( -10.745 0.000 -1.797) 10.895 4.753 ( -3.817 0.000 3.383) 5.100 4.758 ( -2.887 0.000 2.535) 3.842 4.860 ( 7.249 0.000 1.751) 7.457 4.871 ( -10.276 0.000 3.315) 10.798 5.134 ( -0.697 0.000 0.059) 0.699 5.198 ( -9.988 0.000 1.814) 10.151 5.228 ( 5.685 0.000 -7.425) 9.351 5.278 ( 9.852 0.000 -4.547) 10.851 5.375 ( 5.778 0.000 1.102) 5.883 5.403 ( -3.761 0.000 -1.865) 4.198 5.502 ( -14.378 0.000 4.659) 15.114 5.590 ( 11.270 0.000 -3.070) 11.681 5.732 ( 1.419 0.000 1.676) 2.196 5.736 ( -4.711 0.000 1.309) 4.889 5.872 ( 5.785 0.000 0.879) 5.851 5.931 ( -0.942 0.000 -4.320) 4.421 6.308 ( -0.362 0.000 2.364) 2.391 6.371 ( 1.077 0.000 5.065) 5.178 6.387 ( 2.045 0.000 -4.189) 4.662 6.444 ( 0.387 0.000 -2.647) 2.675 6.948 ( -3.225 0.000 5.602) 6.464 6.959 ( 0.731 0.000 4.583) 4.641 7.048 ( -1.218 0.000 1.258) 1.751 7.082 ( 0.610 0.000 -3.097) 3.157 7.388 ( -4.302 0.000 -1.537) 4.568 7.430 ( 3.467 0.000 -3.954) 5.259 7.891 ( 0.275 0.000 0.531) 0.598 7.891 ( 0.195 0.000 0.578) 0.610 8.514 ( 2.108 0.000 13.035) 13.205 8.780 ( -3.525 0.000 -11.961) 12.470 13.338 ( -1.478 0.000 2.761) 3.132 13.403 ( 2.115 0.000 -3.428) 4.029 13.675 ( -3.059 0.000 2.794) 4.143 13.728 ( 1.659 0.000 -2.247) 2.793 14.148 ( 0.594 0.000 0.404) 0.718 14.166 ( -0.416 0.000 -1.421) 1.481 14.425 ( 0.900 0.000 2.885) 3.022 14.473 ( -1.567 0.000 -1.791) 2.380 16.437 ( -1.868 0.000 1.409) 2.340 16.470 ( 4.125 0.000 -1.732) 4.474 17.039 ( 1.249 0.000 3.425) 3.646 17.107 ( -0.996 0.000 -2.944) 3.108 27.834 ( -1.691 0.000 1.584) 2.317 27.885 ( 2.293 0.000 -3.347) 4.057 28.212 ( -1.693 0.000 1.157) 2.051 28.226 ( 1.279 0.000 -0.326) 1.320 28.761 ( -0.944 0.000 0.790) 1.231 28.776 ( 0.727 0.000 -0.655) 0.979 28.811 ( 1.125 0.000 0.357) 1.180 28.815 ( -0.851 0.000 -0.048) 0.852 28.994 ( 0.518 0.000 0.027) 0.519 28.995 ( -0.368 0.000 -0.017) 0.369 29.096 ( -0.104 0.000 0.782) 0.789 29.111 ( 0.040 0.000 -0.570) 0.572 31.317 ( 2.119 0.000 7.475) 7.769 31.477 ( -1.090 0.000 -7.466) 7.545 31.530 ( 6.056 0.000 0.636) 6.089 31.549 ( -5.053 0.000 -1.137) 5.180 31.788 ( -2.398 0.000 6.969) 7.370 31.932 ( 2.283 0.000 -6.650) 7.031 33.579 ( 5.946 0.000 4.198) 7.279 33.663 ( -8.438 0.000 -3.673) 9.203 70.086 ( -1.313 0.000 1.324) 1.864 70.118 ( 1.840 0.000 -1.713) 2.514 70.272 ( -0.795 0.000 1.551) 1.743 70.301 ( 0.612 0.000 -1.186) 1.335 ======================= Grid point 155 (70/112) ======================= q-point: ( 0.09 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.345 ( 0.997 0.000 14.777) 14.810 1.367 ( -2.627 0.000 28.835) 28.954 1.634 ( 11.702 0.000 -19.697) 22.911 1.707 ( 11.127 0.000 -20.320) 23.167 2.901 ( -0.291 0.000 37.303) 37.305 2.970 ( -3.414 0.000 -13.362) 13.791 3.002 ( -6.060 0.000 17.604) 18.618 3.218 ( 6.376 0.000 -24.112) 24.941 3.352 ( 10.058 0.000 9.107) 13.569 3.368 ( 5.623 0.000 -11.903) 13.164 3.486 ( -1.402 0.000 7.579) 7.707 3.573 ( -4.539 0.000 12.626) 13.417 3.608 ( -1.352 0.000 -9.948) 10.039 3.817 ( -2.544 0.000 -1.279) 2.847 3.988 ( -1.685 0.000 -24.602) 24.660 4.157 ( 2.136 0.000 -2.867) 3.576 4.335 ( -6.116 0.000 0.975) 6.194 4.485 ( -8.048 0.000 2.362) 8.387 4.652 ( -12.521 0.000 2.833) 12.837 4.703 ( -7.318 0.000 1.641) 7.499 4.895 ( 8.495 0.000 6.372) 10.620 4.976 ( 1.049 0.000 5.288) 5.391 5.041 ( -4.153 0.000 -2.485) 4.839 5.158 ( -15.383 0.000 3.403) 15.755 5.172 ( 1.594 0.000 4.747) 5.008 5.294 ( 2.036 0.000 -5.288) 5.666 5.358 ( 5.856 0.000 -3.008) 6.584 5.479 ( 4.411 0.000 0.345) 4.425 5.519 ( 5.028 0.000 -4.987) 7.082 5.633 ( -5.103 0.000 2.959) 5.899 5.659 ( 1.152 0.000 -1.701) 2.055 5.760 ( 1.591 0.000 3.058) 3.447 5.972 ( 2.889 0.000 1.055) 3.076 5.995 ( 11.865 0.000 -7.966) 14.291 6.305 ( -2.993 0.000 2.267) 3.755 6.353 ( -2.063 0.000 -5.618) 5.984 6.432 ( 2.276 0.000 -3.626) 4.281 6.434 ( 3.652 0.000 3.795) 5.267 6.965 ( -0.135 0.000 2.920) 2.923 7.016 ( -2.665 0.000 1.174) 2.912 7.046 ( 4.566 0.000 2.982) 5.454 7.072 ( 0.190 0.000 -1.327) 1.341 7.333 ( -2.844 0.000 2.203) 3.597 7.477 ( 4.304 0.000 -1.436) 4.538 7.880 ( -1.908 0.000 -0.658) 2.018 7.881 ( -0.654 0.000 0.021) 0.654 8.551 ( -8.409 0.000 -9.129) 12.412 8.581 ( -7.443 0.000 11.105) 13.369 13.333 ( -1.211 0.000 2.670) 2.932 13.398 ( 0.461 0.000 -3.278) 3.311 13.667 ( -0.727 0.000 3.003) 3.090 13.754 ( 3.050 0.000 -1.113) 3.247 14.155 ( 0.450 0.000 -1.162) 1.246 14.171 ( 1.333 0.000 0.585) 1.456 14.433 ( -0.678 0.000 -0.997) 1.205 14.450 ( -1.246 0.000 1.805) 2.193 16.440 ( 1.641 0.000 0.987) 1.915 16.527 ( 4.155 0.000 -3.771) 5.611 17.057 ( -1.400 0.000 -3.292) 3.578 17.087 ( 0.770 0.000 2.923) 3.022 27.824 ( -0.953 0.000 1.829) 2.062 27.901 ( 2.387 0.000 -3.104) 3.916 28.205 ( -0.068 0.000 1.129) 1.131 28.260 ( 2.493 0.000 -0.218) 2.502 28.749 ( -1.063 0.000 0.649) 1.245 28.771 ( -0.536 0.000 -0.095) 0.544 28.810 ( 0.353 0.000 -0.765) 0.842 28.835 ( 1.070 0.000 0.193) 1.087 28.986 ( -0.482 0.000 -0.150) 0.505 29.002 ( 0.407 0.000 -0.115) 0.423 29.096 ( -0.667 0.000 0.898) 1.118 29.102 ( -0.298 0.000 -0.695) 0.756 31.343 ( -4.739 0.000 -7.378) 8.769 31.409 ( 1.369 0.000 7.201) 7.330 31.530 ( 3.166 0.000 -2.907) 4.299 31.674 ( 7.966 0.000 0.724) 7.999 31.830 ( 1.010 0.000 6.442) 6.520 31.932 ( 3.844 0.000 -6.610) 7.646 33.413 ( -15.274 0.000 -0.745) 15.292 33.646 ( -2.999 0.000 4.374) 5.303 70.082 ( -0.361 0.000 1.287) 1.336 70.144 ( 2.640 0.000 -2.250) 3.469 70.279 ( 0.030 0.000 1.416) 1.416 70.311 ( 1.617 0.000 -0.968) 1.885 ======================= Grid point 156 (71/112) ======================= q-point: ( 0.18 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.484 ( 11.582 0.000 -4.650) 12.481 1.601 ( 3.532 0.000 20.775) 21.074 1.710 ( 14.923 0.000 -15.261) 21.345 1.838 ( 14.578 0.000 -5.708) 15.655 2.824 ( -1.213 0.000 -9.615) 9.691 2.867 ( -9.120 0.000 8.016) 12.142 3.155 ( 12.615 0.000 -28.234) 30.924 3.322 ( 3.351 0.000 16.773) 17.105 3.382 ( -5.627 0.000 -4.083) 6.952 3.388 ( 3.552 0.000 -5.741) 6.751 3.528 ( -2.111 0.000 -0.579) 2.189 3.589 ( 3.856 0.000 1.692) 4.211 3.641 ( -2.468 0.000 11.264) 11.532 3.792 ( -2.010 0.000 4.065) 4.535 3.858 ( 2.842 0.000 3.401) 4.432 4.108 ( -1.282 0.000 -4.310) 4.497 4.287 ( -2.728 0.000 3.199) 4.204 4.361 ( -13.769 0.000 6.667) 15.298 4.411 ( -4.574 0.000 -7.487) 8.774 4.560 ( -8.978 0.000 3.588) 9.669 4.877 ( -5.404 0.000 -2.524) 5.964 4.881 ( -12.773 0.000 4.698) 13.609 5.077 ( -0.629 0.000 1.952) 2.051 5.091 ( 2.414 0.000 3.765) 4.473 5.213 ( -2.689 0.000 4.771) 5.477 5.253 ( -0.504 0.000 -3.546) 3.582 5.376 ( -7.616 0.000 -0.996) 7.680 5.507 ( 5.555 0.000 -2.567) 6.120 5.527 ( -5.485 0.000 1.083) 5.591 5.579 ( 4.365 0.000 1.896) 4.759 5.767 ( 10.468 0.000 -10.729) 14.990 5.907 ( 7.639 0.000 7.716) 10.858 5.942 ( -7.288 0.000 0.350) 7.297 6.090 ( 2.035 0.000 -4.515) 4.952 6.258 ( -0.727 0.000 -1.469) 1.640 6.276 ( -0.740 0.000 -2.062) 2.190 6.464 ( 4.025 0.000 -3.188) 5.134 6.590 ( 6.808 0.000 5.615) 8.825 6.970 ( -0.302 0.000 -0.565) 0.640 6.998 ( -0.210 0.000 3.558) 3.564 7.057 ( -0.636 0.000 -1.347) 1.490 7.150 ( 3.632 0.000 2.314) 4.306 7.302 ( -2.846 0.000 3.067) 4.184 7.514 ( -2.160 0.000 1.848) 2.842 7.851 ( 2.684 0.000 -2.836) 3.904 7.894 ( 1.960 0.000 0.899) 2.156 8.387 ( -2.299 0.000 -6.014) 6.438 8.438 ( -14.164 0.000 3.693) 14.637 13.359 ( 1.069 0.000 4.039) 4.178 13.374 ( -0.098 0.000 -2.365) 2.367 13.692 ( 0.920 0.000 2.080) 2.275 13.817 ( 4.211 0.000 -0.037) 4.211 14.158 ( 0.816 0.000 -0.945) 1.248 14.201 ( 1.443 0.000 0.569) 1.551 14.394 ( -4.384 0.000 -2.382) 4.989 14.431 ( 1.076 0.000 -1.099) 1.538 16.522 ( 5.017 0.000 3.076) 5.885 16.559 ( 2.986 0.000 -3.331) 4.473 17.004 ( -1.552 0.000 -2.787) 3.190 17.113 ( -0.226 0.000 2.004) 2.017 27.833 ( 0.004 0.000 2.247) 2.247 27.916 ( 2.080 0.000 -2.871) 3.545 28.228 ( 1.126 0.000 1.640) 1.990 28.303 ( 2.444 0.000 -0.602) 2.517 28.737 ( -0.662 0.000 0.373) 0.760 28.768 ( 0.060 0.000 0.454) 0.458 28.808 ( 0.179 0.000 -0.759) 0.780 28.850 ( 0.487 0.000 -0.008) 0.487 28.976 ( -0.459 0.000 -0.109) 0.472 29.006 ( 0.259 0.000 -0.349) 0.435 29.090 ( -0.757 0.000 0.976) 1.235 29.091 ( -0.169 0.000 -0.804) 0.821 31.218 ( -2.586 0.000 -5.219) 5.824 31.489 ( 0.991 0.000 5.938) 6.020 31.579 ( 4.969 0.000 -3.830) 6.274 31.795 ( 2.784 0.000 3.499) 4.471 31.949 ( 4.278 0.000 -6.958) 8.168 31.952 ( 7.699 0.000 4.067) 8.707 33.128 ( -15.465 0.000 -0.352) 15.469 33.560 ( -7.825 0.000 0.637) 7.851 70.093 ( 0.172 0.000 1.585) 1.594 70.168 ( 2.354 0.000 -2.698) 3.580 70.296 ( 0.457 0.000 1.588) 1.653 70.341 ( 2.181 0.000 -0.354) 2.210 ======================= Grid point 157 (72/112) ======================= q-point: ( 0.27 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.738 ( 21.777 0.000 -6.177) 22.636 1.810 ( 17.694 0.000 -12.152) 21.465 1.957 ( 9.647 0.000 15.320) 18.104 2.083 ( 15.227 0.000 -1.724) 15.325 2.765 ( -5.828 0.000 -0.533) 5.852 2.771 ( 0.992 0.000 -2.793) 2.964 3.113 ( -8.848 0.000 -15.340) 17.709 3.170 ( 9.248 0.000 -18.825) 20.974 3.312 ( -6.656 0.000 -2.337) 7.055 3.381 ( -6.600 0.000 7.358) 9.885 3.556 ( -12.655 0.000 3.855) 13.229 3.591 ( 7.767 0.000 -0.712) 7.800 3.629 ( -5.007 0.000 11.019) 12.103 3.904 ( 7.455 0.000 0.069) 7.455 3.982 ( 1.967 0.000 7.429) 7.685 4.042 ( -10.052 0.000 2.016) 10.252 4.221 ( -7.463 0.000 2.991) 8.040 4.224 ( 2.512 0.000 1.483) 2.918 4.364 ( 5.062 0.000 -11.380) 12.455 4.493 ( -3.411 0.000 4.536) 5.676 4.739 ( -7.373 0.000 -3.897) 8.339 4.756 ( -6.199 0.000 8.997) 10.926 5.000 ( -5.157 0.000 0.178) 5.160 5.141 ( -8.210 0.000 3.530) 8.937 5.221 ( -1.632 0.000 5.910) 6.131 5.225 ( 1.529 0.000 2.980) 3.349 5.246 ( 0.549 0.000 -4.561) 4.594 5.458 ( -2.968 0.000 1.740) 3.440 5.560 ( 3.006 0.000 -7.121) 7.729 5.671 ( 3.049 0.000 2.597) 4.005 5.734 ( -7.453 0.000 -4.199) 8.554 5.848 ( 1.574 0.000 -1.397) 2.105 5.982 ( -8.891 0.000 -1.714) 9.055 6.077 ( 2.178 0.000 6.089) 6.466 6.260 ( 3.127 0.000 -4.790) 5.720 6.282 ( -0.006 0.000 2.320) 2.320 6.516 ( 3.774 0.000 -0.935) 3.888 6.684 ( 1.080 0.000 0.796) 1.342 6.948 ( -1.146 0.000 -1.834) 2.163 7.029 ( -2.896 0.000 2.153) 3.608 7.037 ( 0.769 0.000 -2.317) 2.441 7.232 ( 2.644 0.000 1.965) 3.294 7.349 ( 4.349 0.000 10.901) 11.737 7.459 ( -3.046 0.000 0.746) 3.136 7.929 ( 6.926 0.000 -3.034) 7.561 7.954 ( 2.580 0.000 1.193) 2.842 8.194 ( -11.703 0.000 -2.022) 11.876 8.339 ( 1.035 0.000 -4.165) 4.292 13.360 ( 0.471 0.000 -1.357) 1.437 13.431 ( 1.906 0.000 5.097) 5.442 13.733 ( 1.803 0.000 1.461) 2.321 13.893 ( 3.830 0.000 -0.187) 3.835 14.168 ( 0.988 0.000 -0.543) 1.127 14.231 ( 1.394 0.000 0.329) 1.432 14.281 ( -3.591 0.000 -4.757) 5.960 14.439 ( 0.796 0.000 -1.759) 1.930 16.585 ( 2.630 0.000 -2.057) 3.339 16.647 ( 4.528 0.000 4.400) 6.314 16.955 ( -1.550 0.000 -1.650) 2.264 17.115 ( -1.020 0.000 0.973) 1.409 27.860 ( 0.458 0.000 2.626) 2.666 27.929 ( 2.087 0.000 -2.649) 3.373 28.265 ( 0.930 0.000 2.131) 2.325 28.331 ( 1.654 0.000 -1.567) 2.279 28.733 ( -0.006 0.000 0.299) 0.299 28.778 ( 0.347 0.000 0.576) 0.672 28.807 ( 0.097 0.000 0.000) 0.097 28.852 ( -0.091 0.000 -0.319) 0.331 28.969 ( -0.293 0.000 0.128) 0.319 29.006 ( 0.119 0.000 -0.580) 0.592 29.084 ( 0.169 0.000 -0.671) 0.692 29.086 ( -0.658 0.000 0.943) 1.150 31.170 ( 0.268 0.000 -0.734) 0.781 31.544 ( 0.355 0.000 4.015) 4.031 31.632 ( 4.686 0.000 -4.228) 6.312 31.836 ( -1.712 0.000 4.112) 4.454 31.972 ( 4.859 0.000 -6.366) 8.009 32.159 ( 11.141 0.000 2.920) 11.517 32.854 ( -14.088 0.000 -0.723) 14.107 33.411 ( -6.933 0.000 -3.079) 7.585 70.111 ( 0.154 0.000 1.699) 1.706 70.182 ( 1.756 0.000 -2.770) 3.279 70.322 ( 0.785 0.000 1.699) 1.871 70.376 ( 1.738 0.000 -0.084) 1.740 ======================= Grid point 158 (73/112) ======================= q-point: ( 0.36 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.069 ( 21.273 0.000 -10.205) 23.594 2.145 ( 24.357 0.000 1.478) 24.402 2.232 ( 7.117 0.000 9.213) 11.642 2.346 ( 14.866 0.000 -1.149) 14.910 2.668 ( -3.012 0.000 -1.702) 3.460 2.775 ( -1.379 0.000 0.553) 1.485 2.893 ( -1.638 0.000 -8.297) 8.457 3.020 ( -13.831 0.000 -3.465) 14.258 3.185 ( -6.724 0.000 -4.049) 7.848 3.312 ( -8.125 0.000 8.398) 11.685 3.397 ( 0.138 0.000 -5.721) 5.722 3.613 ( -9.699 0.000 15.721) 18.473 3.758 ( 9.815 0.000 -0.959) 9.862 3.864 ( -9.138 0.000 0.989) 9.191 3.880 ( -5.183 0.000 -12.849) 13.855 3.995 ( 0.775 0.000 -6.349) 6.396 4.181 ( -3.498 0.000 10.859) 11.409 4.271 ( 2.203 0.000 -4.879) 5.353 4.438 ( 12.365 0.000 -9.575) 15.639 4.461 ( -3.154 0.000 -0.283) 3.167 4.548 ( -7.489 0.000 -5.955) 9.568 4.777 ( -2.543 0.000 8.513) 8.885 4.965 ( -10.743 0.000 6.820) 12.725 4.972 ( -0.653 0.000 5.070) 5.112 5.243 ( -0.804 0.000 4.492) 4.563 5.244 ( 2.608 0.000 -3.107) 4.056 5.332 ( 4.636 0.000 -0.706) 4.689 5.432 ( -2.585 0.000 2.371) 3.508 5.501 ( -1.762 0.000 -7.019) 7.237 5.577 ( -5.016 0.000 1.431) 5.217 5.736 ( 0.252 0.000 3.033) 3.044 5.752 ( -11.809 0.000 -3.757) 12.392 5.923 ( 3.675 0.000 5.063) 6.256 6.084 ( -4.824 0.000 2.717) 5.537 6.285 ( -1.568 0.000 1.423) 2.117 6.299 ( 5.632 0.000 -4.711) 7.342 6.590 ( 2.853 0.000 3.969) 4.888 6.700 ( 0.698 0.000 0.604) 0.923 6.899 ( -1.486 0.000 -3.262) 3.585 6.956 ( -4.599 0.000 0.174) 4.603 7.055 ( 3.194 0.000 -2.196) 3.876 7.243 ( -0.541 0.000 -2.131) 2.199 7.449 ( 1.504 0.000 0.004) 1.504 7.579 ( 4.423 0.000 15.231) 15.860 7.917 ( -5.480 0.000 -3.177) 6.335 8.008 ( 4.574 0.000 -3.844) 5.975 8.085 ( 0.740 0.000 0.840) 1.120 8.333 ( 1.618 0.000 -3.787) 4.118 13.370 ( 1.383 0.000 -0.160) 1.392 13.490 ( -0.003 0.000 3.371) 3.371 13.780 ( 1.893 0.000 1.410) 2.360 13.934 ( 1.461 0.000 -2.219) 2.657 14.186 ( 1.246 0.000 -0.008) 1.246 14.217 ( 0.097 0.000 -1.566) 1.569 14.254 ( 0.963 0.000 -0.201) 0.984 14.424 ( -0.439 0.000 -2.604) 2.640 16.620 ( 2.620 0.000 -0.701) 2.712 16.735 ( 1.348 0.000 2.290) 2.657 16.931 ( -0.208 0.000 0.727) 0.756 17.095 ( -1.441 0.000 -0.111) 1.446 27.890 ( 0.137 0.000 2.793) 2.797 27.946 ( 2.303 0.000 -2.599) 3.473 28.290 ( -0.476 0.000 2.473) 2.518 28.339 ( 1.264 0.000 -2.379) 2.694 28.742 ( 0.569 0.000 0.461) 0.733 28.787 ( 0.105 0.000 0.416) 0.429 28.809 ( -0.093 0.000 0.380) 0.391 28.843 ( -0.267 0.000 -0.651) 0.704 28.968 ( -0.107 0.000 0.412) 0.425 29.001 ( 0.022 0.000 -0.756) 0.756 29.083 ( -0.526 0.000 0.851) 1.000 29.085 ( 0.352 0.000 -0.430) 0.556 31.210 ( 2.234 0.000 4.088) 4.659 31.569 ( -0.098 0.000 1.058) 1.063 31.683 ( 5.213 0.000 -4.041) 6.596 31.808 ( -5.161 0.000 4.014) 6.538 32.018 ( 5.147 0.000 -4.032) 6.539 32.366 ( 8.798 0.000 -2.580) 9.168 32.633 ( -9.495 0.000 4.373) 10.453 33.261 ( -5.596 0.000 -5.825) 8.077 70.127 ( -0.079 0.000 1.708) 1.710 70.186 ( 1.294 0.000 -2.580) 2.887 70.351 ( 0.690 0.000 1.623) 1.763 70.399 ( 0.966 0.000 -0.340) 1.024 ======================= Grid point 159 (74/112) ======================= q-point: ( 0.45 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.354 ( 9.009 0.000 -0.662) 9.033 2.396 ( 16.181 0.000 -3.094) 16.474 2.514 ( 3.008 0.000 -3.095) 4.316 2.575 ( 8.362 0.000 5.137) 9.814 2.618 ( -3.987 0.000 3.082) 5.039 2.692 ( -9.247 0.000 -1.309) 9.339 2.775 ( 3.408 0.000 -0.228) 3.415 2.933 ( 7.307 0.000 -1.156) 7.398 3.061 ( -5.663 0.000 5.259) 7.728 3.217 ( -10.307 0.000 6.190) 12.023 3.392 ( 3.049 0.000 -4.889) 5.761 3.555 ( -8.478 0.000 11.133) 13.994 3.595 ( -11.351 0.000 -12.828) 17.128 3.716 ( -3.869 0.000 -3.807) 5.428 3.932 ( 8.756 0.000 -2.360) 9.069 3.970 ( 2.108 0.000 -4.306) 4.794 4.189 ( -3.845 0.000 5.473) 6.689 4.277 ( 5.529 0.000 -7.855) 9.606 4.330 ( -9.233 0.000 -1.829) 9.413 4.389 ( -0.246 0.000 -10.464) 10.467 4.603 ( 9.973 0.000 -2.667) 10.323 4.743 ( -6.261 0.000 1.449) 6.426 4.964 ( 0.492 0.000 13.213) 13.222 5.033 ( -0.092 0.000 8.668) 8.668 5.273 ( 0.583 0.000 2.320) 2.392 5.277 ( 3.787 0.000 -3.716) 5.306 5.328 ( -4.118 0.000 1.965) 4.562 5.375 ( -8.370 0.000 4.443) 9.476 5.412 ( 2.593 0.000 -8.448) 8.837 5.485 ( -6.607 0.000 -10.898) 12.745 5.659 ( 7.110 0.000 4.914) 8.643 5.769 ( -2.794 0.000 4.987) 5.716 6.010 ( -3.090 0.000 0.342) 3.108 6.010 ( 1.107 0.000 2.589) 2.816 6.265 ( -2.116 0.000 2.784) 3.497 6.361 ( 5.033 0.000 -4.582) 6.806 6.679 ( 1.466 0.000 7.493) 7.635 6.720 ( 0.259 0.000 2.038) 2.055 6.846 ( -0.825 0.000 -4.126) 4.208 6.886 ( -2.614 0.000 -1.341) 2.938 7.104 ( 3.621 0.000 -1.234) 3.826 7.190 ( -2.601 0.000 -3.169) 4.099 7.509 ( 4.420 0.000 1.153) 4.568 7.634 ( -8.020 0.000 4.608) 9.250 7.896 ( 3.576 0.000 3.050) 4.700 8.025 ( 1.184 0.000 -4.030) 4.200 8.125 ( 0.939 0.000 3.681) 3.798 8.317 ( 0.719 0.000 -5.514) 5.561 13.407 ( 2.125 0.000 1.222) 2.452 13.482 ( -2.458 0.000 0.568) 2.523 13.823 ( 1.256 0.000 1.804) 2.198 13.914 ( -0.564 0.000 -3.200) 3.249 14.214 ( 1.552 0.000 0.651) 1.683 14.246 ( 2.175 0.000 1.867) 2.867 14.259 ( 0.003 0.000 -0.940) 0.940 14.379 ( -1.569 0.000 -3.481) 3.819 16.667 ( 2.574 0.000 0.418) 2.608 16.732 ( -2.052 0.000 -0.340) 2.080 16.965 ( 1.808 0.000 2.714) 3.261 17.062 ( -1.563 0.000 -1.217) 1.981 27.909 ( -0.721 0.000 2.678) 2.773 27.965 ( 2.250 0.000 -2.880) 3.655 28.291 ( -1.890 0.000 2.866) 3.434 28.341 ( 1.356 0.000 -2.493) 2.838 28.759 ( 0.684 0.000 0.678) 0.963 28.786 ( -0.402 0.000 -0.128) 0.422 28.811 ( -0.158 0.000 0.668) 0.686 28.834 ( 0.004 0.000 -0.866) 0.866 28.971 ( 0.024 0.000 0.596) 0.596 28.994 ( -0.005 0.000 -0.854) 0.854 29.081 ( -0.436 0.000 0.728) 0.848 29.088 ( 0.369 0.000 -0.319) 0.488 31.309 ( 2.919 0.000 7.156) 7.729 31.554 ( -0.573 0.000 -3.751) 3.794 31.727 ( -7.739 0.000 5.297) 9.378 31.759 ( 6.972 0.000 -3.978) 8.027 32.084 ( 4.176 0.000 -0.352) 4.191 32.306 ( -5.871 0.000 -7.821) 9.780 32.708 ( 6.012 0.000 10.398) 12.011 33.102 ( -5.159 0.000 -8.431) 9.884 70.137 ( -0.448 0.000 1.746) 1.803 70.185 ( 0.940 0.000 -2.375) 2.555 70.373 ( 0.252 0.000 1.502) 1.523 70.406 ( 0.270 0.000 -0.673) 0.725 ======================= Grid point 160 (75/112) ======================= q-point: (-0.45 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.321 ( -21.718 0.000 2.226) 21.832 2.390 ( -6.504 0.000 -3.776) 7.521 2.449 ( -4.909 0.000 3.585) 6.079 2.594 ( 4.978 0.000 4.143) 6.477 2.683 ( 13.040 0.000 -1.440) 13.119 2.697 ( 1.892 0.000 -4.490) 4.873 2.844 ( -19.069 0.000 -4.718) 19.644 2.933 ( -1.230 0.000 -0.060) 1.231 3.155 ( 4.125 0.000 -2.600) 4.876 3.208 ( 15.912 0.000 9.184) 18.372 3.294 ( -11.510 0.000 -1.292) 11.582 3.445 ( 4.487 0.000 3.139) 5.476 3.602 ( 4.714 0.000 7.996) 9.283 3.657 ( 0.243 0.000 -1.789) 1.806 3.959 ( -2.268 0.000 -4.230) 4.800 4.026 ( 6.538 0.000 -8.737) 10.913 4.157 ( -3.641 0.000 4.284) 5.623 4.207 ( -2.036 0.000 4.446) 4.891 4.336 ( 7.682 0.000 -8.611) 11.540 4.370 ( 6.375 0.000 -5.999) 8.754 4.607 ( -7.147 0.000 -1.996) 7.421 4.753 ( 7.949 0.000 -0.470) 7.963 5.089 ( -3.398 0.000 8.168) 8.847 5.104 ( -0.459 0.000 10.577) 10.587 5.174 ( -7.927 0.000 1.398) 8.049 5.300 ( 2.679 0.000 -4.525) 5.259 5.319 ( 3.916 0.000 1.211) 4.099 5.346 ( 1.249 0.000 -3.153) 3.391 5.364 ( 0.468 0.000 -2.974) 3.011 5.455 ( 7.305 0.000 -2.810) 7.827 5.711 ( -4.808 0.000 0.055) 4.808 5.831 ( 7.247 0.000 1.318) 7.366 6.006 ( -0.753 0.000 -1.201) 1.418 6.007 ( 0.913 0.000 1.890) 2.099 6.252 ( -3.584 0.000 4.818) 6.005 6.386 ( 2.777 0.000 -6.670) 7.225 6.748 ( 0.243 0.000 3.086) 3.096 6.773 ( 2.248 0.000 4.468) 5.002 6.800 ( -1.024 0.000 -0.495) 1.137 6.824 ( -2.314 0.000 -3.499) 4.195 7.101 ( -4.537 0.000 -1.775) 4.872 7.159 ( 2.922 0.000 -0.031) 2.922 7.506 ( -7.226 0.000 1.728) 7.430 7.625 ( 5.969 0.000 3.857) 7.106 7.961 ( -0.011 0.000 2.246) 2.246 7.982 ( -1.999 0.000 -4.441) 4.870 8.186 ( 0.788 0.000 6.222) 6.271 8.258 ( -0.781 0.000 -7.876) 7.914 13.426 ( -3.349 0.000 -0.447) 3.379 13.464 ( 2.341 0.000 2.179) 3.198 13.854 ( 0.081 0.000 2.482) 2.483 13.869 ( -1.552 0.000 -2.648) 3.070 14.238 ( -0.975 0.000 -1.494) 1.783 14.245 ( 1.141 0.000 0.342) 1.191 14.308 ( 1.917 0.000 3.092) 3.637 14.310 ( -2.291 0.000 -4.111) 4.706 16.677 ( -3.225 0.000 -0.554) 3.272 16.718 ( 2.260 0.000 0.984) 2.465 17.019 ( -1.509 0.000 -2.282) 2.736 17.025 ( 2.204 0.000 2.323) 3.202 27.909 ( -1.535 0.000 2.387) 2.838 27.973 ( 1.625 0.000 -3.478) 3.839 28.279 ( -2.249 0.000 3.431) 4.103 28.344 ( 0.984 0.000 -2.147) 2.362 28.772 ( -0.780 0.000 -0.479) 0.915 28.776 ( 0.424 0.000 0.775) 0.883 28.816 ( 0.136 0.000 0.780) 0.792 28.829 ( 0.194 0.000 -0.955) 0.975 28.978 ( 0.124 0.000 0.660) 0.672 28.987 ( 0.024 0.000 -0.869) 0.869 29.079 ( -0.442 0.000 0.597) 0.742 29.092 ( 0.375 0.000 -0.348) 0.512 31.424 ( 2.547 0.000 7.451) 7.875 31.474 ( -2.529 0.000 -8.154) 8.537 31.640 ( -7.077 0.000 6.580) 9.663 31.855 ( 7.491 0.000 -5.188) 9.112 32.131 ( -7.057 0.000 -4.386) 8.309 32.164 ( 2.462 0.000 4.910) 5.493 32.913 ( 6.639 0.000 9.228) 11.369 32.934 ( -3.677 0.000 -10.961) 11.561 70.141 ( -0.859 0.000 1.845) 2.035 70.179 ( 0.590 0.000 -2.241) 2.318 70.385 ( -0.271 0.000 1.338) 1.365 70.398 ( -0.341 0.000 -0.910) 0.972 ======================= Grid point 161 (76/112) ======================= q-point: (-0.36 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.911 ( -25.437 0.000 4.832) 25.892 2.249 ( -17.836 0.000 0.701) 17.850 2.318 ( -26.751 0.000 -6.176) 27.454 2.328 ( 0.817 0.000 -1.548) 1.751 2.680 ( 2.223 0.000 -3.491) 4.139 2.769 ( -9.317 0.000 12.636) 15.700 2.796 ( 5.571 0.000 -0.407) 5.586 2.853 ( -3.658 0.000 -3.361) 4.967 3.161 ( 4.938 0.000 0.310) 4.948 3.294 ( 6.949 0.000 2.600) 7.420 3.478 ( 8.400 0.000 -6.218) 10.451 3.622 ( 7.344 0.000 12.016) 14.083 3.733 ( 4.861 0.000 10.545) 11.611 3.818 ( -2.174 0.000 -3.786) 4.365 3.851 ( 10.944 0.000 2.951) 11.334 4.012 ( 3.520 0.000 -15.357) 15.755 4.137 ( -5.166 0.000 8.303) 9.779 4.280 ( 1.464 0.000 3.339) 3.646 4.389 ( 6.818 0.000 -9.813) 11.949 4.468 ( 6.203 0.000 -1.061) 6.293 4.524 ( 3.661 0.000 -3.012) 4.740 4.873 ( 5.564 0.000 -1.151) 5.682 5.055 ( -0.426 0.000 4.075) 4.098 5.104 ( -1.175 0.000 -2.519) 2.779 5.167 ( -0.915 0.000 5.076) 5.158 5.272 ( -0.686 0.000 -5.436) 5.480 5.308 ( 2.304 0.000 -3.904) 4.533 5.415 ( 2.187 0.000 3.004) 3.716 5.419 ( 0.583 0.000 2.859) 2.918 5.644 ( 11.415 0.000 4.082) 12.123 5.655 ( 1.674 0.000 -3.503) 3.883 5.865 ( 0.358 0.000 -6.745) 6.755 6.025 ( -0.546 0.000 -1.714) 1.799 6.054 ( 3.747 0.000 4.986) 6.237 6.209 ( -4.860 0.000 3.355) 5.905 6.351 ( 0.579 0.000 -6.593) 6.619 6.701 ( -5.188 0.000 -5.337) 7.443 6.740 ( -1.469 0.000 -3.142) 3.468 6.810 ( 0.990 0.000 4.437) 4.546 6.901 ( 4.465 0.000 5.967) 7.452 7.012 ( -4.582 0.000 1.369) 4.782 7.207 ( 1.859 0.000 0.806) 2.026 7.431 ( -2.578 0.000 2.049) 3.293 7.788 ( 6.443 0.000 7.592) 9.957 7.868 ( -4.309 0.000 -9.038) 10.013 7.944 ( -3.453 0.000 1.925) 3.954 8.162 ( -1.998 0.000 -7.542) 7.802 8.241 ( -0.414 0.000 4.923) 4.940 13.367 ( -2.772 0.000 0.153) 2.776 13.519 ( 1.732 0.000 1.197) 2.106 13.816 ( -1.891 0.000 -2.095) 2.822 13.868 ( -1.268 0.000 3.401) 3.630 14.203 ( -1.274 0.000 -1.587) 2.035 14.232 ( -2.448 0.000 -3.232) 4.054 14.257 ( 0.285 0.000 -0.529) 0.601 14.360 ( 0.684 0.000 3.280) 3.350 16.613 ( -3.522 0.000 0.085) 3.523 16.758 ( 1.229 0.000 0.188) 1.243 16.971 ( -1.179 0.000 -2.764) 3.005 17.080 ( 2.096 0.000 1.357) 2.497 27.897 ( -1.874 0.000 2.133) 2.840 27.961 ( 0.661 0.000 -4.051) 4.104 28.274 ( -1.717 0.000 3.826) 4.193 28.334 ( -0.260 0.000 -1.755) 1.774 28.753 ( -0.718 0.000 -0.529) 0.892 28.787 ( 0.148 0.000 0.542) 0.561 28.822 ( -0.033 0.000 -0.899) 0.900 28.829 ( 0.537 0.000 0.680) 0.867 28.980 ( 0.071 0.000 -0.795) 0.798 28.987 ( 0.162 0.000 0.624) 0.645 29.075 ( -0.530 0.000 0.523) 0.744 29.096 ( 0.442 0.000 -0.427) 0.615 31.340 ( -3.985 0.000 -7.760) 8.723 31.519 ( 1.714 0.000 5.193) 5.468 31.584 ( -4.923 0.000 5.046) 7.049 31.923 ( 5.091 0.000 -6.009) 7.876 31.980 ( -7.264 0.000 -0.631) 7.292 32.231 ( -2.922 0.000 7.926) 8.447 32.821 ( 3.652 0.000 -11.471) 12.039 33.102 ( 5.734 0.000 8.761) 10.471 70.138 ( -1.222 0.000 1.991) 2.336 70.168 ( 0.273 0.000 -2.168) 2.185 70.379 ( -0.806 0.000 -1.070) 1.340 70.386 ( -0.748 0.000 0.992) 1.242 ======================= Grid point 162 (77/112) ======================= q-point: (-0.27 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.521 ( -24.445 0.000 11.217) 26.896 1.700 ( -29.235 0.000 -5.652) 29.776 1.996 ( -17.909 0.000 7.741) 19.511 2.302 ( 0.324 0.000 -11.931) 11.935 2.592 ( -24.862 0.000 26.082) 36.033 2.769 ( 10.291 0.000 -1.814) 10.449 2.810 ( -1.042 0.000 -3.176) 3.343 2.829 ( 1.007 0.000 7.966) 8.029 3.288 ( 2.680 0.000 0.971) 2.850 3.512 ( 11.492 0.000 4.748) 12.434 3.513 ( 3.085 0.000 -5.939) 6.693 3.737 ( 2.879 0.000 -6.789) 7.375 3.782 ( -1.321 0.000 6.751) 6.879 3.872 ( -3.272 0.000 3.336) 4.673 3.979 ( 10.175 0.000 -7.346) 12.549 4.061 ( -2.779 0.000 2.059) 3.459 4.141 ( 6.422 0.000 6.472) 9.117 4.323 ( 7.904 0.000 -5.061) 9.386 4.419 ( 6.844 0.000 -10.827) 12.808 4.565 ( 6.697 0.000 -2.715) 7.227 4.683 ( 11.336 0.000 1.076) 11.387 4.936 ( 5.067 0.000 -5.079) 7.174 5.072 ( 2.641 0.000 -5.563) 6.159 5.126 ( -1.829 0.000 8.234) 8.435 5.180 ( -0.537 0.000 3.212) 3.257 5.270 ( 6.783 0.000 -7.366) 10.013 5.311 ( 1.370 0.000 -3.483) 3.742 5.435 ( -0.603 0.000 3.974) 4.019 5.458 ( 1.254 0.000 1.373) 1.859 5.702 ( 2.719 0.000 -0.157) 2.723 5.730 ( -3.754 0.000 -2.370) 4.439 5.922 ( 6.582 0.000 3.671) 7.537 5.939 ( -2.057 0.000 -8.207) 8.460 6.141 ( -3.743 0.000 2.216) 4.349 6.159 ( 2.619 0.000 2.385) 3.542 6.327 ( 0.625 0.000 -1.858) 1.960 6.534 ( -8.191 0.000 -3.651) 8.968 6.696 ( -1.043 0.000 -1.174) 1.570 6.873 ( 0.623 0.000 5.527) 5.562 6.969 ( -2.349 0.000 3.349) 4.090 7.030 ( 5.174 0.000 2.403) 5.705 7.234 ( 0.267 0.000 0.448) 0.522 7.457 ( 3.834 0.000 1.607) 4.157 7.660 ( -6.951 0.000 -14.783) 16.336 7.876 ( -5.710 0.000 1.559) 5.919 7.959 ( 2.220 0.000 2.764) 3.546 8.114 ( 5.177 0.000 2.129) 5.598 8.257 ( -1.461 0.000 3.620) 3.903 13.333 ( -1.617 0.000 1.182) 2.003 13.530 ( -0.003 0.000 -3.035) 3.035 13.769 ( -1.377 0.000 -1.855) 2.310 13.863 ( -2.789 0.000 3.034) 4.121 14.170 ( -1.023 0.000 -0.721) 1.252 14.193 ( -0.239 0.000 1.725) 1.742 14.248 ( -0.380 0.000 -1.327) 1.380 14.386 ( -0.823 0.000 3.085) 3.193 16.554 ( -3.444 0.000 1.003) 3.588 16.743 ( -1.752 0.000 -3.915) 4.289 16.943 ( 0.080 0.000 -0.744) 0.749 17.122 ( 1.682 0.000 0.281) 1.705 27.881 ( -1.781 0.000 1.995) 2.674 27.931 ( 0.106 0.000 -4.245) 4.247 28.279 ( -1.456 0.000 3.513) 3.803 28.303 ( -1.574 0.000 -1.511) 2.182 28.741 ( -0.081 0.000 -0.395) 0.403 28.787 ( -0.258 0.000 -0.249) 0.358 28.813 ( -0.266 0.000 -0.522) 0.586 28.843 ( 0.379 0.000 0.442) 0.582 28.976 ( 0.167 0.000 -0.591) 0.614 28.994 ( 0.105 0.000 0.513) 0.523 29.070 ( -0.526 0.000 0.676) 0.856 29.101 ( 0.533 0.000 -0.506) 0.735 31.216 ( -3.222 0.000 -4.957) 5.912 31.544 ( -3.902 0.000 4.061) 5.632 31.571 ( 0.717 0.000 1.602) 1.756 31.862 ( -6.738 0.000 3.265) 7.487 31.933 ( 1.102 0.000 -4.998) 5.118 32.159 ( -8.974 0.000 2.907) 9.433 32.905 ( 12.988 0.000 -5.966) 14.292 33.280 ( 5.918 0.000 8.952) 10.731 70.131 ( -1.528 0.000 2.108) 2.603 70.152 ( 0.105 0.000 -2.156) 2.159 70.352 ( -0.969 0.000 -1.181) 1.528 70.374 ( -1.340 0.000 0.296) 1.373 ======================= Grid point 163 (78/112) ======================= q-point: (-0.18 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.221 ( -23.634 0.000 11.019) 26.077 1.247 ( -20.150 0.000 19.916) 28.332 1.780 ( -12.696 0.000 6.928) 14.463 2.137 ( -1.244 0.000 -21.640) 21.676 2.380 ( -28.169 0.000 38.845) 47.984 2.767 ( 0.714 0.000 -3.631) 3.700 2.956 ( 10.194 0.000 2.658) 10.535 3.057 ( 11.502 0.000 12.664) 17.108 3.262 ( -6.661 0.000 4.598) 8.093 3.508 ( 1.033 0.000 -2.610) 2.807 3.601 ( -2.286 0.000 -4.045) 4.647 3.650 ( -9.216 0.000 -4.385) 10.206 3.796 ( 2.611 0.000 1.083) 2.827 3.851 ( -2.915 0.000 -1.169) 3.141 4.078 ( 5.605 0.000 -6.514) 8.594 4.105 ( 12.710 0.000 -3.707) 13.240 4.267 ( 3.363 0.000 3.076) 4.557 4.450 ( 6.010 0.000 -11.765) 13.211 4.504 ( 14.809 0.000 -5.952) 15.960 4.653 ( 5.998 0.000 -5.064) 7.850 4.878 ( 10.381 0.000 -2.009) 10.574 5.006 ( 8.035 0.000 -4.252) 9.090 5.114 ( 4.015 0.000 -2.931) 4.971 5.124 ( -1.643 0.000 2.304) 2.830 5.189 ( 0.073 0.000 0.925) 0.928 5.298 ( 0.686 0.000 -2.988) 3.066 5.326 ( -0.035 0.000 1.847) 1.847 5.498 ( 5.181 0.000 -1.780) 5.478 5.510 ( 2.573 0.000 2.289) 3.443 5.622 ( -4.248 0.000 -2.437) 4.897 5.635 ( -8.371 0.000 1.763) 8.554 5.951 ( -8.094 0.000 6.854) 10.606 5.952 ( 7.067 0.000 -1.709) 7.271 6.061 ( -5.437 0.000 -4.203) 6.872 6.248 ( 5.237 0.000 0.469) 5.258 6.306 ( -1.572 0.000 -4.330) 4.607 6.378 ( -7.321 0.000 4.331) 8.506 6.669 ( -2.277 0.000 -1.606) 2.786 6.914 ( -0.959 0.000 4.752) 4.848 6.985 ( -0.094 0.000 4.944) 4.945 7.089 ( 0.101 0.000 -3.595) 3.596 7.202 ( -3.819 0.000 -3.121) 4.932 7.421 ( -2.678 0.000 -10.572) 10.906 7.567 ( 5.568 0.000 -1.888) 5.880 7.785 ( -4.239 0.000 2.752) 5.054 7.916 ( -2.868 0.000 -1.341) 3.166 8.270 ( -0.458 0.000 4.782) 4.804 8.411 ( 17.818 0.000 7.938) 19.506 13.326 ( -0.795 0.000 2.064) 2.211 13.470 ( -1.445 0.000 -6.370) 6.531 13.737 ( -0.188 0.000 -2.049) 2.058 13.810 ( -4.549 0.000 0.722) 4.606 14.151 ( -0.657 0.000 -0.198) 0.686 14.224 ( -0.740 0.000 -1.727) 1.879 14.282 ( 5.120 0.000 8.056) 9.545 14.389 ( -1.494 0.000 2.832) 3.202 16.506 ( -3.230 0.000 1.846) 3.720 16.623 ( -5.711 0.000 -7.009) 9.041 16.957 ( 0.817 0.000 1.516) 1.722 17.144 ( 0.913 0.000 -0.846) 1.245 27.868 ( -1.633 0.000 1.866) 2.479 27.898 ( 0.365 0.000 -4.017) 4.034 28.258 ( -1.851 0.000 -1.256) 2.237 28.273 ( -2.170 0.000 2.418) 3.248 28.744 ( 0.768 0.000 -0.311) 0.829 28.777 ( -0.434 0.000 -0.398) 0.588 28.802 ( -0.506 0.000 -0.333) 0.606 28.847 ( -0.348 0.000 0.224) 0.414 28.977 ( 0.364 0.000 -0.266) 0.451 28.999 ( -0.028 0.000 0.357) 0.358 29.071 ( -0.117 0.000 1.096) 1.102 29.107 ( 0.566 0.000 -0.556) 0.794 31.156 ( -0.680 0.000 0.190) 0.706 31.506 ( -3.831 0.000 3.304) 5.059 31.573 ( -0.308 0.000 -1.787) 1.813 31.799 ( -4.978 0.000 6.638) 8.297 31.856 ( -6.504 0.000 -2.250) 6.882 32.031 ( -3.588 0.000 -3.245) 4.838 33.134 ( 14.769 0.000 -1.614) 14.857 33.487 ( 8.901 0.000 8.314) 12.180 70.119 ( -1.783 0.000 2.051) 2.718 70.135 ( 0.053 0.000 -2.277) 2.277 70.326 ( -0.726 0.000 -1.222) 1.422 70.340 ( -2.418 0.000 -0.327) 2.440 ======================= Grid point 164 (79/112) ======================= q-point: (-0.09 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 112 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.093 ( -9.377 0.000 25.952) 27.594 1.142 ( -13.364 0.000 25.909) 29.153 1.653 ( -4.507 0.000 -0.466) 4.531 1.924 ( 0.451 0.000 -24.270) 24.275 2.298 ( -21.671 0.000 50.035) 54.527 2.811 ( 5.464 0.000 3.040) 6.253 3.155 ( 7.268 0.000 3.088) 7.897 3.167 ( -8.106 0.000 6.689) 10.509 3.339 ( 3.235 0.000 10.267) 10.765 3.429 ( -7.660 0.000 -9.972) 12.575 3.501 ( -4.939 0.000 1.228) 5.089 3.600 ( 15.243 0.000 -0.042) 15.243 3.737 ( -5.033 0.000 -5.980) 7.816 3.828 ( 3.289 0.000 -3.878) 5.085 4.040 ( 0.969 0.000 -18.690) 18.715 4.287 ( 8.118 0.000 -13.072) 15.387 4.404 ( 1.363 0.000 -9.369) 9.468 4.411 ( 11.450 0.000 6.917) 13.377 4.698 ( 9.474 0.000 -1.222) 9.552 4.721 ( 4.552 0.000 -1.006) 4.662 5.020 ( -9.305 0.000 -5.424) 10.770 5.028 ( -8.005 0.000 4.800) 9.334 5.063 ( 10.580 0.000 -4.379) 11.451 5.149 ( 0.515 0.000 0.194) 0.550 5.246 ( 4.687 0.000 1.426) 4.899 5.283 ( -0.411 0.000 -4.760) 4.778 5.347 ( 3.014 0.000 -2.680) 4.033 5.434 ( -3.304 0.000 0.278) 3.315 5.484 ( -3.842 0.000 -0.357) 3.859 5.647 ( 1.742 0.000 2.003) 2.654 5.656 ( 5.644 0.000 0.036) 5.644 5.830 ( -6.515 0.000 0.470) 6.532 5.853 ( -11.943 0.000 1.628) 12.053 6.014 ( -1.554 0.000 -1.952) 2.495 6.261 ( 1.062 0.000 2.914) 3.102 6.339 ( 5.078 0.000 -1.270) 5.235 6.340 ( -2.676 0.000 4.286) 5.053 6.536 ( -6.428 0.000 -6.112) 8.870 6.931 ( -1.374 0.000 4.607) 4.808 6.995 ( -4.924 0.000 0.693) 4.972 7.031 ( 0.278 0.000 4.120) 4.130 7.115 ( -1.693 0.000 -2.998) 3.443 7.402 ( 3.369 0.000 -3.530) 4.880 7.514 ( -5.239 0.000 -5.191) 7.375 7.841 ( 3.708 0.000 3.484) 5.088 7.881 ( -0.223 0.000 -0.102) 0.245 8.351 ( 3.294 0.000 9.108) 9.685 8.762 ( 14.873 0.000 -4.657) 15.585 13.334 ( -0.791 0.000 2.682) 2.796 13.405 ( 0.412 0.000 -4.544) 4.562 13.725 ( 0.917 0.000 -2.419) 2.587 13.730 ( -4.668 0.000 1.139) 4.805 14.143 ( -0.237 0.000 0.129) 0.270 14.193 ( -0.956 0.000 -1.695) 1.946 14.393 ( -0.353 0.000 2.708) 2.731 14.450 ( 5.354 0.000 2.630) 5.965 16.468 ( -2.958 0.000 2.128) 3.645 16.471 ( -3.994 0.000 -2.492) 4.708 16.992 ( 0.929 0.000 2.795) 2.945 17.139 ( -0.105 0.000 -1.980) 1.983 27.853 ( -1.746 0.000 1.660) 2.409 27.881 ( 1.387 0.000 -3.592) 3.851 28.224 ( -0.626 0.000 -0.784) 1.003 28.243 ( -2.798 0.000 1.577) 3.212 28.760 ( 1.298 0.000 -0.457) 1.376 28.769 ( -0.429 0.000 0.220) 0.483 28.796 ( 0.022 0.000 0.347) 0.348 28.835 ( -1.074 0.000 0.114) 1.080 28.984 ( 0.518 0.000 -0.025) 0.519 28.999 ( -0.197 0.000 0.174) 0.263 29.084 ( 0.410 0.000 1.067) 1.143 29.111 ( 0.425 0.000 -0.562) 0.704 31.205 ( 3.049 0.000 5.419) 6.218 31.477 ( -1.387 0.000 2.465) 2.828 31.535 ( -0.723 0.000 -4.320) 4.380 31.696 ( -8.387 0.000 -1.506) 8.521 31.784 ( -3.763 0.000 7.356) 8.262 31.965 ( 0.246 0.000 -6.139) 6.144 33.383 ( 12.288 0.000 1.429) 12.371 33.698 ( 7.040 0.000 0.370) 7.050 70.102 ( -1.819 0.000 1.730) 2.510 70.116 ( 0.199 0.000 -2.068) 2.077 70.291 ( -2.581 0.000 0.796) 2.701 70.307 ( -0.166 0.000 -1.200) 1.212 ======================= Grid point 165 (80/112) ======================= q-point: ( 0.00 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.268 ( -6.256 7.727 23.220) 25.259 1.305 ( -2.836 8.360 24.467) 26.011 1.659 ( 5.076 4.929 -11.818) 13.774 1.793 ( 4.472 3.035 -22.245) 22.892 2.638 ( -5.326 12.351 45.239) 47.196 3.003 ( -3.680 -1.155 13.676) 14.210 3.057 ( 6.585 -2.818 5.703) 9.156 3.157 ( -4.217 -3.337 -2.002) 5.738 3.276 ( 0.202 0.411 -8.259) 8.272 3.379 ( -1.802 -2.503 6.638) 7.319 3.457 ( 1.826 0.102 -8.767) 8.955 3.622 ( -6.151 1.100 4.877) 7.926 3.815 ( 6.607 3.408 -27.959) 28.931 3.878 ( 0.672 3.788 -0.433) 3.872 4.100 ( 10.727 8.110 -2.989) 13.776 4.256 ( -0.866 3.186 -18.798) 19.086 4.360 ( 4.480 -5.472 3.692) 7.977 4.424 ( -7.256 -6.272 -0.049) 9.591 4.723 ( -9.755 -1.710 5.309) 11.236 4.810 ( 1.979 -1.189 2.062) 3.095 4.819 ( 2.529 2.789 -0.579) 3.809 4.892 ( 0.195 -0.856 -3.780) 3.881 5.148 ( -1.680 0.341 2.165) 2.761 5.178 ( -1.297 -2.690 -1.109) 3.186 5.271 ( -1.584 4.052 0.028) 4.350 5.316 ( 3.523 3.524 -3.173) 5.907 5.354 ( -0.554 -1.117 0.870) 1.520 5.423 ( 4.036 1.318 -4.693) 6.329 5.544 ( -11.992 2.787 3.904) 12.915 5.606 ( 7.743 0.219 -1.868) 7.969 5.692 ( -4.063 -1.984 1.955) 4.926 5.731 ( 2.776 -0.652 -1.554) 3.247 5.944 ( 1.356 5.914 1.794) 6.327 5.992 ( 1.267 4.692 -2.093) 5.292 6.255 ( -1.120 -5.571 1.155) 5.799 6.284 ( -0.028 -8.062 0.121) 8.063 6.389 ( 3.311 2.475 1.934) 4.564 6.438 ( -0.489 0.043 -2.864) 2.905 6.915 ( 0.523 -1.233 6.813) 6.943 7.008 ( -1.063 -0.693 -1.538) 1.994 7.095 ( -1.222 5.950 2.505) 6.570 7.138 ( -0.018 4.410 -1.522) 4.665 7.389 ( -1.499 0.495 -0.260) 1.599 7.443 ( 0.625 1.017 -4.414) 4.572 7.888 ( -0.797 0.035 1.824) 1.990 7.914 ( 1.516 1.671 -0.419) 2.295 8.439 ( 1.381 -7.045 11.673) 13.704 8.653 ( -1.944 -10.870 -7.675) 13.448 13.353 ( -1.572 1.377 2.118) 2.976 13.411 ( 1.905 0.717 -3.221) 3.810 13.664 ( -2.990 -0.837 2.667) 4.093 13.717 ( 1.927 -0.983 -2.380) 3.216 14.148 ( 0.410 0.071 0.404) 0.580 14.163 ( -0.316 -0.189 -1.020) 1.084 14.378 ( 0.541 -4.281 1.896) 4.713 14.392 ( -0.440 -5.649 0.697) 5.709 16.510 ( -1.655 4.896 1.525) 5.389 16.576 ( 2.676 8.382 -5.512) 10.382 17.064 ( 1.439 2.377 2.757) 3.914 17.124 ( -0.946 1.533 -2.796) 3.327 27.891 ( -1.512 4.338 -0.608) 4.634 27.918 ( 1.942 3.332 -2.916) 4.835 28.203 ( -1.123 -0.872 1.251) 1.894 28.220 ( 0.718 -0.549 -0.512) 1.039 28.761 ( -0.944 -0.027 0.734) 1.196 28.775 ( 0.776 -0.072 -0.664) 1.024 28.808 ( 0.665 -0.268 0.335) 0.792 28.813 ( -0.473 -0.266 -0.057) 0.546 28.992 ( -0.032 0.039 0.497) 0.500 29.003 ( 0.206 0.480 -0.539) 0.751 29.096 ( -0.060 0.037 1.120) 1.122 29.116 ( 0.044 0.443 -0.800) 0.916 31.283 ( 1.229 -2.679 5.795) 6.502 31.382 ( 2.122 -5.691 -3.051) 6.797 31.579 ( 1.888 2.430 0.249) 3.087 31.603 ( -3.056 3.591 -2.129) 5.174 31.829 ( -4.116 3.849 5.414) 7.814 31.955 ( 3.173 2.216 -6.167) 7.281 33.374 ( -9.710 -22.265 7.296) 25.362 33.432 ( 8.016 -13.869 0.217) 16.021 70.136 ( -1.653 3.053 -0.313) 3.486 70.149 ( 2.080 3.364 -1.492) 4.227 70.270 ( -0.622 -0.208 1.550) 1.683 70.299 ( 0.421 -0.126 -1.255) 1.330 ======================= Grid point 166 (81/112) ======================= q-point: ( 0.09 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.422 ( 1.764 8.073 21.457) 22.993 1.483 ( 0.668 9.296 19.274) 21.408 1.680 ( 11.340 4.846 -18.224) 22.004 1.726 ( 9.692 2.360 -20.835) 23.100 2.912 ( -9.532 -2.084 17.346) 19.902 2.928 ( -2.514 -0.694 0.894) 2.757 3.072 ( 1.803 5.532 13.760) 14.940 3.249 ( 5.390 1.462 -14.811) 15.829 3.321 ( 6.893 -1.718 8.091) 10.767 3.404 ( 3.589 1.653 -5.522) 6.790 3.451 ( 0.106 -3.283 5.556) 6.454 3.572 ( 4.180 1.856 -3.374) 5.683 3.691 ( -2.877 7.255 -3.289) 8.470 3.889 ( -2.021 6.026 2.011) 6.666 3.996 ( -3.429 1.071 -21.677) 21.973 4.141 ( -3.223 -0.778 -0.639) 3.377 4.306 ( -4.525 -1.888 0.612) 4.941 4.432 ( -5.891 -3.916 3.237) 7.779 4.650 ( -8.243 1.262 2.093) 8.598 4.736 ( -6.369 1.864 -1.719) 6.855 4.873 ( 4.792 -1.865 3.875) 6.439 4.965 ( 6.512 -1.112 1.501) 6.774 5.096 ( -5.640 3.285 -1.410) 6.678 5.152 ( -1.822 0.008 3.317) 3.785 5.217 ( -10.863 2.953 2.400) 11.510 5.294 ( 1.955 0.110 -3.151) 3.710 5.347 ( 1.742 -1.057 0.545) 2.109 5.451 ( 0.228 -0.740 1.115) 1.358 5.539 ( 1.398 0.582 -2.421) 2.856 5.573 ( -2.331 -3.574 0.732) 4.329 5.667 ( 2.153 -0.218 -0.097) 2.167 5.772 ( 2.483 0.658 0.852) 2.706 5.998 ( 0.621 1.158 0.781) 1.529 6.068 ( 8.118 4.864 -4.895) 10.655 6.247 ( -0.279 -4.120 2.394) 4.773 6.320 ( 3.434 -6.480 -0.686) 7.366 6.392 ( -0.748 1.946 -3.376) 3.968 6.443 ( 2.166 0.529 0.224) 2.241 6.952 ( -0.515 -1.028 0.175) 1.163 7.005 ( 0.416 -1.203 1.736) 2.153 7.091 ( -0.665 4.801 0.672) 4.893 7.168 ( 3.220 5.974 1.385) 6.926 7.349 ( -2.899 1.531 1.027) 3.435 7.462 ( 2.966 -1.005 -0.342) 3.150 7.863 ( -3.289 0.018 1.112) 3.472 7.927 ( 1.391 2.473 -1.907) 3.419 8.474 ( -6.524 -7.383 -1.419) 9.954 8.495 ( -7.063 -7.483 2.515) 10.593 13.343 ( -1.391 0.971 2.334) 2.885 13.407 ( 0.434 0.787 -2.589) 2.741 13.659 ( -0.289 -0.629 2.653) 2.742 13.748 ( 3.263 -0.682 -1.303) 3.579 14.145 ( 0.116 -0.546 -0.452) 0.718 14.181 ( 1.674 0.597 0.069) 1.779 14.384 ( -0.665 -4.615 -0.449) 4.684 14.394 ( 0.158 -4.068 0.567) 4.111 16.459 ( -2.119 3.183 0.317) 3.837 16.631 ( 4.343 6.299 -2.026) 7.915 17.063 ( -1.717 1.624 -1.901) 3.033 17.128 ( 1.815 2.857 1.075) 3.551 27.860 ( -1.359 3.201 0.642) 3.536 27.941 ( 2.305 3.580 -1.930) 4.675 28.194 ( -0.242 -1.062 1.017) 1.490 28.255 ( 2.602 -0.463 -0.104) 2.645 28.748 ( -1.012 -0.004 0.649) 1.203 28.772 ( -0.450 0.101 -0.116) 0.475 28.804 ( 0.214 -0.490 -0.623) 0.821 28.831 ( 1.024 -0.329 0.109) 1.081 28.989 ( -0.428 0.293 0.039) 0.520 29.004 ( 0.334 0.195 -0.343) 0.517 29.097 ( -0.697 0.185 0.568) 0.917 29.109 ( -0.174 0.439 -0.424) 0.635 31.303 ( -1.936 -2.726 -2.755) 4.332 31.391 ( 2.614 -2.958 -1.451) 4.206 31.561 ( 1.408 3.455 0.432) 3.756 31.684 ( 5.641 1.056 1.817) 6.020 31.825 ( -0.215 -0.060 4.794) 4.799 31.988 ( 4.825 4.600 -4.411) 7.994 33.195 ( -14.006 -17.452 3.917) 22.717 33.513 ( 0.551 -12.865 -0.661) 12.894 70.104 ( -1.266 2.107 0.357) 2.484 70.184 ( 2.421 3.100 -1.396) 4.173 70.272 ( -0.254 -0.605 1.031) 1.222 70.314 ( 1.912 0.229 -0.514) 1.994 ======================= Grid point 167 (82/112) ======================= q-point: ( 0.18 0.14 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.609 ( 9.395 10.977 -4.640) 15.176 1.701 ( 5.685 8.835 22.388) 24.731 1.758 ( 15.671 5.210 -18.527) 24.819 1.850 ( 14.438 1.280 -3.066) 14.815 2.798 ( -3.648 -1.279 -3.665) 5.327 2.852 ( -5.051 -2.561 0.854) 5.728 3.183 ( 5.949 1.180 -18.498) 19.467 3.272 ( 3.374 -1.454 -1.102) 3.835 3.406 ( -0.024 2.093 -2.195) 3.033 3.442 ( 1.462 0.596 -3.078) 3.459 3.575 ( 3.335 0.248 11.167) 11.657 3.613 ( -5.460 4.447 6.777) 9.773 3.638 ( 4.216 4.700 -6.456) 9.030 3.787 ( -1.185 -0.524 -1.562) 2.030 3.965 ( -3.610 8.244 11.046) 14.248 4.072 ( 2.704 -1.176 -3.207) 4.357 4.265 ( -2.574 -2.369 5.168) 6.240 4.322 ( -11.583 -3.019 6.643) 13.690 4.446 ( -7.566 3.419 -4.385) 9.390 4.606 ( -7.035 3.545 -0.966) 7.937 4.880 ( -5.140 0.795 -0.546) 5.229 4.927 ( -9.141 3.018 1.418) 9.730 5.057 ( -2.108 -0.546 1.010) 2.401 5.118 ( 0.651 -0.295 0.594) 0.929 5.196 ( -1.275 -0.318 5.159) 5.324 5.250 ( -2.827 -0.170 -1.747) 3.327 5.359 ( -3.107 -2.454 -1.359) 4.186 5.414 ( -3.524 -5.874 1.081) 6.935 5.520 ( 1.990 -2.699 -0.319) 3.369 5.561 ( -0.340 0.509 0.905) 1.093 5.773 ( 8.168 -0.374 -4.832) 9.498 5.853 ( -1.306 -3.886 0.881) 4.193 5.981 ( 1.445 2.163 4.644) 5.323 6.097 ( -1.886 -0.683 -2.299) 3.051 6.280 ( 1.782 2.371 -2.390) 3.809 6.368 ( 2.837 5.215 -2.057) 6.283 6.401 ( 4.465 -1.875 -0.099) 4.844 6.532 ( 5.388 -4.839 4.487) 8.519 6.931 ( -0.494 -1.553 -2.706) 3.159 7.015 ( -0.301 0.149 1.463) 1.501 7.078 ( -1.235 2.353 -0.337) 2.679 7.244 ( 2.445 5.956 2.234) 6.815 7.312 ( -1.950 1.201 2.485) 3.380 7.496 ( -1.541 -1.643 1.935) 2.970 7.825 ( 0.060 -0.473 0.743) 0.883 7.950 ( 3.763 3.311 -2.610) 5.651 8.325 ( -6.802 -6.629 -4.727) 10.609 8.367 ( -7.374 -5.561 1.049) 9.295 13.347 ( -0.235 -0.208 1.293) 1.331 13.399 ( 0.383 1.411 0.615) 1.586 13.691 ( 1.504 -0.049 1.782) 2.333 13.811 ( 4.282 -0.611 -0.223) 4.331 14.150 ( 0.819 -0.502 -0.555) 1.109 14.212 ( 1.547 0.724 0.184) 1.718 14.338 ( -2.782 -4.434 -2.903) 5.985 14.409 ( 1.424 -2.201 -0.604) 2.690 16.457 ( 1.478 -0.808 0.145) 1.691 16.683 ( 1.925 4.566 0.953) 5.046 17.015 ( -1.339 2.772 -2.151) 3.755 17.162 ( 0.600 3.512 1.168) 3.749 27.856 ( -0.167 2.164 1.589) 2.690 27.959 ( 1.435 3.827 -1.758) 4.449 28.215 ( 1.183 -1.197 1.536) 2.279 28.299 ( 2.233 -0.398 -0.402) 2.303 28.738 ( -0.609 0.111 0.422) 0.750 28.769 ( 0.055 0.130 0.445) 0.467 28.801 ( 0.087 -0.561 -0.692) 0.895 28.846 ( 0.492 -0.435 -0.029) 0.657 28.981 ( -0.383 0.443 -0.135) 0.602 29.007 ( 0.266 0.080 -0.303) 0.411 29.085 ( -0.525 -0.004 -0.435) 0.681 29.104 ( -0.402 0.650 0.478) 0.901 31.220 ( -1.670 0.228 -4.975) 5.252 31.444 ( 3.018 -3.515 0.406) 4.651 31.621 ( 3.550 3.225 0.745) 4.854 31.770 ( 1.126 -0.865 3.816) 4.072 31.934 ( 8.316 -1.518 2.526) 8.823 32.033 ( 4.004 6.524 -4.348) 8.803 32.965 ( -13.680 -13.717 1.953) 19.471 33.452 ( -4.536 -10.213 -3.129) 11.605 70.097 ( -0.134 0.785 0.873) 1.182 70.202 ( 1.215 2.258 -2.117) 3.325 70.288 ( 0.756 -0.467 1.577) 1.810 70.351 ( 2.158 0.672 0.009) 2.260 ======================= Grid point 168 (83/112) ======================= q-point: ( 0.27 0.14 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.791 ( 15.990 6.476 -6.069) 18.288 1.932 ( 20.205 8.575 -12.612) 25.314 2.021 ( 9.952 5.802 13.862) 18.024 2.127 ( 15.850 4.906 1.860) 16.696 2.719 ( -4.488 -2.385 -0.907) 5.163 2.803 ( 1.808 1.133 -3.118) 3.778 3.112 ( -8.580 -0.877 -11.722) 14.553 3.152 ( 3.450 -2.195 -9.701) 10.528 3.360 ( -4.026 2.560 -7.166) 8.609 3.374 ( -6.181 3.787 -0.426) 7.261 3.587 ( 3.790 1.802 -2.610) 4.942 3.649 ( -5.858 3.455 5.554) 8.781 3.652 ( -2.087 4.072 6.751) 8.156 3.837 ( 0.119 -5.884 0.907) 5.955 3.980 ( 2.859 2.757 7.514) 8.499 4.125 ( -11.377 0.411 6.233) 12.979 4.151 ( 0.240 0.165 -3.494) 3.506 4.309 ( 0.450 5.423 5.522) 7.753 4.375 ( 3.684 1.127 -7.176) 8.145 4.490 ( -4.873 0.069 1.657) 5.147 4.742 ( -8.295 1.682 -0.996) 8.522 4.828 ( -3.635 4.043 2.807) 6.119 4.986 ( -5.046 -0.821 -0.354) 5.124 5.122 ( -4.784 -2.150 3.292) 6.192 5.158 ( -3.633 -3.008 3.789) 6.050 5.227 ( 0.099 -1.088 -0.180) 1.107 5.285 ( -1.042 2.111 1.080) 2.589 5.395 ( -0.239 -6.666 -1.525) 6.842 5.509 ( -1.246 -3.621 -2.030) 4.334 5.593 ( -0.910 -3.781 2.218) 4.477 5.744 ( -3.402 -1.368 -2.214) 4.283 5.843 ( 0.727 0.030 1.168) 1.376 5.986 ( -6.562 -0.582 -2.756) 7.141 6.103 ( 2.005 2.098 6.215) 6.859 6.260 ( -0.237 1.293 -4.230) 4.429 6.408 ( 2.828 7.996 -1.332) 8.585 6.496 ( 3.952 0.302 2.433) 4.651 6.654 ( 3.514 -4.069 3.345) 6.332 6.893 ( -1.146 -2.411 -2.689) 3.789 7.006 ( -0.688 -2.232 -2.572) 3.474 7.051 ( -1.815 1.716 1.275) 2.804 7.272 ( -0.703 2.229 0.753) 2.455 7.363 ( 2.810 0.759 6.814) 7.410 7.468 ( -0.980 0.546 2.388) 2.638 7.883 ( 4.062 -1.911 0.907) 4.580 7.996 ( 1.647 1.091 -3.672) 4.170 8.136 ( -5.831 -4.229 -2.714) 7.698 8.314 ( 0.647 -2.560 -2.947) 3.957 13.349 ( 0.364 -0.697 -0.525) 0.946 13.436 ( 0.833 0.139 3.934) 4.023 13.740 ( 2.357 0.700 1.311) 2.786 13.887 ( 3.881 -0.633 -0.297) 3.944 14.163 ( 1.050 -0.323 -0.316) 1.143 14.234 ( 0.400 -0.438 -1.466) 1.581 14.259 ( -1.345 -1.112 -2.590) 3.123 14.425 ( 1.046 -1.411 -1.544) 2.338 16.500 ( 2.847 -3.337 -0.028) 4.387 16.715 ( -0.034 0.276 2.081) 2.100 16.986 ( -0.339 4.828 -0.649) 4.884 17.168 ( -0.690 3.917 0.598) 4.022 27.876 ( 0.450 1.638 2.188) 2.770 27.967 ( 1.329 3.338 -1.975) 4.100 28.253 ( 1.043 -1.233 1.827) 2.439 28.323 ( 1.124 -0.764 -1.220) 1.826 28.735 ( 0.008 0.199 0.333) 0.388 28.779 ( 0.352 0.124 0.567) 0.678 28.799 ( 0.048 -0.661 -0.019) 0.663 28.848 ( -0.032 -0.383 -0.268) 0.469 28.975 ( -0.182 0.567 0.040) 0.597 29.008 ( 0.204 0.244 -0.409) 0.518 29.075 ( -0.103 -0.215 -0.435) 0.495 29.101 ( -0.456 0.704 0.586) 1.023 31.184 ( 0.704 1.268 -0.992) 1.757 31.499 ( 2.951 -3.384 -0.149) 4.493 31.679 ( 2.137 3.471 0.141) 4.078 31.807 ( -0.385 -1.207 3.220) 3.460 32.048 ( 2.369 5.043 -2.668) 6.178 32.143 ( 11.859 -0.627 -0.056) 11.875 32.743 ( -12.235 -9.685 1.340) 15.662 33.326 ( -4.981 -7.997 -5.035) 10.682 70.109 ( 0.277 0.122 1.201) 1.239 70.198 ( 0.690 0.951 -2.306) 2.588 70.320 ( 1.115 0.126 1.682) 2.022 70.386 ( 1.598 0.685 0.013) 1.739 ======================= Grid point 169 (84/112) ======================= q-point: ( 0.36 0.14 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.064 ( 19.457 2.501 -6.080) 20.538 2.257 ( 14.003 5.692 3.563) 15.529 2.279 ( 15.235 5.214 1.878) 16.211 2.417 ( 14.204 6.948 -0.598) 15.823 2.623 ( -3.726 -3.054 -2.057) 5.238 2.810 ( -1.677 2.254 -0.269) 2.822 2.943 ( -1.105 4.443 -4.956) 6.747 3.093 ( -4.932 2.248 -1.175) 5.546 3.165 ( -14.016 0.158 1.281) 14.075 3.243 ( -1.653 1.801 -3.975) 4.667 3.537 ( -6.135 6.243 2.706) 9.162 3.622 ( -3.309 2.546 4.328) 6.014 3.744 ( 5.858 -2.737 -1.545) 6.648 3.796 ( -4.061 -0.095 0.381) 4.080 3.981 ( -8.295 3.912 -8.080) 12.223 4.013 ( 0.025 0.438 -1.349) 1.418 4.134 ( -0.086 -3.099 4.229) 5.244 4.282 ( -0.420 1.743 -5.388) 5.678 4.393 ( -0.694 -2.378 -1.614) 2.957 4.523 ( 6.588 3.576 -2.637) 7.946 4.568 ( -6.488 2.057 -4.641) 8.238 4.825 ( -1.910 3.242 4.569) 5.919 4.932 ( -5.225 -1.583 6.961) 8.846 4.991 ( -5.619 0.687 2.862) 6.343 5.194 ( 1.210 -3.631 1.236) 4.022 5.234 ( 0.517 -2.101 0.411) 2.202 5.300 ( -0.355 -3.295 0.691) 3.385 5.362 ( -0.890 -6.496 -3.392) 7.382 5.462 ( -3.066 -1.496 1.238) 3.629 5.557 ( -2.451 -2.283 3.795) 5.061 5.715 ( -6.753 -1.758 -1.309) 7.100 5.762 ( -1.365 1.343 -1.729) 2.580 5.954 ( 1.467 1.595 5.147) 5.585 6.117 ( -4.655 2.734 2.878) 6.118 6.231 ( 1.045 -0.641 -2.321) 2.625 6.437 ( 2.625 7.530 -3.273) 8.620 6.579 ( 2.238 -0.183 3.709) 4.335 6.723 ( 1.175 0.258 3.053) 3.281 6.846 ( -1.537 -2.578 -1.948) 3.578 6.963 ( -2.120 0.312 -1.204) 2.458 7.042 ( 1.403 -0.569 -0.959) 1.792 7.247 ( -1.550 -0.220 -1.568) 2.216 7.431 ( 2.560 -1.492 -0.594) 3.022 7.564 ( 1.332 -2.186 11.348) 11.634 7.892 ( -3.214 -2.027 -3.330) 5.052 7.962 ( 2.818 -2.517 -1.177) 3.958 8.135 ( 3.243 2.961 -1.167) 4.544 8.314 ( 1.676 -1.722 -2.907) 3.772 13.361 ( 1.281 -0.769 -0.009) 1.494 13.472 ( -0.594 -1.620 2.874) 3.353 13.793 ( 2.159 1.214 1.239) 2.769 13.929 ( 1.614 -0.461 -2.048) 2.648 14.183 ( 1.282 -0.178 0.200) 1.310 14.203 ( 0.428 -0.976 -1.374) 1.739 14.267 ( 0.963 0.932 -0.220) 1.358 14.415 ( -0.214 -0.871 -2.488) 2.644 16.553 ( 2.957 -4.119 0.061) 5.071 16.712 ( -1.708 -3.591 0.862) 4.068 16.995 ( 0.886 6.042 1.440) 6.274 17.150 ( -1.427 4.054 -0.146) 4.300 27.905 ( 0.306 1.474 2.471) 2.894 27.976 ( 1.650 2.643 -2.241) 3.838 28.277 ( -0.267 -1.340 1.996) 2.419 28.323 ( 0.624 -1.427 -1.947) 2.494 28.744 ( 0.537 0.199 0.468) 0.740 28.787 ( 0.087 0.019 0.248) 0.263 28.802 ( -0.007 -0.593 0.477) 0.761 28.841 ( -0.274 -0.272 -0.593) 0.708 28.975 ( 0.024 0.714 0.326) 0.785 29.007 ( 0.071 0.513 -0.580) 0.778 29.074 ( 0.266 -0.253 -0.041) 0.370 29.097 ( -0.469 0.577 0.427) 0.858 31.226 ( 2.534 1.576 3.597) 4.674 31.547 ( 2.361 -1.957 -0.378) 3.090 31.705 ( 2.186 1.769 -2.061) 3.487 31.802 ( -3.862 0.020 3.955) 5.527 32.072 ( 3.430 4.671 -3.284) 6.661 32.334 ( 8.249 -2.940 -4.308) 9.759 32.574 ( -7.291 -5.155 6.191) 10.865 33.191 ( -4.505 -6.516 -6.519) 10.259 70.125 ( 0.141 -0.042 1.414) 1.422 70.190 ( 0.644 0.190 -2.213) 2.313 70.353 ( 0.868 0.349 1.557) 1.816 70.407 ( 0.861 0.562 -0.357) 1.088 ======================= Grid point 170 (85/112) ======================= q-point: ( 0.45 0.14 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.328 ( 8.755 -1.353 -0.882) 8.903 2.415 ( 12.239 1.362 -3.464) 12.793 2.494 ( -1.764 -2.088 -3.206) 4.213 2.616 ( -4.692 2.339 1.640) 5.493 2.670 ( 12.791 6.880 7.402) 16.301 2.747 ( -3.266 4.859 -0.764) 5.904 2.844 ( 1.336 6.079 -0.909) 6.290 3.022 ( -0.373 3.809 4.124) 5.627 3.098 ( 1.887 6.731 -0.032) 6.991 3.206 ( -5.251 0.437 5.553) 7.655 3.455 ( -3.173 4.648 -5.628) 7.959 3.570 ( -5.313 1.088 7.719) 9.434 3.604 ( -8.122 1.689 -7.618) 11.263 3.768 ( -5.049 3.937 -6.859) 9.383 3.907 ( 6.866 -1.605 -0.972) 7.117 3.990 ( 0.843 1.574 -4.101) 4.473 4.144 ( -3.271 -3.932 4.558) 6.851 4.257 ( 3.986 -1.430 -8.509) 9.504 4.326 ( -3.904 -0.225 -1.370) 4.144 4.411 ( -3.127 1.811 -7.116) 7.981 4.646 ( 7.496 3.366 -1.355) 8.328 4.790 ( -4.526 3.837 -0.458) 5.951 4.931 ( -1.097 -2.154 10.205) 10.487 5.021 ( 1.382 -2.214 7.417) 7.862 5.198 ( 0.220 -5.614 -4.653) 7.294 5.215 ( -4.390 -7.544 2.720) 9.143 5.274 ( -1.494 -1.703 2.137) 3.114 5.356 ( 3.010 -3.587 -3.618) 5.918 5.402 ( -6.052 -0.049 3.516) 7.000 5.494 ( -2.658 0.137 -8.449) 8.859 5.671 ( 4.913 1.433 4.790) 7.010 5.783 ( -0.056 0.829 1.519) 1.731 6.013 ( -0.274 -0.230 3.088) 3.108 6.038 ( -3.725 2.865 -0.044) 4.699 6.254 ( 0.705 0.211 3.548) 3.623 6.445 ( 2.538 5.661 -6.094) 8.696 6.643 ( 1.156 -1.752 4.411) 4.885 6.746 ( -1.290 -2.098 1.762) 3.028 6.815 ( -0.987 1.341 1.266) 2.092 6.922 ( -0.882 3.028 -1.595) 3.534 7.082 ( 2.959 -1.737 -0.128) 3.433 7.190 ( -2.313 -0.562 -3.403) 4.153 7.490 ( 4.132 -1.832 0.358) 4.534 7.580 ( -6.366 -4.849 4.116) 8.999 7.895 ( 3.212 -0.286 1.851) 3.718 7.981 ( 0.100 -2.824 -1.222) 3.079 8.178 ( 1.706 3.440 0.873) 3.938 8.309 ( 0.838 -0.622 -4.333) 4.457 13.395 ( 2.028 -1.027 1.034) 2.497 13.459 ( -2.347 -2.002 0.715) 3.166 13.835 ( 1.163 1.107 1.474) 2.180 13.915 ( -0.406 0.063 -2.888) 2.917 14.212 ( 1.340 -0.234 0.708) 1.533 14.228 ( 1.573 -1.001 0.754) 2.011 14.277 ( 0.578 1.057 0.036) 1.205 14.375 ( -1.337 -0.378 -3.315) 3.594 16.607 ( 2.757 -4.343 0.528) 5.171 16.674 ( -2.580 -4.663 -0.264) 5.336 17.035 ( 1.522 5.455 2.325) 6.122 17.118 ( -1.465 4.249 -1.036) 4.612 27.926 ( -0.411 1.667 2.512) 3.042 27.986 ( 1.733 1.923 -2.712) 3.750 28.277 ( -1.813 -1.351 2.533) 3.395 28.320 ( 1.159 -1.957 -2.256) 3.204 28.760 ( 0.610 0.089 0.652) 0.897 28.785 ( -0.357 -0.097 -0.214) 0.427 28.806 ( -0.050 -0.357 0.721) 0.806 28.831 ( -0.104 -0.301 -0.838) 0.896 28.980 ( 0.097 0.848 0.551) 1.016 29.001 ( 0.013 0.679 -0.747) 1.009 29.081 ( 0.187 0.044 0.426) 0.467 29.092 ( -0.253 0.247 0.007) 0.354 31.326 ( 3.146 1.628 6.615) 7.504 31.556 ( -0.211 0.179 -3.437) 3.448 31.729 ( -4.346 -0.202 3.123) 5.356 31.758 ( 2.814 0.139 -0.947) 2.973 32.114 ( 3.023 2.891 -1.107) 4.327 32.280 ( -4.267 -2.112 -6.961) 8.433 32.670 ( 5.644 -3.537 9.864) 11.902 33.046 ( -4.434 -5.322 -8.509) 10.973 70.137 ( -0.273 0.017 1.599) 1.622 70.183 ( 0.636 -0.182 -2.141) 2.241 70.377 ( 0.352 0.420 1.453) 1.553 70.412 ( 0.195 0.451 -0.720) 0.871 ======================= Grid point 171 (86/112) ======================= q-point: (-0.45 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.318 ( -17.254 -1.308 1.131) 17.340 2.354 ( -9.840 0.521 1.031) 9.908 2.452 ( 4.496 -2.357 -0.511) 5.102 2.630 ( -5.419 3.955 2.524) 7.168 2.717 ( 11.796 4.152 -0.203) 12.507 2.795 ( 4.243 7.491 -3.376) 9.247 2.901 ( -19.014 5.414 -3.634) 20.101 3.010 ( -1.463 6.125 0.654) 6.332 3.160 ( 4.312 0.378 0.033) 4.329 3.254 ( 13.968 4.411 3.621) 15.089 3.339 ( -7.674 4.314 0.614) 8.825 3.474 ( 1.779 3.117 -0.013) 3.589 3.623 ( 4.314 2.439 7.215) 8.753 3.713 ( 3.027 4.218 -3.040) 6.016 3.922 ( -2.541 -2.463 -2.222) 4.179 4.021 ( 5.128 -1.017 -6.488) 8.333 4.121 ( -2.669 -2.820 4.643) 6.053 4.201 ( -2.986 -0.717 -0.430) 3.101 4.329 ( 5.957 0.226 -4.417) 7.420 4.384 ( 5.285 1.092 -4.726) 7.174 4.669 ( -6.027 4.605 -2.995) 8.154 4.772 ( 6.083 1.450 0.860) 6.312 4.998 ( -2.432 -5.193 7.877) 9.744 5.081 ( -2.659 -2.748 1.372) 4.063 5.181 ( 3.708 -9.206 1.539) 10.043 5.191 ( 0.141 -3.439 2.120) 4.042 5.282 ( 0.624 -2.573 1.194) 2.905 5.342 ( 0.268 1.757 -2.329) 2.929 5.355 ( -0.241 -1.381 -0.907) 1.670 5.488 ( 6.621 1.838 -3.583) 7.749 5.744 ( -2.397 2.018 -1.738) 3.583 5.812 ( 4.735 -0.791 0.081) 4.801 5.997 ( -1.443 -0.306 1.123) 1.854 6.037 ( 2.528 2.124 1.187) 3.509 6.286 ( -3.080 2.546 5.961) 7.177 6.424 ( 2.255 2.984 -8.189) 9.003 6.703 ( 1.188 -2.757 4.023) 5.020 6.709 ( -2.126 -4.439 -1.749) 5.223 6.836 ( -0.402 3.573 5.943) 6.946 6.894 ( -0.315 4.313 -3.058) 5.297 7.093 ( -3.767 -0.773 -1.346) 4.075 7.152 ( 2.833 -0.729 -0.479) 2.964 7.474 ( -6.508 -2.975 2.231) 7.495 7.590 ( 5.133 -3.326 2.109) 6.470 7.939 ( -2.689 -2.161 -1.226) 3.661 7.959 ( 0.885 -1.707 0.434) 1.971 8.217 ( 0.419 2.332 3.470) 4.202 8.263 ( -0.895 0.510 -6.148) 6.234 13.410 ( -2.968 -1.382 -0.204) 3.280 13.448 ( 2.254 -1.463 1.705) 3.183 13.861 ( -0.122 0.632 2.136) 2.231 13.875 ( -1.423 0.524 -2.291) 2.747 14.231 ( -0.395 -0.661 -0.429) 0.882 14.238 ( 0.333 -0.468 -0.762) 0.954 14.309 ( 1.065 0.091 2.172) 2.421 14.316 ( -1.411 0.368 -2.963) 3.302 16.616 ( -3.130 -4.463 -0.158) 5.454 16.665 ( 2.719 -4.385 0.465) 5.181 17.071 ( -0.846 4.659 0.253) 4.742 17.095 ( 1.466 4.842 -0.069) 5.059 27.932 ( -1.132 2.119 2.293) 3.321 27.988 ( 1.310 1.387 -3.306) 3.817 28.263 ( -2.103 -1.442 3.057) 3.981 28.324 ( 1.124 -1.815 -1.916) 2.869 28.772 ( -0.705 0.013 -0.457) 0.841 28.775 ( 0.342 -0.081 0.731) 0.811 28.813 ( 0.141 -0.277 0.767) 0.827 28.824 ( 0.154 -0.384 -0.888) 0.980 28.986 ( -0.107 0.718 0.498) 0.880 28.996 ( 0.212 0.871 -0.710) 1.144 29.079 ( -0.723 0.028 0.478) 0.868 29.096 ( 0.636 0.269 -0.206) 0.721 31.434 ( 1.430 0.960 5.985) 6.227 31.482 ( -2.009 0.775 -6.568) 6.912 31.652 ( -6.498 0.881 5.953) 8.856 31.843 ( 6.303 -1.343 -3.589) 7.376 32.141 ( -3.717 0.570 -0.824) 3.849 32.169 ( 0.437 1.377 0.250) 1.466 32.840 ( 1.272 -6.008 5.172) 8.028 32.906 ( 0.950 -3.477 -6.841) 7.732 70.142 ( -0.734 0.120 1.684) 1.841 70.176 ( 0.553 -0.243 -2.024) 2.112 70.390 ( -0.195 0.463 1.331) 1.423 70.402 ( -0.411 0.355 -0.959) 1.102 ======================= Grid point 172 (87/112) ======================= q-point: (-0.36 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.937 ( -23.575 3.539 4.695) 24.297 2.277 ( -7.978 1.296 4.411) 9.208 2.387 ( -17.032 4.494 -4.031) 18.071 2.406 ( -14.359 8.753 -6.320) 17.965 2.618 ( 3.335 -3.911 -1.010) 5.238 2.809 ( -6.252 2.512 5.321) 8.585 2.852 ( 0.973 4.263 -0.521) 4.404 2.958 ( -7.051 9.958 2.185) 12.396 3.165 ( 3.741 -0.519 0.326) 3.791 3.302 ( 8.046 1.545 -2.145) 8.469 3.501 ( 6.077 2.234 -1.738) 6.703 3.641 ( 7.375 2.849 8.045) 11.279 3.754 ( 2.236 -0.248 9.202) 9.473 3.792 ( 4.294 1.178 -4.461) 6.303 3.914 ( 8.518 3.053 -0.152) 9.050 4.008 ( 1.205 0.295 -4.492) 4.660 4.139 ( -1.331 0.192 4.707) 4.895 4.182 ( 1.461 -5.104 -2.462) 5.852 4.433 ( 7.004 0.613 -2.425) 7.437 4.462 ( 5.181 -0.182 0.074) 5.185 4.569 ( 0.408 3.562 -4.213) 5.532 4.872 ( 4.669 -0.023 -0.024) 4.669 5.008 ( -0.536 -4.564 4.863) 6.690 5.068 ( 0.472 -0.566 -0.236) 0.774 5.190 ( 0.778 -3.235 -2.554) 4.195 5.209 ( 0.754 -3.776 -3.506) 5.208 5.327 ( 2.745 -3.084 0.212) 4.134 5.341 ( 0.600 -0.490 0.812) 1.122 5.426 ( 3.082 -0.280 3.549) 4.708 5.627 ( 8.917 -0.843 -1.102) 9.025 5.697 ( 1.814 2.725 -1.955) 3.813 5.820 ( 0.119 -2.959 -5.926) 6.625 6.009 ( 0.256 0.006 1.913) 1.930 6.127 ( 4.503 3.622 2.037) 6.128 6.225 ( -5.635 2.537 0.341) 6.189 6.399 ( 0.311 3.295 -3.135) 4.559 6.637 ( -3.492 -2.880 -2.251) 5.055 6.751 ( 0.014 -3.116 2.959) 4.297 6.844 ( -1.547 5.098 -2.826) 6.031 6.909 ( 2.402 1.062 3.877) 4.683 7.011 ( -3.500 -0.255 1.019) 3.654 7.210 ( 2.607 0.154 1.290) 2.913 7.404 ( -2.917 -2.398 2.272) 4.407 7.709 ( 4.765 -7.102 2.712) 8.972 7.843 ( -5.190 -1.088 -2.367) 5.807 7.953 ( -1.619 -0.509 -0.413) 1.746 8.177 ( -2.578 1.166 -5.719) 6.381 8.247 ( -0.508 0.422 3.214) 3.281 13.360 ( -2.312 -0.586 0.118) 2.388 13.498 ( 1.737 -1.886 0.871) 2.708 13.825 ( -1.987 0.758 -1.792) 2.781 13.870 ( -1.443 0.149 3.051) 3.378 14.202 ( -1.302 -0.230 -1.268) 1.832 14.215 ( -1.674 -0.958 -2.532) 3.183 14.273 ( -0.520 0.908 -1.117) 1.531 14.355 ( 0.495 -0.577 3.106) 3.198 16.555 ( -3.259 -3.806 -0.128) 5.012 16.718 ( 2.576 -4.051 0.316) 4.811 17.038 ( -1.021 5.863 -2.192) 6.342 17.138 ( 1.906 4.269 0.968) 4.774 27.929 ( -1.109 2.785 1.868) 3.533 27.973 ( 0.378 1.196 -3.633) 3.844 28.258 ( -1.486 -1.440 3.307) 3.901 28.322 ( 0.116 -1.168 -1.428) 1.848 28.754 ( -0.674 0.152 -0.494) 0.850 28.784 ( 0.087 -0.242 0.560) 0.616 28.817 ( 0.016 -0.417 -0.848) 0.945 28.827 ( 0.458 -0.252 0.672) 0.851 28.983 ( -0.203 0.391 -0.239) 0.502 28.999 ( 0.286 0.986 -0.006) 1.027 29.069 ( -0.716 -0.297 0.360) 0.854 29.106 ( 0.600 0.592 -0.246) 0.878 31.343 ( -4.146 0.296 -7.010) 8.150 31.494 ( -2.370 -1.475 4.150) 5.001 31.630 ( -0.688 3.143 4.843) 5.814 31.880 ( 0.130 -1.695 -2.367) 2.914 32.063 ( -1.573 5.733 -2.727) 6.541 32.197 ( -3.573 -2.784 6.635) 8.034 32.769 ( 2.936 -4.912 -10.218) 11.711 33.030 ( 4.291 -6.626 7.721) 11.042 70.139 ( -0.958 0.118 1.195) 1.536 70.169 ( 0.353 0.114 -1.337) 1.387 70.381 ( -0.903 0.262 -1.125) 1.467 70.393 ( -0.650 0.529 1.031) 1.329 ======================= Grid point 173 (88/112) ======================= q-point: (-0.27 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.584 ( -21.610 7.211 9.858) 24.823 1.829 ( -28.082 9.910 -3.314) 29.963 2.073 ( -15.991 6.995 4.439) 18.010 2.342 ( -0.311 3.467 -10.569) 11.128 2.659 ( -17.228 4.792 18.275) 25.569 2.732 ( 3.029 -1.878 3.742) 5.167 2.833 ( 1.852 2.011 -1.711) 3.225 2.857 ( -4.039 2.257 7.801) 9.070 3.275 ( 3.199 -1.905 2.953) 4.751 3.452 ( 0.038 -3.918 -6.486) 7.578 3.544 ( 8.359 3.469 3.687) 9.773 3.715 ( 1.694 3.045 -0.175) 3.489 3.819 ( 0.463 -1.861 -4.413) 4.812 3.889 ( 2.641 -1.136 -1.581) 3.281 3.987 ( 5.819 1.953 2.739) 6.722 4.076 ( -2.865 2.999 1.972) 4.593 4.193 ( 7.536 5.110 5.249) 10.510 4.272 ( 12.245 -2.434 -5.975) 13.841 4.476 ( 4.359 2.103 -7.187) 8.665 4.547 ( 5.727 -0.904 -2.241) 6.216 4.684 ( 9.830 -0.133 1.719) 9.980 4.943 ( 4.948 0.333 -3.776) 6.234 5.014 ( 0.955 -3.650 -1.740) 4.155 5.110 ( -1.372 -2.077 8.046) 8.422 5.201 ( 1.448 0.540 -2.235) 2.717 5.238 ( 8.422 -2.730 -5.951) 10.668 5.336 ( 0.861 0.867 -3.364) 3.579 5.374 ( 1.127 -4.201 1.053) 4.475 5.479 ( 1.032 0.899 1.665) 2.155 5.654 ( -0.901 -1.468 -3.514) 3.913 5.735 ( 0.090 -1.434 -0.550) 1.539 5.886 ( 6.486 -1.796 -0.360) 6.740 5.983 ( -0.129 1.435 -4.190) 4.431 6.154 ( -2.531 2.550 3.973) 5.356 6.192 ( 0.494 2.613 -0.240) 2.670 6.376 ( -1.793 3.281 0.881) 3.841 6.550 ( -3.950 2.293 -2.474) 5.194 6.714 ( -3.715 -0.036 -2.362) 4.402 6.824 ( -0.663 -2.033 3.059) 3.732 6.944 ( -0.660 -1.732 2.934) 3.471 7.039 ( 3.126 0.571 2.518) 4.055 7.258 ( 1.090 1.671 1.283) 2.372 7.421 ( 3.099 -2.893 1.190) 4.403 7.642 ( -5.279 -2.556 -10.984) 12.452 7.853 ( -2.132 -2.389 7.095) 7.784 7.924 ( 1.072 -2.541 0.494) 2.801 8.095 ( -1.184 -0.789 -1.291) 1.921 8.261 ( 0.023 -0.499 2.317) 2.370 13.333 ( -1.027 0.126 0.811) 1.315 13.514 ( 0.374 -1.499 -2.231) 2.714 13.774 ( -1.849 0.472 -1.809) 2.629 13.857 ( -3.110 -0.544 2.762) 4.195 14.170 ( -1.087 0.011 -1.031) 1.498 14.178 ( -0.634 -1.142 1.092) 1.702 14.256 ( -0.561 0.590 -0.935) 1.239 14.377 ( -0.877 -0.997 2.847) 3.142 16.499 ( -2.837 -2.773 0.049) 3.968 16.757 ( 1.951 -2.087 -1.302) 3.140 17.003 ( -0.567 6.877 -2.285) 7.269 17.172 ( 1.205 3.783 0.264) 3.979 27.928 ( -0.226 3.402 0.546) 3.453 27.944 ( -0.271 1.758 -2.833) 3.345 28.260 ( -1.348 -1.555 2.172) 2.992 28.304 ( -1.059 -0.123 -0.426) 1.148 28.743 ( -0.096 0.207 -0.379) 0.442 28.786 ( -0.232 -0.181 -0.019) 0.295 28.808 ( -0.211 -0.444 -0.728) 0.878 28.840 ( 0.277 -0.346 0.494) 0.664 28.978 ( -0.033 0.257 -0.242) 0.354 29.003 ( 0.113 0.704 0.049) 0.715 29.062 ( -0.509 -0.378 0.629) 0.893 29.113 ( 0.525 0.748 -0.393) 0.995 31.221 ( -3.391 0.503 -4.475) 5.637 31.459 ( -3.827 -4.161 2.685) 6.259 31.664 ( -0.370 3.995 2.090) 4.524 31.840 ( -2.585 0.855 1.552) 3.134 32.018 ( -2.582 5.878 -1.731) 6.649 32.119 ( -8.081 -3.394 2.375) 9.081 32.836 ( 11.835 -6.431 -7.263) 15.302 33.164 ( 2.480 -10.283 9.642) 14.313 70.128 ( -0.744 0.126 0.080) 0.759 70.168 ( 0.125 0.930 -0.055) 0.940 70.352 ( -1.143 0.114 -1.301) 1.735 70.384 ( -1.144 0.688 0.377) 1.387 ======================= Grid point 174 (89/112) ======================= q-point: (-0.18 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.329 ( -18.970 10.165 13.952) 25.648 1.389 ( -21.907 11.936 12.926) 28.098 1.849 ( -12.089 6.312 3.913) 14.187 2.168 ( -3.070 2.359 -19.538) 19.918 2.497 ( -23.545 10.637 35.349) 43.784 2.731 ( -0.522 -1.613 -1.468) 2.242 2.935 ( 9.487 -3.153 0.649) 10.018 3.062 ( 9.192 0.197 14.383) 17.071 3.266 ( -6.450 0.476 4.216) 7.720 3.396 ( -1.102 -7.179 -0.289) 7.269 3.608 ( -4.395 1.915 -0.447) 4.814 3.675 ( -4.110 0.092 -3.588) 5.457 3.776 ( 3.639 -2.207 -5.354) 6.839 3.935 ( -5.116 6.072 0.591) 7.962 4.084 ( 15.326 -0.421 -3.464) 15.718 4.133 ( 5.796 4.895 -6.844) 10.218 4.311 ( 2.938 3.955 3.546) 6.070 4.483 ( 7.001 2.493 -9.830) 12.323 4.485 ( 10.524 -1.514 -6.742) 12.589 4.641 ( 7.097 -0.382 -3.604) 7.969 4.846 ( 7.286 -2.934 -0.446) 7.868 5.010 ( 5.975 -1.078 -3.055) 6.797 5.056 ( 2.429 -1.302 1.192) 3.003 5.132 ( 0.072 -1.497 1.363) 2.026 5.223 ( 3.176 2.368 -1.867) 4.380 5.289 ( 0.115 -1.419 -3.676) 3.942 5.335 ( 2.418 -0.444 -1.067) 2.680 5.444 ( 6.807 -3.718 -0.847) 7.802 5.513 ( 1.166 0.016 0.539) 1.285 5.574 ( -3.151 0.486 -1.156) 3.392 5.710 ( -7.158 2.094 1.640) 7.636 5.876 ( 3.311 -3.941 -2.819) 5.868 6.033 ( -1.318 4.155 3.696) 5.715 6.102 ( -5.051 2.907 -4.746) 7.516 6.215 ( 2.234 -2.232 3.933) 5.044 6.341 ( -3.287 -0.108 1.013) 3.442 6.434 ( -5.724 8.464 -3.539) 10.813 6.622 ( -4.660 -5.205 -3.281) 7.718 6.839 ( -1.581 -3.409 5.350) 6.538 6.975 ( 0.402 -0.705 4.018) 4.099 7.095 ( 1.651 0.280 -0.858) 1.881 7.263 ( -1.401 3.547 -0.244) 3.821 7.423 ( -2.092 0.149 -7.974) 8.246 7.550 ( 4.057 -1.795 -2.465) 5.075 7.810 ( -2.659 2.350 2.074) 4.110 7.913 ( -3.093 -0.512 0.458) 3.168 8.184 ( 3.280 -7.804 7.395) 11.240 8.350 ( 9.849 -4.677 3.926) 11.588 13.335 ( 0.114 0.835 1.288) 1.540 13.473 ( -1.070 0.124 -4.899) 5.016 13.733 ( -0.683 -0.372 -2.064) 2.206 13.800 ( -4.764 -0.919 1.059) 4.966 14.148 ( -0.661 -0.181 -0.373) 0.780 14.211 ( 0.090 -2.039 2.226) 3.020 14.251 ( 1.428 -1.128 2.669) 3.230 14.376 ( -1.437 -1.468 2.386) 3.148 16.459 ( -1.282 -0.612 -0.046) 1.421 16.749 ( -0.387 3.905 -4.788) 6.191 16.988 ( 0.366 5.318 -0.137) 5.332 17.183 ( 0.068 3.035 -0.671) 3.109 27.910 ( 0.390 1.210 -3.532) 3.754 27.940 ( 0.411 5.815 0.274) 5.836 28.237 ( -1.877 -1.469 -0.223) 2.394 28.282 ( -1.876 0.359 1.026) 2.168 28.745 ( 0.704 0.156 -0.304) 0.783 28.777 ( -0.445 0.028 -0.264) 0.518 28.797 ( -0.328 -0.420 -0.437) 0.689 28.843 ( -0.400 -0.452 0.236) 0.648 28.979 ( 0.212 0.190 0.013) 0.285 29.004 ( 0.004 0.362 -0.014) 0.363 29.064 ( -0.006 -0.228 1.191) 1.213 29.118 ( 0.444 0.729 -0.528) 1.003 31.160 ( -1.035 0.357 0.273) 1.128 31.413 ( -3.580 -5.303 2.457) 6.853 31.635 ( -3.265 1.651 0.154) 3.662 31.833 ( -0.091 4.875 0.290) 4.885 31.892 ( -10.364 1.568 3.110) 10.934 32.034 ( -1.216 1.420 -3.081) 3.603 33.020 ( 13.057 -10.640 -4.021) 17.316 33.296 ( 1.788 -15.288 12.019) 19.529 70.117 ( -0.056 0.592 -0.693) 0.913 70.172 ( 0.088 2.139 0.536) 2.207 70.319 ( -1.204 -0.151 -1.443) 1.885 70.356 ( -1.898 0.958 -0.430) 2.169 ======================= Grid point 175 (90/112) ======================= q-point: (-0.09 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.201 ( -10.533 9.880 23.543) 27.619 1.250 ( -12.859 9.809 21.498) 26.902 1.710 ( -4.217 5.656 -2.104) 7.362 1.947 ( -0.787 1.945 -21.260) 21.363 2.458 ( -17.549 13.877 43.683) 49.079 2.791 ( 5.723 -0.025 6.337) 8.539 3.068 ( 0.517 -6.338 2.918) 6.997 3.179 ( -0.511 -2.420 -1.443) 2.863 3.315 ( -0.463 -2.960 11.735) 12.112 3.404 ( -1.571 0.211 4.776) 5.032 3.490 ( -5.158 -0.506 -1.399) 5.368 3.634 ( 6.590 -0.865 -3.077) 7.324 3.767 ( 0.881 4.038 -9.660) 10.507 3.883 ( 3.560 5.801 -0.750) 6.848 4.096 ( 2.139 5.297 -19.185) 20.018 4.305 ( 9.808 0.400 -8.576) 13.035 4.367 ( 1.390 -2.257 -7.968) 8.398 4.413 ( 2.446 1.486 0.214) 2.870 4.666 ( 8.291 -1.851 1.451) 8.618 4.746 ( 6.394 1.803 -1.757) 6.871 4.924 ( -2.287 -5.659 -0.537) 6.127 4.967 ( -7.593 -3.566 -2.787) 8.839 5.128 ( 6.023 2.282 0.964) 6.512 5.155 ( 0.278 -0.460 1.014) 1.148 5.246 ( 0.826 -0.485 -2.857) 3.013 5.299 ( 3.449 2.531 -2.241) 4.830 5.398 ( 4.909 2.279 -3.867) 6.651 5.473 ( -1.045 2.460 -0.893) 2.818 5.489 ( -4.717 0.643 0.021) 4.761 5.600 ( 6.355 -2.137 -0.344) 6.713 5.638 ( -0.643 -0.888 2.219) 2.475 5.837 ( -7.199 -0.270 -4.248) 8.363 5.975 ( -6.853 8.849 4.247) 11.971 6.011 ( -0.314 -0.691 -0.216) 0.789 6.275 ( -2.013 -5.256 -0.275) 5.635 6.283 ( -0.418 -5.355 3.546) 6.437 6.344 ( -0.863 7.651 -0.862) 7.747 6.492 ( -3.914 -2.728 -3.941) 6.188 6.865 ( -1.264 -2.231 6.542) 7.026 7.014 ( 0.317 -0.539 2.476) 2.554 7.097 ( 0.017 3.528 -0.534) 3.568 7.192 ( -4.179 6.136 -1.440) 7.563 7.390 ( 2.235 -0.775 -2.992) 3.814 7.521 ( -2.921 0.372 -5.270) 6.037 7.858 ( 3.346 1.705 2.870) 4.726 7.883 ( -0.671 0.014 1.128) 1.313 8.295 ( 2.945 -5.442 9.054) 10.967 8.605 ( 11.471 -12.626 -0.586) 17.069 13.353 ( 0.108 1.540 1.593) 2.218 13.417 ( -0.028 1.017 -3.997) 4.125 13.715 ( 0.738 -1.003 -2.481) 2.776 13.720 ( -4.749 -0.885 1.390) 5.027 14.140 ( 0.016 -0.130 -0.021) 0.133 14.192 ( -1.389 -0.286 -0.860) 1.659 14.338 ( 1.926 -5.710 4.184) 7.336 14.379 ( -0.041 -3.448 2.003) 3.987 16.466 ( 2.406 2.839 -0.263) 3.731 16.663 ( -3.545 9.609 -5.606) 11.676 17.014 ( 1.406 3.016 2.033) 3.900 17.163 ( -0.953 2.043 -1.719) 2.835 27.897 ( 1.231 1.784 -2.764) 3.512 27.939 ( -0.203 6.584 -1.976) 6.877 28.206 ( -0.949 -1.475 0.003) 1.754 28.248 ( -2.483 0.184 0.571) 2.555 28.760 ( 1.184 0.019 -0.440) 1.263 28.769 ( -0.473 0.038 0.223) 0.524 28.794 ( 0.203 -0.199 0.203) 0.349 28.831 ( -1.027 -0.419 0.134) 1.117 28.985 ( 0.285 0.111 0.285) 0.418 29.004 ( 0.073 0.357 -0.189) 0.411 29.081 ( 0.458 -0.141 1.328) 1.412 29.120 ( 0.284 0.596 -0.633) 0.914 31.195 ( 2.163 -0.792 4.901) 5.415 31.379 ( -1.734 -5.665 1.519) 6.116 31.579 ( -2.022 1.301 -0.527) 2.462 31.722 ( -7.316 1.653 -1.166) 7.590 31.848 ( -1.571 6.080 2.683) 6.828 31.985 ( -0.589 2.141 -4.638) 5.142 33.232 ( 12.131 -15.395 -0.081) 19.601 33.407 ( -1.712 -20.303 10.568) 22.952 70.120 ( 1.313 1.538 -1.074) 2.289 70.172 ( -0.598 3.932 -0.379) 3.996 70.283 ( -1.680 -0.430 -0.216) 1.748 70.317 ( -1.360 0.662 -0.765) 1.695 ======================= Grid point 176 (91/112) ======================= q-point: ( 0.00 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.486 ( -3.150 11.279 15.075) 19.090 1.519 ( -0.786 12.123 15.977) 20.071 1.820 ( 3.290 10.099 -9.744) 14.413 1.885 ( 2.817 6.361 -13.139) 14.867 2.828 ( -0.682 -2.203 13.463) 13.659 2.930 ( -2.020 -3.139 2.277) 4.372 3.057 ( 1.464 0.779 11.670) 11.787 3.092 ( -3.864 0.736 17.874) 18.302 3.222 ( 3.538 -2.871 1.716) 4.868 3.308 ( -1.277 -10.178 -4.274) 11.113 3.439 ( -2.133 4.886 -3.310) 6.275 3.690 ( -3.724 4.833 12.040) 13.498 3.911 ( 7.225 4.192 -12.463) 15.004 4.009 ( 0.062 7.386 -11.478) 13.649 4.245 ( -1.591 -0.300 4.282) 4.578 4.276 ( 2.843 4.365 -1.942) 5.559 4.358 ( -8.625 6.068 -7.396) 12.881 4.414 ( 8.585 7.652 -14.397) 18.426 4.698 ( -7.047 -0.444 5.336) 8.851 4.785 ( 3.901 -1.513 3.310) 5.335 4.851 ( 4.922 -0.998 -5.342) 7.332 4.859 ( -1.692 -1.490 -4.391) 4.936 5.040 ( 1.243 -8.763 2.964) 9.333 5.120 ( -2.503 -4.105 -2.518) 5.428 5.323 ( 1.728 -1.494 -0.477) 2.334 5.373 ( -0.620 -1.555 -2.936) 3.379 5.406 ( -5.312 6.019 2.527) 8.416 5.460 ( 3.894 4.864 -0.850) 6.288 5.554 ( -0.064 -2.855 -0.956) 3.011 5.583 ( 1.834 0.985 -2.866) 3.542 5.694 ( -8.873 2.620 3.255) 9.807 5.756 ( 4.189 2.597 -2.676) 5.608 6.029 ( -1.361 0.225 3.362) 3.634 6.065 ( 0.640 -0.867 0.119) 1.085 6.098 ( 0.694 -8.076 0.307) 8.112 6.127 ( 0.002 -4.468 -1.139) 4.611 6.456 ( 2.454 3.622 1.272) 4.556 6.507 ( -1.333 7.224 -3.086) 7.968 6.877 ( 1.595 -2.469 6.401) 7.043 6.969 ( -1.723 -2.727 -2.044) 3.819 7.207 ( 1.772 4.796 1.955) 5.474 7.242 ( -2.059 5.323 -1.389) 5.874 7.411 ( 1.177 1.105 1.309) 2.079 7.458 ( -2.026 -0.079 -2.792) 3.451 7.887 ( -1.429 -0.111 4.423) 4.650 7.961 ( 2.196 2.976 -1.916) 4.165 8.248 ( -0.045 -10.670 9.348) 14.186 8.406 ( 0.675 -11.879 -4.512) 12.725 13.388 ( -1.510 1.867 1.130) 2.654 13.429 ( 1.230 0.855 -2.507) 2.921 13.648 ( -2.230 -0.586 1.793) 2.921 13.690 ( 1.991 -1.531 -2.136) 3.298 14.151 ( -0.591 0.219 0.765) 0.991 14.164 ( 0.705 0.405 -0.471) 0.940 14.277 ( 0.990 -4.210 1.799) 4.684 14.297 ( -0.558 -4.045 -0.019) 4.084 16.614 ( -0.412 4.706 2.928) 5.558 16.703 ( 0.288 3.406 -5.660) 6.612 17.127 ( 1.413 3.221 0.392) 3.539 17.161 ( -0.755 1.786 -2.341) 3.039 27.972 ( 1.307 3.886 -0.004) 4.100 28.014 ( -1.032 4.970 -4.231) 6.608 28.175 ( -0.090 -1.839 1.492) 2.370 28.202 ( -0.340 -1.245 -1.134) 1.718 28.762 ( -0.904 0.194 0.626) 1.117 28.775 ( 0.846 0.114 -0.649) 1.072 28.799 ( -0.402 -0.586 0.329) 0.783 28.805 ( 0.433 -0.476 -0.164) 0.664 28.996 ( -0.062 0.346 0.701) 0.784 29.011 ( 0.304 0.245 -0.685) 0.788 29.100 ( -0.023 0.319 1.295) 1.334 29.123 ( 0.016 0.098 -0.913) 0.919 31.230 ( 0.928 -2.178 3.463) 4.195 31.278 ( 1.513 -4.179 -0.846) 4.524 31.627 ( 2.655 2.139 1.861) 3.884 31.660 ( -2.217 1.885 -1.002) 3.077 31.933 ( -8.127 5.864 2.564) 10.344 32.020 ( 4.576 3.897 -5.004) 7.821 32.932 ( -5.992 -17.837 12.992) 22.866 33.102 ( 6.377 -16.791 -4.263) 18.460 70.188 ( 0.502 2.273 0.816) 2.466 70.223 ( -0.251 2.978 -2.649) 3.993 70.263 ( -0.107 -0.463 1.572) 1.642 70.295 ( -0.057 -0.267 -1.489) 1.514 ======================= Grid point 177 (92/112) ======================= q-point: ( 0.09 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.620 ( 4.075 9.094 13.338) 16.649 1.684 ( 7.070 8.282 8.386) 13.744 1.820 ( 5.470 9.574 -10.989) 15.568 1.872 ( 9.257 12.665 -12.487) 20.050 2.819 ( -6.808 -6.078 6.896) 11.439 2.897 ( -3.007 -3.321 -5.143) 6.821 3.168 ( 4.413 -3.151 7.077) 8.916 3.227 ( 2.362 -0.115 8.192) 8.527 3.269 ( 1.534 -9.652 -8.558) 12.990 3.285 ( 4.978 -1.541 -0.999) 5.306 3.528 ( 1.400 8.978 17.974) 20.140 3.690 ( 2.853 8.159 -1.879) 8.845 3.863 ( 0.662 7.283 -10.042) 12.422 4.001 ( 3.305 1.722 -4.202) 5.617 4.052 ( -10.937 6.286 -6.954) 14.404 4.171 ( -7.759 4.336 3.674) 9.618 4.304 ( -2.835 3.192 2.345) 4.871 4.395 ( -5.882 1.398 -0.892) 6.111 4.703 ( -4.087 2.538 -5.054) 6.978 4.771 ( -1.210 1.854 0.042) 2.215 4.832 ( 4.117 -1.461 1.674) 4.678 4.931 ( 5.463 -1.733 -0.959) 5.811 5.067 ( -0.297 -5.686 -1.854) 5.988 5.109 ( 1.471 -7.611 0.619) 7.777 5.262 ( -8.465 2.543 -2.540) 9.196 5.315 ( -7.631 1.125 3.571) 8.500 5.336 ( 0.099 -0.818 1.078) 1.357 5.476 ( -9.895 2.951 2.814) 10.703 5.540 ( -1.762 -0.056 -0.969) 2.012 5.548 ( 2.317 2.422 0.964) 3.488 5.641 ( 5.200 -1.982 -2.040) 5.927 5.784 ( -0.278 0.576 1.951) 2.053 5.981 ( -3.269 -2.655 0.829) 4.292 6.080 ( 0.063 -3.389 -1.199) 3.596 6.137 ( 2.824 -8.070 1.614) 8.701 6.217 ( 7.574 -1.991 -0.450) 7.844 6.484 ( 1.858 6.228 -3.477) 7.371 6.523 ( 3.117 7.927 1.616) 8.670 6.915 ( -0.199 -2.830 -1.845) 3.384 6.970 ( 1.726 -2.372 3.086) 4.258 7.192 ( -2.025 4.974 -1.442) 5.561 7.275 ( 3.421 4.289 1.874) 5.797 7.384 ( -2.943 1.335 -1.232) 3.458 7.453 ( 0.504 -0.088 2.230) 2.287 7.876 ( -3.497 1.213 3.225) 4.910 7.974 ( 2.602 2.250 -3.731) 5.075 8.269 ( -5.086 -11.231 6.325) 13.857 8.317 ( -3.864 -9.246 -6.938) 12.188 13.370 ( -1.665 1.590 1.655) 2.836 13.423 ( -0.033 0.616 -1.149) 1.304 13.651 ( 0.829 -0.029 1.462) 1.681 13.725 ( 3.512 -1.456 -1.364) 4.039 14.142 ( -0.156 0.336 0.041) 0.373 14.192 ( 2.008 0.566 -0.214) 2.097 14.281 ( -0.669 -4.578 -1.196) 4.779 14.313 ( 1.659 -3.673 0.742) 4.098 16.550 ( -5.040 4.901 0.322) 7.037 16.709 ( 0.820 1.200 -0.459) 1.524 17.126 ( 0.103 3.826 -1.668) 4.175 17.183 ( 2.682 2.216 0.370) 3.499 27.940 ( -1.928 4.257 -0.915) 4.762 28.028 ( 2.086 4.424 -0.408) 4.908 28.163 ( -0.456 -1.828 0.781) 2.040 28.238 ( 2.814 -1.332 0.242) 3.123 28.750 ( -0.890 0.257 0.626) 1.118 28.776 ( -0.346 0.271 -0.088) 0.449 28.792 ( 0.065 -0.672 -0.382) 0.776 28.821 ( 0.846 -0.703 -0.084) 1.103 28.997 ( -0.284 0.457 0.261) 0.598 29.009 ( 0.224 0.233 -0.644) 0.721 29.103 ( -0.623 0.332 0.454) 0.839 29.115 ( -0.086 0.119 -0.350) 0.380 31.253 ( 0.367 -1.923 -1.604) 2.531 31.311 ( 3.603 -3.945 -2.205) 5.780 31.637 ( 1.605 3.087 -1.797) 3.916 31.721 ( 4.877 1.984 2.575) 5.862 31.845 ( -4.845 2.962 5.968) 8.238 32.089 ( 5.547 4.344 -1.522) 7.208 32.841 ( -10.693 -14.525 4.820) 18.670 33.181 ( 4.668 -17.540 -4.448) 18.688 70.156 ( -2.198 2.597 -0.235) 3.411 70.243 ( 1.157 1.970 -1.258) 2.608 70.259 ( 0.073 -0.341 1.131) 1.184 70.317 ( 2.294 -0.078 -0.015) 2.295 ======================= Grid point 178 (93/112) ======================= q-point: ( 0.18 0.29 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.819 ( 8.927 6.024 0.005) 10.770 1.847 ( 13.156 4.236 -9.714) 16.893 1.946 ( 9.402 12.372 6.906) 17.004 2.001 ( 13.534 15.867 -1.300) 20.895 2.745 ( -6.423 -4.182 4.476) 8.875 2.810 ( 1.216 -1.043 -7.813) 7.976 3.163 ( -1.226 -1.954 -8.389) 8.700 3.276 ( 1.164 -0.980 -7.679) 7.828 3.343 ( 5.687 -6.146 -4.499) 9.505 3.385 ( 5.998 -8.040 7.121) 12.302 3.617 ( -0.799 4.589 -2.769) 5.419 3.694 ( 0.998 4.160 -7.073) 8.267 3.834 ( -4.520 4.960 7.759) 10.259 3.856 ( -1.941 14.186 -2.046) 14.463 4.074 ( -4.228 3.914 3.495) 6.739 4.155 ( 3.213 1.896 14.030) 14.517 4.229 ( -5.574 3.034 3.099) 7.062 4.289 ( -5.782 2.157 1.739) 6.412 4.543 ( -6.335 5.594 -3.368) 9.098 4.676 ( -7.185 2.531 -0.965) 7.678 4.901 ( 1.193 1.609 -5.695) 6.037 4.942 ( -6.287 -2.311 1.073) 6.784 5.024 ( -2.407 -4.152 1.129) 4.930 5.096 ( -4.616 -3.962 -0.213) 6.087 5.160 ( 3.323 -4.872 -4.427) 7.374 5.224 ( -5.134 -0.655 3.598) 6.303 5.269 ( -7.542 -0.269 0.900) 7.600 5.361 ( -4.922 -2.144 3.165) 6.232 5.513 ( -1.793 1.384 0.078) 2.266 5.570 ( -1.624 1.072 2.728) 3.351 5.711 ( 2.422 -5.844 -3.236) 7.106 5.806 ( 1.135 1.017 2.010) 2.522 6.006 ( 1.792 -1.282 4.440) 4.957 6.054 ( -0.468 -2.155 0.410) 2.243 6.198 ( 3.031 -6.577 -0.745) 7.280 6.354 ( 6.626 -5.852 2.690) 9.240 6.507 ( 3.560 7.214 -2.357) 8.383 6.588 ( 1.750 10.907 2.624) 11.354 6.902 ( 0.685 -2.366 -3.070) 3.936 7.005 ( 0.493 -1.015 0.585) 1.271 7.129 ( -3.521 2.874 -1.675) 4.844 7.324 ( -0.217 1.486 -0.595) 1.616 7.358 ( 0.184 2.647 2.876) 3.913 7.457 ( -1.902 -2.000 1.679) 3.231 7.844 ( -1.768 2.026 2.667) 3.788 8.005 ( 4.736 1.989 -4.482) 6.818 8.142 ( -8.140 -9.554 -4.146) 13.219 8.240 ( -0.749 -6.742 -1.306) 6.908 13.356 ( -1.242 0.949 0.899) 1.803 13.418 ( -0.439 0.267 1.321) 1.417 13.696 ( 2.806 0.668 0.983) 3.047 13.791 ( 4.395 -1.397 -0.461) 4.634 14.147 ( 0.713 0.259 -0.257) 0.802 14.223 ( 1.524 0.029 -1.131) 1.898 14.252 ( -0.650 -3.017 -1.628) 3.489 14.352 ( 2.247 -3.064 -0.187) 3.804 16.485 ( -2.095 2.951 0.088) 3.621 16.698 ( -2.129 -2.018 1.084) 3.127 17.120 ( 0.249 5.964 -0.645) 6.004 17.226 ( 1.347 2.421 0.623) 2.840 27.916 ( -0.430 3.535 0.345) 3.578 28.045 ( 0.300 3.578 -0.533) 3.630 28.186 ( 1.363 -1.202 1.565) 2.398 28.284 ( 1.842 -1.137 0.159) 2.171 28.742 ( -0.492 0.378 0.498) 0.796 28.773 ( -0.048 0.175 0.508) 0.539 28.789 ( 0.030 -0.525 -0.617) 0.810 28.831 ( 0.427 -0.936 -0.097) 1.033 28.992 ( -0.142 0.631 -0.248) 0.693 29.010 ( 0.283 0.145 -0.303) 0.439 29.089 ( -0.540 0.409 -0.610) 0.911 29.113 ( -0.407 0.137 0.629) 0.761 31.227 ( 0.381 0.492 -4.192) 4.238 31.364 ( 4.048 -4.015 -2.073) 6.067 31.686 ( 4.560 2.749 -1.291) 5.479 31.804 ( -1.768 4.320 8.101) 9.350 31.891 ( 6.275 -2.277 2.072) 6.989 32.172 ( 4.528 5.593 -1.252) 7.304 32.674 ( -10.082 -11.805 1.856) 15.635 33.177 ( 0.420 -15.479 -6.442) 16.771 70.127 ( -0.980 1.894 0.287) 2.152 70.224 ( -0.655 -0.351 -1.383) 1.570 70.297 ( 1.734 1.426 1.235) 2.563 70.360 ( 2.143 0.097 0.330) 2.171 ======================= Grid point 179 (94/112) ======================= q-point: ( 0.27 0.29 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.972 ( 13.185 9.025 -6.443) 17.228 2.076 ( 16.476 4.760 -2.998) 17.410 2.160 ( 10.330 8.540 4.575) 14.163 2.317 ( 16.361 12.370 3.657) 20.834 2.664 ( -4.498 -2.700 -1.051) 5.350 2.830 ( 6.728 0.923 -4.247) 8.010 3.027 ( -8.081 -4.102 -4.035) 9.920 3.147 ( -1.986 -0.189 -11.731) 11.900 3.377 ( 3.464 -2.013 -4.518) 6.038 3.502 ( -3.499 6.629 -3.450) 8.252 3.609 ( 4.877 -8.223 4.265) 10.469 3.683 ( 0.002 0.913 -0.250) 0.947 3.736 ( -1.712 11.717 -2.659) 12.136 3.832 ( -8.002 5.497 4.009) 10.503 4.040 ( -6.620 2.007 5.315) 8.723 4.103 ( -3.375 -0.137 3.713) 5.019 4.193 ( -4.477 3.601 -0.495) 5.767 4.399 ( 5.299 1.641 -0.087) 5.548 4.463 ( -1.236 7.938 3.002) 8.576 4.522 ( -7.253 3.426 0.243) 8.025 4.776 ( -7.355 0.143 -4.927) 8.854 4.843 ( -3.173 -1.845 -1.335) 3.906 5.015 ( -1.936 2.287 -0.244) 3.006 5.044 ( -0.573 -5.118 4.166) 6.624 5.082 ( -5.561 -6.655 -0.837) 8.713 5.191 ( -3.410 -2.932 1.672) 4.798 5.232 ( 0.684 -3.716 -1.010) 3.911 5.291 ( -3.445 -2.541 -0.177) 4.285 5.480 ( -2.051 0.121 0.442) 2.102 5.530 ( -6.056 -2.387 5.699) 8.652 5.709 ( 1.520 -1.408 -1.871) 2.792 5.855 ( -0.988 2.337 3.596) 4.401 5.945 ( -3.329 -3.638 -2.086) 5.354 6.143 ( 1.018 1.609 6.303) 6.585 6.225 ( 0.898 -4.003 -1.489) 4.364 6.491 ( 4.276 -7.213 3.076) 8.932 6.567 ( 4.212 6.451 -0.919) 7.759 6.636 ( 0.539 9.604 4.810) 10.754 6.885 ( 1.028 -0.742 -3.317) 3.551 6.981 ( -1.947 1.735 -3.112) 4.060 7.077 ( -0.926 0.074 0.313) 0.980 7.298 ( -3.978 0.454 0.778) 4.079 7.360 ( -0.002 -1.178 1.516) 1.920 7.458 ( 0.273 -2.032 1.796) 2.726 7.859 ( 0.442 -0.958 1.458) 1.799 7.955 ( -3.358 -3.641 -6.077) 7.840 8.099 ( 5.989 0.403 -2.742) 6.599 8.240 ( 1.712 -4.179 -1.173) 4.666 13.344 ( -0.405 0.346 0.203) 0.570 13.427 ( -0.656 -1.076 2.560) 2.854 13.762 ( 3.342 1.372 0.876) 3.717 13.866 ( 3.986 -1.379 -0.417) 4.238 14.161 ( 1.000 0.129 -0.122) 1.015 14.201 ( -0.412 -1.761 -2.962) 3.471 14.264 ( 1.513 0.870 -0.026) 1.746 14.383 ( 1.670 -2.461 -1.192) 3.205 16.473 ( 0.335 0.455 0.157) 0.586 16.661 ( -2.743 -4.056 0.967) 4.991 17.121 ( -0.216 6.640 0.699) 6.680 17.239 ( -0.370 2.599 0.410) 2.657 27.925 ( 0.483 3.025 1.222) 3.298 28.041 ( 0.298 3.126 -1.044) 3.309 28.221 ( 0.835 -1.437 1.331) 2.129 28.301 ( 0.135 -1.382 -0.415) 1.450 28.742 ( 0.043 0.471 0.376) 0.604 28.782 ( 0.203 -0.292 0.762) 0.841 28.785 ( 0.101 -0.169 -0.297) 0.356 28.835 ( 0.068 -0.933 -0.176) 0.952 28.990 ( 0.161 0.860 -0.181) 0.893 29.014 ( 0.419 0.256 -0.176) 0.521 29.077 ( -0.228 0.402 -0.554) 0.721 29.110 ( -0.587 0.072 0.715) 0.928 31.220 ( 1.884 2.149 -1.515) 3.234 31.422 ( 4.364 -4.020 -1.896) 6.229 31.748 ( 2.514 2.960 -0.951) 3.999 31.828 ( -2.640 3.565 7.242) 8.493 32.045 ( 7.504 -3.419 2.128) 8.517 32.230 ( 4.753 5.641 -4.201) 8.489 32.528 ( -7.906 -8.531 2.719) 11.945 33.105 ( -1.335 -12.892 -7.367) 14.908 70.122 ( -0.136 1.130 0.703) 1.338 70.202 ( -0.383 -0.568 -1.392) 1.552 70.336 ( 1.459 1.301 1.139) 2.263 70.395 ( 1.481 0.088 0.116) 1.488 ======================= Grid point 180 (95/112) ======================= q-point: ( 0.36 0.29 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.179 ( 13.947 7.855 -3.798) 16.451 2.340 ( 6.033 3.571 1.381) 7.145 2.405 ( 18.285 4.833 2.674) 19.101 2.531 ( -0.827 -0.714 -5.400) 5.509 2.635 ( 11.124 8.102 -0.087) 13.762 2.862 ( -4.057 1.823 -0.186) 4.452 2.966 ( 4.725 -1.794 3.049) 5.902 3.065 ( -0.221 0.452 -4.903) 4.929 3.304 ( -8.568 5.774 -0.936) 10.374 3.372 ( -3.018 10.304 -4.088) 11.489 3.594 ( -8.293 1.073 5.285) 9.892 3.714 ( 3.912 1.161 -2.916) 5.016 3.746 ( -4.196 4.570 1.137) 6.308 3.783 ( 3.100 -0.111 0.638) 3.167 3.982 ( 0.614 -0.884 1.896) 2.180 4.044 ( -6.968 2.324 -4.255) 8.488 4.108 ( -3.277 0.329 -1.742) 3.726 4.341 ( -2.683 1.613 -5.305) 6.159 4.365 ( -5.415 1.898 0.568) 5.766 4.580 ( -2.144 2.142 -4.763) 5.646 4.632 ( 1.989 2.527 -2.258) 3.929 4.798 ( -2.035 -4.691 3.106) 5.983 4.973 ( -5.774 0.067 3.530) 6.768 4.983 ( -0.922 1.118 -3.550) 3.835 5.109 ( 0.735 -4.820 3.596) 6.058 5.138 ( -1.186 -5.038 -2.812) 5.890 5.215 ( -1.494 -4.595 0.645) 4.874 5.249 ( -2.011 -3.239 1.450) 4.079 5.450 ( -1.439 -1.004 0.468) 1.816 5.484 ( -4.547 -3.159 5.682) 7.933 5.717 ( -1.415 0.819 0.465) 1.700 5.783 ( -1.952 1.177 -2.031) 3.053 5.961 ( -0.000 -0.338 6.133) 6.142 6.172 ( -2.771 2.815 3.338) 5.172 6.217 ( 0.184 -2.073 0.291) 2.102 6.535 ( 0.890 -1.759 -2.060) 2.851 6.627 ( 2.484 5.170 -0.492) 5.757 6.675 ( -1.073 0.563 3.746) 3.937 6.890 ( 0.084 4.353 0.618) 4.397 6.954 ( 2.179 0.006 -0.652) 2.274 7.061 ( -0.579 1.694 -1.142) 2.123 7.224 ( -3.946 -1.301 0.248) 4.163 7.390 ( 2.818 -2.734 -1.638) 4.255 7.473 ( -1.864 -6.375 4.143) 7.828 7.852 ( 0.816 -1.516 -2.030) 2.662 7.924 ( 1.267 -1.443 -0.763) 2.066 8.182 ( 4.744 1.587 -1.730) 5.293 8.273 ( 2.644 -1.937 -1.115) 3.462 13.348 ( 0.645 -0.247 0.310) 0.757 13.430 ( -1.271 -2.253 1.961) 3.246 13.823 ( 2.511 1.599 0.734) 3.066 13.914 ( 2.013 -1.020 -1.524) 2.724 14.182 ( 1.197 0.004 0.384) 1.258 14.186 ( 0.896 -0.566 -0.897) 1.389 14.287 ( 1.088 1.060 -0.389) 1.568 14.388 ( 0.373 -1.757 -2.153) 2.804 16.493 ( 1.522 -1.563 0.255) 2.196 16.619 ( -2.550 -4.683 0.421) 5.349 17.127 ( -0.058 5.949 1.485) 6.132 17.225 ( -1.278 2.774 -0.012) 3.054 27.949 ( 0.649 2.811 1.720) 3.359 28.039 ( 0.657 3.020 -1.580) 3.471 28.237 ( 0.010 -2.281 0.851) 2.434 28.287 ( -0.822 -1.950 -0.810) 2.266 28.750 ( 0.449 0.414 0.414) 0.738 28.783 ( 0.021 -0.543 -0.134) 0.560 28.793 ( 0.145 -0.011 0.692) 0.707 28.831 ( -0.199 -0.748 -0.439) 0.890 28.995 ( 0.385 1.135 0.095) 1.202 29.020 ( 0.265 0.641 -0.174) 0.715 29.073 ( 0.265 0.177 -0.201) 0.377 29.104 ( -0.722 -0.016 0.594) 0.935 31.272 ( 3.416 2.790 2.328) 4.987 31.493 ( 4.794 -3.298 -0.901) 5.888 31.744 ( -1.460 2.189 -1.338) 2.951 31.827 ( -3.931 2.204 5.211) 6.889 32.159 ( 3.638 1.495 0.043) 3.933 32.273 ( 3.559 -1.886 -6.093) 7.304 32.470 ( -0.825 -2.816 5.855) 6.549 33.009 ( -2.127 -10.731 -7.483) 13.254 70.130 ( 0.105 0.600 0.970) 1.146 70.187 ( -0.055 -0.578 -1.365) 1.484 70.368 ( 1.013 1.061 1.061) 1.810 70.415 ( 0.790 0.111 -0.307) 0.855 ======================= Grid point 181 (96/112) ======================= q-point: ( 0.45 0.29 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.321 ( 2.636 0.689 -1.096) 2.937 2.407 ( -2.227 -1.807 -3.735) 4.709 2.496 ( 11.806 2.209 -3.480) 12.505 2.652 ( -6.541 0.568 3.250) 7.326 2.840 ( 11.124 7.982 6.934) 15.347 2.874 ( 6.760 6.773 -0.187) 9.571 2.986 ( -2.173 6.818 -4.349) 8.374 3.058 ( 0.569 2.519 9.880) 10.212 3.233 ( -3.656 2.700 3.361) 5.652 3.330 ( 3.772 11.173 -5.129) 12.860 3.531 ( -4.921 0.985 0.841) 5.089 3.619 ( -2.401 3.397 -4.390) 6.048 3.667 ( -3.366 5.108 -3.930) 7.271 3.835 ( -6.972 3.010 -2.526) 8.003 3.903 ( 5.213 1.115 -2.223) 5.776 4.020 ( -1.261 1.181 -2.632) 3.148 4.063 ( -0.976 -2.635 4.599) 5.390 4.243 ( -0.854 0.559 -7.915) 7.981 4.326 ( -0.202 0.727 1.380) 1.573 4.450 ( -3.418 1.444 -5.953) 7.015 4.672 ( 1.791 -3.535 1.913) 4.400 4.816 ( 0.211 -3.680 -1.737) 4.075 4.913 ( -3.854 -0.364 5.365) 6.616 4.971 ( 0.572 -0.096 0.255) 0.634 5.057 ( -4.624 -4.465 0.838) 6.483 5.087 ( -2.097 -4.662 -5.580) 7.568 5.233 ( 3.731 -2.910 -0.428) 4.751 5.262 ( -0.702 -4.516 3.906) 6.011 5.410 ( -4.480 0.688 3.595) 5.785 5.476 ( 2.636 -1.576 -3.506) 4.661 5.711 ( 0.493 1.615 3.607) 3.983 5.788 ( 1.971 -0.418 -1.181) 2.335 5.998 ( -1.486 -0.238 5.555) 5.755 6.115 ( -3.007 3.947 -1.455) 5.171 6.261 ( 0.901 -0.298 6.327) 6.398 6.508 ( -0.001 -1.597 -5.603) 5.826 6.648 ( 0.735 2.626 0.183) 2.733 6.673 ( -1.135 -1.194 0.647) 1.770 6.901 ( -1.354 5.043 5.058) 7.270 7.005 ( 1.917 3.544 -1.085) 4.173 7.060 ( 2.132 0.991 -0.135) 2.354 7.156 ( -3.273 -2.173 -1.313) 4.142 7.432 ( 2.343 -3.920 -0.836) 4.643 7.454 ( -2.547 -7.013 2.226) 7.786 7.879 ( 2.259 -1.153 0.185) 2.543 7.929 ( -0.430 -2.264 -0.676) 2.402 8.237 ( 2.185 2.129 -0.044) 3.051 8.299 ( 1.394 -0.247 -2.157) 2.580 13.372 ( 1.480 -1.011 0.752) 1.944 13.413 ( -1.897 -2.245 0.799) 3.046 13.862 ( 1.014 1.330 0.794) 1.851 13.915 ( 0.001 -0.188 -2.082) 2.091 14.207 ( 0.939 -0.198 0.790) 1.243 14.212 ( 1.519 -0.521 0.499) 1.681 14.297 ( 0.444 0.883 -0.203) 1.009 14.361 ( -0.770 -0.959 -2.800) 3.058 16.528 ( 1.928 -3.007 0.464) 3.602 16.577 ( -2.252 -4.278 -0.086) 4.835 17.146 ( 0.565 4.797 1.734) 5.132 17.199 ( -1.080 3.192 -0.619) 3.426 27.974 ( 0.240 2.930 1.992) 3.551 28.036 ( 0.724 2.668 -2.228) 3.551 28.238 ( -1.212 -2.360 1.595) 3.095 28.269 ( 0.256 -2.808 -1.505) 3.196 28.763 ( 0.432 0.195 0.505) 0.693 28.781 ( -0.186 -0.306 -0.235) 0.428 28.800 ( 0.008 -0.203 0.652) 0.682 28.822 ( -0.185 -0.588 -0.678) 0.916 29.004 ( 0.279 1.353 0.391) 1.435 29.019 ( 0.051 0.983 -0.432) 1.074 29.082 ( 0.570 0.002 0.195) 0.602 29.094 ( -0.706 -0.110 0.285) 0.769 31.374 ( 3.883 3.030 5.157) 7.132 31.556 ( 1.562 -0.489 -1.705) 2.363 31.709 ( 0.312 -1.165 -1.029) 1.585 31.767 ( -5.882 0.180 3.080) 6.642 32.188 ( 0.043 3.049 -0.861) 3.169 32.252 ( 0.919 0.831 -4.583) 4.747 32.581 ( 4.507 -4.343 7.279) 9.600 32.897 ( -2.707 -8.821 -8.407) 12.483 70.140 ( -0.080 0.342 1.178) 1.229 70.176 ( 0.213 -0.504 -1.421) 1.523 70.390 ( 0.426 0.802 1.048) 1.387 70.419 ( 0.149 0.198 -0.635) 0.682 ======================= Grid point 182 (97/112) ======================= q-point: (-0.45 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.297 ( -5.282 -0.255 1.129) 5.407 2.381 ( 2.242 -2.059 -1.686) 3.479 2.416 ( -14.450 3.185 3.097) 15.118 2.691 ( 4.107 0.947 -0.214) 4.220 2.841 ( -4.786 6.926 2.519) 8.788 2.952 ( 2.792 7.023 -2.074) 7.837 3.035 ( -16.320 5.704 -7.991) 19.046 3.129 ( 1.452 5.523 7.181) 9.175 3.171 ( 3.887 0.927 3.045) 5.024 3.386 ( 7.897 7.226 -3.366) 11.221 3.458 ( 1.558 6.292 0.026) 6.482 3.580 ( -0.803 7.151 -5.236) 8.899 3.690 ( 3.602 3.763 4.792) 7.078 3.772 ( 8.283 0.841 -4.971) 9.697 3.913 ( -4.777 1.904 1.922) 5.490 3.997 ( 1.222 -0.217 -1.599) 2.024 4.089 ( 0.123 0.723 5.955) 6.000 4.178 ( -0.853 -0.549 -6.345) 6.426 4.350 ( 2.084 0.946 0.841) 2.438 4.403 ( 2.821 0.586 -4.009) 4.937 4.715 ( -4.282 -2.728 -0.552) 5.107 4.774 ( 2.796 -3.873 0.097) 4.778 4.908 ( -3.671 -2.416 7.140) 8.384 4.966 ( 0.973 -9.320 1.605) 9.507 5.039 ( 3.250 -2.927 -2.956) 5.279 5.062 ( 0.105 -2.622 0.874) 2.766 5.246 ( -0.820 -3.197 -0.044) 3.301 5.315 ( 4.066 -2.468 -1.333) 4.939 5.383 ( -0.561 2.441 2.244) 3.363 5.519 ( 6.072 0.931 -4.719) 7.747 5.748 ( -0.392 -1.281 1.790) 2.235 5.806 ( 2.045 -0.877 -4.324) 4.863 6.022 ( -0.883 3.276 4.793) 5.872 6.086 ( 2.423 2.694 -0.638) 3.679 6.323 ( -2.318 0.503 8.081) 8.422 6.450 ( 0.459 -2.050 -7.219) 7.519 6.645 ( -1.618 -0.427 -0.120) 1.678 6.673 ( 1.185 0.522 0.769) 1.506 6.926 ( -1.213 4.531 6.228) 7.796 6.999 ( 0.222 5.876 -2.972) 6.589 7.068 ( -3.812 -1.430 -1.251) 4.259 7.134 ( 3.561 -0.455 0.406) 3.613 7.393 ( -4.452 -4.758 2.338) 6.923 7.492 ( 3.394 -6.132 -0.853) 7.060 7.891 ( -2.614 -2.092 -0.613) 3.404 7.917 ( 0.945 -2.293 0.209) 2.489 8.258 ( -0.470 1.518 0.989) 1.872 8.279 ( -0.907 0.899 -3.296) 3.535 13.380 ( -1.935 -1.248 0.088) 2.305 13.411 ( 1.842 -1.905 0.970) 2.822 13.876 ( -0.483 0.751 1.380) 1.644 13.886 ( -1.211 0.503 -1.525) 2.012 14.218 ( -0.431 -0.467 -0.020) 0.635 14.229 ( 0.198 -0.458 -0.867) 1.001 14.310 ( 0.296 0.001 1.403) 1.434 14.320 ( -0.901 -0.032 -2.136) 2.318 16.533 ( -2.141 -3.152 0.026) 3.811 16.573 ( 2.343 -4.092 0.236) 4.721 17.168 ( -0.188 4.176 0.649) 4.230 17.187 ( 1.150 3.712 -0.384) 3.905 27.989 ( -0.451 3.205 1.856) 3.731 28.027 ( 0.647 2.240 -2.668) 3.543 28.225 ( -1.630 -2.143 2.093) 3.411 28.274 ( 1.409 -2.910 -1.309) 3.488 28.772 ( -0.456 -0.050 -0.197) 0.499 28.773 ( 0.077 -0.080 0.409) 0.424 28.806 ( 0.146 -0.322 0.677) 0.764 28.815 ( 0.066 -0.517 -0.692) 0.867 29.006 ( -0.483 1.161 0.299) 1.293 29.019 ( 0.422 1.230 -0.485) 1.388 29.079 ( -0.907 -0.026 0.406) 0.994 29.099 ( 0.862 -0.064 -0.089) 0.869 31.462 ( -1.721 1.735 2.153) 3.257 31.506 ( -0.895 1.528 -2.455) 3.027 31.663 ( -4.735 0.058 3.558) 5.923 31.796 ( 5.352 -3.149 0.297) 6.217 32.163 ( -2.788 2.381 2.716) 4.563 32.236 ( 1.231 4.647 -4.861) 6.836 32.691 ( -1.616 -7.912 5.391) 9.710 32.796 ( 2.083 -6.917 -7.125) 10.146 70.146 ( -0.428 0.299 1.195) 1.304 70.170 ( 0.437 -0.359 -1.390) 1.501 70.402 ( -0.158 0.552 1.040) 1.188 70.410 ( -0.461 0.331 -0.811) 0.990 ======================= Grid point 183 (98/112) ======================= q-point: (-0.36 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.073 ( -18.732 9.420 4.922) 21.537 2.316 ( -1.762 2.295 2.642) 3.918 2.441 ( -1.536 -0.416 0.210) 1.605 2.551 ( -13.322 1.807 -4.939) 14.323 2.627 ( -12.431 7.261 -1.662) 14.492 2.807 ( -8.824 -3.343 5.147) 10.749 2.955 ( -2.236 5.477 -2.766) 6.530 3.115 ( -3.731 -0.356 -2.619) 4.572 3.248 ( 0.276 13.479 5.330) 14.497 3.378 ( 5.710 5.250 -7.544) 10.820 3.579 ( 6.754 4.705 3.801) 9.067 3.701 ( -2.475 -1.386 0.909) 2.979 3.732 ( 7.992 5.070 2.342) 9.750 3.879 ( 0.288 -3.317 -4.544) 5.633 3.921 ( 7.977 7.795 1.819) 11.301 4.053 ( 6.484 0.753 0.393) 6.540 4.130 ( 1.972 0.705 -1.769) 2.741 4.164 ( 3.117 3.128 4.919) 6.610 4.411 ( 3.187 -1.292 -1.862) 3.911 4.460 ( 4.668 -0.876 3.841) 6.108 4.627 ( -1.570 1.058 -1.760) 2.585 4.845 ( 3.855 -4.865 -0.027) 6.207 4.916 ( 0.117 -4.393 3.389) 5.550 5.022 ( -2.168 -6.735 1.026) 7.149 5.057 ( 4.484 -2.395 1.093) 5.199 5.117 ( 4.660 -5.658 0.341) 7.338 5.246 ( 0.862 -2.973 0.190) 3.101 5.349 ( 2.297 -1.116 -4.161) 4.882 5.438 ( 4.428 1.662 0.097) 4.731 5.607 ( 7.753 -1.157 -5.155) 9.382 5.734 ( -1.857 -0.203 1.384) 2.325 5.786 ( 1.860 0.384 -5.932) 6.229 6.038 ( 0.142 2.995 0.148) 3.002 6.178 ( 4.624 1.852 2.331) 5.499 6.282 ( -4.052 1.536 -1.396) 4.553 6.436 ( -0.672 -0.379 2.949) 3.048 6.620 ( -1.028 1.326 -0.101) 1.681 6.692 ( -0.070 -1.272 0.918) 1.570 6.945 ( -3.250 2.978 0.624) 4.452 6.969 ( -1.197 5.242 -1.409) 5.558 6.999 ( -0.118 -0.071 0.701) 0.715 7.209 ( 3.706 -0.045 1.249) 3.911 7.344 ( -2.762 -3.223 2.541) 4.947 7.538 ( 2.189 -8.972 -0.765) 9.267 7.824 ( -3.936 -0.708 0.104) 4.000 7.918 ( -0.971 -2.588 -0.149) 2.768 8.201 ( -3.674 1.100 -3.307) 5.064 8.251 ( -1.644 -0.131 0.582) 1.749 13.352 ( -1.118 0.002 0.025) 1.119 13.450 ( 1.694 -2.561 0.365) 3.092 13.842 ( -2.206 0.855 -1.122) 2.619 13.872 ( -1.858 -0.008 2.133) 2.828 14.191 ( -1.661 -0.455 -1.015) 1.999 14.206 ( -1.031 -0.178 -2.023) 2.278 14.288 ( -0.853 0.546 -0.701) 1.232 14.337 ( -0.066 -1.123 2.500) 2.741 16.497 ( -1.650 -1.575 -0.129) 2.285 16.622 ( 2.812 -4.702 0.200) 5.482 17.161 ( 0.303 5.345 -1.371) 5.527 17.219 ( 1.627 3.201 0.482) 3.623 27.989 ( -0.275 2.522 -0.688) 2.629 28.016 ( -0.018 2.927 -0.633) 2.994 28.222 ( -0.693 -1.836 2.041) 2.831 28.289 ( 0.974 -2.050 -0.694) 2.373 28.758 ( -0.553 0.235 -0.340) 0.691 28.777 ( -0.063 -0.392 0.475) 0.619 28.808 ( 0.031 -0.351 -0.744) 0.823 28.819 ( 0.342 -0.536 0.669) 0.923 28.997 ( -0.571 0.885 -0.015) 1.054 29.021 ( 0.047 0.941 -0.327) 0.997 29.068 ( -0.591 0.281 0.325) 0.731 29.113 ( 0.749 0.004 -0.200) 0.775 31.354 ( -4.789 0.801 -5.024) 6.987 31.464 ( -5.349 -1.658 1.824) 5.889 31.687 ( 1.771 2.512 3.732) 4.835 31.870 ( 1.446 -0.128 1.732) 2.260 32.139 ( -5.107 -0.021 5.767) 7.703 32.207 ( 0.818 6.528 -5.431) 8.531 32.633 ( 0.674 -7.785 -6.358) 10.074 32.854 ( 1.713 -9.926 4.691) 11.111 70.145 ( -0.425 0.420 0.298) 0.667 70.170 ( 0.456 -0.119 -0.446) 0.649 70.389 ( -0.977 0.491 -0.911) 1.423 70.403 ( -0.616 0.337 0.872) 1.119 ======================= Grid point 184 (99/112) ======================= q-point: (-0.27 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.797 ( -17.558 12.165 7.867) 22.763 2.040 ( -23.389 9.956 -1.491) 25.464 2.236 ( -12.630 7.656 -0.585) 14.781 2.416 ( -5.197 2.858 -4.987) 7.748 2.646 ( 6.338 -3.909 -0.432) 7.459 2.717 ( -6.408 -2.127 12.181) 13.927 2.886 ( 0.514 2.854 0.248) 2.911 2.972 ( -11.468 6.321 7.021) 14.858 3.261 ( -3.386 3.734 6.354) 8.110 3.430 ( -2.167 1.817 -3.476) 4.481 3.657 ( 4.785 5.090 2.477) 7.412 3.718 ( -2.795 -2.681 -0.914) 3.980 3.746 ( -3.256 -4.958 -4.085) 7.202 3.906 ( 11.210 5.853 -2.642) 12.919 4.083 ( 3.601 7.250 3.545) 8.837 4.161 ( 4.954 4.195 0.038) 6.492 4.232 ( 12.535 -1.746 -6.279) 14.129 4.310 ( 6.933 4.840 4.140) 9.414 4.479 ( 6.005 0.264 0.254) 6.016 4.566 ( 3.379 1.877 1.805) 4.266 4.669 ( 5.871 -1.116 0.397) 5.990 4.875 ( 2.343 -6.941 -2.379) 7.702 4.970 ( 1.694 -6.647 4.583) 8.250 5.032 ( 2.033 -0.630 -0.165) 2.135 5.162 ( 2.972 -4.772 -1.326) 5.776 5.181 ( 7.233 -1.793 -0.342) 7.460 5.286 ( 2.757 -4.110 -0.037) 4.950 5.328 ( 1.158 -1.127 -6.481) 6.679 5.504 ( 3.371 1.526 -1.774) 4.104 5.650 ( 1.493 -0.061 -4.832) 5.058 5.706 ( -0.736 -0.340 -1.751) 1.929 5.853 ( 6.744 -1.487 1.280) 7.024 6.003 ( -2.110 1.695 -4.677) 5.404 6.212 ( -2.325 0.844 -0.182) 2.480 6.237 ( 0.676 2.096 -1.364) 2.590 6.437 ( -4.062 2.065 5.530) 7.166 6.595 ( -1.782 -0.085 -1.265) 2.187 6.692 ( -0.857 2.562 0.928) 2.856 6.846 ( -4.880 0.977 -1.222) 5.124 6.947 ( -0.173 3.630 0.198) 3.639 7.046 ( 1.769 0.050 2.501) 3.064 7.281 ( 2.046 0.382 1.727) 2.705 7.361 ( 3.141 -2.729 1.772) 4.523 7.535 ( -1.077 -7.490 -3.669) 8.410 7.794 ( -1.013 -2.207 6.379) 6.826 7.886 ( -1.741 -1.657 -0.455) 2.447 8.094 ( -4.803 0.627 -2.775) 5.582 8.227 ( -0.865 -2.496 0.274) 2.656 13.344 ( 0.212 1.034 0.176) 1.070 13.473 ( 1.136 -2.304 -1.179) 2.826 13.786 ( -2.747 0.711 -1.382) 3.156 13.842 ( -3.559 -0.871 1.911) 4.133 14.158 ( -1.146 -0.522 0.426) 1.329 14.171 ( -1.056 0.076 -1.240) 1.631 14.267 ( -1.042 0.472 -0.371) 1.203 14.345 ( -1.272 -1.938 2.260) 3.237 16.476 ( -0.385 0.500 -0.144) 0.648 16.677 ( 3.348 -4.658 -0.358) 5.748 17.156 ( 0.674 6.578 -2.264) 6.989 17.244 ( 0.771 2.822 0.023) 2.925 27.967 ( -0.160 1.886 -2.747) 3.336 28.023 ( 0.576 3.597 0.919) 3.757 28.227 ( -0.422 -1.166 0.944) 1.559 28.294 ( -0.092 -0.875 0.037) 0.880 28.749 ( -0.112 0.393 -0.272) 0.491 28.779 ( -0.140 -0.464 0.317) 0.579 28.800 ( -0.178 -0.215 -0.892) 0.935 28.828 ( 0.108 -0.775 0.429) 0.892 28.988 ( -0.362 0.639 0.040) 0.735 29.015 ( -0.373 0.258 -0.248) 0.517 29.065 ( -0.100 0.821 0.471) 0.952 29.122 ( 0.567 0.040 -0.373) 0.680 31.236 ( -3.924 0.982 -3.097) 5.095 31.381 ( -5.046 -3.540 1.617) 6.372 31.708 ( -2.931 1.464 2.408) 4.066 31.909 ( 1.007 1.967 2.190) 3.111 32.046 ( -7.757 0.892 2.556) 8.216 32.174 ( -1.106 7.922 -2.641) 8.423 32.663 ( 8.914 -9.796 -8.649) 15.818 32.909 ( -2.185 -13.525 9.914) 16.911 70.139 ( 0.033 0.797 -0.598) 0.997 70.179 ( 0.504 0.109 0.581) 0.776 70.360 ( -1.254 0.676 -1.075) 1.785 70.394 ( -1.045 0.193 0.368) 1.124 ======================= Grid point 185 (100/112) ======================= q-point: (-0.18 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.572 ( -16.079 11.915 10.734) 22.710 1.670 ( -18.355 13.776 7.003) 23.995 2.019 ( -10.547 9.687 1.419) 14.391 2.203 ( -8.698 0.786 -10.127) 13.372 2.677 ( -5.042 2.991 8.611) 10.417 2.767 ( 2.284 1.181 4.662) 5.324 2.899 ( -3.794 5.703 9.963) 12.090 3.038 ( 5.608 -2.446 9.649) 11.425 3.241 ( -3.110 -2.939 4.419) 6.151 3.353 ( -4.538 3.954 7.156) 9.351 3.570 ( -4.113 -10.004 -7.788) 13.329 3.600 ( -8.400 -2.498 1.462) 8.885 3.828 ( 5.982 6.988 1.820) 9.377 4.081 ( -3.589 8.836 1.312) 9.627 4.126 ( 13.915 4.169 -5.294) 15.460 4.254 ( 7.048 5.817 -6.978) 11.497 4.374 ( 4.089 1.156 -1.206) 4.417 4.445 ( 8.706 -1.169 -4.517) 9.877 4.563 ( 3.949 4.455 -6.084) 8.512 4.674 ( 8.203 4.050 -0.681) 9.174 4.769 ( 4.612 -4.373 2.393) 6.791 4.946 ( 4.402 -4.878 -0.154) 6.573 5.006 ( -2.405 -9.073 2.380) 9.684 5.086 ( 5.174 1.259 0.581) 5.356 5.189 ( 3.548 -5.360 -6.035) 8.817 5.282 ( 3.803 2.079 -1.194) 4.495 5.334 ( 7.115 -0.478 -4.410) 8.385 5.373 ( 5.309 -3.888 1.867) 6.840 5.535 ( 1.851 1.746 -2.127) 3.316 5.614 ( -1.342 3.512 -1.660) 4.109 5.694 ( 0.011 -2.848 -1.749) 3.342 5.865 ( -3.689 2.884 -2.948) 5.533 6.010 ( 4.811 -5.241 0.460) 7.129 6.153 ( -6.415 1.016 -1.452) 6.655 6.193 ( -1.044 -0.862 -3.345) 3.608 6.358 ( -9.019 0.617 3.254) 9.608 6.512 ( -4.404 -1.572 -2.983) 5.547 6.654 ( -2.457 11.273 -2.829) 11.879 6.802 ( -2.295 -1.766 5.536) 6.247 6.966 ( 0.287 0.185 3.008) 3.027 7.104 ( 3.032 0.978 1.251) 3.423 7.309 ( 0.271 0.953 0.816) 1.284 7.422 ( -0.496 -0.485 -2.814) 2.899 7.492 ( 2.805 -3.766 -1.642) 4.975 7.858 ( -0.562 1.066 4.687) 4.839 7.881 ( -1.180 -2.998 5.712) 6.557 8.029 ( 1.361 -4.472 1.267) 4.843 8.245 ( 3.285 -5.439 0.088) 6.355 13.361 ( 1.367 1.672 0.159) 2.166 13.468 ( 0.135 -0.726 -2.698) 2.797 13.726 ( -2.051 -0.129 -1.796) 2.729 13.776 ( -4.817 -1.243 1.022) 5.078 14.148 ( -0.630 0.142 -0.440) 0.781 14.165 ( -0.163 -1.597 3.095) 3.487 14.245 ( -0.886 -0.006 -0.396) 0.971 14.332 ( -1.935 -2.600 1.618) 3.623 16.487 ( 1.917 2.846 -0.086) 3.432 16.731 ( 3.307 -3.420 -1.584) 5.014 17.142 ( 0.076 7.039 -2.727) 7.549 17.242 ( -0.768 2.381 -0.690) 2.595 27.946 ( 0.405 2.270 -2.417) 3.341 28.048 ( 1.731 3.303 -0.376) 3.748 28.213 ( -1.311 -0.326 -0.946) 1.650 28.283 ( -1.431 -0.277 0.299) 1.488 28.751 ( 0.561 0.381 -0.253) 0.724 28.777 ( -0.363 -0.099 0.242) 0.448 28.789 ( -0.071 -0.250 -0.797) 0.838 28.828 ( -0.417 -0.919 0.185) 1.026 28.985 ( -0.022 0.439 0.240) 0.501 29.007 ( -0.195 -0.059 0.008) 0.204 29.072 ( 0.177 0.941 0.814) 1.257 29.127 ( 0.393 0.057 -0.503) 0.641 31.171 ( -1.917 0.757 0.611) 2.150 31.315 ( -4.087 -4.243 2.328) 6.335 31.651 ( -4.525 1.001 1.988) 5.042 31.849 ( -8.567 -3.496 2.591) 9.609 32.007 ( 3.411 9.299 -5.933) 11.546 32.129 ( -3.054 7.470 1.639) 8.235 32.749 ( 6.582 -14.023 -5.391) 16.402 32.971 ( -1.258 -15.611 12.275) 19.898 70.139 ( 0.827 1.374 -0.828) 1.805 70.198 ( 0.837 0.300 1.022) 1.354 70.326 ( -1.305 0.834 -1.436) 2.112 70.369 ( -1.681 0.235 -0.445) 1.754 ======================= Grid point 186 (101/112) ======================= q-point: (-0.09 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.447 ( -9.445 12.123 16.724) 22.713 1.502 ( -10.552 13.808 12.803) 21.586 1.885 ( -4.050 10.908 -2.812) 11.971 1.991 ( -3.368 2.196 -11.647) 12.321 2.706 ( -1.945 4.673 14.029) 14.914 2.877 ( 0.096 6.272 18.360) 19.402 2.940 ( 0.475 -2.200 2.897) 3.669 3.083 ( -4.528 -3.803 3.802) 7.030 3.218 ( -2.641 -5.949 1.903) 6.781 3.409 ( -3.109 -7.847 -4.957) 9.788 3.478 ( -3.159 3.710 12.772) 13.670 3.561 ( 3.754 -1.661 6.202) 7.437 3.887 ( 1.151 5.803 -3.298) 6.774 4.067 ( 4.181 11.726 -2.177) 12.638 4.209 ( 4.950 2.779 -18.774) 19.614 4.303 ( 0.833 2.417 0.166) 2.562 4.362 ( 4.179 2.327 -8.642) 9.877 4.504 ( 2.945 5.966 -9.000) 11.193 4.640 ( 7.794 -0.659 1.727) 8.010 4.780 ( 1.848 0.262 1.184) 2.211 4.842 ( 0.920 -1.008 -3.172) 3.453 4.913 ( -3.420 -1.336 -3.838) 5.311 5.004 ( -0.870 -11.396 4.636) 12.334 5.171 ( 1.511 -3.323 -2.054) 4.188 5.236 ( 7.563 2.030 -1.718) 8.017 5.366 ( 3.550 1.624 -1.332) 4.125 5.400 ( 3.725 -2.060 -1.727) 4.593 5.493 ( 4.464 -0.361 0.597) 4.519 5.509 ( -3.644 1.391 -0.614) 3.948 5.621 ( 4.746 4.247 -4.100) 7.574 5.636 ( -0.923 0.789 -2.332) 2.629 5.827 ( -2.199 -0.429 -0.486) 2.292 5.999 ( -3.370 0.683 -1.243) 3.656 6.067 ( 0.910 -3.465 0.184) 3.587 6.149 ( -2.787 -7.073 -0.153) 7.604 6.204 ( -8.791 0.278 1.512) 8.924 6.440 ( -1.578 2.043 -0.156) 2.586 6.576 ( -3.028 10.720 -2.950) 11.523 6.819 ( -1.489 -3.002 6.445) 7.264 6.993 ( -0.259 -1.588 1.713) 2.350 7.163 ( 1.962 3.361 1.282) 4.097 7.296 ( -2.363 3.948 -0.565) 4.636 7.384 ( 0.925 0.106 -1.492) 1.758 7.511 ( -0.289 -1.795 -2.837) 3.369 7.873 ( -2.036 -0.838 4.525) 5.032 7.913 ( 2.934 3.290 1.581) 4.683 8.139 ( 2.972 -8.882 8.346) 12.545 8.350 ( 7.031 -10.852 -0.698) 12.950 13.388 ( 1.149 1.849 0.152) 2.182 13.439 ( -0.249 0.915 -2.778) 2.936 13.689 ( -0.403 -1.235 -1.862) 2.270 13.699 ( -4.048 -1.024 0.931) 4.278 14.142 ( 0.219 0.322 -0.022) 0.391 14.178 ( -1.372 -0.922 1.728) 2.391 14.244 ( 0.700 -2.710 1.457) 3.156 14.311 ( -1.413 -3.286 0.890) 3.686 16.546 ( 4.090 4.468 0.527) 6.080 16.752 ( 0.874 -0.025 -3.750) 3.851 17.118 ( -0.102 5.617 -1.596) 5.841 17.207 ( -1.883 1.835 -1.511) 3.033 27.946 ( 1.571 2.939 -1.497) 3.654 28.063 ( 0.929 4.382 -3.345) 5.590 28.173 ( -1.475 -1.281 -0.465) 2.009 28.246 ( -2.505 -0.437 -0.365) 2.569 28.763 ( 0.961 0.221 -0.421) 1.072 28.771 ( -0.574 0.182 0.355) 0.699 28.788 ( 0.499 -0.274 -0.161) 0.592 28.818 ( -0.843 -0.816 0.141) 1.182 28.990 ( 0.086 0.338 0.513) 0.620 29.009 ( 0.296 0.035 -0.154) 0.335 29.085 ( 0.306 0.623 1.191) 1.379 29.128 ( 0.217 0.077 -0.646) 0.686 31.179 ( 0.509 -0.584 3.723) 3.803 31.277 ( -2.082 -4.190 2.057) 5.111 31.604 ( -1.805 1.599 1.580) 2.883 31.731 ( -5.856 -0.783 1.378) 6.067 31.999 ( 3.003 7.296 -8.031) 11.259 32.068 ( -5.664 6.296 0.607) 8.491 32.840 ( 2.928 -17.802 7.955) 19.717 33.049 ( 1.006 -16.015 4.644) 16.705 70.157 ( 1.735 1.898 -0.400) 2.603 70.225 ( 1.149 0.757 0.739) 1.562 70.286 ( -1.703 0.922 -1.791) 2.638 70.328 ( -1.932 0.283 -0.944) 2.169 ======================= Grid point 187 (102/112) ======================= q-point: ( 0.00 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.672 ( 0.849 6.621 5.174) 8.446 1.717 ( 1.762 3.821 1.624) 4.510 2.005 ( -1.106 8.947 3.867) 9.809 2.067 ( 1.083 6.419 0.743) 6.552 2.697 ( 0.398 -3.972 -1.009) 4.117 2.784 ( 3.259 -9.151 -7.731) 12.415 3.020 ( -4.250 -2.044 3.611) 5.940 3.086 ( -3.124 -8.349 -3.054) 9.423 3.163 ( 2.406 4.278 10.753) 11.820 3.219 ( 3.371 -0.700 7.261) 8.036 3.620 ( -3.764 9.802 14.260) 17.708 3.752 ( -1.533 -1.536 16.566) 16.707 3.971 ( -1.809 4.574 -1.866) 5.261 4.070 ( -1.385 -2.102 -10.174) 10.481 4.322 ( -0.279 3.937 -2.576) 4.713 4.353 ( -1.007 4.885 1.216) 5.134 4.559 ( -3.191 8.866 -6.643) 11.529 4.596 ( 5.087 7.915 -13.643) 16.573 4.703 ( -2.114 0.067 4.727) 5.179 4.733 ( 4.383 -3.519 1.040) 5.717 4.770 ( 2.087 -3.648 -2.580) 4.932 4.812 ( 1.331 -4.256 -2.935) 5.338 4.928 ( 2.522 -0.266 -2.936) 3.880 5.002 ( -2.120 -6.033 -5.595) 8.497 5.253 ( 0.919 -3.486 -1.027) 3.749 5.275 ( -0.238 -5.205 -2.212) 5.660 5.471 ( -1.862 1.073 -0.835) 2.306 5.489 ( 1.203 -1.263 -2.267) 2.860 5.640 ( 2.989 9.167 2.916) 10.073 5.689 ( 0.709 7.314 -1.895) 7.588 5.761 ( -5.213 2.753 1.714) 6.139 5.796 ( -2.033 1.012 -0.256) 2.285 5.888 ( -0.793 -8.694 0.655) 8.755 5.919 ( -2.157 -8.921 -1.230) 9.260 6.058 ( 1.573 1.102 0.789) 2.077 6.099 ( 0.982 -2.125 -2.562) 3.471 6.568 ( 2.013 5.952 3.840) 7.364 6.627 ( -1.535 1.980 -1.106) 2.739 6.843 ( 1.417 0.589 2.995) 3.365 6.902 ( -1.667 -3.696 -1.888) 4.473 7.306 ( 1.385 4.951 2.466) 5.701 7.348 ( -1.289 4.878 -1.563) 5.282 7.397 ( 0.905 -3.015 2.003) 3.731 7.430 ( -1.154 -2.638 -1.227) 3.130 7.907 ( -1.802 2.879 8.218) 8.893 8.008 ( -0.522 -3.554 7.418) 8.242 8.075 ( 1.701 0.098 -2.842) 3.314 8.195 ( 1.959 -8.429 -5.495) 10.251 13.423 ( -0.983 1.370 0.136) 1.692 13.439 ( 0.086 -0.068 -1.217) 1.222 13.644 ( -0.570 0.283 0.279) 0.695 13.661 ( 1.147 -1.237 -1.200) 2.070 14.163 ( -0.327 1.091 1.265) 1.703 14.178 ( 0.930 0.624 0.085) 1.123 14.213 ( 0.239 -1.825 0.683) 1.963 14.229 ( -0.365 -2.490 -0.506) 2.567 16.692 ( -0.131 2.860 1.547) 3.254 16.728 ( -0.151 -0.530 -1.726) 1.812 17.177 ( 0.670 1.507 -1.185) 2.031 17.187 ( -0.203 0.532 -1.812) 1.899 28.051 ( 1.617 3.643 0.952) 4.098 28.096 ( -0.319 1.922 -3.040) 3.611 28.133 ( -0.239 -1.274 0.834) 1.541 28.168 ( -1.251 -2.153 -2.141) 3.284 28.769 ( -0.781 0.538 0.522) 1.082 28.779 ( 0.494 -0.006 -0.177) 0.525 28.787 ( -0.471 -0.304 0.023) 0.561 28.794 ( 0.708 -0.552 -0.381) 0.975 29.004 ( 0.057 0.436 0.508) 0.672 29.011 ( 0.233 -0.197 -0.096) 0.320 29.109 ( -0.025 0.546 0.499) 0.740 29.119 ( -0.028 -0.407 -0.455) 0.611 31.202 ( 0.861 -0.422 1.819) 2.056 31.216 ( 0.898 -1.834 0.575) 2.121 31.664 ( 1.238 1.370 2.060) 2.766 31.679 ( -0.182 -0.016 0.771) 0.792 32.047 ( -7.092 4.678 0.974) 8.551 32.088 ( 0.144 1.411 -2.444) 2.826 32.703 ( -0.508 -3.356 6.291) 7.148 32.800 ( 4.440 -11.330 -2.858) 12.500 70.227 ( 0.613 1.465 1.456) 2.155 70.250 ( 0.188 -0.826 1.535) 1.753 70.267 ( -0.332 1.404 -2.282) 2.700 70.287 ( -0.435 -0.611 -1.866) 2.011 ======================= Grid point 188 (103/112) ======================= q-point: ( 0.09 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.757 ( 5.549 4.185 0.987) 7.020 1.784 ( 6.649 1.763 -4.209) 8.065 2.079 ( 5.122 12.214 4.079) 13.858 2.137 ( 7.618 8.950 -2.688) 12.057 2.698 ( -0.574 -3.531 0.815) 3.669 2.777 ( 2.283 -8.159 -7.228) 11.137 3.019 ( 0.335 -5.015 6.709) 8.383 3.044 ( -0.121 -7.684 1.655) 7.861 3.274 ( 3.114 1.927 -5.080) 6.262 3.296 ( 4.474 -0.064 -1.842) 4.839 3.730 ( -2.672 9.239 19.932) 22.131 3.858 ( 1.946 4.670 9.063) 10.380 3.890 ( -4.412 -1.615 -3.967) 6.149 3.977 ( 1.576 -2.947 -8.432) 9.070 4.211 ( -10.744 7.475 5.325) 14.131 4.295 ( -9.607 2.513 6.830) 12.053 4.421 ( -2.173 8.217 -9.250) 12.562 4.485 ( -1.611 4.731 -5.345) 7.317 4.711 ( -2.067 -0.634 -3.093) 3.773 4.764 ( -0.886 -3.713 -2.642) 4.642 4.858 ( 8.110 2.749 1.125) 8.637 4.919 ( 6.613 -1.031 -2.183) 7.040 4.927 ( -1.731 -5.326 -1.796) 5.881 4.937 ( -0.842 -4.915 -0.803) 5.051 5.215 ( -3.669 -2.136 -0.390) 4.263 5.271 ( 0.410 -4.893 -0.241) 4.916 5.406 ( -5.455 4.571 -1.261) 7.228 5.484 ( -1.784 -3.593 -2.082) 4.520 5.552 ( -11.811 3.674 1.820) 12.502 5.604 ( -5.075 -1.013 0.615) 5.212 5.704 ( 0.628 8.967 0.596) 9.009 5.808 ( 0.034 2.532 4.182) 4.888 5.888 ( -0.005 -6.449 1.766) 6.687 5.935 ( 1.052 -8.658 1.235) 8.809 6.079 ( 2.899 2.030 -1.161) 3.725 6.151 ( 4.195 -4.081 -0.706) 5.895 6.631 ( 3.407 6.815 -2.819) 8.123 6.681 ( 5.965 4.561 2.901) 8.050 6.852 ( -1.083 -1.632 -2.165) 2.919 6.903 ( 1.623 -4.116 2.920) 5.301 7.300 ( -2.548 5.391 -1.989) 6.286 7.351 ( 1.270 3.196 1.559) 3.776 7.384 ( -2.076 -1.541 -0.679) 2.673 7.425 ( -0.279 -3.044 1.449) 3.382 7.925 ( -3.193 4.061 6.275) 8.128 8.026 ( 0.854 1.549 -2.344) 2.936 8.064 ( -2.911 -6.513 2.426) 7.535 8.143 ( -0.667 -7.127 -7.548) 10.402 13.403 ( -1.623 1.475 0.976) 2.400 13.425 ( -0.993 -0.513 0.151) 1.128 13.662 ( 2.234 1.101 0.027) 2.491 13.692 ( 3.214 -1.695 -0.921) 3.749 14.160 ( -0.203 1.455 -0.042) 1.469 14.199 ( 0.627 -1.613 -1.030) 2.014 14.216 ( 1.009 0.041 0.138) 1.019 14.249 ( 1.995 -2.450 0.357) 3.179 16.640 ( -4.880 3.701 0.240) 6.130 16.698 ( -2.782 -1.884 0.097) 3.361 17.191 ( 1.881 2.156 -0.896) 2.998 17.210 ( 2.666 0.271 -0.208) 2.687 28.024 ( -2.036 3.819 -1.293) 4.517 28.084 ( -0.986 -0.927 -1.092) 1.738 28.145 ( 2.230 1.760 1.384) 3.160 28.199 ( 2.965 -2.469 0.794) 3.940 28.759 ( -0.756 0.605 0.531) 1.104 28.773 ( -0.723 -0.696 0.366) 1.068 28.789 ( 0.482 0.575 -0.497) 0.900 28.804 ( 0.607 -0.842 -0.306) 1.083 29.006 ( -0.083 0.405 0.039) 0.415 29.011 ( 0.104 -0.054 -0.439) 0.454 29.109 ( -0.423 0.277 0.215) 0.549 29.114 ( -0.199 -0.199 -0.113) 0.304 31.230 ( 1.811 -0.216 -1.342) 2.265 31.248 ( 2.901 -2.040 -1.421) 3.821 31.689 ( 2.158 2.172 -0.908) 3.194 31.726 ( 3.807 -1.240 0.179) 4.008 31.967 ( -5.054 7.920 6.618) 11.492 32.107 ( 0.679 -3.831 3.804) 5.441 32.688 ( -2.681 1.083 -0.965) 3.048 32.854 ( 4.175 -13.267 -4.568) 14.639 70.202 ( -2.182 1.871 -0.333) 2.893 70.233 ( -1.703 -1.218 -0.267) 2.111 70.287 ( 2.254 1.462 0.184) 2.693 70.309 ( 2.347 -0.708 0.189) 2.459 ======================= Grid point 189 (104/112) ======================= q-point: ( 0.18 0.43 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.897 ( 11.570 1.584 -6.431) 13.332 1.899 ( 10.772 1.722 -1.655) 11.033 2.239 ( 7.907 12.583 2.782) 15.120 2.297 ( 12.588 9.421 -2.010) 15.851 2.678 ( -2.723 -1.165 1.723) 3.426 2.750 ( 2.091 -5.241 -5.592) 7.945 3.096 ( 3.088 -3.552 -0.030) 4.707 3.155 ( 6.178 -9.016 6.091) 12.512 3.241 ( 0.637 1.015 -5.846) 5.968 3.291 ( 0.202 -2.506 -9.534) 9.860 3.710 ( -0.935 3.678 -7.522) 8.425 3.749 ( -0.943 0.378 -10.131) 10.182 3.952 ( -5.669 6.034 12.413) 14.921 4.068 ( -3.324 -4.813 13.223) 14.459 4.142 ( -3.813 9.312 10.033) 14.209 4.179 ( -8.064 3.227 11.256) 14.217 4.328 ( 1.374 7.806 -8.878) 11.902 4.428 ( -0.494 4.477 -5.853) 7.385 4.649 ( -2.167 3.452 -2.382) 4.721 4.691 ( -5.239 -0.966 0.642) 5.366 4.839 ( -2.875 -6.710 -5.410) 9.086 4.886 ( -2.397 -8.434 -2.675) 9.167 4.923 ( -3.651 0.773 2.068) 4.266 4.969 ( -1.076 -0.807 -0.458) 1.420 5.149 ( -3.266 1.999 -0.338) 3.844 5.237 ( -4.786 -2.630 0.585) 5.492 5.276 ( -5.995 1.508 -1.549) 6.373 5.312 ( -7.836 -1.642 1.678) 8.180 5.511 ( -0.723 -0.672 0.313) 1.035 5.538 ( -4.202 -3.700 2.376) 6.082 5.719 ( 0.730 6.829 -0.180) 6.870 5.860 ( 0.624 -0.878 2.961) 3.151 5.909 ( 1.072 -1.550 0.955) 2.113 6.005 ( 4.019 -4.750 5.843) 8.535 6.140 ( 3.444 1.605 1.022) 3.935 6.221 ( 3.037 -5.802 2.578) 7.037 6.673 ( 3.754 7.798 -3.016) 9.165 6.796 ( 3.410 3.164 1.779) 4.981 6.828 ( 0.347 0.603 -1.236) 1.419 6.955 ( 1.674 -4.443 2.382) 5.312 7.215 ( -4.427 5.385 -2.711) 7.479 7.313 ( -2.968 -2.927 -1.462) 4.418 7.392 ( -0.430 0.851 1.379) 1.677 7.415 ( -1.504 -1.814 0.498) 2.408 7.897 ( -3.431 3.132 1.637) 4.926 7.982 ( -5.078 -5.565 -3.139) 8.162 8.041 ( 4.827 1.949 -4.365) 6.793 8.111 ( 2.251 -5.169 -1.859) 5.937 13.382 ( -1.680 1.464 0.996) 2.441 13.409 ( -1.391 -1.029 1.264) 2.143 13.720 ( 3.861 1.584 0.172) 4.177 13.756 ( 4.316 -1.854 -0.334) 4.710 14.159 ( 0.443 0.955 -0.590) 1.207 14.187 ( -0.005 -1.868 -1.760) 2.567 14.252 ( 2.237 1.407 0.009) 2.642 14.293 ( 2.502 -2.551 -0.122) 3.576 16.558 ( -3.905 3.869 0.159) 5.500 16.636 ( -3.899 -3.602 0.520) 5.333 17.218 ( 1.046 3.222 0.170) 3.392 17.251 ( 1.450 -0.120 0.396) 1.508 27.994 ( -0.483 3.805 -0.484) 3.866 28.060 ( -0.391 -2.119 -0.746) 2.280 28.199 ( 1.524 2.424 1.776) 3.370 28.251 ( 1.541 -2.186 0.985) 2.851 28.753 ( -0.386 0.647 0.484) 0.895 28.767 ( -0.321 -0.664 0.401) 0.840 28.791 ( 0.226 0.697 -0.318) 0.799 28.810 ( 0.306 -1.066 -0.191) 1.125 29.004 ( 0.139 0.493 -0.421) 0.663 29.011 ( 0.275 -0.103 -0.414) 0.508 29.099 ( -0.523 0.548 -0.148) 0.772 29.110 ( -0.466 -0.401 0.433) 0.752 31.245 ( 2.320 1.440 -3.194) 4.202 31.290 ( 3.639 -2.964 -2.547) 5.340 31.744 ( 4.973 3.133 -1.669) 6.110 31.812 ( 5.697 -3.246 -0.301) 6.564 31.965 ( -3.631 8.796 9.911) 13.740 32.154 ( -1.546 -7.807 7.559) 10.976 32.620 ( -1.158 7.207 -5.427) 9.096 32.861 ( 2.230 -14.495 -6.931) 16.221 70.167 ( -1.343 1.906 -0.152) 2.336 70.202 ( -1.203 -1.482 -0.565) 1.991 70.329 ( 1.912 1.474 0.636) 2.496 70.353 ( 2.039 -0.787 0.475) 2.237 ======================= Grid point 190 (105/112) ======================= q-point: ( 0.27 0.43 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.096 ( 14.896 3.346 -3.795) 15.731 2.127 ( 15.099 0.354 -0.066) 15.103 2.383 ( 4.962 11.176 2.783) 12.541 2.515 ( 9.658 1.831 -1.888) 10.009 2.654 ( 1.995 4.421 -1.826) 5.183 2.780 ( 6.179 -5.311 -5.053) 9.587 3.021 ( -3.903 2.868 -7.388) 8.835 3.105 ( -3.537 -4.037 -9.139) 10.599 3.327 ( 7.991 -0.877 1.026) 8.104 3.397 ( 9.263 -7.798 7.043) 14.008 3.639 ( -3.468 4.296 -4.105) 6.880 3.689 ( -0.921 -0.723 -4.112) 4.275 3.904 ( -7.568 3.708 9.002) 12.331 3.963 ( -13.004 -0.192 8.838) 15.724 4.114 ( -2.501 11.241 -1.878) 11.668 4.169 ( -1.871 4.084 -2.611) 5.196 4.265 ( -5.435 3.635 -1.191) 6.646 4.414 ( -0.343 -3.172 -1.111) 3.378 4.583 ( -6.567 3.197 -1.244) 7.409 4.608 ( -2.663 1.531 3.371) 4.560 4.727 ( -4.601 -0.997 -4.258) 6.348 4.813 ( -4.469 -2.458 -5.880) 7.784 4.882 ( 2.006 -4.522 1.688) 5.227 4.933 ( 0.856 -5.144 -0.595) 5.249 5.085 ( -1.566 2.884 -2.597) 4.185 5.152 ( -4.541 -2.190 2.884) 5.808 5.202 ( -5.072 -0.556 1.281) 5.261 5.228 ( -3.110 -2.611 0.505) 4.092 5.473 ( -3.360 -0.176 0.623) 3.422 5.493 ( -4.038 -1.524 3.923) 5.832 5.727 ( 0.228 3.682 0.026) 3.689 5.836 ( -2.616 -5.990 -1.768) 6.771 5.964 ( 0.800 7.143 5.193) 8.867 6.106 ( 1.446 -5.631 3.632) 6.855 6.211 ( 0.973 3.200 5.197) 6.181 6.320 ( 3.048 -7.480 6.391) 10.299 6.712 ( 3.059 6.238 -2.819) 7.498 6.812 ( -0.352 -1.174 -2.175) 2.497 6.856 ( 1.377 6.459 2.526) 7.071 7.006 ( 1.542 -4.884 1.664) 5.385 7.113 ( -3.290 7.368 -2.694) 8.507 7.267 ( -0.589 -5.576 -0.989) 5.694 7.340 ( -4.585 1.164 0.096) 4.731 7.393 ( -1.663 -3.434 -0.944) 3.931 7.851 ( -0.935 1.044 -1.780) 2.265 7.896 ( -0.566 -2.622 -3.204) 4.179 8.119 ( 6.265 1.512 -2.218) 6.816 8.164 ( 4.215 -2.947 -0.558) 5.174 13.363 ( -1.173 1.401 0.792) 1.991 13.396 ( -1.352 -1.728 1.530) 2.675 13.795 ( 3.909 1.791 0.294) 4.310 13.832 ( 4.043 -1.824 -0.209) 4.440 14.166 ( 0.804 0.339 -0.460) 0.987 14.176 ( 0.417 -0.722 -1.512) 1.726 14.289 ( 1.985 1.607 -0.427) 2.589 14.331 ( 2.053 -2.427 -0.871) 3.296 16.507 ( -1.950 2.719 0.256) 3.356 16.577 ( -3.050 -3.906 0.493) 4.980 17.227 ( -0.432 3.524 0.812) 3.642 17.265 ( -0.346 -0.224 0.548) 0.686 27.995 ( 0.609 3.588 0.231) 3.647 28.057 ( 0.582 -1.820 -0.528) 1.982 28.222 ( -0.324 1.696 0.981) 1.986 28.265 ( -0.505 -2.097 0.353) 2.185 28.754 ( 0.045 0.648 0.343) 0.734 28.768 ( 0.006 -0.706 0.263) 0.754 28.794 ( 0.220 0.725 0.095) 0.764 28.813 ( 0.153 -1.075 -0.057) 1.087 29.007 ( 0.531 0.677 -0.357) 0.931 29.016 ( 0.617 -0.161 -0.267) 0.692 29.089 ( -0.502 0.758 -0.008) 0.909 29.104 ( -0.626 -0.588 0.544) 1.017 31.271 ( 3.303 2.932 -1.882) 4.801 31.340 ( 4.309 -3.759 -2.052) 6.075 31.815 ( 3.379 3.862 -1.530) 5.355 31.887 ( -0.427 -1.241 2.842) 3.130 32.019 ( 2.883 4.217 6.409) 8.195 32.176 ( -2.750 -8.695 7.455) 11.778 32.568 ( 1.187 10.441 -6.536) 12.375 32.825 ( 1.196 -13.706 -7.863) 15.847 70.151 ( -0.558 1.526 0.174) 1.634 70.181 ( -0.665 -1.360 -0.480) 1.588 70.365 ( 1.485 1.372 0.533) 2.091 70.388 ( 1.465 -0.783 0.245) 1.679 ======================= Grid point 191 (106/112) ======================= q-point: ( 0.36 0.43 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.340 ( 13.057 6.412 -0.763) 14.567 2.411 ( 6.681 2.088 1.875) 7.247 2.430 ( 3.898 0.086 0.112) 3.901 2.505 ( -0.764 -2.352 -5.334) 5.879 2.793 ( 12.062 5.402 -2.955) 13.543 2.850 ( 4.304 -1.329 -1.903) 4.890 2.995 ( 5.266 3.023 -0.181) 6.074 3.050 ( 3.803 -2.044 -3.732) 5.707 3.417 ( -3.770 5.853 0.478) 6.978 3.538 ( -1.335 4.627 -0.180) 4.819 3.551 ( -4.587 -4.436 3.860) 7.458 3.641 ( 2.471 -4.630 1.926) 5.591 3.823 ( -5.067 2.914 0.723) 5.889 3.849 ( -3.442 0.701 3.205) 4.756 4.064 ( -3.143 5.008 -2.471) 6.408 4.102 ( -2.047 1.210 -3.785) 4.470 4.148 ( -5.539 9.390 1.243) 10.973 4.348 ( -4.958 -2.810 0.465) 5.718 4.440 ( -5.545 4.730 -1.432) 7.428 4.571 ( -3.029 -5.006 -5.848) 8.272 4.626 ( -1.910 -1.399 -5.826) 6.289 4.666 ( -4.948 -6.830 -3.721) 9.218 4.933 ( 4.568 2.271 -3.602) 6.245 5.013 ( 2.622 -3.785 -0.508) 4.633 5.048 ( -0.725 2.597 -0.399) 2.726 5.117 ( -3.118 1.536 0.173) 3.480 5.132 ( -1.167 -3.788 3.828) 5.510 5.177 ( -3.736 -3.786 1.870) 5.638 5.430 ( -1.950 0.330 1.682) 2.596 5.451 ( -3.935 -1.282 3.622) 5.500 5.728 ( -0.501 1.188 0.732) 1.483 5.774 ( -1.839 -2.511 -1.092) 3.298 6.012 ( -1.062 5.637 6.593) 8.739 6.135 ( -1.009 -5.369 3.651) 6.571 6.256 ( -0.810 5.501 5.051) 7.512 6.400 ( -0.085 -8.067 4.655) 9.314 6.723 ( 1.154 3.985 -3.415) 5.374 6.761 ( -1.804 2.223 -3.524) 4.541 6.920 ( 2.527 2.644 2.702) 4.547 7.019 ( -0.609 -3.678 0.878) 3.831 7.084 ( 0.903 7.938 0.015) 7.990 7.252 ( -2.247 2.625 -0.775) 3.541 7.281 ( -0.076 -7.340 0.308) 7.347 7.349 ( -1.297 -4.692 -1.407) 5.068 7.846 ( 1.548 1.038 -1.493) 2.388 7.886 ( 0.891 -2.338 -1.523) 2.930 8.210 ( 4.894 1.356 -0.958) 5.168 8.239 ( 4.176 -1.466 -0.463) 4.450 13.355 ( -0.370 0.957 0.693) 1.238 13.386 ( -1.158 -1.948 1.210) 2.569 13.857 ( 2.609 1.620 0.032) 3.072 13.889 ( 2.421 -1.444 -0.761) 2.920 14.181 ( 1.083 -0.014 -0.307) 1.126 14.182 ( 1.085 -0.021 0.206) 1.104 14.312 ( 1.149 1.459 -0.918) 2.071 14.348 ( 0.925 -1.958 -1.611) 2.699 16.489 ( -0.468 1.132 0.282) 1.257 16.535 ( -1.965 -3.291 0.318) 3.846 17.222 ( -0.831 3.131 1.013) 3.394 17.254 ( -1.124 -0.021 0.414) 1.198 28.015 ( 1.007 3.356 0.689) 3.571 28.068 ( 0.947 -0.966 -0.576) 1.470 28.211 ( -1.127 0.462 0.157) 1.228 28.245 ( -1.580 -2.165 -0.237) 2.690 28.760 ( 0.309 0.508 0.262) 0.650 28.771 ( 0.153 -0.580 0.105) 0.609 28.799 ( 0.065 0.523 0.223) 0.572 28.813 ( -0.055 -0.863 -0.157) 0.878 29.017 ( 0.764 0.879 -0.105) 1.170 29.027 ( 0.698 -0.038 -0.039) 0.700 29.082 ( -0.331 0.649 0.120) 0.739 29.097 ( -0.726 -0.639 0.532) 1.104 31.338 ( 4.572 3.606 0.868) 5.888 31.417 ( 5.303 -3.930 -0.267) 6.606 31.803 ( -3.637 3.354 -0.645) 4.989 31.854 ( -5.462 -0.637 2.985) 6.257 32.147 ( 5.553 0.483 2.385) 6.063 32.210 ( 1.028 -4.517 5.232) 6.989 32.548 ( 2.096 9.174 -5.083) 10.696 32.773 ( 0.221 -11.822 -7.416) 13.957 70.148 ( -0.131 1.028 0.382) 1.105 70.169 ( -0.249 -1.028 -0.406) 1.133 70.391 ( 0.967 1.103 0.399) 1.520 70.410 ( 0.854 -0.611 -0.069) 1.052 ======================= Grid point 192 (107/112) ======================= q-point: ( 0.45 0.43 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.346 ( -2.430 1.395 -2.678) 3.876 2.374 ( -2.666 -1.397 -4.438) 5.362 2.554 ( 8.083 3.370 0.704) 8.786 2.624 ( -0.171 -2.948 3.145) 4.314 2.961 ( 9.190 3.514 3.549) 10.460 2.976 ( 7.950 2.269 0.203) 8.270 3.095 ( 0.858 3.759 0.033) 3.856 3.124 ( 4.857 1.631 1.994) 5.498 3.316 ( -6.434 6.495 3.804) 9.902 3.468 ( -4.199 -6.279 -0.348) 7.562 3.515 ( 1.834 6.386 -4.262) 7.894 3.616 ( -0.604 -3.244 -4.184) 5.329 3.811 ( 0.783 6.494 -2.107) 6.872 3.899 ( 0.346 -1.264 -4.309) 4.503 3.938 ( -2.925 4.412 2.902) 6.037 4.008 ( -3.930 -1.826 0.583) 4.372 4.140 ( -0.440 9.666 3.273) 10.214 4.276 ( -2.349 0.689 -2.234) 3.314 4.371 ( -1.797 4.217 0.746) 4.645 4.456 ( -3.184 -0.954 -5.206) 6.176 4.521 ( -1.589 -6.817 -2.531) 7.443 4.610 ( -0.606 -13.370 -4.847) 14.234 4.922 ( -3.206 1.472 -0.083) 3.529 4.968 ( -4.530 -2.371 -2.444) 5.667 5.056 ( 0.919 3.692 0.666) 3.862 5.084 ( -0.447 2.714 -1.786) 3.280 5.162 ( 2.722 -3.176 0.254) 4.190 5.178 ( 0.181 -4.007 2.452) 4.701 5.425 ( -1.354 0.805 2.488) 2.945 5.446 ( 2.947 -1.218 -0.367) 3.210 5.725 ( -0.703 0.660 1.703) 1.957 5.759 ( 0.520 -2.214 -0.752) 2.395 6.048 ( -0.857 4.731 6.607) 8.171 6.142 ( -1.205 -2.887 2.498) 4.003 6.279 ( -1.003 4.026 4.967) 6.472 6.400 ( -2.075 -6.815 1.022) 7.197 6.701 ( -0.516 2.794 -2.168) 3.574 6.719 ( 0.911 1.797 -4.304) 4.752 6.966 ( -0.376 1.666 3.516) 3.909 7.023 ( -0.060 -2.989 0.382) 3.014 7.118 ( 2.015 6.794 1.563) 7.257 7.205 ( -1.618 6.297 -1.392) 6.649 7.291 ( -0.865 -8.488 1.892) 8.739 7.335 ( 1.408 -5.714 -2.208) 6.285 7.864 ( 1.134 0.117 -0.470) 1.233 7.886 ( 0.114 -1.798 -1.020) 2.071 8.271 ( 2.205 1.347 -0.120) 2.587 8.292 ( 1.983 -0.650 -0.892) 2.269 13.361 ( 0.359 0.020 0.647) 0.740 13.375 ( -0.922 -1.334 0.700) 1.766 13.887 ( 0.816 1.117 -0.038) 1.383 13.906 ( 0.470 -0.676 -1.042) 1.328 14.204 ( 0.947 -0.014 0.668) 1.159 14.206 ( 1.113 -0.144 0.527) 1.240 14.316 ( 0.215 0.975 -0.958) 1.383 14.338 ( -0.173 -1.205 -1.952) 2.301 16.492 ( 0.405 -0.451 0.301) 0.677 16.509 ( -1.139 -2.148 0.112) 2.433 17.220 ( -0.191 2.316 0.942) 2.507 17.238 ( -0.668 0.542 0.077) 0.863 28.039 ( 0.736 3.095 0.995) 3.334 28.075 ( 0.462 0.376 -0.976) 1.143 28.195 ( -0.706 -0.981 0.353) 1.259 28.215 ( -0.947 -2.273 -0.705) 2.561 28.767 ( 0.224 0.257 0.258) 0.427 28.774 ( 0.037 -0.343 0.010) 0.345 28.800 ( -0.059 0.251 0.206) 0.330 28.809 ( -0.137 -0.586 -0.306) 0.675 29.030 ( 0.514 0.975 0.128) 1.110 29.036 ( 0.243 0.428 -0.056) 0.495 29.081 ( 0.192 0.035 0.159) 0.252 29.087 ( -0.668 -0.464 0.381) 0.899 31.446 ( 4.916 3.805 3.228) 7.005 31.520 ( 4.778 -3.041 1.111) 5.772 31.709 ( -4.361 1.374 -1.271) 4.746 31.749 ( -7.247 -1.867 0.884) 7.536 32.233 ( 1.584 2.772 2.535) 4.076 32.286 ( 2.629 -0.718 1.785) 3.258 32.555 ( 1.893 3.613 -1.797) 4.457 32.704 ( -0.672 -9.317 -7.297) 11.853 70.150 ( -0.027 0.618 0.479) 0.782 70.164 ( 0.018 -0.669 -0.443) 0.803 70.407 ( 0.357 0.732 0.368) 0.894 70.418 ( 0.226 -0.322 -0.255) 0.469 ======================= Grid point 193 (108/112) ======================= q-point: (-0.45 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.304 ( -0.830 0.874 0.637) 1.363 2.333 ( 1.190 -1.928 -0.886) 2.432 2.522 ( -10.709 6.220 3.033) 12.751 2.646 ( -0.941 -4.984 1.349) 5.248 2.976 ( -11.180 5.847 -0.382) 12.622 3.053 ( -7.194 -0.069 -4.525) 8.499 3.096 ( -1.741 3.370 -0.818) 3.880 3.155 ( 3.583 -1.322 1.485) 4.097 3.294 ( 1.646 7.713 6.725) 10.365 3.421 ( 0.572 -3.937 3.144) 5.071 3.582 ( 9.709 5.735 -11.341) 15.993 3.672 ( 9.632 -2.129 -10.687) 14.543 3.789 ( -1.597 6.363 0.462) 6.577 3.827 ( 3.823 3.825 1.922) 5.739 3.952 ( -2.981 1.984 2.352) 4.284 4.002 ( 1.288 -1.120 1.996) 2.627 4.172 ( 0.306 7.366 4.985) 8.899 4.238 ( 0.980 6.152 -4.919) 7.937 4.340 ( -2.392 -1.508 4.407) 5.237 4.417 ( 0.606 0.761 -2.478) 2.662 4.523 ( 0.351 -11.770 -1.514) 11.872 4.580 ( 4.110 -11.309 -2.652) 12.322 4.879 ( -3.562 -0.263 2.616) 4.427 4.891 ( -1.614 -0.702 5.645) 5.913 5.040 ( -3.369 2.197 -0.304) 4.033 5.059 ( -2.453 0.314 2.514) 3.527 5.193 ( 2.572 -0.848 -1.787) 3.245 5.237 ( 5.446 -4.271 -3.529) 7.769 5.446 ( 2.746 3.504 -1.072) 4.579 5.510 ( 5.538 -2.090 -4.088) 7.193 5.731 ( -0.441 0.418 1.630) 1.739 5.767 ( 1.371 -2.491 -1.822) 3.377 6.108 ( 1.405 4.019 5.505) 6.959 6.139 ( 0.774 1.567 -0.719) 1.889 6.312 ( -1.538 -0.320 6.743) 6.923 6.363 ( -1.372 -4.732 -0.670) 4.972 6.679 ( -0.582 2.524 -1.036) 2.790 6.703 ( 0.644 0.814 -2.744) 2.934 6.982 ( -1.314 1.054 3.980) 4.321 7.015 ( -0.989 -2.213 -0.298) 2.442 7.149 ( -1.022 6.604 -0.521) 6.703 7.186 ( 2.163 6.329 -0.466) 6.705 7.282 ( -1.732 -5.956 1.881) 6.482 7.347 ( 1.682 -7.813 -2.301) 8.317 7.864 ( -1.473 -0.438 -0.185) 1.548 7.875 ( -0.206 -1.483 -0.314) 1.530 8.281 ( -1.090 0.777 -0.190) 1.352 8.290 ( -1.036 0.038 -1.514) 1.835 13.366 ( -0.506 -0.086 0.262) 0.576 13.378 ( 0.883 -1.203 0.491) 1.571 13.889 ( -0.801 0.445 0.445) 1.019 13.893 ( -1.025 0.070 -0.573) 1.176 14.214 ( -0.353 0.098 -0.097) 0.379 14.220 ( 0.030 -0.390 -0.423) 0.576 14.311 ( -0.255 0.123 0.203) 0.349 14.315 ( -0.565 -0.298 -1.079) 1.253 16.494 ( -0.512 -0.598 0.104) 0.794 16.509 ( 1.137 -1.993 0.157) 2.299 17.230 ( 0.396 1.744 0.404) 1.833 17.237 ( 0.800 1.078 -0.117) 1.348 28.051 ( -0.470 2.462 0.718) 2.607 28.068 ( -0.007 1.159 -1.146) 1.630 28.189 ( -0.321 -0.735 0.785) 1.122 28.213 ( 1.332 -2.684 -0.521) 3.041 28.771 ( -0.220 -0.010 0.130) 0.255 28.771 ( -0.166 -0.069 0.059) 0.189 28.802 ( 0.100 -0.040 0.300) 0.319 28.805 ( 0.042 -0.331 -0.280) 0.435 29.029 ( -0.636 0.971 0.149) 1.171 29.038 ( -0.031 0.327 -0.192) 0.380 29.081 ( -0.227 0.298 0.254) 0.453 29.092 ( 0.706 -0.589 -0.006) 0.920 31.502 ( -4.486 1.968 -0.479) 4.922 31.528 ( -3.094 -0.044 -0.347) 3.113 31.669 ( 0.517 1.258 2.110) 2.510 31.723 ( 4.817 -3.603 2.555) 6.536 32.247 ( -2.665 5.280 3.126) 6.689 32.316 ( 1.309 0.928 -2.391) 2.880 32.566 ( -1.938 -1.942 1.281) 3.027 32.643 ( 1.581 -7.180 -6.063) 9.529 70.153 ( -0.075 0.406 0.426) 0.593 70.162 ( 0.227 -0.404 -0.497) 0.680 70.411 ( -0.258 0.319 0.403) 0.575 70.414 ( -0.389 0.031 -0.299) 0.492 ======================= Grid point 194 (109/112) ======================= q-point: (-0.36 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.293 ( -12.759 10.697 4.477) 17.242 2.362 ( 1.446 2.314 1.452) 3.091 2.402 ( 4.741 -1.883 1.908) 5.446 2.518 ( -13.007 -7.125 -2.930) 15.117 2.725 ( -16.875 2.465 3.713) 17.453 2.760 ( -14.989 -0.285 1.827) 15.103 3.057 ( -4.152 3.824 -4.653) 7.315 3.101 ( -4.543 -0.869 -4.358) 6.355 3.442 ( 9.385 5.615 -0.393) 10.943 3.527 ( 3.292 3.411 -1.621) 5.010 3.582 ( 1.707 1.172 -0.376) 2.104 3.689 ( -3.422 -3.363 -2.187) 5.273 3.860 ( 8.424 3.701 -2.320) 9.490 3.890 ( -0.024 3.762 -0.472) 3.791 4.012 ( 7.958 3.788 0.758) 8.846 4.074 ( 3.723 1.265 2.212) 4.512 4.209 ( 5.618 7.110 -3.362) 9.665 4.269 ( 1.803 5.788 6.104) 8.603 4.407 ( 3.190 -3.216 6.855) 8.216 4.410 ( 0.724 -1.856 2.794) 3.431 4.534 ( 3.083 -6.771 -1.283) 7.550 4.654 ( 5.407 -11.631 -1.756) 12.946 4.860 ( -3.542 2.934 3.301) 5.661 4.969 ( 1.459 -5.194 5.463) 7.678 5.011 ( 1.942 1.392 1.311) 2.725 5.046 ( 0.141 -1.384 4.466) 4.677 5.220 ( 2.858 0.933 -3.670) 4.744 5.284 ( 3.998 -4.396 -5.925) 8.391 5.495 ( 4.710 3.600 -3.658) 6.966 5.567 ( 5.731 -2.947 -5.972) 8.786 5.737 ( -0.016 1.301 0.799) 1.527 5.776 ( 1.930 -1.806 -2.476) 3.621 6.126 ( 0.619 4.809 -3.128) 5.770 6.196 ( 2.391 -1.161 0.315) 2.676 6.301 ( -1.734 2.187 1.116) 3.006 6.382 ( -0.608 -4.389 6.200) 7.621 6.666 ( -0.907 2.684 1.017) 3.010 6.699 ( 0.781 0.188 -0.005) 0.803 6.964 ( -3.523 0.644 -0.665) 3.643 6.993 ( -1.700 -0.902 3.336) 3.851 7.120 ( 0.172 7.936 -3.110) 8.526 7.234 ( 2.316 2.300 0.670) 3.332 7.269 ( -0.733 -3.911 1.464) 4.240 7.357 ( 1.546 -8.075 -1.690) 8.394 7.823 ( -2.792 0.871 0.440) 2.957 7.861 ( -1.496 -2.612 0.527) 3.056 8.222 ( -4.012 0.999 -1.876) 4.540 8.241 ( -3.201 -0.768 -0.817) 3.392 13.364 ( 0.259 1.209 -0.032) 1.237 13.400 ( 1.272 -2.216 0.056) 2.556 13.858 ( -2.355 0.651 -0.191) 2.451 13.868 ( -2.240 -0.344 0.954) 2.459 14.190 ( -1.436 0.329 -1.024) 1.794 14.200 ( -1.064 -0.432 -1.430) 1.834 14.298 ( -0.928 0.543 0.230) 1.099 14.313 ( -0.664 -1.009 1.425) 1.868 16.493 ( 0.410 1.081 -0.028) 1.156 16.538 ( 2.019 -3.259 0.082) 3.835 17.242 ( 1.075 2.396 -0.643) 2.704 17.259 ( 1.400 0.627 -0.054) 1.535 28.035 ( -0.797 2.056 -1.036) 2.436 28.059 ( -0.600 0.403 0.131) 0.734 28.203 ( 1.071 0.625 0.785) 1.468 28.241 ( 1.684 -2.432 0.074) 2.959 28.764 ( -0.392 0.268 -0.061) 0.479 28.770 ( -0.226 -0.345 0.227) 0.471 28.804 ( 0.075 -0.016 -0.302) 0.311 28.808 ( 0.186 -0.396 0.307) 0.535 29.016 ( -0.841 0.884 0.016) 1.220 29.028 ( -0.738 -0.231 -0.162) 0.790 29.083 ( 0.305 1.086 0.043) 1.128 29.104 ( 0.695 -0.797 -0.163) 1.070 31.380 ( -5.765 1.732 -2.777) 6.629 31.422 ( -6.311 -2.276 -0.647) 6.740 31.749 ( 2.035 3.673 3.830) 5.683 31.829 ( 2.278 -3.676 4.175) 6.011 32.207 ( -2.852 6.275 0.654) 6.924 32.313 ( 2.517 0.044 -4.502) 5.158 32.512 ( -2.783 -0.151 -0.952) 2.945 32.646 ( -0.313 -9.716 1.057) 9.778 70.155 ( 0.066 0.527 -0.052) 0.533 70.164 ( 0.373 -0.387 -0.155) 0.559 70.399 ( -0.914 0.435 -0.306) 1.057 70.405 ( -0.745 -0.116 0.366) 0.838 ======================= Grid point 195 (110/112) ======================= q-point: (-0.27 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.035 ( -16.342 10.224 2.179) 19.399 2.168 ( -18.018 -0.454 -4.402) 18.554 2.364 ( -8.855 5.490 2.670) 10.756 2.440 ( -12.373 -0.605 4.261) 13.100 2.589 ( 5.225 -0.061 3.302) 6.181 2.649 ( -0.693 -4.217 7.998) 9.068 2.949 ( -1.816 3.139 -1.592) 3.960 3.003 ( -3.620 -1.573 1.233) 4.134 3.395 ( -7.720 6.521 -4.181) 10.937 3.525 ( -4.388 2.317 1.558) 5.201 3.552 ( -6.194 -4.106 -4.325) 8.598 3.637 ( -3.295 -4.353 1.252) 5.601 3.914 ( 0.761 13.197 8.220) 15.567 4.022 ( 11.256 3.953 -0.240) 11.932 4.174 ( 13.050 -2.503 -5.309) 14.310 4.196 ( 8.033 -1.188 -2.280) 8.435 4.274 ( 2.992 7.772 -1.425) 8.449 4.374 ( 4.531 0.953 2.731) 5.375 4.520 ( 5.546 -0.872 5.925) 8.162 4.544 ( 5.123 -2.149 6.110) 8.258 4.633 ( 7.172 -2.384 2.351) 7.915 4.728 ( 1.809 -4.333 -1.773) 5.020 4.840 ( 2.664 0.137 2.211) 3.464 4.982 ( -0.147 -9.939 -0.260) 9.943 5.087 ( 4.041 3.276 -0.526) 5.229 5.155 ( 4.862 -2.700 3.009) 6.323 5.249 ( 4.639 1.343 -3.526) 5.980 5.296 ( 3.492 -2.206 -5.168) 6.616 5.545 ( 4.443 2.703 -4.549) 6.909 5.612 ( 4.743 -3.312 -6.310) 8.560 5.737 ( 0.040 3.011 -1.041) 3.186 5.807 ( 2.848 -3.225 -0.026) 4.302 6.079 ( -2.134 5.277 -4.888) 7.503 6.177 ( -2.048 -3.595 -3.103) 5.172 6.294 ( -0.813 3.678 -0.549) 3.807 6.391 ( -3.416 -5.148 2.019) 6.500 6.651 ( -2.511 4.930 1.984) 5.877 6.732 ( -0.178 -1.679 3.708) 4.075 6.889 ( -2.818 4.895 -0.494) 5.670 6.987 ( -2.458 -2.914 3.361) 5.082 7.109 ( 1.970 7.496 -2.567) 8.165 7.255 ( 0.614 -4.528 0.369) 4.584 7.323 ( 4.303 0.117 1.693) 4.626 7.380 ( 1.889 -5.844 -0.119) 6.142 7.786 ( -2.256 1.417 2.950) 3.975 7.837 ( -1.943 -2.973 1.965) 4.059 8.121 ( -4.673 2.018 -2.206) 5.547 8.171 ( -3.003 -2.731 -1.103) 4.206 13.376 ( 1.222 2.016 -0.304) 2.377 13.423 ( 1.553 -2.488 -0.664) 3.007 13.803 ( -3.433 0.895 -0.452) 3.576 13.822 ( -3.694 -0.989 0.739) 3.895 14.158 ( -1.230 0.433 -0.151) 1.312 14.169 ( -1.051 -0.372 -0.861) 1.408 14.279 ( -1.524 0.851 0.428) 1.797 14.306 ( -1.618 -1.738 1.425) 2.769 16.512 ( 1.881 2.799 -0.115) 3.375 16.585 ( 3.177 -4.162 -0.159) 5.239 17.253 ( 0.904 2.893 -1.371) 3.327 17.278 ( 0.732 0.321 -0.542) 0.965 28.012 ( -0.475 2.346 -1.361) 2.753 28.051 ( -0.294 -0.869 0.154) 0.930 28.231 ( 1.144 1.502 0.207) 1.899 28.268 ( 0.921 -1.688 0.145) 1.928 28.758 ( -0.084 0.487 -0.047) 0.497 28.769 ( -0.067 -0.524 0.195) 0.563 28.801 ( -0.144 0.299 -0.466) 0.572 28.812 ( -0.048 -0.756 0.083) 0.762 29.002 ( -0.665 0.675 0.081) 0.951 29.013 ( -0.771 -0.357 -0.041) 0.850 29.090 ( 0.379 1.337 -0.021) 1.389 29.113 ( 0.539 -0.853 -0.293) 1.051 31.265 ( -4.696 1.862 -1.318) 5.221 31.314 ( -5.264 -2.914 0.276) 6.023 31.757 ( -4.228 3.511 3.437) 6.482 31.847 ( -4.702 -4.899 4.307) 8.041 32.191 ( 3.695 9.879 -5.016) 11.679 32.331 ( 2.099 3.361 -4.287) 5.838 32.480 ( 1.366 -3.809 -1.766) 4.415 32.638 ( -4.367 -12.386 7.885) 15.318 70.157 ( 0.473 0.914 -0.365) 1.092 70.173 ( 0.615 -0.593 0.188) 0.875 70.376 ( -1.235 0.818 -0.453) 1.549 70.390 ( -1.127 -0.483 0.086) 1.229 ======================= Grid point 196 (111/112) ======================= q-point: (-0.18 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.781 ( -13.368 7.985 3.902) 16.053 1.859 ( -12.922 2.282 0.106) 13.123 2.196 ( -11.835 5.835 6.591) 14.750 2.229 ( -13.139 2.190 4.292) 13.994 2.692 ( 0.969 -0.390 0.083) 1.048 2.719 ( 5.252 -2.841 -1.303) 6.112 3.004 ( 1.075 1.154 7.621) 7.782 3.025 ( 0.437 0.679 10.583) 10.613 3.233 ( -5.429 2.713 -4.247) 7.407 3.354 ( -5.730 -9.126 -9.051) 14.073 3.475 ( -5.930 5.773 10.933) 13.712 3.550 ( -6.701 -2.377 5.999) 9.303 4.007 ( -1.333 11.085 10.638) 15.422 4.189 ( 4.383 -1.591 1.374) 4.861 4.286 ( 2.051 5.441 -0.628) 5.849 4.312 ( 8.404 2.714 -8.772) 12.447 4.367 ( 9.719 0.644 -3.867) 10.480 4.459 ( 6.670 0.532 -4.494) 8.060 4.637 ( 4.704 -0.610 -3.568) 5.935 4.676 ( 4.603 -2.703 2.112) 5.740 4.716 ( 0.305 -2.314 2.892) 3.716 4.791 ( 5.834 -1.233 1.791) 6.226 4.958 ( 5.056 0.434 -1.541) 5.304 5.006 ( 5.905 -5.512 -1.609) 8.237 5.155 ( 5.090 1.753 -1.585) 5.612 5.241 ( 3.477 -5.834 1.430) 6.941 5.326 ( 4.782 1.572 -3.129) 5.927 5.346 ( 7.751 -0.335 -3.154) 8.374 5.569 ( 2.174 1.844 -4.162) 5.045 5.622 ( 1.782 -3.165 -4.846) 6.056 5.728 ( 0.580 6.456 -1.271) 6.606 5.868 ( 2.598 -6.506 1.204) 7.108 5.976 ( -3.984 5.793 -4.734) 8.476 6.099 ( -3.670 -5.173 -2.627) 6.865 6.217 ( -5.514 2.549 -5.127) 7.949 6.290 ( -6.287 -4.542 -2.321) 8.096 6.605 ( -4.513 6.919 2.937) 8.767 6.730 ( -3.337 -4.859 4.705) 7.542 6.859 ( -1.780 7.614 -0.448) 7.832 6.959 ( -2.425 -2.120 1.916) 3.748 7.166 ( 4.297 5.587 1.338) 7.174 7.288 ( 2.519 -4.089 0.808) 4.870 7.401 ( 0.572 -0.998 0.341) 1.199 7.416 ( 3.109 -2.482 0.415) 4.000 7.818 ( 0.392 -1.189 8.472) 8.564 7.837 ( -1.312 -2.125 5.262) 5.824 8.041 ( -0.833 3.692 -3.037) 4.853 8.134 ( 0.746 -5.130 -1.811) 5.492 13.401 ( 1.845 2.105 -0.655) 2.875 13.442 ( 1.405 -1.774 -1.426) 2.675 13.732 ( -3.503 0.652 -0.907) 3.677 13.751 ( -4.388 -1.169 0.211) 4.546 14.148 ( -0.583 0.054 1.094) 1.240 14.152 ( -0.409 -0.168 0.455) 0.635 14.251 ( -1.788 0.776 0.077) 1.950 14.281 ( -2.117 -2.131 0.911) 3.139 16.561 ( 3.643 4.107 -0.072) 5.490 16.649 ( 4.110 -4.321 -0.505) 5.985 17.243 ( -0.475 2.952 -2.031) 3.614 17.270 ( -0.906 0.173 -1.158) 1.480 28.000 ( 0.391 2.890 -1.047) 3.098 28.054 ( 0.644 -1.962 -0.030) 2.066 28.235 ( -0.350 1.929 -1.461) 2.445 28.269 ( -0.794 -1.163 -0.560) 1.516 28.761 ( 0.403 0.519 -0.121) 0.668 28.771 ( 0.130 -0.457 0.151) 0.499 28.792 ( -0.268 0.511 -0.487) 0.755 28.808 ( -0.365 -0.967 -0.032) 1.034 28.995 ( -0.242 0.458 0.305) 0.602 29.003 ( -0.348 -0.315 0.274) 0.543 29.097 ( 0.328 1.286 0.092) 1.330 29.119 ( 0.377 -0.805 -0.335) 0.951 31.194 ( -2.942 1.640 1.207) 3.578 31.241 ( -3.784 -2.948 1.840) 5.138 31.691 ( -5.138 2.924 2.922) 6.594 31.766 ( -6.577 -4.139 3.357) 8.465 32.201 ( 3.635 9.283 -11.957) 15.568 32.298 ( -2.542 5.567 -1.487) 6.298 32.514 ( 2.561 -5.407 0.889) 6.048 32.665 ( -1.160 -13.752 10.837) 17.547 70.168 ( 1.062 1.319 -0.234) 1.709 70.191 ( 1.021 -0.840 0.468) 1.403 70.347 ( -1.400 1.043 -0.873) 1.952 70.365 ( -1.533 -0.617 -0.526) 1.734 ======================= Grid point 197 (112/112) ======================= q-point: (-0.09 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-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 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.654 ( -5.662 7.715 7.032) 11.875 1.716 ( -4.875 3.764 3.383) 7.027 2.057 ( -8.240 5.134 4.268) 10.605 2.088 ( -6.154 5.606 4.483) 9.455 2.699 ( 0.739 -0.851 -1.168) 1.623 2.779 ( 3.921 -6.668 -4.453) 8.926 3.050 ( -2.714 3.468 8.071) 9.194 3.101 ( -3.533 1.476 14.507) 15.004 3.123 ( -2.659 -1.202 -2.841) 4.072 3.199 ( -3.817 -8.993 -7.095) 12.074 3.557 ( -1.587 3.411 13.487) 14.002 3.587 ( 1.997 1.288 16.559) 16.728 4.018 ( -4.933 8.577 5.783) 11.461 4.186 ( -3.163 -4.876 -3.651) 6.863 4.301 ( 3.873 7.976 -5.286) 10.322 4.361 ( 2.726 1.213 -4.962) 5.790 4.465 ( 9.084 7.095 -6.874) 13.420 4.580 ( 11.007 -1.304 -7.573) 13.424 4.655 ( 2.751 2.880 -3.763) 5.479 4.736 ( 1.808 -4.762 -0.884) 5.170 4.782 ( 0.310 -3.866 3.289) 5.085 4.840 ( 0.436 -3.448 -1.872) 3.948 4.955 ( -2.095 5.726 -4.078) 7.335 5.073 ( 1.476 -4.434 -4.777) 6.683 5.224 ( 3.640 -1.675 -1.522) 4.286 5.285 ( 0.330 -6.068 -0.245) 6.082 5.433 ( 8.655 3.085 -2.285) 9.468 5.477 ( 5.933 -1.221 -1.839) 6.330 5.557 ( 0.243 3.153 0.354) 3.182 5.623 ( 3.187 -2.540 -0.928) 4.180 5.751 ( 3.314 7.577 -3.250) 8.886 5.859 ( -3.845 3.198 0.679) 5.047 5.926 ( 1.316 -6.451 -2.951) 7.215 5.999 ( -4.043 -6.830 -3.474) 8.663 6.068 ( -4.893 4.084 -1.340) 6.512 6.163 ( -5.043 -4.328 -2.146) 6.984 6.555 ( -3.743 7.613 3.934) 9.351 6.693 ( -5.108 -4.298 3.066) 7.346 6.818 ( -0.805 6.877 0.065) 6.924 6.938 ( -1.442 -4.081 0.224) 4.334 7.251 ( 2.679 5.288 2.503) 6.434 7.346 ( 2.223 -1.684 1.470) 3.152 7.387 ( -1.167 1.859 -0.667) 2.294 7.449 ( 0.468 -3.499 -0.771) 3.613 7.864 ( -1.734 0.671 8.026) 8.239 7.923 ( 0.439 -4.283 11.215) 12.013 8.049 ( 3.984 3.247 -3.848) 6.421 8.167 ( 4.464 -7.322 -3.257) 9.173 13.425 ( 1.262 1.556 -0.811) 2.161 13.446 ( 0.525 -0.379 -1.688) 1.808 13.673 ( -1.817 -0.213 -0.925) 2.050 13.680 ( -3.156 -0.765 0.081) 3.248 14.151 ( 0.160 0.518 0.837) 0.997 14.163 ( 0.037 -0.588 1.985) 2.071 14.221 ( -1.221 0.275 -0.279) 1.283 14.250 ( -1.665 -2.402 0.274) 2.936 16.637 ( 4.153 4.224 0.412) 5.938 16.713 ( 3.182 -3.098 -0.980) 4.548 17.204 ( -1.486 2.603 -2.132) 3.678 17.228 ( -2.035 0.079 -1.698) 2.651 28.012 ( 1.669 3.384 -0.273) 3.783 28.076 ( 1.762 -2.399 0.006) 2.976 28.189 ( -2.434 2.259 -2.926) 4.426 28.228 ( -2.478 -1.347 -1.649) 3.267 28.769 ( 0.694 0.366 -0.289) 0.836 28.775 ( -0.118 -0.019 0.426) 0.443 28.786 ( 0.145 0.251 -0.416) 0.507 28.800 ( -0.563 -0.896 0.051) 1.060 28.998 ( 0.076 0.412 0.541) 0.684 29.005 ( 0.203 -0.302 0.340) 0.498 29.103 ( 0.223 1.000 0.311) 1.071 29.121 ( 0.203 -0.658 -0.362) 0.778 31.179 ( -0.829 0.656 2.773) 2.968 31.209 ( -1.700 -2.374 2.299) 3.716 31.647 ( -2.010 2.447 2.545) 4.063 31.697 ( -3.517 -2.289 2.520) 4.894 32.133 ( -0.618 6.037 -7.385) 9.559 32.193 ( -5.870 2.657 -4.139) 7.658 32.607 ( 2.885 -2.598 7.730) 8.650 32.744 ( 2.101 -12.832 3.599) 13.491 70.193 ( 1.600 1.514 0.372) 2.234 70.218 ( 1.376 -0.945 0.847) 1.872 70.310 ( -1.571 1.093 -1.586) 2.486 70.326 ( -1.819 -0.469 -1.199) 2.229 =================== 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 3/32340 10.0 454.807 563.803 578.550 0.000 -112.771 0.000 3/32340 20.0 95.796 90.755 116.596 0.000 -17.383 0.000 3/32340 30.0 35.960 29.744 40.757 0.000 -5.863 0.000 3/32340 40.0 18.747 14.576 20.612 0.000 -2.827 0.000 3/32340 50.0 11.940 8.976 12.904 0.000 -1.692 0.000 3/32340 60.0 8.601 6.337 9.188 0.000 -1.166 0.000 3/32340 70.0 6.698 4.873 7.095 0.000 -0.880 0.000 3/32340 80.0 5.490 3.963 5.779 0.000 -0.707 0.000 3/32340 90.0 4.661 3.349 4.883 0.000 -0.591 0.000 3/32340 100.0 4.057 2.907 4.235 0.000 -0.509 0.000 3/32340 110.0 3.598 2.574 3.746 0.000 -0.448 0.000 3/32340 120.0 3.236 2.315 3.362 0.000 -0.400 0.000 3/32340 130.0 2.944 2.106 3.053 0.000 -0.362 0.000 3/32340 140.0 2.703 1.935 2.799 0.000 -0.331 0.000 3/32340 150.0 2.500 1.792 2.586 0.000 -0.305 0.000 3/32340 160.0 2.328 1.671 2.405 0.000 -0.283 0.000 3/32340 170.0 2.179 1.567 2.250 0.000 -0.264 0.000 3/32340 180.0 2.049 1.477 2.114 0.000 -0.247 0.000 3/32340 190.0 1.934 1.398 1.995 0.000 -0.233 0.000 3/32340 200.0 1.833 1.329 1.890 0.000 -0.220 0.000 3/32340 210.0 1.743 1.267 1.796 0.000 -0.209 0.000 3/32340 220.0 1.662 1.213 1.712 0.000 -0.199 0.000 3/32340 230.0 1.589 1.164 1.636 0.000 -0.190 0.000 3/32340 240.0 1.522 1.120 1.568 0.000 -0.182 0.000 3/32340 250.0 1.462 1.080 1.506 0.000 -0.175 0.000 3/32340 260.0 1.407 1.044 1.449 0.000 -0.168 0.000 3/32340 270.0 1.356 1.011 1.397 0.000 -0.162 0.000 3/32340 280.0 1.310 0.981 1.349 0.000 -0.156 0.000 3/32340 290.0 1.266 0.954 1.304 0.000 -0.151 0.000 3/32340 300.0 1.226 0.928 1.263 0.000 -0.146 0.000 3/32340 310.0 1.189 0.905 1.225 0.000 -0.142 0.000 3/32340 320.0 1.154 0.883 1.189 0.000 -0.138 0.000 3/32340 330.0 1.122 0.862 1.156 0.000 -0.134 0.000 3/32340 340.0 1.091 0.843 1.125 0.000 -0.130 0.000 3/32340 350.0 1.063 0.825 1.096 0.000 -0.127 0.000 3/32340 360.0 1.036 0.808 1.068 0.000 -0.124 0.000 3/32340 370.0 1.010 0.792 1.042 0.000 -0.121 0.000 3/32340 380.0 0.986 0.777 1.017 0.000 -0.118 0.000 3/32340 390.0 0.963 0.762 0.994 0.000 -0.115 0.000 3/32340 400.0 0.941 0.748 0.972 0.000 -0.113 0.000 3/32340 410.0 0.921 0.735 0.951 0.000 -0.110 0.000 3/32340 420.0 0.901 0.723 0.931 0.000 -0.108 0.000 3/32340 430.0 0.882 0.711 0.912 0.000 -0.106 0.000 3/32340 440.0 0.864 0.699 0.893 0.000 -0.104 0.000 3/32340 450.0 0.847 0.688 0.876 0.000 -0.102 0.000 3/32340 460.0 0.830 0.677 0.859 0.000 -0.100 0.000 3/32340 470.0 0.815 0.667 0.843 0.000 -0.098 0.000 3/32340 480.0 0.800 0.657 0.827 0.000 -0.096 0.000 3/32340 490.0 0.785 0.647 0.812 0.000 -0.095 0.000 3/32340 500.0 0.771 0.638 0.798 0.000 -0.093 0.000 3/32340 510.0 0.757 0.629 0.784 0.000 -0.091 0.000 3/32340 520.0 0.744 0.620 0.771 0.000 -0.090 0.000 3/32340 530.0 0.732 0.611 0.758 0.000 -0.088 0.000 3/32340 540.0 0.720 0.603 0.746 0.000 -0.087 0.000 3/32340 550.0 0.708 0.595 0.734 0.000 -0.086 0.000 3/32340 560.0 0.697 0.587 0.722 0.000 -0.084 0.000 3/32340 570.0 0.686 0.579 0.711 0.000 -0.083 0.000 3/32340 580.0 0.675 0.572 0.700 0.000 -0.082 0.000 3/32340 590.0 0.665 0.565 0.689 0.000 -0.080 0.000 3/32340 600.0 0.655 0.558 0.679 0.000 -0.079 0.000 3/32340 610.0 0.645 0.551 0.669 0.000 -0.078 0.000 3/32340 620.0 0.636 0.544 0.660 0.000 -0.077 0.000 3/32340 630.0 0.626 0.537 0.650 0.000 -0.076 0.000 3/32340 640.0 0.618 0.531 0.641 0.000 -0.075 0.000 3/32340 650.0 0.609 0.525 0.632 0.000 -0.074 0.000 3/32340 660.0 0.601 0.518 0.624 0.000 -0.073 0.000 3/32340 670.0 0.593 0.512 0.615 0.000 -0.072 0.000 3/32340 680.0 0.585 0.506 0.607 0.000 -0.071 0.000 3/32340 690.0 0.577 0.501 0.599 0.000 -0.070 0.000 3/32340 700.0 0.569 0.495 0.591 0.000 -0.069 0.000 3/32340 710.0 0.562 0.489 0.584 0.000 -0.068 0.000 3/32340 720.0 0.555 0.484 0.577 0.000 -0.068 0.000 3/32340 730.0 0.548 0.479 0.569 0.000 -0.067 0.000 3/32340 740.0 0.541 0.474 0.562 0.000 -0.066 0.000 3/32340 750.0 0.535 0.468 0.556 0.000 -0.065 0.000 3/32340 760.0 0.528 0.463 0.549 0.000 -0.064 0.000 3/32340 770.0 0.522 0.459 0.542 0.000 -0.064 0.000 3/32340 780.0 0.516 0.454 0.536 0.000 -0.063 0.000 3/32340 790.0 0.510 0.449 0.530 0.000 -0.062 0.000 3/32340 800.0 0.504 0.444 0.524 0.000 -0.061 0.000 3/32340 810.0 0.498 0.440 0.518 0.000 -0.061 0.000 3/32340 820.0 0.492 0.435 0.512 0.000 -0.060 0.000 3/32340 830.0 0.487 0.431 0.506 0.000 -0.059 0.000 3/32340 840.0 0.481 0.427 0.501 0.000 -0.059 0.000 3/32340 850.0 0.476 0.423 0.495 0.000 -0.058 0.000 3/32340 860.0 0.471 0.418 0.490 0.000 -0.058 0.000 3/32340 870.0 0.466 0.414 0.485 0.000 -0.057 0.000 3/32340 880.0 0.461 0.410 0.480 0.000 -0.056 0.000 3/32340 890.0 0.456 0.407 0.475 0.000 -0.056 0.000 3/32340 900.0 0.451 0.403 0.470 0.000 -0.055 0.000 3/32340 910.0 0.447 0.399 0.465 0.000 -0.055 0.000 3/32340 920.0 0.442 0.395 0.460 0.000 -0.054 0.000 3/32340 930.0 0.438 0.392 0.456 0.000 -0.054 0.000 3/32340 940.0 0.433 0.388 0.451 0.000 -0.053 0.000 3/32340 950.0 0.429 0.385 0.447 0.000 -0.053 0.000 3/32340 960.0 0.425 0.381 0.443 0.000 -0.052 0.000 3/32340 970.0 0.421 0.378 0.438 0.000 -0.052 0.000 3/32340 980.0 0.417 0.374 0.434 0.000 -0.051 0.000 3/32340 990.0 0.413 0.371 0.430 0.000 -0.051 0.000 3/32340 1000.0 0.409 0.368 0.426 0.000 -0.050 0.000 3/32340 Thermal conductivity related properties were written into "kappa-m1175.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 12:53:40]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|