----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 03:43:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 8 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.525363430017508 0.000000000000000 0.000000000000000 b 0.000000000000000 8.795664239999999 0.000000000000000 c -4.019710819432918 0.000000000000000 10.165151249579678 Atomic positions (fractional): *1 Li 0.61863645119979 0.73798427082894 0.20104191151723 6.941 2 Li 0.38136354880021 0.23798427082894 0.29895808848277 6.941 3 Li 0.38136354880021 0.26201572917106 0.79895808848277 6.941 4 Li 0.61863645119979 0.76201572917106 0.70104191151723 6.941 *5 Li 0.90691856513894 0.96454475523689 0.29691584176067 6.941 6 Li 0.09308143486106 0.46454475523689 0.20308415823933 6.941 7 Li 0.09308143486106 0.03545524476311 0.70308415823933 6.941 8 Li 0.90691856513894 0.53545524476311 0.79691584176067 6.941 *9 Li 0.37199139099124 0.50877849211252 0.06983329254927 6.941 10 Li 0.62800860900876 0.00877849211252 0.43016670745073 6.941 11 Li 0.62800860900876 0.49122150788748 0.93016670745073 6.941 12 Li 0.37199139099124 0.99122150788748 0.56983329254927 6.941 *13 O 0.25358602888355 0.67663568167636 0.14295133685584 15.999 14 O 0.74641397111645 0.17663568167636 0.35704866314416 15.999 15 O 0.74641397111645 0.32336431832364 0.85704866314416 15.999 16 O 0.25358602888355 0.82336431832364 0.64295133685584 15.999 *17 O 0.76736348289590 0.81095881455686 0.38068639925864 15.999 18 O 0.23263651710410 0.31095881455686 0.11931360074136 15.999 19 O 0.23263651710410 0.18904118544314 0.61931360074136 15.999 20 O 0.76736348289590 0.68904118544314 0.88068639925864 15.999 *21 O 0.78219924253547 0.89091047092973 0.11491022388978 15.999 22 O 0.21780075746453 0.39091047092973 0.38508977611022 15.999 23 O 0.21780075746453 0.10908952907027 0.88508977611022 15.999 24 O 0.78219924253547 0.60908952907027 0.61491022388978 15.999 *25 O 0.74162191231371 0.94874465220405 0.62318292420981 15.999 26 O 0.25837808768629 0.44874465220405 0.87681707579019 15.999 27 O 0.25837808768629 0.05125534779595 0.37681707579019 15.999 28 O 0.74162191231371 0.55125534779595 0.12318292420981 15.999 *29 K 0.70439169357993 0.00764714401112 0.86141890992964 39.098 30 K 0.29560830642007 0.50764714401112 0.63858109007036 39.098 31 K 0.29560830642007 0.99235285598888 0.13858109007036 39.098 32 K 0.70439169357993 0.49235285598888 0.36141890992964 39.098 *33 K 0.72000591615521 0.27333281267963 0.60795227880355 39.098 34 K 0.27999408384479 0.77333281267963 0.89204772119645 39.098 35 K 0.27999408384479 0.72666718732037 0.39204772119645 39.098 36 K 0.72000591615521 0.22666718732037 0.10795227880355 39.098 *37 Ga 0.89822244884121 0.71129803530764 0.06327068533386 69.723 38 Ga 0.10177755115879 0.21129803530763 0.43672931466615 69.723 39 Ga 0.10177755115879 0.28870196469236 0.93672931466614 69.723 40 Ga 0.89822244884121 0.78870196469236 0.56327068533386 69.723 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.525363430017508 0.000000000000000 0.000000000000000 b 0.000000000000000 8.795664239999999 0.000000000000000 c -4.019710819432918 0.000000000000000 10.165151249579678 Atomic positions (fractional): *1 Li 0.61863645119979 0.73798427082894 0.20104191151723 6.941 > 1 2 Li 0.38136354880021 0.23798427082894 0.29895808848277 6.941 > 2 3 Li 0.38136354880021 0.26201572917106 0.79895808848277 6.941 > 3 4 Li 0.61863645119979 0.76201572917106 0.70104191151723 6.941 > 4 *5 Li 0.90691856513894 0.96454475523689 0.29691584176067 6.941 > 5 6 Li 0.09308143486106 0.46454475523689 0.20308415823933 6.941 > 6 7 Li 0.09308143486106 0.03545524476311 0.70308415823933 6.941 > 7 8 Li 0.90691856513894 0.53545524476311 0.79691584176067 6.941 > 8 *9 Li 0.37199139099124 0.50877849211252 0.06983329254927 6.941 > 9 10 Li 0.62800860900876 0.00877849211252 0.43016670745073 6.941 > 10 11 Li 0.62800860900876 0.49122150788748 0.93016670745073 6.941 > 11 12 Li 0.37199139099124 0.99122150788748 0.56983329254927 6.941 > 12 *13 O 0.25358602888355 0.67663568167636 0.14295133685584 15.999 > 13 14 O 0.74641397111645 0.17663568167636 0.35704866314416 15.999 > 14 15 O 0.74641397111645 0.32336431832364 0.85704866314416 15.999 > 15 16 O 0.25358602888355 0.82336431832364 0.64295133685584 15.999 > 16 *17 O 0.76736348289590 0.81095881455686 0.38068639925864 15.999 > 17 18 O 0.23263651710410 0.31095881455686 0.11931360074136 15.999 > 18 19 O 0.23263651710410 0.18904118544314 0.61931360074136 15.999 > 19 20 O 0.76736348289590 0.68904118544314 0.88068639925864 15.999 > 20 *21 O 0.78219924253547 0.89091047092973 0.11491022388978 15.999 > 21 22 O 0.21780075746453 0.39091047092973 0.38508977611022 15.999 > 22 23 O 0.21780075746453 0.10908952907027 0.88508977611022 15.999 > 23 24 O 0.78219924253547 0.60908952907027 0.61491022388978 15.999 > 24 *25 O 0.74162191231371 0.94874465220405 0.62318292420981 15.999 > 25 26 O 0.25837808768629 0.44874465220405 0.87681707579019 15.999 > 26 27 O 0.25837808768629 0.05125534779595 0.37681707579019 15.999 > 27 28 O 0.74162191231371 0.55125534779595 0.12318292420981 15.999 > 28 *29 K 0.70439169357993 0.00764714401112 0.86141890992964 39.098 > 29 30 K 0.29560830642007 0.50764714401112 0.63858109007036 39.098 > 30 31 K 0.29560830642007 0.99235285598888 0.13858109007036 39.098 > 31 32 K 0.70439169357993 0.49235285598888 0.36141890992964 39.098 > 32 *33 K 0.72000591615521 0.27333281267963 0.60795227880355 39.098 > 33 34 K 0.27999408384479 0.77333281267963 0.89204772119645 39.098 > 34 35 K 0.27999408384479 0.72666718732037 0.39204772119645 39.098 > 35 36 K 0.72000591615521 0.22666718732037 0.10795227880355 39.098 > 36 *37 Ga 0.89822244884121 0.71129803530764 0.06327068533386 69.723 > 37 38 Ga 0.10177755115879 0.21129803530763 0.43672931466615 69.723 > 38 39 Ga 0.10177755115879 0.28870196469236 0.93672931466614 69.723 > 39 40 Ga 0.89822244884121 0.78870196469236 0.56327068533386 69.723 > 40 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.050726860035017 0.000000000000000 0.000000000000000 b 0.000000000000000 8.795664239999999 0.000000000000000 c -4.019710819432918 0.000000000000000 10.165151249579678 Atomic positions (fractional): *1 Li 0.30931822559990 0.73798427082894 0.20104191151723 6.941 > 1 2 Li 0.80931822559989 0.73798427082894 0.20104191151723 6.941 > 1 3 Li 0.19068177440011 0.23798427082894 0.29895808848277 6.941 > 2 4 Li 0.69068177440011 0.23798427082894 0.29895808848277 6.941 > 2 5 Li 0.19068177440011 0.26201572917106 0.79895808848277 6.941 > 3 6 Li 0.69068177440011 0.26201572917106 0.79895808848277 6.941 > 3 7 Li 0.30931822559990 0.76201572917106 0.70104191151723 6.941 > 4 8 Li 0.80931822559989 0.76201572917106 0.70104191151723 6.941 > 4 *9 Li 0.45345928256947 0.96454475523689 0.29691584176067 6.941 > 5 10 Li 0.95345928256947 0.96454475523689 0.29691584176067 6.941 > 5 11 Li 0.04654071743053 0.46454475523689 0.20308415823933 6.941 > 6 12 Li 0.54654071743053 0.46454475523689 0.20308415823933 6.941 > 6 13 Li 0.04654071743053 0.03545524476311 0.70308415823933 6.941 > 7 14 Li 0.54654071743053 0.03545524476311 0.70308415823933 6.941 > 7 15 Li 0.45345928256947 0.53545524476311 0.79691584176067 6.941 > 8 16 Li 0.95345928256947 0.53545524476311 0.79691584176067 6.941 > 8 *17 Li 0.18599569549562 0.50877849211252 0.06983329254927 6.941 > 9 18 Li 0.68599569549562 0.50877849211252 0.06983329254927 6.941 > 9 19 Li 0.31400430450438 0.00877849211252 0.43016670745073 6.941 > 10 20 Li 0.81400430450438 0.00877849211252 0.43016670745073 6.941 > 10 21 Li 0.31400430450438 0.49122150788748 0.93016670745073 6.941 > 11 22 Li 0.81400430450438 0.49122150788748 0.93016670745073 6.941 > 11 23 Li 0.18599569549562 0.99122150788748 0.56983329254927 6.941 > 12 24 Li 0.68599569549562 0.99122150788748 0.56983329254927 6.941 > 12 *25 O 0.12679301444178 0.67663568167636 0.14295133685584 15.999 > 13 26 O 0.62679301444178 0.67663568167636 0.14295133685584 15.999 > 13 27 O 0.37320698555822 0.17663568167636 0.35704866314416 15.999 > 14 28 O 0.87320698555822 0.17663568167636 0.35704866314416 15.999 > 14 29 O 0.37320698555822 0.32336431832364 0.85704866314416 15.999 > 15 30 O 0.87320698555822 0.32336431832364 0.85704866314416 15.999 > 15 31 O 0.12679301444178 0.82336431832364 0.64295133685584 15.999 > 16 32 O 0.62679301444178 0.82336431832364 0.64295133685584 15.999 > 16 *33 O 0.38368174144795 0.81095881455686 0.38068639925864 15.999 > 17 34 O 0.88368174144795 0.81095881455686 0.38068639925864 15.999 > 17 35 O 0.11631825855205 0.31095881455686 0.11931360074136 15.999 > 18 36 O 0.61631825855205 0.31095881455686 0.11931360074136 15.999 > 18 37 O 0.11631825855205 0.18904118544314 0.61931360074136 15.999 > 19 38 O 0.61631825855205 0.18904118544314 0.61931360074136 15.999 > 19 39 O 0.38368174144795 0.68904118544314 0.88068639925864 15.999 > 20 40 O 0.88368174144795 0.68904118544314 0.88068639925864 15.999 > 20 *41 O 0.39109962126773 0.89091047092973 0.11491022388978 15.999 > 21 42 O 0.89109962126773 0.89091047092973 0.11491022388978 15.999 > 21 43 O 0.10890037873227 0.39091047092973 0.38508977611022 15.999 > 22 44 O 0.60890037873227 0.39091047092973 0.38508977611022 15.999 > 22 45 O 0.10890037873227 0.10908952907027 0.88508977611022 15.999 > 23 46 O 0.60890037873227 0.10908952907027 0.88508977611022 15.999 > 23 47 O 0.39109962126773 0.60908952907027 0.61491022388978 15.999 > 24 48 O 0.89109962126773 0.60908952907027 0.61491022388978 15.999 > 24 *49 O 0.37081095615686 0.94874465220405 0.62318292420981 15.999 > 25 50 O 0.87081095615686 0.94874465220405 0.62318292420981 15.999 > 25 51 O 0.12918904384314 0.44874465220405 0.87681707579019 15.999 > 26 52 O 0.62918904384314 0.44874465220405 0.87681707579019 15.999 > 26 53 O 0.12918904384314 0.05125534779595 0.37681707579019 15.999 > 27 54 O 0.62918904384314 0.05125534779595 0.37681707579019 15.999 > 27 55 O 0.37081095615686 0.55125534779595 0.12318292420981 15.999 > 28 56 O 0.87081095615686 0.55125534779595 0.12318292420981 15.999 > 28 *57 K 0.35219584678997 0.00764714401112 0.86141890992964 39.098 > 29 58 K 0.85219584678997 0.00764714401112 0.86141890992964 39.098 > 29 59 K 0.14780415321003 0.50764714401112 0.63858109007036 39.098 > 30 60 K 0.64780415321003 0.50764714401112 0.63858109007036 39.098 > 30 61 K 0.14780415321003 0.99235285598888 0.13858109007036 39.098 > 31 62 K 0.64780415321003 0.99235285598888 0.13858109007036 39.098 > 31 63 K 0.35219584678997 0.49235285598888 0.36141890992964 39.098 > 32 64 K 0.85219584678997 0.49235285598888 0.36141890992964 39.098 > 32 *65 K 0.36000295807761 0.27333281267963 0.60795227880355 39.098 > 33 66 K 0.86000295807761 0.27333281267963 0.60795227880355 39.098 > 33 67 K 0.13999704192239 0.77333281267963 0.89204772119645 39.098 > 34 68 K 0.63999704192239 0.77333281267963 0.89204772119645 39.098 > 34 69 K 0.13999704192239 0.72666718732037 0.39204772119645 39.098 > 35 70 K 0.63999704192239 0.72666718732037 0.39204772119645 39.098 > 35 71 K 0.36000295807761 0.22666718732037 0.10795227880355 39.098 > 36 72 K 0.86000295807761 0.22666718732037 0.10795227880355 39.098 > 36 *73 Ga 0.44911122442061 0.71129803530764 0.06327068533386 69.723 > 37 74 Ga 0.94911122442061 0.71129803530764 0.06327068533386 69.723 > 37 75 Ga 0.05088877557939 0.21129803530763 0.43672931466615 69.723 > 38 76 Ga 0.55088877557939 0.21129803530763 0.43672931466615 69.723 > 38 77 Ga 0.05088877557939 0.28870196469236 0.93672931466614 69.723 > 39 78 Ga 0.55088877557939 0.28870196469236 0.93672931466614 69.723 > 39 79 Ga 0.44911122442061 0.78870196469236 0.56327068533386 69.723 > 40 80 Ga 0.94911122442061 0.78870196469236 0.56327068533386 69.723 > 40 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.0555603 0.0000000 0.0051039 0.0000000 3.0957386 0.0000000 0.0051026 0.0000000 3.0588628 -------------------------- Born effective charges -------------------------- 1 Li 1.0618153 0.0990440 -0.0435603 0.0182724 0.8411012 0.0747444 -0.0247186 0.1678985 1.0359774 2 Li 1.0618153 -0.0990440 -0.0435603 -0.0182724 0.8411012 -0.0747444 -0.0247186 -0.1678985 1.0359774 3 Li 1.0618153 0.0990440 -0.0435603 0.0182724 0.8411012 0.0747444 -0.0247186 0.1678985 1.0359774 4 Li 1.0618153 -0.0990440 -0.0435603 -0.0182724 0.8411012 -0.0747444 -0.0247186 -0.1678985 1.0359774 5 Li 0.8196380 0.0772188 -0.0566781 0.0752180 1.0193465 0.1780518 -0.0737112 0.0525354 0.9839511 6 Li 0.8196380 -0.0772188 -0.0566781 -0.0752180 1.0193465 -0.1780518 -0.0737112 -0.0525354 0.9839511 7 Li 0.8196380 0.0772188 -0.0566781 0.0752180 1.0193465 0.1780518 -0.0737112 0.0525354 0.9839511 8 Li 0.8196380 -0.0772188 -0.0566781 -0.0752180 1.0193465 -0.1780518 -0.0737112 -0.0525354 0.9839511 9 Li 0.9926521 -0.0260834 -0.0180245 0.0952573 0.9542544 0.1491288 0.0200792 0.1070579 0.7902924 10 Li 0.9926521 0.0260834 -0.0180245 -0.0952573 0.9542544 -0.1491288 0.0200792 -0.1070579 0.7902924 11 Li 0.9926521 -0.0260834 -0.0180245 0.0952573 0.9542544 0.1491288 0.0200792 0.1070579 0.7902924 12 Li 0.9926521 0.0260834 -0.0180245 -0.0952573 0.9542544 -0.1491288 0.0200792 -0.1070579 0.7902924 13 O -2.2325167 0.0858089 -0.2585793 0.0409714 -1.6760314 0.0006155 -0.2548936 -0.0324475 -1.6975648 14 O -2.2325167 -0.0858089 -0.2585793 -0.0409714 -1.6760314 -0.0006155 -0.2548936 0.0324475 -1.6975648 15 O -2.2325167 0.0858089 -0.2585793 0.0409714 -1.6760314 0.0006155 -0.2548936 -0.0324475 -1.6975648 16 O -2.2325167 -0.0858089 -0.2585793 -0.0409714 -1.6760314 -0.0006155 -0.2548936 0.0324475 -1.6975648 17 O -1.5849259 -0.0667210 0.0813774 -0.0084220 -1.6566755 -0.0148272 0.0444058 0.0164046 -2.3320895 18 O -1.5849259 0.0667210 0.0813774 0.0084220 -1.6566755 0.0148272 0.0444058 -0.0164046 -2.3320895 19 O -1.5849259 -0.0667210 0.0813774 -0.0084220 -1.6566755 -0.0148272 0.0444058 0.0164046 -2.3320895 20 O -1.5849259 0.0667210 0.0813774 0.0084220 -1.6566755 0.0148272 0.0444058 -0.0164046 -2.3320895 21 O -1.7337938 0.1465502 0.1415689 0.2569114 -2.1368022 -0.2408373 0.1634955 -0.1724985 -1.7586010 22 O -1.7337938 -0.1465502 0.1415689 -0.2569114 -2.1368022 0.2408373 0.1634955 0.1724985 -1.7586010 23 O -1.7337938 0.1465502 0.1415689 0.2569114 -2.1368022 -0.2408373 0.1634955 -0.1724985 -1.7586010 24 O -1.7337938 -0.1465502 0.1415689 -0.2569114 -2.1368022 0.2408373 0.1634955 0.1724985 -1.7586010 25 O -1.9167946 0.2273786 0.1473624 0.2911956 -1.9902653 -0.1108506 0.1151625 -0.0979327 -1.6353449 26 O -1.9167946 -0.2273786 0.1473624 -0.2911956 -1.9902653 0.1108506 0.1151625 0.0979327 -1.6353449 27 O -1.9167946 0.2273786 0.1473624 0.2911956 -1.9902653 -0.1108506 0.1151625 -0.0979327 -1.6353449 28 O -1.9167946 -0.2273786 0.1473624 -0.2911956 -1.9902653 0.1108506 0.1151625 0.0979327 -1.6353449 29 K 1.1427021 0.0870075 -0.0396770 0.0294325 1.1973677 -0.0263300 -0.0370542 -0.0660836 1.1630392 30 K 1.1427021 -0.0870075 -0.0396770 -0.0294325 1.1973677 0.0263300 -0.0370542 0.0660836 1.1630392 31 K 1.1427021 0.0870075 -0.0396770 0.0294325 1.1973677 -0.0263300 -0.0370542 -0.0660836 1.1630392 32 K 1.1427021 -0.0870075 -0.0396770 -0.0294325 1.1973677 0.0263300 -0.0370542 0.0660836 1.1630392 33 K 1.1825703 -0.0079503 0.0255441 -0.0085460 1.1506622 0.0536847 0.0074697 0.0694602 1.1982667 34 K 1.1825703 0.0079503 0.0255441 0.0085460 1.1506622 -0.0536847 0.0074697 -0.0694602 1.1982667 35 K 1.1825703 -0.0079503 0.0255441 -0.0085460 1.1506622 0.0536847 0.0074697 0.0694602 1.1982667 36 K 1.1825703 0.0079503 0.0255441 0.0085460 1.1506622 -0.0536847 0.0074697 -0.0694602 1.1982667 37 Ga 2.2686531 -0.0885218 0.0206664 -0.1076449 2.2970424 0.0983586 0.0397649 0.0961093 2.2520733 38 Ga 2.2686531 0.0885218 0.0206664 0.1076449 2.2970424 -0.0983586 0.0397649 -0.0961093 2.2520733 39 Ga 2.2686531 -0.0885218 0.0206664 -0.1076449 2.2970424 0.0983586 0.0397649 0.0961093 2.2520733 40 Ga 2.2686531 0.0885218 0.0206664 0.1076449 2.2970424 -0.0983586 0.0397649 -0.0961093 2.2520733 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 240/240 Permutation basis: 14520/14520 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3720 Number of blocks in projector: 3720 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 280 eigenvectors found. (1) Complementary block size: 40 (1) Compute compressed projector. (1) Use standard solver. (1) 20 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 800 / 800 (1) 287 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 13 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 280 eigenvectors found. (1) Complementary block size: 40 (1) Compute compressed projector. (1) Use standard solver. (1) 20 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 440 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 440 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 440 Use standard eigh solver. Tree of FC basis block matrices: - (3720, 3631), data: False |-- (440, 430), data: True |-- (440, 430), data: True |-- (440, 430), data: True |-- (800, 780), data: False |-- (800, 20), data: (800, 40) @ (40, 20) |-- (300, 280), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True |-- (800, 781), data: False |-- (800, 13), data: (800, 32) @ (32, 13) |-- (300, 287), data: True |-- (500, 481), data: False |-- (500, 17), data: (500, 36) @ (36, 17) |-- (250, 233), data: True |-- (250, 231), data: True |-- (800, 780), data: False |-- (800, 20), data: (800, 40) @ (40, 20) |-- (300, 280), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 1200 - Time: 0.752 Solver_block: 200 / 1200 - Time: 0.625 Solver_block: 300 / 1200 - Time: 0.586 Solver_block: 400 / 1200 - Time: 0.564 Solver_block: 500 / 1200 - Time: 0.941 Solver_block: 600 / 1200 - Time: 1.014 Solver_block: 700 / 1200 - Time: 0.656 Solver_block: 800 / 1200 - Time: 1.037 Solver_block: 900 / 1200 - Time: 0.574 Solver_block: 1000 / 1200 - Time: 0.998 Solver_block: 1100 / 1200 - Time: 0.792 Solver_block: 1200 / 1200 - Time: 0.601 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 9.623 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 240/240 Permutation basis: 14520/14520 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3720 Number of blocks in projector: 3720 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 280 eigenvectors found. (1) Complementary block size: 40 (1) Compute compressed projector. (1) Use standard solver. (1) 20 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 800 / 800 (1) 287 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 13 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 800 Use submatrix version of eigh solver. (1) Block: 500 / 800 (2) Block: 250 / 500 (2) 230 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 480 eigenvectors found. (1) Block: 800 / 800 (1) 280 eigenvectors found. (1) Complementary block size: 40 (1) Compute compressed projector. (1) Use standard solver. (1) 20 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 440 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 440 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 440 Use standard eigh solver. Tree of FC basis block matrices: - (3720, 3631), data: False |-- (440, 430), data: True |-- (440, 430), data: True |-- (440, 430), data: True |-- (800, 780), data: False |-- (800, 20), data: (800, 40) @ (40, 20) |-- (300, 280), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True |-- (800, 781), data: False |-- (800, 13), data: (800, 32) @ (32, 13) |-- (300, 287), data: True |-- (500, 481), data: False |-- (500, 17), data: (500, 36) @ (36, 17) |-- (250, 233), data: True |-- (250, 231), data: True |-- (800, 780), data: False |-- (800, 20), data: (800, 40) @ (40, 20) |-- (300, 280), data: True |-- (500, 480), data: False |-- (500, 18), data: (500, 38) @ (38, 18) |-- (250, 232), data: True |-- (250, 230), data: True 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 03:44:14]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 03:44:14]------------------------- 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 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.525363430017508 0.000000000000000 0.000000000000000 b 0.000000000000000 8.795664239999999 0.000000000000000 c -4.019710819432918 0.000000000000000 10.165151249579678 Atomic positions (fractional): 1 Li 0.61863645119979 0.73798427082894 0.20104191151723 6.941 2 Li 0.38136354880021 0.23798427082894 0.29895808848277 6.941 3 Li 0.38136354880021 0.26201572917106 0.79895808848277 6.941 4 Li 0.61863645119979 0.76201572917106 0.70104191151723 6.941 5 Li 0.90691856513894 0.96454475523689 0.29691584176067 6.941 6 Li 0.09308143486106 0.46454475523689 0.20308415823933 6.941 7 Li 0.09308143486106 0.03545524476311 0.70308415823933 6.941 8 Li 0.90691856513894 0.53545524476311 0.79691584176067 6.941 9 Li 0.37199139099124 0.50877849211252 0.06983329254927 6.941 10 Li 0.62800860900876 0.00877849211252 0.43016670745073 6.941 11 Li 0.62800860900876 0.49122150788748 0.93016670745073 6.941 12 Li 0.37199139099124 0.99122150788748 0.56983329254927 6.941 13 O 0.25358602888355 0.67663568167636 0.14295133685584 15.999 14 O 0.74641397111645 0.17663568167636 0.35704866314416 15.999 15 O 0.74641397111645 0.32336431832364 0.85704866314416 15.999 16 O 0.25358602888355 0.82336431832364 0.64295133685584 15.999 17 O 0.76736348289590 0.81095881455686 0.38068639925864 15.999 18 O 0.23263651710410 0.31095881455686 0.11931360074136 15.999 19 O 0.23263651710410 0.18904118544314 0.61931360074136 15.999 20 O 0.76736348289590 0.68904118544314 0.88068639925864 15.999 21 O 0.78219924253547 0.89091047092973 0.11491022388978 15.999 22 O 0.21780075746453 0.39091047092973 0.38508977611022 15.999 23 O 0.21780075746453 0.10908952907027 0.88508977611022 15.999 24 O 0.78219924253547 0.60908952907027 0.61491022388978 15.999 25 O 0.74162191231371 0.94874465220405 0.62318292420981 15.999 26 O 0.25837808768629 0.44874465220405 0.87681707579019 15.999 27 O 0.25837808768629 0.05125534779595 0.37681707579019 15.999 28 O 0.74162191231371 0.55125534779595 0.12318292420981 15.999 29 K 0.70439169357993 0.00764714401112 0.86141890992964 39.098 30 K 0.29560830642007 0.50764714401112 0.63858109007036 39.098 31 K 0.29560830642007 0.99235285598888 0.13858109007036 39.098 32 K 0.70439169357993 0.49235285598888 0.36141890992964 39.098 33 K 0.72000591615521 0.27333281267963 0.60795227880355 39.098 34 K 0.27999408384479 0.77333281267963 0.89204772119645 39.098 35 K 0.27999408384479 0.72666718732037 0.39204772119645 39.098 36 K 0.72000591615521 0.22666718732037 0.10795227880355 39.098 37 Ga 0.89822244884121 0.71129803530764 0.06327068533386 69.723 38 Ga 0.10177755115879 0.21129803530763 0.43672931466615 69.723 39 Ga 0.10177755115879 0.28870196469236 0.93672931466614 69.723 40 Ga 0.89822244884121 0.78870196469236 0.56327068533386 69.723 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.050726860035017 0.000000000000000 0.000000000000000 b 0.000000000000000 8.795664239999999 0.000000000000000 c -4.019710819432918 0.000000000000000 10.165151249579678 Atomic positions (fractional): 1 Li 0.30931822559990 0.73798427082894 0.20104191151723 6.941 > 1 2 Li 0.80931822559989 0.73798427082894 0.20104191151723 6.941 > 1 3 Li 0.19068177440011 0.23798427082894 0.29895808848277 6.941 > 3 4 Li 0.69068177440011 0.23798427082894 0.29895808848277 6.941 > 3 5 Li 0.19068177440011 0.26201572917106 0.79895808848277 6.941 > 5 6 Li 0.69068177440011 0.26201572917106 0.79895808848277 6.941 > 5 7 Li 0.30931822559990 0.76201572917106 0.70104191151723 6.941 > 7 8 Li 0.80931822559989 0.76201572917106 0.70104191151723 6.941 > 7 9 Li 0.45345928256947 0.96454475523689 0.29691584176067 6.941 > 9 10 Li 0.95345928256947 0.96454475523689 0.29691584176067 6.941 > 9 11 Li 0.04654071743053 0.46454475523689 0.20308415823933 6.941 > 11 12 Li 0.54654071743053 0.46454475523689 0.20308415823933 6.941 > 11 13 Li 0.04654071743053 0.03545524476311 0.70308415823933 6.941 > 13 14 Li 0.54654071743053 0.03545524476311 0.70308415823933 6.941 > 13 15 Li 0.45345928256947 0.53545524476311 0.79691584176067 6.941 > 15 16 Li 0.95345928256947 0.53545524476311 0.79691584176067 6.941 > 15 17 Li 0.18599569549562 0.50877849211252 0.06983329254927 6.941 > 17 18 Li 0.68599569549562 0.50877849211252 0.06983329254927 6.941 > 17 19 Li 0.31400430450438 0.00877849211252 0.43016670745073 6.941 > 19 20 Li 0.81400430450438 0.00877849211252 0.43016670745073 6.941 > 19 21 Li 0.31400430450438 0.49122150788748 0.93016670745073 6.941 > 21 22 Li 0.81400430450438 0.49122150788748 0.93016670745073 6.941 > 21 23 Li 0.18599569549562 0.99122150788748 0.56983329254927 6.941 > 23 24 Li 0.68599569549562 0.99122150788748 0.56983329254927 6.941 > 23 25 O 0.12679301444178 0.67663568167636 0.14295133685584 15.999 > 25 26 O 0.62679301444178 0.67663568167636 0.14295133685584 15.999 > 25 27 O 0.37320698555822 0.17663568167636 0.35704866314416 15.999 > 27 28 O 0.87320698555822 0.17663568167636 0.35704866314416 15.999 > 27 29 O 0.37320698555822 0.32336431832364 0.85704866314416 15.999 > 29 30 O 0.87320698555822 0.32336431832364 0.85704866314416 15.999 > 29 31 O 0.12679301444178 0.82336431832364 0.64295133685584 15.999 > 31 32 O 0.62679301444178 0.82336431832364 0.64295133685584 15.999 > 31 33 O 0.38368174144795 0.81095881455686 0.38068639925864 15.999 > 33 34 O 0.88368174144795 0.81095881455686 0.38068639925864 15.999 > 33 35 O 0.11631825855205 0.31095881455686 0.11931360074136 15.999 > 35 36 O 0.61631825855205 0.31095881455686 0.11931360074136 15.999 > 35 37 O 0.11631825855205 0.18904118544314 0.61931360074136 15.999 > 37 38 O 0.61631825855205 0.18904118544314 0.61931360074136 15.999 > 37 39 O 0.38368174144795 0.68904118544314 0.88068639925864 15.999 > 39 40 O 0.88368174144795 0.68904118544314 0.88068639925864 15.999 > 39 41 O 0.39109962126773 0.89091047092973 0.11491022388978 15.999 > 41 42 O 0.89109962126773 0.89091047092973 0.11491022388978 15.999 > 41 43 O 0.10890037873227 0.39091047092973 0.38508977611022 15.999 > 43 44 O 0.60890037873227 0.39091047092973 0.38508977611022 15.999 > 43 45 O 0.10890037873227 0.10908952907027 0.88508977611022 15.999 > 45 46 O 0.60890037873227 0.10908952907027 0.88508977611022 15.999 > 45 47 O 0.39109962126773 0.60908952907027 0.61491022388978 15.999 > 47 48 O 0.89109962126773 0.60908952907027 0.61491022388978 15.999 > 47 49 O 0.37081095615686 0.94874465220405 0.62318292420981 15.999 > 49 50 O 0.87081095615686 0.94874465220405 0.62318292420981 15.999 > 49 51 O 0.12918904384314 0.44874465220405 0.87681707579019 15.999 > 51 52 O 0.62918904384314 0.44874465220405 0.87681707579019 15.999 > 51 53 O 0.12918904384314 0.05125534779595 0.37681707579019 15.999 > 53 54 O 0.62918904384314 0.05125534779595 0.37681707579019 15.999 > 53 55 O 0.37081095615686 0.55125534779595 0.12318292420981 15.999 > 55 56 O 0.87081095615686 0.55125534779595 0.12318292420981 15.999 > 55 57 K 0.35219584678997 0.00764714401112 0.86141890992964 39.098 > 57 58 K 0.85219584678997 0.00764714401112 0.86141890992964 39.098 > 57 59 K 0.14780415321003 0.50764714401112 0.63858109007036 39.098 > 59 60 K 0.64780415321003 0.50764714401112 0.63858109007036 39.098 > 59 61 K 0.14780415321003 0.99235285598888 0.13858109007036 39.098 > 61 62 K 0.64780415321003 0.99235285598888 0.13858109007036 39.098 > 61 63 K 0.35219584678997 0.49235285598888 0.36141890992964 39.098 > 63 64 K 0.85219584678997 0.49235285598888 0.36141890992964 39.098 > 63 65 K 0.36000295807761 0.27333281267963 0.60795227880355 39.098 > 65 66 K 0.86000295807761 0.27333281267963 0.60795227880355 39.098 > 65 67 K 0.13999704192239 0.77333281267963 0.89204772119645 39.098 > 67 68 K 0.63999704192239 0.77333281267963 0.89204772119645 39.098 > 67 69 K 0.13999704192239 0.72666718732037 0.39204772119645 39.098 > 69 70 K 0.63999704192239 0.72666718732037 0.39204772119645 39.098 > 69 71 K 0.36000295807761 0.22666718732037 0.10795227880355 39.098 > 71 72 K 0.86000295807761 0.22666718732037 0.10795227880355 39.098 > 71 73 Ga 0.44911122442061 0.71129803530764 0.06327068533386 69.723 > 73 74 Ga 0.94911122442061 0.71129803530764 0.06327068533386 69.723 > 73 75 Ga 0.05088877557939 0.21129803530763 0.43672931466615 69.723 > 75 76 Ga 0.55088877557939 0.21129803530763 0.43672931466615 69.723 > 75 77 Ga 0.05088877557939 0.28870196469236 0.93672931466614 69.723 > 77 78 Ga 0.55088877557939 0.28870196469236 0.93672931466614 69.723 > 77 79 Ga 0.44911122442061 0.78870196469236 0.56327068533386 69.723 > 79 80 Ga 0.94911122442061 0.78870196469236 0.56327068533386 69.723 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.0555603 0.0000000 0.0051039 0.0000000 3.0957386 0.0000000 0.0051026 0.0000000 3.0588628 -------------------------- Born effective charges -------------------------- 1 Li 1.0618153 0.0990440 -0.0435603 0.0182724 0.8411012 0.0747444 -0.0247186 0.1678985 1.0359774 2 Li 1.0618153 -0.0990440 -0.0435603 -0.0182724 0.8411012 -0.0747444 -0.0247186 -0.1678985 1.0359774 3 Li 1.0618153 0.0990440 -0.0435603 0.0182724 0.8411012 0.0747444 -0.0247186 0.1678985 1.0359774 4 Li 1.0618153 -0.0990440 -0.0435603 -0.0182724 0.8411012 -0.0747444 -0.0247186 -0.1678985 1.0359774 5 Li 0.8196380 0.0772188 -0.0566781 0.0752180 1.0193465 0.1780518 -0.0737112 0.0525354 0.9839511 6 Li 0.8196380 -0.0772188 -0.0566781 -0.0752180 1.0193465 -0.1780518 -0.0737112 -0.0525354 0.9839511 7 Li 0.8196380 0.0772188 -0.0566781 0.0752180 1.0193465 0.1780518 -0.0737112 0.0525354 0.9839511 8 Li 0.8196380 -0.0772188 -0.0566781 -0.0752180 1.0193465 -0.1780518 -0.0737112 -0.0525354 0.9839511 9 Li 0.9926521 -0.0260834 -0.0180245 0.0952573 0.9542544 0.1491288 0.0200792 0.1070579 0.7902924 10 Li 0.9926521 0.0260834 -0.0180245 -0.0952573 0.9542544 -0.1491288 0.0200792 -0.1070579 0.7902924 11 Li 0.9926521 -0.0260834 -0.0180245 0.0952573 0.9542544 0.1491288 0.0200792 0.1070579 0.7902924 12 Li 0.9926521 0.0260834 -0.0180245 -0.0952573 0.9542544 -0.1491288 0.0200792 -0.1070579 0.7902924 13 O -2.2325167 0.0858089 -0.2585793 0.0409714 -1.6760314 0.0006155 -0.2548936 -0.0324475 -1.6975648 14 O -2.2325167 -0.0858089 -0.2585793 -0.0409714 -1.6760314 -0.0006155 -0.2548936 0.0324475 -1.6975648 15 O -2.2325167 0.0858089 -0.2585793 0.0409714 -1.6760314 0.0006155 -0.2548936 -0.0324475 -1.6975648 16 O -2.2325167 -0.0858089 -0.2585793 -0.0409714 -1.6760314 -0.0006155 -0.2548936 0.0324475 -1.6975648 17 O -1.5849259 -0.0667210 0.0813774 -0.0084220 -1.6566755 -0.0148272 0.0444058 0.0164046 -2.3320895 18 O -1.5849259 0.0667210 0.0813774 0.0084220 -1.6566755 0.0148272 0.0444058 -0.0164046 -2.3320895 19 O -1.5849259 -0.0667210 0.0813774 -0.0084220 -1.6566755 -0.0148272 0.0444058 0.0164046 -2.3320895 20 O -1.5849259 0.0667210 0.0813774 0.0084220 -1.6566755 0.0148272 0.0444058 -0.0164046 -2.3320895 21 O -1.7337938 0.1465502 0.1415689 0.2569114 -2.1368022 -0.2408373 0.1634955 -0.1724985 -1.7586010 22 O -1.7337938 -0.1465502 0.1415689 -0.2569114 -2.1368022 0.2408373 0.1634955 0.1724985 -1.7586010 23 O -1.7337938 0.1465502 0.1415689 0.2569114 -2.1368022 -0.2408373 0.1634955 -0.1724985 -1.7586010 24 O -1.7337938 -0.1465502 0.1415689 -0.2569114 -2.1368022 0.2408373 0.1634955 0.1724985 -1.7586010 25 O -1.9167946 0.2273786 0.1473624 0.2911956 -1.9902653 -0.1108506 0.1151625 -0.0979327 -1.6353449 26 O -1.9167946 -0.2273786 0.1473624 -0.2911956 -1.9902653 0.1108506 0.1151625 0.0979327 -1.6353449 27 O -1.9167946 0.2273786 0.1473624 0.2911956 -1.9902653 -0.1108506 0.1151625 -0.0979327 -1.6353449 28 O -1.9167946 -0.2273786 0.1473624 -0.2911956 -1.9902653 0.1108506 0.1151625 0.0979327 -1.6353449 29 K 1.1427021 0.0870075 -0.0396770 0.0294325 1.1973677 -0.0263300 -0.0370542 -0.0660836 1.1630392 30 K 1.1427021 -0.0870075 -0.0396770 -0.0294325 1.1973677 0.0263300 -0.0370542 0.0660836 1.1630392 31 K 1.1427021 0.0870075 -0.0396770 0.0294325 1.1973677 -0.0263300 -0.0370542 -0.0660836 1.1630392 32 K 1.1427021 -0.0870075 -0.0396770 -0.0294325 1.1973677 0.0263300 -0.0370542 0.0660836 1.1630392 33 K 1.1825703 -0.0079503 0.0255441 -0.0085460 1.1506622 0.0536847 0.0074697 0.0694602 1.1982667 34 K 1.1825703 0.0079503 0.0255441 0.0085460 1.1506622 -0.0536847 0.0074697 -0.0694602 1.1982667 35 K 1.1825703 -0.0079503 0.0255441 -0.0085460 1.1506622 0.0536847 0.0074697 0.0694602 1.1982667 36 K 1.1825703 0.0079503 0.0255441 0.0085460 1.1506622 -0.0536847 0.0074697 -0.0694602 1.1982667 37 Ga 2.2686531 -0.0885218 0.0206664 -0.1076449 2.2970424 0.0983586 0.0397649 0.0961093 2.2520733 38 Ga 2.2686531 0.0885218 0.0206664 0.1076449 2.2970424 -0.0983586 0.0397649 -0.0961093 2.2520733 39 Ga 2.2686531 -0.0885218 0.0206664 -0.1076449 2.2970424 0.0983586 0.0397649 0.0961093 2.2520733 40 Ga 2.2686531 0.0885218 0.0206664 0.1076449 2.2970424 -0.0983586 0.0397649 -0.0961093 2.2520733 ---------------------------------------------------------------------------- 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] [-0.0037 0.0000 0.0093] [ 0.0037 0.0000 -0.0093] 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] [-0.0037 0.0000 0.0093] [ 0.0037 0.0000 -0.0093] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0037 0.0000 0.0093] [ 0.0037 0.0000 -0.0093] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0037 0.0000 0.0093] [ 0.0037 0.0000 -0.0093] 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] [-0.0037 0.0000 0.0093] [ 0.0037 0.0000 -0.0093] Computing fc3[ 41, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0037 0.0000 0.0093] [ 0.0037 0.0000 -0.0093] 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] [-0.0037 0.0000 0.0093] [ 0.0037 0.0000 -0.0093] Computing fc3[ 57, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0037 0.0000 0.0093] [ 0.0037 0.0000 -0.0093] 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] [-0.0037 0.0000 0.0093] [ 0.0037 0.0000 -0.0093] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0037 0.0000 0.0093] [ 0.0037 0.0000 -0.0093] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (xxx) -0.00000000 (xxx) -0.00000000 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (xy) -0.00000000 (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 03:44:42]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 03:44:43]------------------------- 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 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.525363430017508 0.000000000000000 0.000000000000000 b 0.000000000000000 8.795664239999999 0.000000000000000 c -4.019710819432918 0.000000000000000 10.165151249579678 Atomic positions (fractional): 1 Li 0.61863645119979 0.73798427082894 0.20104191151723 6.941 2 Li 0.38136354880021 0.23798427082894 0.29895808848277 6.941 3 Li 0.38136354880021 0.26201572917106 0.79895808848277 6.941 4 Li 0.61863645119979 0.76201572917106 0.70104191151723 6.941 5 Li 0.90691856513894 0.96454475523689 0.29691584176067 6.941 6 Li 0.09308143486106 0.46454475523689 0.20308415823933 6.941 7 Li 0.09308143486106 0.03545524476311 0.70308415823933 6.941 8 Li 0.90691856513894 0.53545524476311 0.79691584176067 6.941 9 Li 0.37199139099124 0.50877849211252 0.06983329254927 6.941 10 Li 0.62800860900876 0.00877849211252 0.43016670745073 6.941 11 Li 0.62800860900876 0.49122150788748 0.93016670745073 6.941 12 Li 0.37199139099124 0.99122150788748 0.56983329254927 6.941 13 O 0.25358602888355 0.67663568167636 0.14295133685584 15.999 14 O 0.74641397111645 0.17663568167636 0.35704866314416 15.999 15 O 0.74641397111645 0.32336431832364 0.85704866314416 15.999 16 O 0.25358602888355 0.82336431832364 0.64295133685584 15.999 17 O 0.76736348289590 0.81095881455686 0.38068639925864 15.999 18 O 0.23263651710410 0.31095881455686 0.11931360074136 15.999 19 O 0.23263651710410 0.18904118544314 0.61931360074136 15.999 20 O 0.76736348289590 0.68904118544314 0.88068639925864 15.999 21 O 0.78219924253547 0.89091047092973 0.11491022388978 15.999 22 O 0.21780075746453 0.39091047092973 0.38508977611022 15.999 23 O 0.21780075746453 0.10908952907027 0.88508977611022 15.999 24 O 0.78219924253547 0.60908952907027 0.61491022388978 15.999 25 O 0.74162191231371 0.94874465220405 0.62318292420981 15.999 26 O 0.25837808768629 0.44874465220405 0.87681707579019 15.999 27 O 0.25837808768629 0.05125534779595 0.37681707579019 15.999 28 O 0.74162191231371 0.55125534779595 0.12318292420981 15.999 29 K 0.70439169357993 0.00764714401112 0.86141890992964 39.098 30 K 0.29560830642007 0.50764714401112 0.63858109007036 39.098 31 K 0.29560830642007 0.99235285598888 0.13858109007036 39.098 32 K 0.70439169357993 0.49235285598888 0.36141890992964 39.098 33 K 0.72000591615521 0.27333281267963 0.60795227880355 39.098 34 K 0.27999408384479 0.77333281267963 0.89204772119645 39.098 35 K 0.27999408384479 0.72666718732037 0.39204772119645 39.098 36 K 0.72000591615521 0.22666718732037 0.10795227880355 39.098 37 Ga 0.89822244884121 0.71129803530764 0.06327068533386 69.723 38 Ga 0.10177755115879 0.21129803530763 0.43672931466615 69.723 39 Ga 0.10177755115879 0.28870196469236 0.93672931466614 69.723 40 Ga 0.89822244884121 0.78870196469236 0.56327068533386 69.723 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.050726860035017 0.000000000000000 0.000000000000000 b 0.000000000000000 8.795664239999999 0.000000000000000 c -4.019710819432918 0.000000000000000 10.165151249579678 Atomic positions (fractional): 1 Li 0.30931822559990 0.73798427082894 0.20104191151723 6.941 > 1 2 Li 0.80931822559989 0.73798427082894 0.20104191151723 6.941 > 1 3 Li 0.19068177440011 0.23798427082894 0.29895808848277 6.941 > 3 4 Li 0.69068177440011 0.23798427082894 0.29895808848277 6.941 > 3 5 Li 0.19068177440011 0.26201572917106 0.79895808848277 6.941 > 5 6 Li 0.69068177440011 0.26201572917106 0.79895808848277 6.941 > 5 7 Li 0.30931822559990 0.76201572917106 0.70104191151723 6.941 > 7 8 Li 0.80931822559989 0.76201572917106 0.70104191151723 6.941 > 7 9 Li 0.45345928256947 0.96454475523689 0.29691584176067 6.941 > 9 10 Li 0.95345928256947 0.96454475523689 0.29691584176067 6.941 > 9 11 Li 0.04654071743053 0.46454475523689 0.20308415823933 6.941 > 11 12 Li 0.54654071743053 0.46454475523689 0.20308415823933 6.941 > 11 13 Li 0.04654071743053 0.03545524476311 0.70308415823933 6.941 > 13 14 Li 0.54654071743053 0.03545524476311 0.70308415823933 6.941 > 13 15 Li 0.45345928256947 0.53545524476311 0.79691584176067 6.941 > 15 16 Li 0.95345928256947 0.53545524476311 0.79691584176067 6.941 > 15 17 Li 0.18599569549562 0.50877849211252 0.06983329254927 6.941 > 17 18 Li 0.68599569549562 0.50877849211252 0.06983329254927 6.941 > 17 19 Li 0.31400430450438 0.00877849211252 0.43016670745073 6.941 > 19 20 Li 0.81400430450438 0.00877849211252 0.43016670745073 6.941 > 19 21 Li 0.31400430450438 0.49122150788748 0.93016670745073 6.941 > 21 22 Li 0.81400430450438 0.49122150788748 0.93016670745073 6.941 > 21 23 Li 0.18599569549562 0.99122150788748 0.56983329254927 6.941 > 23 24 Li 0.68599569549562 0.99122150788748 0.56983329254927 6.941 > 23 25 O 0.12679301444178 0.67663568167636 0.14295133685584 15.999 > 25 26 O 0.62679301444178 0.67663568167636 0.14295133685584 15.999 > 25 27 O 0.37320698555822 0.17663568167636 0.35704866314416 15.999 > 27 28 O 0.87320698555822 0.17663568167636 0.35704866314416 15.999 > 27 29 O 0.37320698555822 0.32336431832364 0.85704866314416 15.999 > 29 30 O 0.87320698555822 0.32336431832364 0.85704866314416 15.999 > 29 31 O 0.12679301444178 0.82336431832364 0.64295133685584 15.999 > 31 32 O 0.62679301444178 0.82336431832364 0.64295133685584 15.999 > 31 33 O 0.38368174144795 0.81095881455686 0.38068639925864 15.999 > 33 34 O 0.88368174144795 0.81095881455686 0.38068639925864 15.999 > 33 35 O 0.11631825855205 0.31095881455686 0.11931360074136 15.999 > 35 36 O 0.61631825855205 0.31095881455686 0.11931360074136 15.999 > 35 37 O 0.11631825855205 0.18904118544314 0.61931360074136 15.999 > 37 38 O 0.61631825855205 0.18904118544314 0.61931360074136 15.999 > 37 39 O 0.38368174144795 0.68904118544314 0.88068639925864 15.999 > 39 40 O 0.88368174144795 0.68904118544314 0.88068639925864 15.999 > 39 41 O 0.39109962126773 0.89091047092973 0.11491022388978 15.999 > 41 42 O 0.89109962126773 0.89091047092973 0.11491022388978 15.999 > 41 43 O 0.10890037873227 0.39091047092973 0.38508977611022 15.999 > 43 44 O 0.60890037873227 0.39091047092973 0.38508977611022 15.999 > 43 45 O 0.10890037873227 0.10908952907027 0.88508977611022 15.999 > 45 46 O 0.60890037873227 0.10908952907027 0.88508977611022 15.999 > 45 47 O 0.39109962126773 0.60908952907027 0.61491022388978 15.999 > 47 48 O 0.89109962126773 0.60908952907027 0.61491022388978 15.999 > 47 49 O 0.37081095615686 0.94874465220405 0.62318292420981 15.999 > 49 50 O 0.87081095615686 0.94874465220405 0.62318292420981 15.999 > 49 51 O 0.12918904384314 0.44874465220405 0.87681707579019 15.999 > 51 52 O 0.62918904384314 0.44874465220405 0.87681707579019 15.999 > 51 53 O 0.12918904384314 0.05125534779595 0.37681707579019 15.999 > 53 54 O 0.62918904384314 0.05125534779595 0.37681707579019 15.999 > 53 55 O 0.37081095615686 0.55125534779595 0.12318292420981 15.999 > 55 56 O 0.87081095615686 0.55125534779595 0.12318292420981 15.999 > 55 57 K 0.35219584678997 0.00764714401112 0.86141890992964 39.098 > 57 58 K 0.85219584678997 0.00764714401112 0.86141890992964 39.098 > 57 59 K 0.14780415321003 0.50764714401112 0.63858109007036 39.098 > 59 60 K 0.64780415321003 0.50764714401112 0.63858109007036 39.098 > 59 61 K 0.14780415321003 0.99235285598888 0.13858109007036 39.098 > 61 62 K 0.64780415321003 0.99235285598888 0.13858109007036 39.098 > 61 63 K 0.35219584678997 0.49235285598888 0.36141890992964 39.098 > 63 64 K 0.85219584678997 0.49235285598888 0.36141890992964 39.098 > 63 65 K 0.36000295807761 0.27333281267963 0.60795227880355 39.098 > 65 66 K 0.86000295807761 0.27333281267963 0.60795227880355 39.098 > 65 67 K 0.13999704192239 0.77333281267963 0.89204772119645 39.098 > 67 68 K 0.63999704192239 0.77333281267963 0.89204772119645 39.098 > 67 69 K 0.13999704192239 0.72666718732037 0.39204772119645 39.098 > 69 70 K 0.63999704192239 0.72666718732037 0.39204772119645 39.098 > 69 71 K 0.36000295807761 0.22666718732037 0.10795227880355 39.098 > 71 72 K 0.86000295807761 0.22666718732037 0.10795227880355 39.098 > 71 73 Ga 0.44911122442061 0.71129803530764 0.06327068533386 69.723 > 73 74 Ga 0.94911122442061 0.71129803530764 0.06327068533386 69.723 > 73 75 Ga 0.05088877557939 0.21129803530763 0.43672931466615 69.723 > 75 76 Ga 0.55088877557939 0.21129803530763 0.43672931466615 69.723 > 75 77 Ga 0.05088877557939 0.28870196469236 0.93672931466614 69.723 > 77 78 Ga 0.55088877557939 0.28870196469236 0.93672931466614 69.723 > 77 79 Ga 0.44911122442061 0.78870196469236 0.56327068533386 69.723 > 79 80 Ga 0.94911122442061 0.78870196469236 0.56327068533386 69.723 > 79 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.0555603 0.0000000 0.0051039 0.0000000 3.0957386 0.0000000 0.0051026 0.0000000 3.0588628 -------------------------- Born effective charges -------------------------- 1 Li 1.0618153 0.0990440 -0.0435603 0.0182724 0.8411012 0.0747444 -0.0247186 0.1678985 1.0359774 2 Li 1.0618153 -0.0990440 -0.0435603 -0.0182724 0.8411012 -0.0747444 -0.0247186 -0.1678985 1.0359774 3 Li 1.0618153 0.0990440 -0.0435603 0.0182724 0.8411012 0.0747444 -0.0247186 0.1678985 1.0359774 4 Li 1.0618153 -0.0990440 -0.0435603 -0.0182724 0.8411012 -0.0747444 -0.0247186 -0.1678985 1.0359774 5 Li 0.8196380 0.0772188 -0.0566781 0.0752180 1.0193465 0.1780518 -0.0737112 0.0525354 0.9839511 6 Li 0.8196380 -0.0772188 -0.0566781 -0.0752180 1.0193465 -0.1780518 -0.0737112 -0.0525354 0.9839511 7 Li 0.8196380 0.0772188 -0.0566781 0.0752180 1.0193465 0.1780518 -0.0737112 0.0525354 0.9839511 8 Li 0.8196380 -0.0772188 -0.0566781 -0.0752180 1.0193465 -0.1780518 -0.0737112 -0.0525354 0.9839511 9 Li 0.9926521 -0.0260834 -0.0180245 0.0952573 0.9542544 0.1491288 0.0200792 0.1070579 0.7902924 10 Li 0.9926521 0.0260834 -0.0180245 -0.0952573 0.9542544 -0.1491288 0.0200792 -0.1070579 0.7902924 11 Li 0.9926521 -0.0260834 -0.0180245 0.0952573 0.9542544 0.1491288 0.0200792 0.1070579 0.7902924 12 Li 0.9926521 0.0260834 -0.0180245 -0.0952573 0.9542544 -0.1491288 0.0200792 -0.1070579 0.7902924 13 O -2.2325167 0.0858089 -0.2585793 0.0409714 -1.6760314 0.0006155 -0.2548936 -0.0324475 -1.6975648 14 O -2.2325167 -0.0858089 -0.2585793 -0.0409714 -1.6760314 -0.0006155 -0.2548936 0.0324475 -1.6975648 15 O -2.2325167 0.0858089 -0.2585793 0.0409714 -1.6760314 0.0006155 -0.2548936 -0.0324475 -1.6975648 16 O -2.2325167 -0.0858089 -0.2585793 -0.0409714 -1.6760314 -0.0006155 -0.2548936 0.0324475 -1.6975648 17 O -1.5849259 -0.0667210 0.0813774 -0.0084220 -1.6566755 -0.0148272 0.0444058 0.0164046 -2.3320895 18 O -1.5849259 0.0667210 0.0813774 0.0084220 -1.6566755 0.0148272 0.0444058 -0.0164046 -2.3320895 19 O -1.5849259 -0.0667210 0.0813774 -0.0084220 -1.6566755 -0.0148272 0.0444058 0.0164046 -2.3320895 20 O -1.5849259 0.0667210 0.0813774 0.0084220 -1.6566755 0.0148272 0.0444058 -0.0164046 -2.3320895 21 O -1.7337938 0.1465502 0.1415689 0.2569114 -2.1368022 -0.2408373 0.1634955 -0.1724985 -1.7586010 22 O -1.7337938 -0.1465502 0.1415689 -0.2569114 -2.1368022 0.2408373 0.1634955 0.1724985 -1.7586010 23 O -1.7337938 0.1465502 0.1415689 0.2569114 -2.1368022 -0.2408373 0.1634955 -0.1724985 -1.7586010 24 O -1.7337938 -0.1465502 0.1415689 -0.2569114 -2.1368022 0.2408373 0.1634955 0.1724985 -1.7586010 25 O -1.9167946 0.2273786 0.1473624 0.2911956 -1.9902653 -0.1108506 0.1151625 -0.0979327 -1.6353449 26 O -1.9167946 -0.2273786 0.1473624 -0.2911956 -1.9902653 0.1108506 0.1151625 0.0979327 -1.6353449 27 O -1.9167946 0.2273786 0.1473624 0.2911956 -1.9902653 -0.1108506 0.1151625 -0.0979327 -1.6353449 28 O -1.9167946 -0.2273786 0.1473624 -0.2911956 -1.9902653 0.1108506 0.1151625 0.0979327 -1.6353449 29 K 1.1427021 0.0870075 -0.0396770 0.0294325 1.1973677 -0.0263300 -0.0370542 -0.0660836 1.1630392 30 K 1.1427021 -0.0870075 -0.0396770 -0.0294325 1.1973677 0.0263300 -0.0370542 0.0660836 1.1630392 31 K 1.1427021 0.0870075 -0.0396770 0.0294325 1.1973677 -0.0263300 -0.0370542 -0.0660836 1.1630392 32 K 1.1427021 -0.0870075 -0.0396770 -0.0294325 1.1973677 0.0263300 -0.0370542 0.0660836 1.1630392 33 K 1.1825703 -0.0079503 0.0255441 -0.0085460 1.1506622 0.0536847 0.0074697 0.0694602 1.1982667 34 K 1.1825703 0.0079503 0.0255441 0.0085460 1.1506622 -0.0536847 0.0074697 -0.0694602 1.1982667 35 K 1.1825703 -0.0079503 0.0255441 -0.0085460 1.1506622 0.0536847 0.0074697 0.0694602 1.1982667 36 K 1.1825703 0.0079503 0.0255441 0.0085460 1.1506622 -0.0536847 0.0074697 -0.0694602 1.1982667 37 Ga 2.2686531 -0.0885218 0.0206664 -0.1076449 2.2970424 0.0983586 0.0397649 0.0961093 2.2520733 38 Ga 2.2686531 0.0885218 0.0206664 0.1076449 2.2970424 -0.0983586 0.0397649 -0.0961093 2.2520733 39 Ga 2.2686531 -0.0885218 0.0206664 -0.1076449 2.2970424 0.0983586 0.0397649 0.0961093 2.2520733 40 Ga 2.2686531 0.0885218 0.0206664 0.1076449 2.2970424 -0.0983586 0.0397649 -0.0961093 2.2520733 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (xxx) -0.00000000 (xxx) -0.00000000 (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 ... [ 10 6 5 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.53, Number of G-points: 307, Lambda: 0.10 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/104) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.266 ( 0.000 0.000 0.000) 0.000 2.415 ( 0.000 0.000 0.000) 0.000 2.591 ( 0.000 0.000 0.000) 0.000 2.660 ( 0.000 0.000 0.000) 0.000 2.745 ( 0.000 0.000 0.000) 0.000 2.953 ( 0.000 0.000 0.000) 0.000 3.079 ( 0.000 0.000 0.000) 0.000 3.197 ( 0.000 0.000 0.000) 0.000 3.251 ( 0.000 0.000 0.000) 0.000 3.294 ( 0.000 0.000 0.000) 0.000 3.352 ( 0.000 0.000 0.000) 0.000 3.354 ( 0.000 0.000 0.000) 0.000 3.444 ( 0.000 0.000 0.000) 0.000 3.590 ( 0.000 0.000 0.000) 0.000 3.639 ( 0.000 0.000 0.000) 0.000 3.678 ( 0.000 0.000 0.000) 0.000 3.907 ( 0.000 0.000 0.000) 0.000 4.091 ( 0.000 0.000 0.000) 0.000 4.183 ( 0.000 0.000 0.000) 0.000 4.311 ( 0.000 0.000 0.000) 0.000 4.453 ( 0.000 0.000 0.000) 0.000 4.481 ( 0.000 0.000 0.000) 0.000 4.493 ( 0.000 0.000 0.000) 0.000 4.545 ( 0.000 0.000 0.000) 0.000 4.641 ( 0.000 0.000 0.000) 0.000 4.652 ( 0.000 0.000 0.000) 0.000 4.872 ( 0.000 0.000 0.000) 0.000 5.079 ( 0.000 0.000 0.000) 0.000 5.088 ( 0.000 0.000 0.000) 0.000 5.101 ( 0.000 0.000 0.000) 0.000 5.256 ( 0.000 0.000 0.000) 0.000 5.459 ( 0.000 0.000 0.000) 0.000 5.464 ( 0.000 0.000 0.000) 0.000 5.919 ( 0.000 0.000 0.000) 0.000 5.964 ( 0.000 0.000 0.000) 0.000 6.042 ( 0.000 0.000 0.000) 0.000 6.183 ( 0.000 0.000 0.000) 0.000 6.192 ( 0.000 0.000 0.000) 0.000 6.306 ( 0.000 0.000 0.000) 0.000 6.737 ( 0.000 0.000 0.000) 0.000 6.947 ( 0.000 0.000 0.000) 0.000 6.983 ( 0.000 0.000 0.000) 0.000 7.097 ( 0.000 0.000 0.000) 0.000 7.217 ( 0.000 0.000 0.000) 0.000 7.514 ( 0.000 0.000 0.000) 0.000 7.733 ( 0.000 0.000 0.000) 0.000 7.780 ( 0.000 0.000 0.000) 0.000 8.091 ( 0.000 0.000 0.000) 0.000 8.134 ( 0.000 0.000 0.000) 0.000 8.427 ( 0.000 0.000 0.000) 0.000 8.705 ( 0.000 0.000 0.000) 0.000 8.780 ( 0.000 0.000 0.000) 0.000 8.824 ( 0.000 0.000 0.000) 0.000 9.011 ( 0.000 0.000 0.000) 0.000 9.011 ( 0.000 0.000 0.000) 0.000 9.209 ( 0.000 0.000 0.000) 0.000 9.509 ( 0.000 0.000 0.000) 0.000 9.645 ( 0.000 0.000 0.000) 0.000 9.688 ( 0.000 0.000 0.000) 0.000 9.859 ( 0.000 0.000 0.000) 0.000 9.960 ( 0.000 0.000 0.000) 0.000 10.383 ( 0.000 0.000 0.000) 0.000 10.427 ( 0.000 0.000 0.000) 0.000 10.440 ( 0.000 0.000 0.000) 0.000 10.544 ( 0.000 0.000 0.000) 0.000 10.624 ( 0.000 0.000 0.000) 0.000 10.933 ( 0.000 0.000 0.000) 0.000 10.975 ( 0.000 0.000 0.000) 0.000 11.278 ( 0.000 0.000 0.000) 0.000 11.535 ( 0.000 0.000 0.000) 0.000 11.712 ( 0.000 0.000 0.000) 0.000 11.816 ( 0.000 0.000 0.000) 0.000 11.918 ( 0.000 0.000 0.000) 0.000 12.072 ( 0.000 0.000 0.000) 0.000 12.373 ( 0.000 0.000 0.000) 0.000 12.497 ( 0.000 0.000 0.000) 0.000 12.693 ( 0.000 0.000 0.000) 0.000 13.120 ( 0.000 0.000 0.000) 0.000 13.148 ( 0.000 0.000 0.000) 0.000 13.189 ( 0.000 0.000 0.000) 0.000 13.368 ( 0.000 0.000 0.000) 0.000 13.386 ( 0.000 0.000 0.000) 0.000 13.387 ( 0.000 0.000 0.000) 0.000 13.446 ( 0.000 0.000 0.000) 0.000 13.731 ( 0.000 0.000 0.000) 0.000 13.905 ( 0.000 0.000 0.000) 0.000 14.434 ( 0.000 0.000 0.000) 0.000 14.462 ( 0.000 0.000 0.000) 0.000 14.635 ( 0.000 0.000 0.000) 0.000 14.751 ( 0.000 0.000 0.000) 0.000 14.979 ( 0.000 0.000 0.000) 0.000 15.225 ( 0.000 0.000 0.000) 0.000 15.369 ( 0.000 0.000 0.000) 0.000 15.659 ( 0.000 0.000 0.000) 0.000 15.665 ( 0.000 0.000 0.000) 0.000 15.763 ( 0.000 0.000 0.000) 0.000 15.903 ( 0.000 0.000 0.000) 0.000 15.922 ( 0.000 0.000 0.000) 0.000 16.018 ( 0.000 0.000 0.000) 0.000 16.372 ( 0.000 0.000 0.000) 0.000 16.544 ( 0.000 0.000 0.000) 0.000 16.695 ( 0.000 0.000 0.000) 0.000 16.705 ( 0.000 0.000 0.000) 0.000 16.722 ( 0.000 0.000 0.000) 0.000 17.061 ( 0.000 0.000 0.000) 0.000 17.138 ( 0.000 0.000 0.000) 0.000 17.403 ( 0.000 0.000 0.000) 0.000 17.689 ( 0.000 0.000 0.000) 0.000 17.841 ( 0.000 0.000 0.000) 0.000 17.927 ( 0.000 0.000 0.000) 0.000 18.073 ( 0.000 0.000 0.000) 0.000 18.514 ( 0.000 0.000 0.000) 0.000 18.938 ( 0.000 0.000 0.000) 0.000 19.162 ( 0.000 0.000 0.000) 0.000 19.565 ( 0.000 0.000 0.000) 0.000 19.846 ( 0.000 0.000 0.000) 0.000 19.867 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/104) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.649 ( 27.922 0.000 18.306) 33.388 0.691 ( 31.879 0.000 14.963) 35.216 1.226 ( 58.809 0.000 15.522) 60.823 2.316 ( 7.902 0.000 -7.759) 11.074 2.449 ( 2.594 0.000 0.977) 2.771 2.575 ( 3.172 0.000 -12.132) 12.540 2.693 ( 2.427 0.000 3.076) 3.919 2.887 ( 9.015 0.000 5.482) 10.551 3.001 ( 3.301 0.000 3.064) 4.504 3.137 ( -0.617 0.000 3.309) 3.366 3.190 ( -0.192 0.000 -2.868) 2.874 3.223 ( -0.690 0.000 1.411) 1.570 3.303 ( -0.210 0.000 0.405) 0.456 3.346 ( 0.927 0.000 4.459) 4.554 3.517 ( 3.973 0.000 6.049) 7.237 3.519 ( 7.035 0.000 -2.471) 7.457 3.716 ( 5.640 0.000 6.383) 8.518 3.720 ( 3.350 0.000 0.776) 3.439 3.882 ( 1.209 0.000 -5.150) 5.290 4.040 ( -4.059 0.000 -1.475) 4.319 4.059 ( -5.809 0.000 -8.081) 9.953 4.234 ( -4.121 0.000 -6.829) 7.976 4.311 ( 0.791 0.000 -3.068) 3.169 4.472 ( -2.710 0.000 10.972) 11.302 4.484 ( 2.023 0.000 -4.908) 5.308 4.560 ( -3.109 0.000 5.067) 5.945 4.585 ( -2.667 0.000 -1.408) 3.016 4.604 ( 0.806 0.000 1.511) 1.712 4.661 ( -2.241 0.000 10.415) 10.654 4.880 ( 0.051 0.000 2.209) 2.210 5.071 ( -1.323 0.000 -1.518) 2.014 5.105 ( 3.980 0.000 -7.055) 8.100 5.197 ( 3.998 0.000 -9.163) 9.997 5.247 ( -1.205 0.000 1.123) 1.647 5.468 ( 0.665 0.000 2.530) 2.616 5.477 ( 0.498 0.000 -4.585) 4.612 5.926 ( -0.531 0.000 2.368) 2.427 5.934 ( -9.956 0.000 1.525) 10.072 6.016 ( 3.925 0.000 -0.354) 3.941 6.154 ( -3.110 0.000 -2.872) 4.233 6.173 ( -3.370 0.000 4.850) 5.906 6.378 ( 4.393 0.000 5.845) 7.312 6.697 ( -5.338 0.000 0.773) 5.394 6.815 ( -11.503 0.000 -1.507) 11.601 6.892 ( -8.743 0.000 -0.452) 8.755 7.175 ( 4.628 0.000 1.976) 5.033 7.256 ( 5.121 0.000 -3.252) 6.067 7.493 ( -1.950 0.000 -1.077) 2.228 7.727 ( -1.204 0.000 -5.562) 5.691 7.765 ( 3.138 0.000 -0.306) 3.153 8.149 ( 3.679 0.000 4.117) 5.521 8.288 ( 3.575 0.000 -1.591) 3.913 8.554 ( -6.100 0.000 -5.576) 8.265 8.679 ( 9.637 0.000 -6.160) 11.438 8.757 ( 0.907 0.000 -7.575) 7.629 8.868 ( -3.296 0.000 1.245) 3.523 9.094 ( 9.525 0.000 5.347) 10.923 9.201 ( -4.821 0.000 9.375) 10.542 9.314 ( 6.788 0.000 4.591) 8.195 9.522 ( 2.613 0.000 -3.145) 4.089 9.631 ( -0.438 0.000 -12.806) 12.813 9.739 ( 1.672 0.000 5.463) 5.713 9.852 ( -1.608 0.000 1.390) 2.125 9.975 ( 2.627 0.000 -2.770) 3.818 10.264 ( -8.955 0.000 4.964) 10.239 10.421 ( -1.679 0.000 2.980) 3.420 10.429 ( -0.685 0.000 -9.772) 9.796 10.732 ( 13.197 0.000 1.521) 13.284 10.738 ( 6.612 0.000 -19.886) 20.956 10.936 ( -1.345 0.000 3.969) 4.191 10.998 ( 1.231 0.000 3.424) 3.638 11.311 ( 1.982 0.000 3.767) 4.257 11.459 ( -5.097 0.000 -3.796) 6.355 11.630 ( -7.369 0.000 -2.126) 7.670 11.916 ( -1.026 0.000 4.977) 5.082 11.956 ( 2.399 0.000 1.160) 2.664 12.074 ( -0.882 0.000 2.144) 2.319 12.325 ( -4.037 0.000 -3.041) 5.054 12.555 ( 5.143 0.000 2.792) 5.852 12.642 ( -6.870 0.000 -1.893) 7.126 13.077 ( 1.619 0.000 -9.277) 9.417 13.240 ( -7.901 0.000 -1.080) 7.975 13.278 ( 6.664 0.000 6.784) 9.510 13.372 ( -7.047 0.000 3.046) 7.677 13.387 ( 0.892 0.000 -1.537) 1.777 13.429 ( -2.128 0.000 -4.284) 4.783 13.711 ( -11.086 0.000 18.880) 21.894 13.741 ( 2.479 0.000 0.716) 2.580 13.947 ( -1.327 0.000 12.531) 12.601 14.426 ( 0.018 0.000 -1.563) 1.563 14.527 ( 5.158 0.000 -9.746) 11.027 14.627 ( -1.699 0.000 -2.158) 2.746 14.757 ( 0.941 0.000 1.840) 2.067 15.035 ( -8.420 0.000 -0.452) 8.432 15.275 ( -4.576 0.000 -6.934) 8.308 15.385 ( 11.329 0.000 -4.405) 12.156 15.649 ( -1.556 0.000 -2.473) 2.922 15.688 ( 3.462 0.000 -1.164) 3.652 15.783 ( -1.937 0.000 8.401) 8.621 15.958 ( -5.732 0.000 -1.430) 5.908 16.027 ( 7.413 0.000 4.622) 8.736 16.237 ( -3.687 0.000 -2.194) 4.290 16.446 ( 9.065 0.000 -1.749) 9.232 16.567 ( 0.639 0.000 1.676) 1.794 16.724 ( 1.742 0.000 -3.029) 3.494 16.731 ( 2.537 0.000 0.604) 2.608 17.037 ( -4.643 0.000 5.775) 7.410 17.085 ( -4.680 0.000 0.271) 4.688 17.393 ( 14.157 0.000 -29.582) 32.795 17.398 ( 1.294 0.000 -4.897) 5.065 17.685 ( -2.097 0.000 0.206) 2.107 17.853 ( 1.714 0.000 -1.174) 2.077 17.938 ( 0.185 0.000 5.665) 5.668 18.456 ( -5.461 0.000 -2.160) 5.873 18.959 ( 1.597 0.000 2.598) 3.050 19.128 ( -3.112 0.000 -1.739) 3.565 19.621 ( 5.381 0.000 3.397) 6.363 19.854 ( 0.855 0.000 2.110) 2.277 19.905 ( 3.762 0.000 -0.367) 3.780 20.217 ( -7.407 0.000 11.930) 14.042 ======================= Grid point 2 (3/104) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.259 ( 25.241 0.000 16.731) 30.283 1.360 ( 30.164 0.000 14.479) 33.459 2.276 ( 42.359 0.000 11.428) 43.873 2.414 ( 8.561 0.000 -7.049) 11.089 2.499 ( 5.316 0.000 -3.229) 6.220 2.613 ( 9.979 0.000 -11.380) 15.136 2.772 ( 3.161 0.000 2.405) 3.972 2.988 ( -2.545 0.000 0.680) 2.635 3.128 ( 7.749 0.000 7.256) 10.616 3.164 ( -2.261 0.000 0.792) 2.396 3.207 ( -1.564 0.000 -2.626) 3.056 3.212 ( 7.306 0.000 1.730) 7.508 3.387 ( 7.312 0.000 3.381) 8.056 3.394 ( 1.891 0.000 2.378) 3.038 3.574 ( -0.324 0.000 -6.286) 6.294 3.637 ( 4.561 0.000 6.902) 8.273 3.664 ( -1.803 0.000 -7.884) 8.087 3.887 ( -3.337 0.000 6.693) 7.479 3.924 ( 4.978 0.000 0.760) 5.036 3.947 ( -4.155 0.000 -4.270) 5.957 4.025 ( 11.959 0.000 0.440) 11.967 4.164 ( 2.601 0.000 -3.445) 4.317 4.262 ( -4.486 0.000 1.320) 4.676 4.424 ( -7.311 0.000 2.775) 7.820 4.450 ( -4.376 0.000 -5.938) 7.376 4.503 ( 3.370 0.000 -4.316) 5.476 4.597 ( 2.971 0.000 2.429) 3.837 4.685 ( -1.761 0.000 4.106) 4.468 4.692 ( 2.152 0.000 7.128) 7.446 4.888 ( -0.327 0.000 -0.243) 0.407 5.005 ( -4.195 0.000 -3.509) 5.469 5.103 ( 4.219 0.000 -12.009) 12.728 5.184 ( -1.962 0.000 0.495) 2.024 5.256 ( 2.737 0.000 -1.841) 3.299 5.438 ( -0.270 0.000 -6.598) 6.603 5.529 ( 2.080 0.000 5.199) 5.600 5.766 ( -9.308 0.000 3.998) 10.130 5.903 ( -3.384 0.000 -0.666) 3.449 6.040 ( -4.499 0.000 -7.937) 9.124 6.111 ( 7.123 0.000 -1.713) 7.326 6.175 ( -0.754 0.000 7.649) 7.686 6.477 ( -0.153 0.000 2.582) 2.587 6.533 ( -11.930 0.000 3.386) 12.401 6.640 ( -5.568 0.000 -3.010) 6.329 6.724 ( -7.764 0.000 3.403) 8.477 7.315 ( 9.379 0.000 0.944) 9.426 7.342 ( 6.456 0.000 -3.018) 7.126 7.433 ( -3.475 0.000 -0.696) 3.544 7.698 ( 1.783 0.000 -3.407) 3.846 7.810 ( 2.195 0.000 -2.896) 3.634 8.236 ( 1.261 0.000 5.465) 5.609 8.270 ( -2.560 0.000 -2.845) 3.827 8.477 ( 0.148 0.000 1.785) 1.791 8.671 ( -4.059 0.000 -2.747) 4.901 8.842 ( 1.046 0.000 -1.241) 1.623 8.885 ( 10.258 0.000 3.320) 10.782 9.186 ( -1.903 0.000 3.354) 3.856 9.298 ( 9.842 0.000 -0.772) 9.872 9.446 ( 0.939 0.000 3.294) 3.425 9.533 ( 1.735 0.000 -9.116) 9.279 9.557 ( 3.485 0.000 -2.763) 4.447 9.791 ( -0.962 0.000 3.636) 3.762 9.823 ( -1.737 0.000 0.316) 1.766 10.016 ( 4.287 0.000 -2.768) 5.102 10.179 ( -5.118 0.000 6.366) 8.168 10.304 ( -5.147 0.000 -9.251) 10.587 10.396 ( -4.411 0.000 4.849) 6.555 10.705 ( 3.083 0.000 -14.253) 14.583 10.937 ( -2.082 0.000 4.197) 4.686 10.969 ( 10.523 0.000 2.035) 10.718 11.074 ( 3.128 0.000 6.803) 7.488 11.311 ( -4.076 0.000 0.422) 4.098 11.447 ( 6.245 0.000 2.110) 6.592 11.454 ( -8.442 0.000 -3.672) 9.206 11.928 ( 0.050 0.000 0.385) 0.388 11.992 ( 0.913 0.000 0.309) 0.964 12.057 ( -3.693 0.000 3.559) 5.129 12.196 ( -6.609 0.000 -4.479) 7.984 12.513 ( -6.771 0.000 1.110) 6.862 12.701 ( 6.868 0.000 3.876) 7.887 13.044 ( 1.564 0.000 -7.833) 7.987 13.084 ( -9.481 0.000 -2.621) 9.837 13.178 ( -8.980 0.000 -1.991) 9.198 13.376 ( 1.909 0.000 -4.292) 4.697 13.389 ( -1.773 0.000 3.058) 3.535 13.454 ( 5.363 0.000 5.140) 7.428 13.637 ( -5.657 0.000 4.081) 6.975 13.811 ( 3.258 0.000 1.188) 3.467 14.006 ( -2.635 0.000 12.469) 12.744 14.406 ( -0.517 0.000 -4.672) 4.701 14.544 ( -5.033 0.000 -0.536) 5.061 14.564 ( 3.093 0.000 -1.338) 3.370 14.805 ( 2.801 0.000 0.285) 2.815 14.898 ( -6.864 0.000 1.629) 7.055 15.168 ( -1.607 0.000 -6.028) 6.239 15.517 ( 2.916 0.000 -1.189) 3.150 15.590 ( -2.357 0.000 -3.730) 4.412 15.718 ( 2.007 0.000 -9.031) 9.252 15.756 ( -7.063 0.000 6.232) 9.419 15.876 ( -0.717 0.000 6.316) 6.357 16.164 ( -0.932 0.000 -5.571) 5.648 16.199 ( 7.441 0.000 4.230) 8.559 16.569 ( -0.156 0.000 -1.507) 1.515 16.657 ( 12.935 0.000 1.679) 13.043 16.749 ( 2.411 0.000 -1.005) 2.612 16.794 ( 3.323 0.000 1.256) 3.552 16.989 ( -5.530 0.000 7.760) 9.529 17.004 ( -3.960 0.000 -0.416) 3.982 17.376 ( 0.775 0.000 -6.258) 6.305 17.430 ( 6.243 0.000 -12.460) 13.937 17.588 ( -7.990 0.000 0.280) 7.995 17.880 ( 2.277 0.000 -2.655) 3.498 18.032 ( 4.054 0.000 7.778) 8.771 18.298 ( -9.197 0.000 -3.188) 9.734 19.028 ( -5.575 0.000 -3.574) 6.622 19.035 ( 4.001 0.000 3.899) 5.586 19.763 ( 7.135 0.000 2.330) 7.505 19.917 ( 4.290 0.000 2.142) 4.795 19.995 ( 5.680 0.000 1.715) 5.933 20.151 ( -4.795 0.000 1.436) 5.006 ======================= Grid point 3 (4/104) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.784 ( 19.901 0.000 14.039) 24.355 1.976 ( 26.417 0.000 13.069) 29.473 2.516 ( 2.377 0.000 0.070) 2.378 2.527 ( 7.723 0.000 -2.900) 8.250 2.731 ( 11.136 0.000 -10.905) 15.586 2.825 ( 1.773 0.000 0.810) 1.949 2.894 ( 12.368 0.000 -0.923) 12.403 2.961 ( 5.181 0.000 -3.480) 6.242 3.097 ( -5.982 0.000 0.907) 6.050 3.118 ( -4.523 0.000 -6.324) 7.775 3.304 ( 6.965 0.000 4.639) 8.369 3.353 ( 6.154 0.000 4.131) 7.412 3.407 ( -4.574 0.000 -4.094) 6.139 3.454 ( 2.201 0.000 -6.540) 6.900 3.554 ( 3.516 0.000 5.193) 6.271 3.674 ( 3.218 0.000 -3.199) 4.538 3.780 ( -1.206 0.000 1.841) 2.201 3.825 ( 5.174 0.000 9.014) 10.394 3.836 ( -4.573 0.000 -3.067) 5.506 4.093 ( -1.265 0.000 -8.441) 8.536 4.167 ( 12.735 0.000 8.402) 15.257 4.182 ( -5.901 0.000 1.835) 6.180 4.259 ( 6.559 0.000 0.969) 6.630 4.302 ( -5.118 0.000 -0.922) 5.200 4.430 ( 2.048 0.000 -2.254) 3.046 4.560 ( 5.789 0.000 2.685) 6.382 4.633 ( -4.925 0.000 0.239) 4.931 4.671 ( 3.068 0.000 2.906) 4.226 4.765 ( 0.140 0.000 5.220) 5.222 4.856 ( 0.436 0.000 -8.882) 8.893 4.908 ( -4.005 0.000 1.331) 4.220 5.111 ( 5.543 0.000 -10.064) 11.490 5.155 ( -2.090 0.000 2.261) 3.079 5.278 ( -1.166 0.000 -1.744) 2.098 5.403 ( 3.417 0.000 -6.165) 7.048 5.543 ( -5.966 0.000 7.270) 9.404 5.712 ( -0.373 0.000 2.131) 2.164 5.813 ( -4.805 0.000 -1.118) 4.933 5.920 ( -0.437 0.000 -7.825) 7.838 6.225 ( 3.504 0.000 0.568) 3.550 6.238 ( 2.413 0.000 7.345) 7.732 6.352 ( -7.963 0.000 -5.942) 9.936 6.408 ( -4.346 0.000 2.977) 5.267 6.556 ( -0.165 0.000 -3.700) 3.703 6.726 ( -0.036 0.000 7.653) 7.653 7.354 ( -1.899 0.000 -3.242) 3.757 7.457 ( 6.276 0.000 -1.158) 6.382 7.510 ( 9.653 0.000 3.335) 10.213 7.752 ( 5.837 0.000 0.351) 5.848 7.795 ( -2.340 0.000 -0.078) 2.341 8.191 ( -3.877 0.000 -1.653) 4.215 8.281 ( 0.580 0.000 4.908) 4.943 8.567 ( -3.141 0.000 -7.614) 8.237 8.574 ( 6.333 0.000 4.857) 7.981 8.858 ( 1.263 0.000 -2.259) 2.588 9.063 ( 4.898 0.000 6.230) 7.925 9.172 ( -2.350 0.000 2.962) 3.781 9.333 ( -1.070 0.000 -15.643) 15.680 9.447 ( 5.212 0.000 -2.825) 5.928 9.581 ( -2.577 0.000 11.291) 11.582 9.606 ( 3.869 0.000 -2.733) 4.737 9.726 ( -8.608 0.000 3.429) 9.266 9.828 ( 3.310 0.000 -0.399) 3.334 10.089 ( 4.271 0.000 -0.498) 4.300 10.135 ( -4.847 0.000 -10.782) 11.822 10.151 ( -3.193 0.000 5.012) 5.943 10.334 ( -5.647 0.000 4.676) 7.332 10.646 ( 0.684 0.000 -11.033) 11.054 10.900 ( -4.585 0.000 1.438) 4.805 11.083 ( 1.558 0.000 -1.043) 1.875 11.199 ( 4.887 0.000 6.107) 7.821 11.326 ( -2.496 0.000 -1.496) 2.910 11.342 ( 6.469 0.000 4.229) 7.729 11.595 ( 6.720 0.000 2.870) 7.307 11.916 ( -1.085 0.000 -2.758) 2.964 11.979 ( -7.649 0.000 3.532) 8.426 11.998 ( -0.124 0.000 -0.600) 0.612 12.052 ( -5.621 0.000 -2.103) 6.002 12.417 ( -4.814 0.000 1.792) 5.137 12.714 ( -7.679 0.000 -4.238) 8.771 12.979 ( 2.362 0.000 3.215) 3.990 13.025 ( 1.462 0.000 -4.903) 5.117 13.096 ( -1.461 0.000 1.274) 1.938 13.351 ( -2.127 0.000 -3.267) 3.899 13.419 ( 1.981 0.000 5.673) 6.009 13.517 ( -0.441 0.000 -1.448) 1.513 13.631 ( 3.237 0.000 2.975) 4.397 13.859 ( 1.304 0.000 0.591) 1.432 14.024 ( -3.658 0.000 8.934) 9.654 14.316 ( -5.333 0.000 -4.988) 7.302 14.473 ( -1.844 0.000 -2.419) 3.042 14.597 ( -0.221 0.000 0.423) 0.477 14.835 ( -0.869 0.000 2.762) 2.896 14.857 ( 3.150 0.000 -0.528) 3.194 15.130 ( 0.937 0.000 -3.696) 3.813 15.407 ( -11.115 0.000 1.116) 11.171 15.511 ( -2.609 0.000 -5.657) 6.230 15.631 ( -10.427 0.000 4.607) 11.399 15.756 ( 7.412 0.000 -7.082) 10.251 15.945 ( 2.159 0.000 -0.456) 2.206 16.151 ( 3.130 0.000 -1.183) 3.346 16.348 ( 6.240 0.000 2.203) 6.617 16.563 ( 2.057 0.000 -3.903) 4.412 16.787 ( 1.329 0.000 1.987) 2.390 16.847 ( 0.240 0.000 5.377) 5.382 16.867 ( 5.081 0.000 2.244) 5.554 16.938 ( -2.315 0.000 -1.849) 2.963 16.999 ( 4.265 0.000 4.918) 6.510 17.343 ( -0.216 0.000 -3.788) 3.794 17.382 ( -9.312 0.000 1.442) 9.423 17.486 ( 1.288 0.000 -4.885) 5.052 17.856 ( -2.228 0.000 -9.121) 9.389 18.132 ( -6.314 0.000 2.084) 6.649 18.164 ( 4.483 0.000 6.050) 7.530 18.887 ( -6.091 0.000 -5.295) 8.070 19.146 ( 4.711 0.000 3.757) 6.026 19.884 ( 3.711 0.000 2.104) 4.266 20.024 ( 5.528 0.000 1.688) 5.780 20.080 ( -1.854 0.000 -2.634) 3.221 20.129 ( 6.565 0.000 3.474) 7.428 ======================= Grid point 4 (5/104) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.146 ( 10.190 0.000 8.207) 13.084 2.467 ( 17.881 0.000 8.178) 19.663 2.579 ( 4.232 0.000 2.598) 4.966 2.642 ( 5.724 0.000 0.093) 5.725 2.789 ( 0.378 0.000 -1.174) 1.233 2.853 ( -0.792 0.000 1.179) 1.421 2.971 ( 2.948 0.000 -9.643) 10.083 2.973 ( -6.798 0.000 -1.375) 6.935 3.013 ( 0.920 0.000 -4.423) 4.518 3.046 ( 9.599 0.000 -8.209) 12.630 3.318 ( -1.528 0.000 -2.957) 3.329 3.424 ( 3.613 0.000 1.557) 3.935 3.432 ( -2.201 0.000 -5.974) 6.367 3.498 ( 3.721 0.000 5.038) 6.263 3.579 ( -2.500 0.000 5.071) 5.654 3.665 ( -2.202 0.000 -2.849) 3.601 3.752 ( -2.630 0.000 5.203) 5.830 3.789 ( 1.366 0.000 1.789) 2.251 3.945 ( 0.124 0.000 3.119) 3.122 3.986 ( -2.858 0.000 -7.980) 8.476 4.076 ( -2.743 0.000 -3.591) 4.519 4.250 ( -3.732 0.000 5.122) 6.338 4.365 ( -0.191 0.000 -0.786) 0.809 4.366 ( 1.501 0.000 4.309) 4.563 4.402 ( -0.186 0.000 -3.223) 3.228 4.670 ( 9.742 0.000 7.866) 12.522 4.701 ( 4.828 0.000 2.377) 5.381 4.751 ( 0.293 0.000 -4.940) 4.948 4.756 ( 6.322 0.000 -1.476) 6.492 4.831 ( -1.028 0.000 1.896) 2.157 4.873 ( -1.000 0.000 -0.300) 1.044 5.133 ( -1.382 0.000 -1.896) 2.346 5.148 ( 3.903 0.000 -4.402) 5.883 5.181 ( -7.080 0.000 -0.268) 7.085 5.466 ( 4.969 0.000 -2.351) 5.497 5.476 ( -5.560 0.000 4.751) 7.314 5.670 ( -3.183 0.000 -2.210) 3.875 5.737 ( -3.066 0.000 0.490) 3.105 5.961 ( 6.574 0.000 -1.845) 6.828 6.212 ( -2.831 0.000 -4.191) 5.057 6.223 ( -2.776 0.000 1.903) 3.366 6.349 ( 0.184 0.000 9.377) 9.378 6.413 ( 6.304 0.000 -3.986) 7.458 6.566 ( 2.143 0.000 -3.427) 4.042 6.761 ( -0.732 0.000 3.805) 3.875 7.307 ( -1.074 0.000 -2.291) 2.530 7.560 ( 7.385 0.000 -5.318) 9.100 7.684 ( 6.004 0.000 4.373) 7.428 7.739 ( -5.786 0.000 5.713) 8.131 7.911 ( 8.656 0.000 4.281) 9.657 8.119 ( -2.089 0.000 -2.158) 3.004 8.336 ( 1.606 0.000 3.664) 4.000 8.450 ( -3.551 0.000 -8.204) 8.939 8.729 ( 7.141 0.000 1.649) 7.329 8.851 ( -0.885 0.000 0.971) 1.314 9.132 ( -0.861 0.000 1.423) 1.664 9.152 ( -1.820 0.000 4.275) 4.647 9.187 ( -3.404 0.000 -11.846) 12.325 9.484 ( 2.102 0.000 -4.369) 4.849 9.577 ( -6.848 0.000 2.517) 7.296 9.586 ( -4.485 0.000 9.700) 10.687 9.661 ( 2.183 0.000 -0.676) 2.285 9.923 ( 6.480 0.000 -0.950) 6.550 9.965 ( -5.194 0.000 -7.715) 9.300 10.114 ( -4.238 0.000 3.026) 5.208 10.166 ( 3.341 0.000 -0.136) 3.343 10.285 ( -2.509 0.000 3.184) 4.053 10.589 ( 0.315 0.000 -6.577) 6.584 10.815 ( -4.027 0.000 -0.689) 4.086 11.091 ( 0.919 0.000 -0.452) 1.024 11.287 ( 2.048 0.000 -0.118) 2.051 11.360 ( 3.692 0.000 4.711) 5.985 11.511 ( 7.334 0.000 2.269) 7.677 11.695 ( 2.611 0.000 0.344) 2.633 11.829 ( -4.519 0.000 -4.106) 6.106 11.848 ( -8.645 0.000 4.349) 9.677 11.993 ( 0.549 0.000 -1.326) 1.435 11.995 ( -0.745 0.000 0.458) 0.874 12.365 ( -2.243 0.000 1.251) 2.568 12.551 ( -5.277 0.000 -3.011) 6.076 13.030 ( 1.666 0.000 -1.487) 2.233 13.053 ( 2.034 0.000 1.994) 2.848 13.113 ( 0.929 0.000 2.269) 2.452 13.256 ( -5.141 0.000 -2.207) 5.594 13.505 ( 0.970 0.000 -2.370) 2.561 13.539 ( 5.481 0.000 6.744) 8.690 13.712 ( 3.135 0.000 1.180) 3.350 13.866 ( -0.365 0.000 -0.951) 1.018 14.013 ( -2.387 0.000 4.348) 4.960 14.173 ( -5.837 0.000 -4.223) 7.204 14.426 ( -1.331 0.000 -2.354) 2.704 14.559 ( -3.167 0.000 0.535) 3.212 14.897 ( 4.206 0.000 2.147) 4.722 14.913 ( 3.583 0.000 -1.154) 3.764 15.140 ( 2.010 0.000 -1.707) 2.637 15.230 ( -8.473 0.000 1.177) 8.555 15.424 ( -1.997 0.000 -6.109) 6.427 15.476 ( -9.300 0.000 4.851) 10.489 15.812 ( 1.448 0.000 -1.568) 2.134 15.953 ( 2.871 0.000 -5.918) 6.578 16.229 ( 3.593 0.000 1.612) 3.938 16.447 ( 3.518 0.000 0.357) 3.537 16.580 ( 1.438 0.000 -1.866) 2.356 16.837 ( -2.728 0.000 3.350) 4.320 16.838 ( 2.156 0.000 4.084) 4.618 16.901 ( 1.411 0.000 -5.103) 5.294 16.974 ( 4.873 0.000 3.855) 6.213 17.131 ( 4.077 0.000 0.796) 4.154 17.200 ( -11.381 0.000 2.946) 11.756 17.337 ( 1.022 0.000 3.275) 3.431 17.492 ( 1.323 0.000 -2.123) 2.501 17.671 ( -7.092 0.000 -13.123) 14.917 18.111 ( -0.748 0.000 4.888) 4.945 18.266 ( 2.804 0.000 3.251) 4.293 18.753 ( -3.994 0.000 -4.763) 6.216 19.242 ( 3.121 0.000 2.367) 3.917 19.910 ( -1.162 0.000 0.606) 1.311 20.068 ( 1.828 0.000 -1.995) 2.706 20.121 ( 3.644 0.000 1.090) 3.803 20.257 ( 4.462 0.000 2.668) 5.199 ======================= Grid point 5 (6/104) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 52 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.260 ( 0.000 0.000 0.000) 0.000 2.661 ( 0.000 0.000 0.000) 0.000 2.677 ( 0.000 0.000 0.000) 0.000 2.709 ( 0.000 0.000 0.000) 0.000 2.781 ( 0.000 0.000 0.000) 0.000 2.810 ( 0.000 0.000 0.000) 0.000 2.886 ( 0.000 0.000 0.000) 0.000 2.919 ( 0.000 0.000 -0.000) 0.000 3.086 ( 0.000 0.000 0.000) 0.000 3.145 ( 0.000 0.000 0.000) 0.000 3.307 ( 0.000 0.000 0.000) 0.000 3.321 ( -0.000 0.000 -0.000) 0.000 3.458 ( 0.000 0.000 0.000) 0.000 3.515 ( 0.000 0.000 0.000) 0.000 3.592 ( 0.000 0.000 0.000) 0.000 3.628 ( 0.000 0.000 0.000) 0.000 3.756 ( 0.000 0.000 0.000) 0.000 3.863 ( 0.000 0.000 0.000) 0.000 3.885 ( -0.000 0.000 -0.000) 0.000 3.925 ( 0.000 0.000 0.000) 0.000 4.072 ( 0.000 0.000 -0.000) 0.000 4.201 ( -0.000 0.000 0.000) 0.000 4.345 ( 0.000 0.000 0.000) 0.000 4.362 ( 0.000 0.000 0.000) 0.000 4.419 ( 0.000 0.000 -0.000) 0.000 4.742 ( 0.000 0.000 -0.000) 0.000 4.743 ( -0.000 0.000 0.000) 0.000 4.777 ( 0.000 0.000 -0.000) 0.000 4.843 ( -0.000 0.000 0.000) 0.000 4.848 ( 0.000 0.000 -0.000) 0.000 4.941 ( 0.000 0.000 0.000) 0.000 5.006 ( -0.000 0.000 -0.000) 0.000 5.131 ( 0.000 0.000 0.000) 0.000 5.174 ( 0.000 0.000 -0.000) 0.000 5.433 ( 0.000 0.000 0.000) 0.000 5.508 ( 0.000 0.000 0.000) 0.000 5.627 ( 0.000 0.000 0.000) 0.000 5.711 ( 0.000 0.000 -0.000) 0.000 6.033 ( 0.000 0.000 0.000) 0.000 6.173 ( 0.000 0.000 0.000) 0.000 6.199 ( 0.000 0.000 0.000) 0.000 6.373 ( 0.000 0.000 0.000) 0.000 6.513 ( 0.000 0.000 0.000) 0.000 6.544 ( -0.000 0.000 -0.000) 0.000 6.765 ( 0.000 0.000 0.000) 0.000 7.287 ( 0.000 0.000 -0.000) 0.000 7.629 ( 0.000 0.000 0.000) 0.000 7.686 ( 0.000 0.000 -0.000) 0.000 7.763 ( 0.000 0.000 -0.000) 0.000 8.018 ( 0.000 0.000 0.000) 0.000 8.114 ( 0.000 0.000 0.000) 0.000 8.358 ( -0.000 0.000 -0.000) 0.000 8.368 ( 0.000 0.000 0.000) 0.000 8.800 ( 0.000 0.000 0.000) 0.000 8.865 ( 0.000 0.000 -0.000) 0.000 9.090 ( 0.000 0.000 0.000) 0.000 9.123 ( 0.000 0.000 0.000) 0.000 9.141 ( 0.000 0.000 0.000) 0.000 9.487 ( 0.000 0.000 -0.000) 0.000 9.528 ( 0.000 0.000 0.000) 0.000 9.574 ( 0.000 0.000 0.000) 0.000 9.682 ( 0.000 0.000 -0.000) 0.000 9.878 ( 0.000 0.000 0.000) 0.000 10.003 ( 0.000 0.000 -0.000) 0.000 10.064 ( -0.000 0.000 0.000) 0.000 10.198 ( 0.000 0.000 0.000) 0.000 10.278 ( 0.000 0.000 0.000) 0.000 10.568 ( 0.000 0.000 -0.000) 0.000 10.772 ( 0.000 0.000 0.000) 0.000 11.103 ( 0.000 0.000 0.000) 0.000 11.305 ( 0.000 0.000 0.000) 0.000 11.425 ( 0.000 0.000 0.000) 0.000 11.585 ( 0.000 0.000 -0.000) 0.000 11.730 ( 0.000 0.000 0.000) 0.000 11.759 ( 0.000 0.000 0.000) 0.000 11.765 ( 0.000 0.000 0.000) 0.000 11.994 ( 0.000 0.000 -0.000) 0.000 11.996 ( 0.000 0.000 0.000) 0.000 12.350 ( 0.000 0.000 0.000) 0.000 12.493 ( 0.000 0.000 0.000) 0.000 13.050 ( 0.000 0.000 0.000) 0.000 13.080 ( 0.000 0.000 0.000) 0.000 13.131 ( 0.000 0.000 0.000) 0.000 13.187 ( -0.000 0.000 -0.000) 0.000 13.507 ( 0.000 0.000 0.000) 0.000 13.640 ( 0.000 0.000 0.000) 0.000 13.747 ( 0.000 0.000 0.000) 0.000 13.846 ( 0.000 0.000 0.000) 0.000 14.007 ( 0.000 0.000 0.000) 0.000 14.093 ( 0.000 0.000 0.000) 0.000 14.403 ( 0.000 0.000 0.000) 0.000 14.527 ( 0.000 0.000 0.000) 0.000 14.948 ( 0.000 0.000 -0.000) 0.000 14.959 ( 0.000 0.000 0.000) 0.000 15.145 ( 0.000 0.000 0.000) 0.000 15.158 ( 0.000 0.000 0.000) 0.000 15.372 ( 0.000 0.000 0.000) 0.000 15.406 ( 0.000 0.000 -0.000) 0.000 15.810 ( 0.000 0.000 0.000) 0.000 15.964 ( 0.000 0.000 0.000) 0.000 16.271 ( 0.000 0.000 -0.000) 0.000 16.480 ( 0.000 0.000 -0.000) 0.000 16.582 ( -0.000 0.000 0.000) 0.000 16.822 ( 0.000 0.000 0.000) 0.000 16.869 ( 0.000 0.000 -0.000) 0.000 16.941 ( 0.000 0.000 -0.000) 0.000 17.062 ( 0.000 0.000 -0.000) 0.000 17.065 ( -0.000 0.000 0.000) 0.000 17.139 ( 0.000 0.000 0.000) 0.000 17.421 ( 0.000 0.000 0.000) 0.000 17.496 ( 0.000 0.000 -0.000) 0.000 17.497 ( 0.000 0.000 0.000) 0.000 18.127 ( 0.000 0.000 0.000) 0.000 18.304 ( 0.000 0.000 0.000) 0.000 18.696 ( 0.000 0.000 -0.000) 0.000 19.281 ( 0.000 0.000 0.000) 0.000 19.896 ( 0.000 0.000 0.000) 0.000 20.082 ( 0.000 0.000 -0.000) 0.000 20.160 ( 0.000 0.000 0.000) 0.000 20.310 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 11 (7/104) ======================= q-point: ( 0.00 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.607 ( 0.000 31.609 0.000) 31.609 0.679 ( 0.000 35.206 0.000) 35.206 0.980 ( 0.000 50.030 0.000) 50.030 2.262 ( 0.000 -1.247 0.000) 1.247 2.404 ( 0.000 -1.392 0.000) 1.392 2.588 ( 0.000 -0.537 0.000) 0.537 2.665 ( 0.000 0.341 0.000) 0.341 2.680 ( 0.000 -8.810 0.000) 8.810 2.753 ( 0.000 -12.578 0.000) 12.578 2.960 ( 0.000 -9.492 0.000) 9.492 3.210 ( 0.000 -3.127 0.000) 3.127 3.271 ( 0.000 1.880 0.000) 1.880 3.324 ( 0.000 -1.722 0.000) 1.722 3.413 ( 0.000 1.064 0.000) 1.064 3.437 ( 0.000 1.731 0.000) 1.731 3.549 ( 0.000 -0.012 0.000) 0.012 3.633 ( 0.000 2.731 0.000) 2.731 3.688 ( 0.000 0.403 0.000) 0.403 3.819 ( 0.000 5.907 0.000) 5.907 3.971 ( 0.000 5.901 0.000) 5.901 4.145 ( 0.000 -5.188 0.000) 5.188 4.158 ( 0.000 -9.440 0.000) 9.440 4.165 ( 0.000 5.036 0.000) 5.036 4.406 ( 0.000 -8.432 0.000) 8.432 4.486 ( 0.000 2.071 0.000) 2.071 4.508 ( 0.000 -3.141 0.000) 3.141 4.593 ( 0.000 3.258 0.000) 3.258 4.673 ( 0.000 0.962 0.000) 0.962 4.674 ( 0.000 5.074 0.000) 5.074 4.778 ( 0.000 -6.314 0.000) 6.314 5.054 ( 0.000 -2.891 0.000) 2.891 5.090 ( 0.000 -1.594 0.000) 1.594 5.255 ( 0.000 0.502 0.000) 0.502 5.406 ( 0.000 4.237 0.000) 4.237 5.424 ( 0.000 -1.525 0.000) 1.525 5.533 ( 0.000 4.034 0.000) 4.034 5.905 ( 0.000 -1.003 0.000) 1.003 5.928 ( 0.000 -2.911 0.000) 2.911 6.065 ( 0.000 2.120 0.000) 2.120 6.212 ( 0.000 2.124 0.000) 2.124 6.379 ( 0.000 2.677 0.000) 2.677 6.401 ( 0.000 4.239 0.000) 4.239 6.713 ( 0.000 -4.267 0.000) 4.267 6.884 ( 0.000 -5.223 0.000) 5.223 6.941 ( 0.000 -0.401 0.000) 0.401 7.120 ( 0.000 -0.694 0.000) 0.694 7.253 ( 0.000 2.951 0.000) 2.951 7.518 ( 0.000 0.076 0.000) 0.076 7.801 ( 0.000 2.297 0.000) 2.297 8.061 ( 0.000 -2.064 0.000) 2.064 8.112 ( 0.000 0.540 0.000) 0.540 8.170 ( 0.000 2.263 0.000) 2.263 8.450 ( 0.000 2.528 0.000) 2.528 8.743 ( 0.000 3.302 0.000) 3.302 8.785 ( 0.000 0.465 0.000) 0.465 8.958 ( 0.000 -5.348 0.000) 5.348 8.986 ( 0.000 -1.866 0.000) 1.866 9.204 ( 0.000 0.261 0.000) 0.261 9.289 ( 0.000 -2.197 0.000) 2.197 9.473 ( 0.000 -3.889 0.000) 3.889 9.658 ( 0.000 1.020 0.000) 1.020 9.712 ( 0.000 0.042 0.000) 0.042 9.899 ( 0.000 3.899 0.000) 3.899 10.011 ( 0.000 4.265 0.000) 4.265 10.385 ( 0.000 -1.046 0.000) 1.046 10.400 ( 0.000 -1.796 0.000) 1.796 10.453 ( 0.000 0.437 0.000) 0.437 10.597 ( 0.000 -5.624 0.000) 5.624 10.623 ( 0.000 -0.098 0.000) 0.098 10.884 ( 0.000 -4.974 0.000) 4.974 11.041 ( 0.000 5.658 0.000) 5.658 11.287 ( 0.000 0.774 0.000) 0.774 11.518 ( 0.000 -1.512 0.000) 1.512 11.660 ( 0.000 -4.501 0.000) 4.501 11.829 ( 0.000 1.175 0.000) 1.175 12.078 ( 0.000 4.141 0.000) 4.141 12.092 ( 0.000 -6.915 0.000) 6.915 12.521 ( 0.000 2.343 0.000) 2.343 12.562 ( 0.000 13.347 0.000) 13.347 12.648 ( 0.000 -4.333 0.000) 4.333 13.069 ( 0.000 -5.145 0.000) 5.145 13.157 ( 0.000 0.765 0.000) 0.765 13.198 ( 0.000 0.938 0.000) 0.938 13.309 ( 0.000 -4.956 0.000) 4.956 13.378 ( 0.000 -0.976 0.000) 0.976 13.470 ( 0.000 1.163 0.000) 1.163 13.756 ( 0.000 2.381 0.000) 2.381 13.776 ( 0.000 2.948 0.000) 2.948 13.951 ( 0.000 4.937 0.000) 4.937 14.357 ( 0.000 -4.270 0.000) 4.270 14.527 ( 0.000 3.113 0.000) 3.113 14.713 ( 0.000 -0.472 0.000) 0.472 14.879 ( 0.000 -1.291 0.000) 1.291 14.967 ( 0.000 -1.256 0.000) 1.256 15.248 ( 0.000 2.363 0.000) 2.363 15.451 ( 0.000 1.306 0.000) 1.306 15.599 ( 0.000 -4.010 0.000) 4.010 15.648 ( 0.000 -3.104 0.000) 3.104 15.887 ( 0.000 0.587 0.000) 0.587 16.000 ( 0.000 5.208 0.000) 5.208 16.020 ( 0.000 0.022 0.000) 0.022 16.372 ( 0.000 0.280 0.000) 0.280 16.447 ( 0.000 -8.147 0.000) 8.147 16.611 ( 0.000 -4.606 0.000) 4.606 16.710 ( 0.000 1.443 0.000) 1.443 16.793 ( 0.000 1.877 0.000) 1.877 16.980 ( 0.000 8.130 0.000) 8.130 17.149 ( 0.000 1.252 0.000) 1.252 17.355 ( 0.000 -4.213 0.000) 4.213 17.620 ( 0.000 -5.897 0.000) 5.897 17.901 ( 0.000 4.938 0.000) 4.938 17.946 ( 0.000 1.806 0.000) 1.806 18.151 ( 0.000 6.853 0.000) 6.853 18.538 ( 0.000 2.876 0.000) 2.876 18.614 ( 0.000 -3.546 0.000) 3.546 18.965 ( 0.000 2.745 0.000) 2.745 19.158 ( 0.000 -4.964 0.000) 4.964 19.475 ( 0.000 -7.688 0.000) 7.688 19.922 ( 0.000 6.271 0.000) 6.271 20.321 ( 0.000 -2.388 0.000) 2.388 ======================= Grid point 12 (8/104) ======================= q-point: ( 0.10 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.857 ( 20.314 22.537 3.754) 30.572 0.972 ( 24.106 21.845 11.777) 34.598 1.554 ( 43.107 29.670 15.265) 54.512 2.322 ( 7.191 -0.446 -4.951) 8.742 2.444 ( 3.237 -0.256 1.141) 3.441 2.562 ( 5.175 -0.607 -12.281) 13.341 2.676 ( 0.820 -3.486 4.096) 5.441 2.785 ( 7.763 -11.558 0.674) 13.940 2.865 ( 7.259 -6.527 7.639) 12.396 3.039 ( 1.579 -8.914 4.214) 9.985 3.210 ( -1.038 -2.095 -1.299) 2.674 3.271 ( -1.752 -0.018 -2.803) 3.305 3.280 ( 3.580 1.040 -1.425) 3.991 3.326 ( 0.073 1.699 1.747) 2.438 3.491 ( 4.353 -1.342 4.000) 6.062 3.574 ( 5.261 4.104 -1.114) 6.765 3.674 ( -0.566 -1.409 -1.282) 1.987 3.816 ( 5.815 5.150 6.407) 10.069 3.930 ( -1.897 -7.060 -8.468) 11.187 3.949 ( 2.268 3.615 -1.087) 4.404 4.105 ( -3.015 2.941 -2.344) 4.821 4.144 ( -1.452 -3.120 -0.194) 3.447 4.183 ( 8.540 -9.369 4.419) 13.425 4.414 ( -5.676 0.107 3.191) 6.512 4.471 ( 2.473 -2.489 -1.287) 3.737 4.560 ( 2.858 -2.752 5.167) 6.515 4.605 ( -3.747 1.219 -3.208) 5.082 4.629 ( 1.669 -0.800 -0.513) 1.921 4.645 ( -1.990 5.001 -0.404) 5.397 4.818 ( 1.837 -4.608 2.999) 5.796 5.038 ( -3.288 -2.329 -1.114) 4.181 5.064 ( 1.346 -2.578 -3.540) 4.582 5.231 ( -5.716 -1.175 -5.837) 8.253 5.247 ( -1.361 1.112 -0.940) 1.993 5.507 ( 0.374 4.782 -3.011) 5.663 5.570 ( 3.182 2.942 4.181) 6.022 5.879 ( -7.524 -3.807 1.995) 8.665 5.905 ( -0.578 -1.622 1.300) 2.157 6.064 ( 3.566 3.403 -3.264) 5.912 6.188 ( -3.928 2.000 5.005) 6.670 6.280 ( -7.925 6.963 -1.341) 10.634 6.422 ( 1.121 1.576 2.546) 3.197 6.706 ( -0.815 -1.253 -1.603) 2.192 6.784 ( -14.382 -0.922 3.843) 14.915 6.857 ( -5.910 -1.912 -0.682) 6.249 7.090 ( 2.507 -3.895 -3.907) 6.060 7.309 ( 4.014 2.253 0.630) 4.646 7.512 ( -0.434 0.985 -1.596) 1.925 7.747 ( -0.813 2.453 -6.299) 6.808 7.881 ( -5.182 5.521 -0.077) 7.573 8.193 ( 3.899 3.742 3.722) 6.562 8.241 ( 2.797 -2.879 0.037) 4.014 8.576 ( 0.679 1.307 -0.083) 1.475 8.694 ( -2.487 0.096 0.332) 2.511 8.710 ( 6.137 0.685 -9.075) 10.977 8.951 ( -2.784 -0.916 1.406) 3.251 9.092 ( 5.748 1.973 3.052) 6.800 9.234 ( -0.456 0.817 8.857) 8.906 9.319 ( 4.782 0.794 -3.353) 5.894 9.447 ( 3.174 -5.474 -6.470) 9.050 9.645 ( -0.361 1.626 -2.998) 3.429 9.755 ( 3.468 0.171 1.329) 3.718 9.893 ( -2.143 3.650 1.862) 4.624 10.001 ( 0.525 2.988 -1.208) 3.266 10.254 ( -8.861 -0.946 3.700) 9.649 10.402 ( -0.808 -2.446 -6.868) 7.335 10.423 ( -2.529 -0.105 2.782) 3.761 10.697 ( 8.003 -2.958 -11.948) 14.681 10.735 ( 11.002 -0.847 1.681) 11.162 10.903 ( 1.644 -2.817 3.103) 4.502 11.038 ( -0.134 3.950 1.851) 4.364 11.310 ( 1.338 -0.429 2.476) 2.847 11.460 ( -5.614 -0.573 -2.645) 6.232 11.592 ( -6.254 -3.053 -1.743) 7.174 11.847 ( 1.854 -1.635 1.257) 2.774 12.037 ( -2.795 -1.928 -1.871) 3.877 12.083 ( -0.540 3.412 1.554) 3.789 12.397 ( -7.567 7.316 -3.328) 11.039 12.562 ( 1.933 0.421 0.542) 2.051 12.649 ( -2.420 2.553 3.570) 5.012 13.046 ( 1.097 -3.206 -7.930) 8.624 13.206 ( -1.137 -1.936 3.640) 4.277 13.245 ( -0.701 -4.293 4.021) 5.923 13.304 ( -2.984 -0.612 0.263) 3.057 13.382 ( 3.954 -5.247 1.988) 6.864 13.448 ( -1.783 0.202 -1.438) 2.299 13.619 ( -7.717 3.786 3.644) 9.336 13.785 ( -2.839 -0.472 -0.522) 2.925 14.024 ( 3.078 5.476 5.788) 8.542 14.389 ( 2.932 -3.451 -2.293) 5.076 14.538 ( 1.749 1.483 -2.414) 3.330 14.640 ( -5.631 -0.310 -0.842) 5.702 14.792 ( -2.940 1.931 1.207) 3.719 15.006 ( -2.415 -2.306 0.012) 3.339 15.320 ( 1.947 2.915 -2.811) 4.493 15.386 ( 3.994 0.823 -5.883) 7.158 15.595 ( -4.426 -2.161 1.844) 5.260 15.693 ( 1.955 -2.258 4.345) 5.273 15.795 ( -4.849 -0.057 2.622) 5.513 16.024 ( 1.237 5.903 1.394) 6.190 16.083 ( 4.372 0.432 -2.058) 4.852 16.329 ( -7.655 1.391 0.036) 7.780 16.458 ( -2.312 2.547 -4.118) 5.366 16.508 ( 5.142 -2.229 0.723) 5.651 16.682 ( 4.614 -0.327 -0.821) 4.697 16.829 ( 0.510 3.208 -1.563) 3.605 16.983 ( -2.722 0.683 4.675) 5.452 17.111 ( -2.450 0.198 -3.370) 4.171 17.349 ( 2.772 -0.640 -7.744) 8.250 17.605 ( -2.829 -0.735 2.680) 3.966 17.703 ( -0.320 13.447 -22.036) 25.817 17.888 ( -1.924 2.501 -1.278) 3.404 18.001 ( 1.477 6.850 5.904) 9.163 18.462 ( -5.039 0.684 -2.693) 5.754 18.948 ( 1.914 -2.102 4.272) 5.131 19.075 ( -1.744 -4.855 -0.363) 5.171 19.461 ( 18.738 -21.100 18.399) 33.688 19.545 ( 8.050 -9.108 -0.491) 12.165 19.936 ( 1.547 5.721 0.278) 5.933 20.265 ( -5.545 -0.131 2.484) 6.077 ======================= Grid point 13 (9/104) ======================= q-point: ( 0.20 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.333 ( 24.504 9.543 9.879) 28.091 1.517 ( 24.295 13.561 14.214) 31.244 2.380 ( 14.614 -0.259 -3.807) 15.103 2.453 ( 29.616 12.620 7.991) 33.169 2.504 ( 3.147 0.393 0.041) 3.171 2.639 ( 11.649 3.379 -11.814) 16.932 2.741 ( 3.090 -3.553 1.709) 5.009 2.909 ( 3.216 -8.124 1.780) 8.917 3.069 ( 8.590 -7.996 5.330) 12.889 3.089 ( 4.431 -3.945 3.182) 6.732 3.186 ( -2.893 0.869 -0.388) 3.046 3.251 ( 1.988 1.089 -1.941) 2.985 3.332 ( 4.565 -1.268 -2.346) 5.286 3.416 ( 4.138 0.101 4.488) 6.105 3.553 ( -3.281 -3.906 -1.520) 5.322 3.656 ( 4.957 3.057 -1.151) 5.937 3.660 ( 2.004 -2.859 0.901) 3.606 3.792 ( -2.215 -4.167 -7.895) 9.198 3.949 ( 2.181 4.176 7.687) 9.015 4.036 ( -0.591 3.718 -2.345) 4.435 4.075 ( 8.675 4.385 1.980) 9.920 4.150 ( 4.367 1.524 -0.784) 4.692 4.293 ( -3.560 -0.892 -2.093) 4.225 4.382 ( 3.810 -7.994 5.043) 10.191 4.468 ( -3.461 1.265 -4.595) 5.890 4.497 ( -2.056 3.993 -1.220) 4.654 4.576 ( 0.716 0.409 -1.062) 1.345 4.659 ( -1.952 -2.638 4.435) 5.517 4.704 ( 4.500 -0.040 3.825) 5.907 4.854 ( 0.051 -2.926 1.755) 3.413 4.952 ( -4.048 -3.855 -4.056) 6.907 5.069 ( 2.770 -3.315 -6.848) 8.096 5.128 ( -0.337 -6.340 -4.783) 7.949 5.200 ( -4.003 0.564 1.133) 4.198 5.467 ( -0.543 2.071 -6.097) 6.462 5.656 ( 2.750 4.297 4.503) 6.805 5.737 ( -8.263 -1.135 2.984) 8.858 5.874 ( -4.270 -1.927 0.300) 4.694 6.107 ( -5.354 5.599 -6.786) 10.298 6.145 ( 5.553 2.004 -3.060) 6.650 6.190 ( -1.449 2.631 9.317) 9.789 6.433 ( -3.168 -2.770 1.665) 4.525 6.550 ( -12.152 -0.193 0.914) 12.187 6.633 ( -5.511 -1.910 -2.739) 6.444 6.747 ( -4.257 3.627 5.814) 8.067 7.165 ( 7.333 -7.427 -4.533) 11.379 7.373 ( 1.599 -1.448 1.944) 2.904 7.483 ( -1.004 1.634 -1.375) 2.360 7.730 ( 4.170 4.810 -6.287) 8.947 7.865 ( 1.979 4.091 -0.987) 4.651 8.237 ( -2.258 -1.918 0.698) 3.044 8.293 ( 2.597 4.998 4.542) 7.236 8.508 ( -2.683 1.190 1.067) 3.123 8.666 ( -0.996 0.509 -1.140) 1.597 8.856 ( 8.369 -1.369 -6.029) 10.405 8.916 ( -0.811 3.962 5.836) 7.100 9.192 ( 1.615 1.280 3.356) 3.938 9.288 ( 5.727 -1.418 -4.115) 7.193 9.378 ( 2.103 -4.364 -3.222) 5.818 9.505 ( 5.018 -1.091 0.140) 5.137 9.629 ( 1.413 4.063 -2.126) 4.798 9.794 ( -2.457 -0.261 1.991) 3.173 9.868 ( -0.219 3.911 -0.134) 3.919 10.024 ( 3.369 0.876 -1.912) 3.972 10.163 ( -4.783 -1.350 5.406) 7.343 10.288 ( -4.766 -1.671 -8.624) 9.994 10.401 ( -3.666 0.751 4.570) 5.907 10.706 ( 2.375 -0.592 -11.774) 12.026 10.877 ( 2.368 -3.006 1.996) 4.316 11.032 ( 8.111 3.441 4.049) 9.697 11.078 ( 2.200 0.539 4.937) 5.431 11.326 ( -3.888 1.315 0.778) 4.178 11.345 ( -3.230 -6.459 -1.316) 7.341 11.488 ( -0.032 0.319 0.086) 0.332 11.888 ( 1.198 -2.646 1.032) 3.082 11.982 ( -2.397 -3.074 -1.832) 4.306 12.067 ( -2.497 3.077 1.607) 4.276 12.258 ( -5.733 4.479 -2.316) 7.634 12.504 ( -6.149 0.030 1.678) 6.374 12.739 ( 5.391 3.822 3.998) 7.724 13.004 ( -0.381 -3.413 -6.275) 7.153 13.062 ( -10.363 -2.452 -2.689) 10.983 13.201 ( -2.746 1.794 -0.866) 3.392 13.316 ( -1.312 -2.406 -0.656) 2.818 13.431 ( 3.251 -2.089 4.202) 5.709 13.454 ( 1.195 0.147 -0.879) 1.491 13.573 ( -3.151 -2.435 6.394) 7.533 13.735 ( -0.912 -3.950 -0.129) 4.056 14.095 ( -0.389 5.771 6.102) 8.407 14.400 ( 0.347 -1.277 -4.682) 4.866 14.540 ( -4.372 -0.549 -1.048) 4.529 14.558 ( 1.680 -0.463 -0.446) 1.799 14.772 ( -0.650 -0.891 1.381) 1.768 14.940 ( -3.714 0.824 0.110) 3.806 15.240 ( -2.672 7.095 -4.221) 8.677 15.492 ( -5.376 -3.580 -2.421) 6.897 15.513 ( 6.721 -0.950 -2.196) 7.134 15.707 ( -4.954 -0.018 0.719) 5.006 15.804 ( 2.163 -4.432 9.114) 10.363 15.966 ( -4.656 11.100 -3.985) 12.680 16.117 ( 0.204 -3.034 -4.675) 5.577 16.270 ( 3.412 3.243 2.021) 5.122 16.490 ( 3.689 -3.756 -0.603) 5.299 16.665 ( 10.826 -0.346 0.142) 10.832 16.758 ( 3.472 0.912 -1.485) 3.885 16.832 ( 1.188 1.952 1.524) 2.747 16.954 ( -4.510 -0.061 6.389) 7.820 17.035 ( -2.947 0.073 -2.502) 3.866 17.353 ( 2.168 0.550 -4.698) 5.204 17.568 ( 1.000 7.575 -8.070) 11.113 17.583 ( -6.750 2.097 -1.235) 7.175 17.866 ( 0.559 -0.731 -0.876) 1.270 18.092 ( 3.524 5.431 3.327) 7.279 18.317 ( -7.908 2.236 -1.638) 8.379 18.987 ( -5.555 -4.096 -2.817) 7.454 19.026 ( 3.376 -1.162 4.219) 5.527 19.685 ( 8.563 -6.336 1.446) 10.750 19.793 ( 8.941 -14.229 6.341) 17.962 19.986 ( 3.719 4.135 0.342) 5.571 20.191 ( -3.434 1.074 0.930) 3.716 ======================= Grid point 14 (10/104) ======================= q-point: ( 0.30 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.830 ( 20.897 4.786 11.022) 24.105 2.011 ( 19.235 3.930 10.920) 22.465 2.483 ( 7.252 -3.895 -2.460) 8.591 2.557 ( 2.832 1.970 0.370) 3.470 2.739 ( 5.949 -0.940 -7.916) 9.946 2.809 ( 6.025 0.654 -0.446) 6.077 2.932 ( 7.411 2.260 0.538) 7.766 2.970 ( 8.428 1.232 -5.543) 10.163 3.075 ( -5.562 -1.753 -0.306) 5.840 3.148 ( -0.527 3.718 -2.956) 4.779 3.275 ( 7.162 -2.983 2.749) 8.231 3.308 ( 5.933 -3.455 0.821) 6.915 3.358 ( -2.233 -4.950 -8.778) 10.322 3.471 ( 4.464 2.367 2.735) 5.746 3.550 ( 3.683 -0.816 4.211) 5.653 3.674 ( -1.896 -4.909 2.874) 5.996 3.712 ( 2.630 2.686 -1.654) 4.106 3.843 ( 5.158 4.929 0.658) 7.165 3.961 ( -4.143 4.449 2.909) 6.740 4.039 ( 0.016 -2.636 0.195) 2.644 4.192 ( 6.625 2.730 2.997) 7.767 4.222 ( -3.068 0.444 -0.803) 3.202 4.264 ( 5.637 2.880 -3.214) 7.099 4.387 ( -4.969 5.343 -0.266) 7.302 4.438 ( 1.531 -0.414 -1.851) 2.438 4.537 ( 7.269 -1.281 3.690) 8.252 4.611 ( -2.182 -2.398 4.217) 5.319 4.646 ( 2.846 -0.722 1.193) 3.169 4.776 ( 0.317 0.564 3.761) 3.816 4.840 ( -1.233 -3.247 -9.814) 10.411 4.860 ( -1.140 -1.840 2.564) 3.356 5.073 ( 2.410 -4.187 -4.660) 6.712 5.126 ( -3.140 -4.460 0.506) 5.478 5.157 ( 3.569 -5.939 -2.172) 7.261 5.417 ( 0.521 1.901 -6.346) 6.645 5.653 ( -4.450 3.079 5.008) 7.373 5.718 ( -1.057 2.840 3.172) 4.387 5.782 ( -2.997 -3.118 0.323) 4.337 5.952 ( -4.529 3.570 -7.797) 9.698 6.223 ( 1.196 -0.402 2.981) 3.237 6.266 ( 2.001 2.754 4.042) 5.285 6.330 ( -5.700 -1.640 -5.206) 7.892 6.392 ( -3.461 -1.582 2.971) 4.828 6.557 ( -0.225 -0.127 -2.089) 2.105 6.769 ( -0.027 3.916 5.922) 7.099 7.260 ( 5.676 -8.899 -2.720) 10.900 7.386 ( 1.565 -3.169 -5.097) 6.203 7.485 ( -0.359 -4.389 5.921) 7.379 7.808 ( 8.274 7.403 -4.664) 12.042 7.904 ( 1.273 6.439 3.682) 7.526 8.185 ( -3.833 -0.428 0.790) 3.937 8.344 ( 0.889 6.589 3.707) 7.613 8.541 ( 2.375 -2.085 2.401) 3.969 8.628 ( 0.508 3.868 -4.166) 5.707 8.877 ( 1.848 2.070 -5.396) 6.067 9.001 ( 1.215 -5.179 5.858) 7.913 9.204 ( -1.240 3.099 0.064) 3.338 9.321 ( 1.235 -1.336 -9.502) 9.674 9.401 ( 4.218 -3.882 -1.397) 5.900 9.579 ( 0.583 0.375 4.683) 4.734 9.668 ( 2.488 4.445 -0.222) 5.098 9.717 ( -7.613 -1.182 3.933) 8.651 9.858 ( 0.923 3.143 -1.940) 3.807 10.091 ( 3.132 -0.145 0.345) 3.155 10.129 ( -3.307 -0.872 -3.125) 4.633 10.149 ( -2.171 0.119 -2.504) 3.316 10.341 ( -6.274 0.939 4.042) 7.522 10.633 ( -1.110 -1.520 -9.494) 9.679 10.882 ( -2.423 -1.122 0.571) 2.731 11.110 ( 0.856 1.739 -0.483) 1.998 11.177 ( 2.564 -2.266 2.722) 4.373 11.285 ( -0.489 -2.869 1.002) 3.078 11.367 ( 6.965 2.157 4.955) 8.815 11.582 ( 5.734 -1.511 2.598) 6.474 11.901 ( -0.134 -2.162 0.000) 2.166 11.909 ( -4.236 -3.109 -1.612) 5.496 12.023 ( -3.018 3.186 0.850) 4.471 12.154 ( -4.864 6.148 -0.350) 7.848 12.411 ( -5.114 -0.420 1.862) 5.459 12.703 ( -9.372 -1.292 -4.623) 10.530 12.951 ( 2.167 -1.873 -0.148) 2.868 13.021 ( 2.435 0.186 1.376) 2.803 13.151 ( -1.800 4.084 -0.637) 4.509 13.314 ( 0.263 -2.883 0.381) 2.920 13.428 ( -3.428 -1.119 2.355) 4.307 13.484 ( 1.781 -2.256 -1.651) 3.315 13.611 ( 3.706 -1.625 3.303) 5.224 13.756 ( 1.241 -6.874 2.761) 7.511 14.097 ( -3.141 4.818 3.988) 6.999 14.316 ( -5.293 -0.217 -4.809) 7.155 14.477 ( -1.473 0.378 -2.639) 3.046 14.578 ( -0.314 -1.777 0.377) 1.844 14.794 ( 2.636 -1.729 0.254) 3.163 14.891 ( -1.645 0.036 0.691) 1.785 15.188 ( -0.863 6.326 -1.604) 6.583 15.364 ( -6.806 -2.095 -1.964) 7.387 15.529 ( -2.898 0.711 -2.520) 3.906 15.626 ( -4.974 1.637 3.127) 6.099 15.877 ( -0.720 8.050 -4.997) 9.502 15.905 ( 2.587 -4.460 3.627) 6.304 16.107 ( 3.469 -2.270 -3.654) 5.527 16.371 ( 5.715 -0.037 -0.403) 5.729 16.550 ( 3.512 0.285 -1.436) 3.805 16.756 ( 0.007 -0.363 0.013) 0.363 16.850 ( 3.463 -1.375 3.356) 5.014 16.885 ( 1.220 0.174 0.185) 1.246 16.931 ( -0.215 0.545 3.130) 3.184 17.014 ( 3.421 0.479 1.613) 3.812 17.331 ( -3.563 0.121 -1.386) 3.825 17.443 ( -6.721 5.169 1.557) 8.620 17.537 ( 0.613 4.374 -4.968) 6.648 17.863 ( -0.389 0.440 -5.489) 5.521 18.065 ( -5.735 -2.031 -1.406) 6.245 18.282 ( 2.609 7.575 5.561) 9.752 18.846 ( -6.576 -3.859 -4.596) 8.903 19.124 ( 3.853 -2.442 3.714) 5.883 19.835 ( 5.917 -4.226 1.605) 7.446 19.936 ( 4.067 -8.844 1.636) 9.871 20.069 ( 4.909 2.145 0.234) 5.362 20.178 ( 1.657 1.553 1.494) 2.718 ======================= Grid point 15 (11/104) ======================= q-point: ( 0.40 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.188 ( 9.532 4.316 6.998) 12.588 2.358 ( 13.815 -6.550 5.937) 16.401 2.580 ( 3.928 -6.290 -0.407) 7.427 2.629 ( 3.146 0.868 1.059) 3.431 2.746 ( -0.983 -2.622 -1.673) 3.262 2.914 ( 1.220 1.408 -5.247) 5.568 2.963 ( 2.058 -1.402 -3.630) 4.402 2.978 ( -1.505 1.518 -2.817) 3.536 3.018 ( 3.399 5.927 1.152) 6.929 3.168 ( 6.285 9.498 -5.046) 12.457 3.257 ( -0.530 -5.192 -4.217) 6.710 3.379 ( 2.309 -1.759 -2.744) 3.994 3.432 ( 4.288 -1.982 1.267) 4.891 3.539 ( 0.175 1.010 2.679) 2.869 3.613 ( 0.056 2.696 4.357) 5.124 3.679 ( -1.540 2.903 0.653) 3.351 3.732 ( 2.069 1.379 0.069) 2.487 3.846 ( -1.267 2.282 2.502) 3.616 3.920 ( -3.332 -0.301 0.545) 3.390 4.006 ( -0.637 0.975 -2.910) 3.134 4.139 ( -3.621 2.700 -4.739) 6.547 4.240 ( -7.249 1.815 3.287) 8.164 4.314 ( -0.479 -2.604 -0.186) 2.655 4.385 ( 4.277 -0.464 2.123) 4.798 4.418 ( -1.150 1.315 -1.313) 2.185 4.666 ( 4.319 -0.843 6.679) 7.998 4.696 ( 5.635 -0.599 3.060) 6.440 4.743 ( 5.031 -0.488 -0.205) 5.059 4.753 ( 1.201 -1.493 -3.773) 4.232 4.824 ( 2.543 -2.030 -2.901) 4.359 4.861 ( -0.076 1.613 2.011) 2.579 5.055 ( -4.265 -6.947 3.717) 8.960 5.078 ( -0.777 -3.671 -4.117) 5.570 5.213 ( 3.303 -0.905 -3.080) 4.606 5.409 ( 1.668 -0.288 -1.373) 2.179 5.590 ( -5.634 6.490 1.810) 8.783 5.672 ( -1.428 0.194 -0.998) 1.752 5.773 ( -3.573 2.592 0.846) 4.495 5.901 ( 4.994 -4.492 -2.129) 7.047 6.177 ( -3.508 -2.724 -2.866) 5.286 6.233 ( -0.963 0.078 2.071) 2.285 6.355 ( -2.039 -0.472 6.239) 6.580 6.431 ( 7.783 2.209 -2.446) 8.452 6.573 ( 2.076 0.531 -2.268) 3.120 6.792 ( -0.811 3.124 2.493) 4.078 7.304 ( 0.436 -0.514 -1.141) 1.325 7.403 ( 5.499 -12.688 -6.967) 15.484 7.534 ( -0.463 -6.641 7.706) 10.184 7.900 ( 2.898 6.703 0.100) 7.303 8.014 ( 7.534 7.750 5.338) 12.055 8.120 ( -3.398 0.783 -0.007) 3.487 8.396 ( 1.824 6.493 2.759) 7.287 8.499 ( -2.793 4.598 -7.112) 8.917 8.714 ( 6.112 -2.201 3.754) 7.503 8.861 ( -0.243 1.791 -2.732) 3.276 9.017 ( -1.214 -8.042 -1.160) 8.215 9.154 ( -2.670 1.203 -3.121) 4.279 9.256 ( -3.073 3.470 -0.247) 4.641 9.464 ( 3.289 -5.684 -1.410) 6.716 9.536 ( -7.033 -0.237 0.019) 7.037 9.647 ( -3.444 3.902 8.870) 10.284 9.693 ( 1.965 3.526 -3.264) 5.191 9.907 ( 3.810 -0.486 -1.080) 3.990 9.995 ( -2.550 2.213 -6.276) 7.127 10.107 ( -4.619 0.124 2.269) 5.147 10.174 ( 3.112 0.216 0.387) 3.143 10.265 ( -3.256 -2.171 2.144) 4.462 10.556 ( -1.201 -3.511 -5.354) 6.514 10.834 ( -1.819 2.216 -0.999) 3.036 11.117 ( 1.001 2.452 -0.334) 2.669 11.234 ( 2.771 -4.775 0.567) 5.550 11.332 ( 2.214 -2.470 3.361) 4.722 11.535 ( 6.450 1.617 2.727) 7.187 11.658 ( 0.623 -3.012 -0.250) 3.086 11.833 ( -2.760 1.358 0.798) 3.178 11.875 ( -2.899 0.601 0.364) 2.983 11.982 ( -1.370 2.468 0.128) 2.826 12.085 ( -2.068 5.937 -0.296) 6.294 12.354 ( -2.383 -1.433 1.136) 3.004 12.530 ( -5.337 -1.976 -2.807) 6.346 12.987 ( 2.105 -2.304 0.196) 3.127 13.080 ( 1.101 0.619 1.129) 1.694 13.132 ( -0.400 1.868 1.218) 2.266 13.253 ( -4.608 -0.245 -1.879) 4.983 13.462 ( 2.936 -3.997 3.175) 5.889 13.517 ( 2.921 -1.855 0.350) 3.478 13.698 ( 3.319 -1.766 1.276) 3.971 13.798 ( 1.225 -5.312 1.991) 5.803 14.052 ( -3.212 2.854 0.805) 4.372 14.177 ( -5.637 0.426 -3.867) 6.849 14.434 ( -1.140 0.702 -2.388) 2.738 14.543 ( -3.186 -1.684 0.549) 3.645 14.859 ( 4.115 -2.772 -1.106) 5.083 14.895 ( 0.796 -2.522 1.283) 2.940 15.181 ( 0.352 3.987 0.253) 4.010 15.241 ( -4.939 2.034 -0.952) 5.425 15.454 ( -1.268 2.381 -5.165) 5.827 15.537 ( -7.680 6.004 6.040) 11.468 15.840 ( -1.244 1.895 -1.921) 2.972 15.963 ( 4.711 -0.740 -4.629) 6.646 16.173 ( 2.902 -3.008 2.114) 4.684 16.457 ( 4.511 -0.358 -2.137) 5.005 16.582 ( 0.869 1.105 -1.178) 1.834 16.765 ( 0.176 -3.674 3.112) 4.818 16.846 ( -2.996 -1.611 2.487) 4.214 16.888 ( 2.351 -0.940 -5.060) 5.658 17.020 ( 5.405 2.763 3.825) 7.175 17.118 ( 2.070 -1.036 1.794) 2.928 17.206 ( -7.341 1.638 2.248) 7.850 17.392 ( -1.361 4.168 1.744) 4.719 17.523 ( 0.059 2.880 -0.534) 2.929 17.730 ( -5.172 6.550 -11.488) 14.200 18.023 ( -0.885 -6.307 3.723) 7.377 18.379 ( 3.283 8.371 4.049) 9.862 18.703 ( -4.917 -4.715 -4.764) 8.313 19.204 ( 2.346 -4.091 2.201) 5.204 19.893 ( 0.128 -1.613 0.748) 1.782 20.003 ( 3.425 -4.944 -0.799) 6.067 20.149 ( 3.306 1.519 0.330) 3.653 20.251 ( 3.396 -0.726 2.235) 4.130 ======================= Grid point 16 (12/104) ======================= q-point: (-0.50 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.285 ( 0.000 2.416 0.000) 2.416 2.591 ( 0.000 -5.751 0.000) 5.751 2.606 ( -0.000 -4.213 -0.000) 4.213 2.632 ( 0.000 -8.756 0.000) 8.756 2.691 ( -0.000 -2.058 -0.000) 2.058 2.887 ( -0.000 -0.495 0.000) 0.495 2.913 ( 0.000 1.958 0.000) 1.958 2.976 ( 0.000 3.181 -0.000) 3.181 3.147 ( 0.000 7.767 0.000) 7.767 3.207 ( 0.000 6.330 0.000) 6.330 3.269 ( 0.000 -1.669 0.000) 1.669 3.333 ( -0.000 1.189 -0.000) 1.189 3.500 ( 0.000 2.369 -0.000) 2.369 3.511 ( 0.000 -1.952 0.000) 1.952 3.637 ( 0.000 3.807 0.000) 3.807 3.650 ( 0.000 4.274 -0.000) 4.274 3.770 ( 0.000 1.829 0.000) 1.829 3.868 ( 0.000 -0.709 0.000) 0.709 3.905 ( -0.000 2.925 -0.000) 2.925 3.941 ( 0.000 0.213 0.000) 0.213 4.107 ( 0.000 -7.564 -0.000) 7.564 4.137 ( -0.000 6.994 0.000) 6.994 4.318 ( 0.000 -2.077 0.000) 2.077 4.395 ( 0.000 2.048 0.000) 2.048 4.424 ( 0.000 -0.075 -0.000) 0.075 4.735 ( 0.000 -1.559 -0.000) 1.559 4.740 ( 0.000 -0.260 0.000) 0.260 4.766 ( 0.000 -0.678 0.000) 0.678 4.795 ( 0.000 -3.942 0.000) 3.942 4.832 ( 0.000 -1.808 0.000) 1.808 4.951 ( 0.000 0.158 0.000) 0.158 5.000 ( -0.000 -0.372 -0.000) 0.372 5.025 ( 0.000 -8.274 0.000) 8.274 5.227 ( 0.000 4.243 0.000) 4.243 5.439 ( 0.000 -4.869 0.000) 4.869 5.518 ( 0.000 6.061 -0.000) 6.061 5.669 ( 0.000 3.315 0.000) 3.315 5.722 ( 0.000 1.354 -0.000) 1.354 5.970 ( 0.000 -3.967 0.000) 3.967 6.134 ( 0.000 -3.880 0.000) 3.880 6.235 ( 0.000 1.503 0.000) 1.503 6.350 ( 0.000 -2.373 0.000) 2.373 6.531 ( 0.000 1.450 0.000) 1.450 6.564 ( 0.000 1.729 -0.000) 1.729 6.790 ( 0.000 2.790 0.000) 2.790 7.298 ( 0.000 1.060 -0.000) 1.060 7.437 ( 0.000 -14.764 0.000) 14.764 7.558 ( 0.000 -5.801 0.000) 5.801 7.933 ( 0.000 6.575 -0.000) 6.575 8.081 ( 0.000 0.982 -0.000) 0.982 8.143 ( 0.000 7.018 0.000) 7.018 8.410 ( 0.000 6.019 -0.000) 6.019 8.433 ( 0.000 6.192 -0.000) 6.192 8.824 ( 0.000 -3.861 -0.000) 3.861 8.834 ( -0.000 2.951 0.000) 2.951 8.974 ( 0.000 -7.427 0.000) 7.427 9.107 ( 0.000 -1.272 0.000) 1.272 9.230 ( 0.000 5.100 0.000) 5.100 9.454 ( 0.000 -0.344 0.000) 0.344 9.493 ( 0.000 -7.745 -0.000) 7.745 9.654 ( 0.000 8.743 0.000) 8.743 9.698 ( 0.000 0.681 -0.000) 0.681 9.901 ( 0.000 2.383 0.000) 2.383 10.012 ( 0.000 2.365 -0.000) 2.365 10.036 ( -0.000 -2.816 0.000) 2.816 10.203 ( 0.000 -0.174 0.000) 0.174 10.252 ( 0.000 -2.743 0.000) 2.743 10.524 ( 0.000 -4.541 -0.000) 4.541 10.813 ( 0.000 4.206 0.000) 4.206 11.132 ( 0.000 2.652 0.000) 2.652 11.265 ( 0.000 -3.678 0.000) 3.678 11.372 ( 0.000 -4.513 0.000) 4.513 11.601 ( -0.000 0.650 0.000) 0.650 11.645 ( 0.000 -4.211 0.000) 4.211 11.815 ( 0.000 4.172 0.000) 4.172 11.843 ( 0.000 4.156 0.000) 4.156 11.974 ( 0.000 1.157 0.000) 1.157 12.069 ( 0.000 4.876 0.000) 4.876 12.337 ( 0.000 -1.740 0.000) 1.740 12.474 ( 0.000 -1.864 0.000) 1.864 13.022 ( 0.000 -2.472 0.000) 2.472 13.073 ( 0.000 -0.813 0.000) 0.813 13.140 ( 0.000 0.940 0.000) 0.940 13.198 ( 0.000 1.046 0.000) 1.046 13.496 ( 0.000 -1.099 0.000) 1.099 13.570 ( 0.000 -5.673 0.000) 5.673 13.735 ( 0.000 -1.902 -0.000) 1.902 13.816 ( 0.000 -3.219 0.000) 3.219 14.018 ( 0.000 1.350 0.000) 1.350 14.102 ( 0.000 0.960 0.000) 0.960 14.414 ( 0.000 0.911 0.000) 0.911 14.509 ( 0.000 -1.802 0.000) 1.802 14.903 ( 0.000 -4.260 -0.000) 4.260 14.907 ( -0.000 -3.538 0.000) 3.538 15.189 ( 0.000 2.267 -0.000) 2.267 15.190 ( -0.000 4.593 0.000) 4.593 15.423 ( 0.000 4.171 0.000) 4.171 15.480 ( 0.000 7.294 -0.000) 7.294 15.818 ( 0.000 0.662 0.000) 0.662 15.994 ( 0.000 0.618 0.000) 0.618 16.210 ( 0.000 -3.650 0.000) 3.650 16.492 ( 0.000 0.420 0.000) 0.420 16.580 ( 0.000 0.611 0.000) 0.611 16.794 ( 0.000 -2.955 0.000) 2.955 16.815 ( 0.000 -4.585 -0.000) 4.585 16.905 ( 0.000 -3.124 -0.000) 3.124 17.081 ( -0.000 2.870 0.000) 2.870 17.119 ( 0.000 3.504 0.000) 3.504 17.163 ( 0.000 1.775 0.000) 1.775 17.396 ( 0.000 -1.518 0.000) 1.518 17.528 ( 0.000 3.377 0.000) 3.377 17.615 ( 0.000 10.569 -0.000) 10.569 18.033 ( 0.000 -6.894 0.000) 6.894 18.432 ( 0.000 10.400 0.000) 10.400 18.631 ( 0.000 -6.804 -0.000) 6.804 19.234 ( 0.000 -4.902 0.000) 4.902 19.892 ( 0.000 -0.313 0.000) 0.313 20.033 ( 0.000 -3.913 0.000) 3.913 20.182 ( 0.000 1.360 0.000) 1.360 20.294 ( 0.000 -1.510 0.000) 1.510 ======================= Grid point 22 (13/104) ======================= q-point: ( 0.00 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.190 ( 0.000 29.780 0.000) 29.780 1.320 ( 0.000 32.029 0.000) 32.029 1.844 ( 0.000 38.567 0.000) 38.567 2.138 ( 0.000 -14.372 0.000) 14.372 2.281 ( 0.000 -15.892 0.000) 15.892 2.495 ( 0.000 -0.983 0.000) 0.983 2.540 ( 0.000 -5.248 0.000) 5.248 2.643 ( 0.000 -4.410 0.000) 4.410 2.646 ( 0.000 0.437 0.000) 0.437 2.837 ( 0.000 -0.821 0.000) 0.821 3.137 ( 0.000 -4.676 0.000) 4.676 3.214 ( 0.000 -7.189 0.000) 7.189 3.315 ( 0.000 0.405 0.000) 0.405 3.362 ( 0.000 -3.563 0.000) 3.563 3.439 ( 0.000 0.971 0.000) 0.971 3.625 ( 0.000 4.844 0.000) 4.844 3.680 ( 0.000 -1.595 0.000) 1.595 3.738 ( 0.000 5.354 0.000) 5.354 3.893 ( 0.000 -2.408 0.000) 2.408 4.022 ( 0.000 1.903 0.000) 1.903 4.037 ( 0.000 -9.203 0.000) 9.203 4.105 ( 0.000 -0.181 0.000) 0.181 4.134 ( 0.000 -0.654 0.000) 0.654 4.248 ( 0.000 -5.517 0.000) 5.517 4.489 ( 0.000 1.322 0.000) 1.322 4.510 ( 0.000 0.209 0.000) 0.209 4.621 ( 0.000 -3.065 0.000) 3.065 4.627 ( 0.000 1.108 0.000) 1.108 4.771 ( 0.000 2.907 0.000) 2.907 4.776 ( 0.000 4.178 0.000) 4.178 4.993 ( 0.000 -2.897 0.000) 2.897 5.038 ( 0.000 -3.585 0.000) 3.585 5.281 ( 0.000 2.164 0.000) 2.164 5.389 ( 0.000 -2.420 0.000) 2.420 5.494 ( 0.000 4.540 0.000) 4.540 5.584 ( 0.000 0.845 0.000) 0.845 5.884 ( 0.000 -1.178 0.000) 1.178 5.891 ( 0.000 -0.516 0.000) 0.516 6.123 ( 0.000 4.119 0.000) 4.119 6.269 ( 0.000 3.583 0.000) 3.583 6.325 ( 0.000 -3.936 0.000) 3.936 6.558 ( 0.000 -9.986 0.000) 9.986 6.594 ( 0.000 11.271 0.000) 11.271 6.847 ( 0.000 -0.727 0.000) 0.727 6.939 ( 0.000 0.305 0.000) 0.305 7.054 ( 0.000 -5.561 0.000) 5.561 7.332 ( 0.000 5.154 0.000) 5.154 7.501 ( 0.000 -2.201 0.000) 2.201 7.865 ( 0.000 4.266 0.000) 4.266 8.018 ( 0.000 -2.718 0.000) 2.718 8.128 ( 0.000 1.182 0.000) 1.182 8.190 ( 0.000 -0.519 0.000) 0.519 8.527 ( 0.000 5.689 0.000) 5.689 8.792 ( 0.000 -0.248 0.000) 0.248 8.793 ( 0.000 1.276 0.000) 1.276 8.825 ( 0.000 -7.713 0.000) 7.713 8.984 ( 0.000 2.719 0.000) 2.719 9.222 ( 0.000 -5.600 0.000) 5.600 9.246 ( 0.000 4.185 0.000) 4.185 9.393 ( 0.000 -3.466 0.000) 3.466 9.671 ( 0.000 0.352 0.000) 0.352 9.705 ( 0.000 -1.059 0.000) 1.059 9.990 ( 0.000 5.233 0.000) 5.233 10.081 ( 0.000 2.200 0.000) 2.200 10.366 ( 0.000 -0.725 0.000) 0.725 10.371 ( 0.000 -1.136 0.000) 1.136 10.452 ( 0.000 -0.372 0.000) 0.372 10.496 ( 0.000 -4.327 0.000) 4.327 10.626 ( 0.000 0.733 0.000) 0.733 10.767 ( 0.000 -6.571 0.000) 6.571 11.154 ( 0.000 5.777 0.000) 5.777 11.292 ( 0.000 -0.783 0.000) 0.783 11.496 ( 0.000 -0.282 0.000) 0.282 11.575 ( 0.000 -3.989 0.000) 3.989 11.856 ( 0.000 1.719 0.000) 1.719 11.972 ( 0.000 -4.995 0.000) 4.995 12.196 ( 0.000 7.332 0.000) 7.332 12.502 ( 0.000 -6.792 0.000) 6.792 12.625 ( 0.000 4.648 0.000) 4.648 12.792 ( 0.000 7.861 0.000) 7.861 12.963 ( 0.000 -2.889 0.000) 2.889 13.170 ( 0.000 0.413 0.000) 0.413 13.197 ( 0.000 -2.327 0.000) 2.327 13.235 ( 0.000 -2.892 0.000) 2.892 13.366 ( 0.000 0.761 0.000) 0.761 13.465 ( 0.000 -1.740 0.000) 1.740 13.806 ( 0.000 2.483 0.000) 2.483 13.821 ( 0.000 1.718 0.000) 1.718 14.072 ( 0.000 7.042 0.000) 7.042 14.284 ( 0.000 -3.801 0.000) 3.801 14.572 ( 0.000 2.045 0.000) 2.045 14.685 ( 0.000 -2.683 0.000) 2.683 14.863 ( 0.000 0.125 0.000) 0.125 14.932 ( 0.000 -2.327 0.000) 2.327 15.311 ( 0.000 4.238 0.000) 4.238 15.488 ( 0.000 2.512 0.000) 2.512 15.510 ( 0.000 -5.412 0.000) 5.412 15.588 ( 0.000 -2.693 0.000) 2.693 15.911 ( 0.000 1.874 0.000) 1.874 16.008 ( 0.000 -1.541 0.000) 1.541 16.099 ( 0.000 5.004 0.000) 5.004 16.296 ( 0.000 -6.988 0.000) 6.988 16.390 ( 0.000 1.787 0.000) 1.787 16.523 ( 0.000 -4.636 0.000) 4.636 16.744 ( 0.000 2.040 0.000) 2.040 16.803 ( 0.000 -0.481 0.000) 0.481 17.128 ( 0.000 5.628 0.000) 5.628 17.202 ( 0.000 5.576 0.000) 5.576 17.271 ( 0.000 -4.267 0.000) 4.267 17.493 ( 0.000 -7.311 0.000) 7.311 17.988 ( 0.000 2.311 0.000) 2.311 17.988 ( 0.000 3.512 0.000) 3.512 18.283 ( 0.000 6.579 0.000) 6.579 18.523 ( 0.000 -5.769 0.000) 5.769 18.641 ( 0.000 8.104 0.000) 8.104 19.004 ( 0.000 -5.343 0.000) 5.343 19.060 ( 0.000 1.537 0.000) 1.537 19.317 ( 0.000 -8.485 0.000) 8.485 20.046 ( 0.000 6.481 0.000) 6.481 20.256 ( 0.000 -4.303 0.000) 4.303 ======================= Grid point 23 (14/104) ======================= q-point: ( 0.10 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.355 ( 11.208 27.452 -0.938) 29.667 1.434 ( 15.414 25.949 5.612) 30.699 2.130 ( 21.592 23.624 8.159) 33.028 2.214 ( 5.990 -11.771 0.585) 13.221 2.358 ( 9.583 -17.132 1.663) 19.700 2.514 ( 2.748 4.588 1.525) 5.561 2.601 ( 9.892 -1.042 -7.878) 12.689 2.688 ( 4.573 0.642 -0.980) 4.720 2.741 ( 6.266 -5.564 6.059) 10.341 2.914 ( 4.913 -2.387 5.843) 7.998 3.157 ( 1.738 -3.384 -0.404) 3.825 3.223 ( 2.414 -3.822 1.300) 4.703 3.295 ( 1.165 -0.228 -4.333) 4.493 3.395 ( -1.256 3.697 -0.877) 4.002 3.422 ( 4.674 -4.012 -0.292) 6.166 3.644 ( -0.197 2.756 -2.538) 3.751 3.665 ( 0.537 -0.326 -0.921) 1.115 3.817 ( -1.475 -7.154 -5.516) 9.154 3.867 ( 4.966 1.860 6.699) 8.544 4.000 ( 2.754 2.184 -3.913) 5.260 4.104 ( 3.671 3.135 2.153) 5.286 4.107 ( 1.693 -4.724 -0.940) 5.105 4.177 ( -0.056 0.706 2.974) 3.057 4.273 ( 3.410 -9.663 5.994) 11.872 4.447 ( -5.083 2.225 2.310) 6.010 4.556 ( 1.500 -1.567 1.803) 2.820 4.597 ( -1.622 0.102 -3.335) 3.710 4.620 ( 1.868 -0.121 -3.885) 4.312 4.735 ( -1.898 3.769 -1.440) 4.459 4.797 ( 0.995 1.274 1.921) 2.510 4.981 ( -1.131 -3.247 -2.076) 4.016 5.004 ( -1.743 -3.277 -2.339) 4.387 5.239 ( -8.466 1.970 -2.597) 9.072 5.270 ( -2.776 1.260 0.864) 3.168 5.550 ( -1.925 0.215 -3.737) 4.209 5.586 ( 2.587 -1.352 3.519) 4.572 5.841 ( -4.029 0.293 -0.129) 4.042 5.880 ( -1.285 -0.959 0.721) 1.758 6.130 ( 1.903 4.038 -0.917) 4.557 6.250 ( -2.741 4.305 2.733) 5.789 6.315 ( -2.360 -3.324 0.529) 4.110 6.439 ( -6.291 -1.352 1.351) 6.575 6.650 ( -1.334 0.248 0.193) 1.370 6.786 ( -11.742 -1.030 3.584) 12.320 6.871 ( -2.594 2.928 -1.023) 4.043 7.032 ( 0.986 -3.421 -2.549) 4.379 7.347 ( 1.211 2.960 -1.022) 3.358 7.503 ( -0.086 -2.431 -1.693) 2.964 7.823 ( 1.079 5.084 -6.678) 8.462 7.931 ( -3.067 0.539 -2.141) 3.779 8.202 ( 2.197 -0.647 2.975) 3.754 8.248 ( 4.039 0.528 4.485) 6.059 8.603 ( 1.444 2.609 0.185) 2.988 8.708 ( -1.163 0.678 -2.871) 3.171 8.734 ( 0.696 1.426 -4.865) 5.118 8.892 ( 2.246 -4.622 2.847) 5.875 9.100 ( 5.838 0.468 7.714) 9.686 9.225 ( 1.633 -2.472 -0.549) 3.013 9.334 ( 5.771 1.491 -2.658) 6.527 9.387 ( 2.649 -0.967 -3.193) 4.260 9.670 ( 0.475 0.884 -0.617) 1.178 9.736 ( 3.026 -2.072 -0.713) 3.737 9.970 ( -2.600 4.037 2.177) 5.272 10.050 ( -2.929 1.080 1.303) 3.383 10.248 ( -7.011 1.020 -0.303) 7.091 10.350 ( -1.942 -2.906 -5.088) 6.172 10.429 ( -0.992 1.277 2.940) 3.355 10.602 ( 6.279 -6.393 -4.019) 9.821 10.743 ( 10.017 1.563 0.362) 10.145 10.844 ( 7.797 -3.168 2.792) 8.867 11.125 ( -2.734 4.863 1.079) 5.682 11.281 ( -1.850 -2.715 0.816) 3.385 11.453 ( -4.538 0.467 -0.215) 4.567 11.531 ( -4.241 -3.099 -0.431) 5.271 11.848 ( 0.204 1.261 -1.062) 1.661 11.957 ( -0.994 -4.403 -1.689) 4.819 12.179 ( -1.826 5.950 0.458) 6.240 12.418 ( -6.680 -4.762 -2.449) 8.561 12.649 ( 1.882 7.577 -2.741) 8.274 12.768 ( -3.688 8.854 5.872) 11.246 12.957 ( 1.736 -5.486 -4.567) 7.347 13.141 ( -6.405 -6.136 3.164) 9.418 13.200 ( 1.387 0.374 1.207) 1.876 13.283 ( 2.239 -3.490 -1.187) 4.313 13.322 ( -0.970 1.479 0.862) 1.968 13.432 ( -3.100 -2.095 -0.351) 3.758 13.721 ( -7.047 5.010 0.404) 8.656 13.785 ( -3.850 0.558 -1.126) 4.050 14.125 ( 4.108 5.244 0.886) 6.720 14.317 ( 3.335 -4.182 -1.512) 5.559 14.559 ( -0.890 0.773 -0.754) 1.399 14.615 ( -5.493 -2.025 -0.633) 5.888 14.831 ( -2.670 2.548 1.400) 3.948 14.955 ( -0.715 -3.100 0.608) 3.239 15.365 ( 5.374 1.914 -1.973) 6.036 15.407 ( 1.465 0.730 -6.988) 7.178 15.574 ( -2.327 -0.095 4.821) 5.355 15.638 ( 1.897 -2.634 5.972) 6.798 15.817 ( -6.554 2.890 -0.046) 7.163 16.034 ( 1.026 -5.278 -0.577) 5.408 16.130 ( 2.007 4.948 2.001) 5.702 16.270 ( -1.099 -3.836 -2.104) 4.511 16.465 ( 5.758 0.163 0.632) 5.795 16.512 ( -0.210 -0.834 -1.451) 1.687 16.721 ( 1.362 3.521 -0.658) 3.832 16.826 ( 1.430 -1.849 -0.044) 2.338 17.058 ( -5.508 4.418 -0.682) 7.094 17.111 ( -3.581 0.014 -4.445) 5.708 17.354 ( 4.774 1.605 -2.171) 5.485 17.519 ( 1.553 -5.487 1.914) 6.015 17.912 ( -4.932 5.684 -8.615) 11.439 17.935 ( -2.967 2.393 -4.139) 5.627 18.192 ( -0.619 12.039 1.376) 12.133 18.475 ( -3.442 -0.197 -3.755) 5.098 18.855 ( 5.136 -5.155 10.141) 12.482 18.983 ( -2.820 -5.827 1.195) 6.583 19.231 ( 14.937 -3.248 8.278) 17.383 19.391 ( 7.544 -7.667 0.256) 10.759 20.047 ( 0.062 5.712 0.575) 5.741 20.226 ( -3.137 -3.382 0.889) 4.698 ======================= Grid point 24 (15/104) ======================= q-point: ( 0.20 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.608 ( 16.895 18.158 1.770) 24.865 1.822 ( 16.929 18.043 11.550) 27.305 2.264 ( 4.718 -11.493 -2.475) 12.668 2.463 ( 6.503 -5.262 1.191) 8.450 2.586 ( 8.988 -8.271 0.149) 12.215 2.717 ( 8.399 -6.865 -1.653) 10.972 2.726 ( 12.603 6.627 -2.221) 14.412 2.842 ( 17.236 14.106 1.836) 22.348 2.933 ( 9.664 -4.267 2.547) 10.867 3.050 ( 6.497 -0.569 2.478) 6.977 3.197 ( 0.171 0.514 -0.320) 0.629 3.262 ( 1.847 1.580 -1.203) 2.712 3.349 ( 5.855 -1.015 1.628) 6.162 3.423 ( 4.195 3.951 1.448) 5.942 3.476 ( 1.312 -6.907 -0.418) 7.043 3.563 ( -3.037 0.035 -3.984) 5.010 3.687 ( 1.407 -0.788 -1.454) 2.171 3.800 ( 4.399 0.014 -0.799) 4.471 3.988 ( 1.965 0.113 6.271) 6.572 4.084 ( 4.785 1.815 -0.823) 5.184 4.135 ( 6.374 0.680 -1.761) 6.648 4.193 ( 4.462 3.344 -0.079) 5.577 4.250 ( 4.342 -1.711 1.448) 4.886 4.351 ( -4.871 1.668 2.360) 5.664 4.399 ( 3.470 -8.202 4.334) 9.905 4.518 ( -0.480 1.846 -2.688) 3.296 4.556 ( -1.652 -3.276 -0.212) 3.675 4.631 ( -1.356 -1.637 -2.108) 2.993 4.744 ( 3.876 4.453 1.445) 6.078 4.829 ( 0.759 0.415 1.390) 1.637 4.901 ( -4.607 -1.642 -3.247) 5.870 4.963 ( -1.276 -5.901 -4.471) 7.513 5.095 ( -3.637 1.674 -2.701) 4.830 5.206 ( -5.603 -0.406 1.309) 5.768 5.473 ( -2.122 -0.916 -5.021) 5.527 5.594 ( -3.030 -6.156 2.390) 7.266 5.789 ( -1.360 3.389 0.152) 3.655 5.855 ( -3.156 -0.302 2.863) 4.272 6.171 ( 0.925 1.594 1.144) 2.169 6.200 ( -5.446 3.121 -2.573) 6.784 6.267 ( 1.056 4.237 3.062) 5.333 6.383 ( -2.735 -2.343 0.333) 3.617 6.539 ( -13.030 -0.756 1.563) 13.145 6.568 ( -7.230 -3.762 1.292) 8.252 6.842 ( -1.181 5.653 2.051) 6.129 7.057 ( 3.261 -4.856 -4.187) 7.194 7.349 ( 0.458 -0.137 -2.100) 2.153 7.454 ( -3.233 -3.529 -2.026) 5.197 7.858 ( 7.110 6.888 -6.185) 11.673 7.928 ( 2.941 2.226 -0.350) 3.705 8.217 ( -2.358 0.590 4.000) 4.681 8.371 ( 4.118 -0.857 6.448) 7.698 8.532 ( -4.059 5.175 -0.684) 6.612 8.702 ( 1.316 2.812 -1.180) 3.321 8.805 ( 5.837 -3.437 -3.878) 7.806 8.938 ( 0.874 -3.737 1.384) 4.080 9.236 ( 4.366 2.649 -2.380) 5.634 9.266 ( 3.643 1.183 2.906) 4.808 9.337 ( 1.789 0.069 -5.894) 6.160 9.492 ( 5.410 -1.440 2.334) 6.065 9.680 ( 0.675 1.512 0.001) 1.656 9.761 ( -1.566 -2.937 0.837) 3.433 9.946 ( 0.004 3.943 -0.162) 3.947 10.037 ( 1.101 -0.144 -0.587) 1.256 10.152 ( -3.789 0.745 0.994) 3.987 10.244 ( -4.035 -2.813 -6.818) 8.407 10.437 ( -1.443 3.298 3.039) 4.711 10.645 ( 1.279 -5.765 -4.003) 7.134 10.874 ( 3.778 2.876 -2.067) 5.179 11.044 ( 7.498 -2.788 2.046) 8.257 11.112 ( 1.178 2.946 3.997) 5.103 11.231 ( -3.045 -4.482 1.849) 5.725 11.366 ( -3.616 2.519 0.242) 4.413 11.469 ( -0.502 -2.093 0.797) 2.295 11.855 ( 0.453 -0.532 0.352) 0.782 11.917 ( -1.506 -3.197 -2.427) 4.287 12.142 ( -2.769 4.373 0.851) 5.245 12.291 ( -4.876 -1.619 -1.568) 5.372 12.568 ( -7.412 7.104 0.464) 10.277 12.822 ( 0.369 2.902 2.951) 4.155 12.919 ( -2.331 -4.216 -4.197) 6.389 13.014 ( -4.355 -2.437 -0.050) 4.991 13.232 ( 1.663 1.648 0.020) 2.341 13.283 ( -1.799 -1.151 0.841) 2.295 13.376 ( -1.368 -3.954 0.709) 4.244 13.382 ( 2.380 -3.891 2.779) 5.341 13.617 ( -4.269 3.943 1.151) 5.925 13.694 ( -3.867 -0.728 -1.298) 4.143 14.189 ( 1.123 4.300 1.446) 4.673 14.350 ( 1.334 -3.795 -3.339) 5.228 14.526 ( -2.837 -0.580 -1.559) 3.289 14.545 ( -0.192 -0.977 -0.248) 1.027 14.789 ( -2.719 2.377 1.544) 3.928 14.914 ( -3.200 -2.896 -0.391) 4.333 15.377 ( 1.168 5.691 -2.562) 6.349 15.476 ( -7.272 2.548 -1.507) 7.851 15.503 ( 6.153 -1.332 -2.037) 6.617 15.688 ( -2.508 -5.358 3.928) 7.101 15.747 ( -1.518 3.529 5.463) 6.678 16.028 ( -2.422 -6.652 0.531) 7.099 16.131 ( -0.957 5.784 -3.560) 6.859 16.256 ( 2.859 -2.922 -3.823) 5.597 16.517 ( 4.611 4.731 0.478) 6.624 16.646 ( 10.355 -1.608 1.013) 10.528 16.787 ( 4.284 2.083 -0.477) 4.787 16.845 ( -0.261 -0.153 3.113) 3.128 16.963 ( -4.411 0.424 -0.137) 4.433 17.022 ( -2.550 -1.225 -4.262) 5.116 17.396 ( 1.418 3.725 -1.308) 4.195 17.546 ( -0.079 -2.682 0.111) 2.686 17.755 ( -6.564 7.257 -4.293) 10.686 17.862 ( -2.252 -0.036 -1.564) 2.742 18.219 ( 0.738 7.853 -3.085) 8.469 18.377 ( -3.772 2.980 -0.028) 4.808 18.896 ( -4.727 -4.325 0.210) 6.410 18.977 ( 1.314 -4.316 5.884) 7.415 19.556 ( 12.222 -7.703 6.240) 15.737 19.568 ( 11.670 -6.411 0.179) 13.316 20.065 ( 1.501 3.948 0.880) 4.315 20.181 ( -1.997 -1.822 0.893) 2.847 ======================= Grid point 25 (16/104) ======================= q-point: ( 0.30 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.956 ( 18.041 8.338 4.345) 20.344 2.135 ( 8.879 8.796 8.121) 14.905 2.358 ( 6.620 -8.514 -1.406) 10.876 2.556 ( 4.010 -4.572 -0.043) 6.082 2.681 ( 4.823 -1.215 -1.525) 5.202 2.847 ( 4.283 -4.649 2.902) 6.955 2.893 ( 8.714 2.357 -5.941) 10.806 3.024 ( 2.315 -0.132 -5.549) 6.014 3.076 ( 5.203 1.905 -1.573) 5.759 3.184 ( 7.714 -3.304 -3.240) 8.996 3.226 ( 6.230 1.803 -0.884) 6.546 3.256 ( -0.758 -1.104 -0.665) 1.496 3.365 ( -1.439 6.200 -3.770) 7.398 3.488 ( 4.559 -0.964 2.035) 5.084 3.555 ( 2.315 -0.369 2.985) 3.795 3.656 ( 7.512 5.534 7.270) 11.829 3.707 ( 3.090 -3.948 -0.713) 5.064 3.950 ( 6.845 -1.269 5.737) 9.021 3.986 ( -3.405 6.030 -0.450) 6.939 4.071 ( -4.635 3.999 -2.567) 6.638 4.211 ( -1.864 0.001 -1.258) 2.249 4.232 ( 1.258 0.416 0.855) 1.577 4.302 ( 3.027 -1.099 0.281) 3.233 4.393 ( 3.255 1.111 -2.249) 4.109 4.445 ( 2.286 -3.053 2.068) 4.338 4.542 ( 0.544 -2.048 -1.668) 2.697 4.592 ( 0.521 1.130 4.579) 4.745 4.602 ( 5.461 -1.142 3.257) 6.460 4.782 ( -2.169 -0.633 -3.567) 4.223 4.817 ( 0.181 2.903 -1.468) 3.258 4.859 ( 1.913 0.965 0.806) 2.289 4.937 ( 1.789 -7.686 -0.557) 7.911 5.061 ( 1.842 -1.438 -4.564) 5.128 5.100 ( -5.998 -2.365 1.134) 6.546 5.438 ( 2.186 0.510 -3.819) 4.430 5.596 ( 2.601 -6.365 3.488) 7.710 5.751 ( -3.670 1.187 -0.489) 3.888 5.794 ( -6.323 2.081 3.430) 7.488 6.038 ( -6.473 5.131 -5.127) 9.722 6.204 ( -0.968 -1.982 1.162) 2.493 6.291 ( -9.013 -0.599 -0.512) 9.048 6.330 ( -1.490 -0.231 5.785) 5.978 6.376 ( 3.761 2.753 -1.421) 4.873 6.539 ( 1.009 -2.189 0.312) 2.431 6.854 ( 0.363 4.901 2.359) 5.451 7.092 ( 4.091 -8.031 -2.905) 9.469 7.339 ( 0.805 -1.538 -4.871) 5.171 7.397 ( -1.800 -4.155 2.476) 5.161 7.943 ( 5.067 5.202 -4.264) 8.421 7.998 ( 4.032 3.126 1.484) 5.313 8.201 ( -2.577 3.449 5.667) 7.117 8.464 ( 1.852 -5.912 4.791) 7.831 8.520 ( 2.315 10.905 2.063) 11.337 8.708 ( 0.677 4.739 -3.684) 6.041 8.855 ( 3.066 -5.609 -3.962) 7.521 8.939 ( -1.019 -2.558 -0.233) 2.763 9.250 ( 2.126 1.154 -8.498) 8.836 9.313 ( 1.026 0.520 -2.941) 3.158 9.360 ( -0.060 2.007 4.042) 4.513 9.579 ( 1.476 -1.998 1.898) 3.126 9.680 ( -3.106 -0.931 2.026) 3.823 9.723 ( -0.266 0.415 3.200) 3.238 9.939 ( 0.221 4.878 -4.028) 6.330 10.072 ( 2.373 -1.938 0.275) 3.076 10.112 ( -2.422 -0.279 -0.614) 2.514 10.149 ( 0.369 -0.563 -5.519) 5.560 10.382 ( -7.318 3.707 2.023) 8.450 10.577 ( -4.453 -4.460 -5.103) 8.109 10.885 ( 0.239 1.801 -0.690) 1.944 11.058 ( 0.744 -6.056 -0.054) 6.102 11.183 ( 0.214 2.503 -0.357) 2.538 11.251 ( 1.304 -0.987 2.657) 3.120 11.416 ( 6.767 2.814 5.143) 8.954 11.536 ( 4.737 -3.151 2.879) 6.377 11.855 ( -1.282 -1.025 1.459) 2.196 11.883 ( 0.059 -1.350 -2.284) 2.654 12.096 ( -2.852 4.262 0.956) 5.217 12.224 ( -2.473 0.179 0.662) 2.566 12.434 ( -7.699 3.934 0.927) 8.695 12.652 ( -10.856 -4.416 -3.789) 12.317 12.946 ( 1.705 1.707 -0.585) 2.482 13.025 ( 2.675 -0.179 2.765) 3.852 13.217 ( -3.916 2.096 0.436) 4.463 13.277 ( 2.130 0.340 0.707) 2.270 13.353 ( -2.863 -5.096 1.473) 6.028 13.435 ( 2.045 -4.220 0.557) 4.722 13.599 ( 1.448 0.911 1.431) 2.230 13.667 ( 0.953 -2.596 0.748) 2.865 14.176 ( -3.159 3.631 0.687) 4.862 14.297 ( -4.241 -2.046 -3.459) 5.842 14.486 ( -0.406 0.672 -3.032) 3.132 14.541 ( -0.548 -1.933 -0.945) 2.220 14.777 ( 0.768 0.046 0.854) 1.149 14.855 ( -2.792 -3.012 0.752) 4.175 15.329 ( -5.238 6.117 -1.387) 8.171 15.378 ( -2.149 4.467 -0.743) 5.012 15.519 ( -0.596 -1.344 -3.576) 3.866 15.695 ( 0.704 3.247 2.101) 3.931 15.785 ( -0.363 -5.582 7.288) 9.188 15.942 ( -5.252 -1.922 -1.400) 5.765 16.135 ( 4.716 4.589 -4.650) 8.058 16.312 ( 5.941 -4.789 -3.526) 8.406 16.612 ( 4.110 5.322 -0.055) 6.725 16.785 ( -1.998 1.315 -1.115) 2.639 16.812 ( 3.812 -1.125 -1.200) 4.152 16.879 ( -0.077 0.180 0.911) 0.932 16.932 ( 1.378 -0.841 3.890) 4.212 16.992 ( 3.091 -2.969 0.462) 4.311 17.375 ( -3.872 4.254 -0.085) 5.753 17.509 ( -2.955 0.386 -1.590) 3.378 17.637 ( -4.196 6.088 0.237) 7.397 17.841 ( -0.195 -3.282 1.420) 3.582 18.111 ( -5.891 7.334 -7.731) 12.177 18.389 ( 2.482 1.261 1.239) 3.047 18.788 ( -6.175 0.180 -0.482) 6.196 19.042 ( 1.487 -6.437 4.144) 7.798 19.754 ( 8.347 -3.780 1.516) 9.287 19.782 ( 8.915 -6.256 1.269) 10.965 20.113 ( 2.956 2.267 0.839) 3.818 20.181 ( 1.188 -0.951 1.328) 2.020 ======================= Grid point 26 (17/104) ======================= q-point: ( 0.40 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.275 ( 8.023 -1.154 3.275) 8.742 2.301 ( 10.679 6.082 4.847) 13.211 2.442 ( 3.515 -6.521 -1.088) 7.488 2.600 ( 1.234 -4.057 -1.549) 4.514 2.716 ( -2.067 -0.098 -0.553) 2.142 2.837 ( -2.040 -5.921 -3.663) 7.255 2.979 ( 0.969 0.979 -4.881) 5.071 2.999 ( 1.719 0.697 -3.365) 3.842 3.176 ( 5.393 -1.303 -5.209) 7.610 3.198 ( 5.215 8.924 5.997) 11.950 3.324 ( 6.070 -0.497 -3.817) 7.188 3.367 ( 2.169 2.280 1.174) 3.359 3.404 ( 8.176 4.021 0.606) 9.131 3.533 ( -0.089 -0.926 2.414) 2.587 3.640 ( 2.575 0.620 3.770) 4.608 3.745 ( 3.175 -2.167 -0.808) 3.928 3.774 ( 0.951 5.886 1.252) 6.093 3.875 ( -5.502 1.110 -0.513) 5.637 3.956 ( -3.971 3.812 -1.401) 5.680 4.038 ( -2.120 2.573 0.204) 3.340 4.115 ( -8.104 -2.523 -1.863) 8.690 4.235 ( 0.141 -5.176 1.203) 5.316 4.356 ( -2.446 4.278 -2.532) 5.541 4.369 ( 3.224 2.119 2.796) 4.765 4.453 ( -1.000 1.914 -0.000) 2.160 4.607 ( 2.896 -7.415 3.646) 8.756 4.683 ( 2.711 0.861 3.839) 4.778 4.697 ( 3.439 -1.635 0.578) 3.851 4.743 ( 1.487 0.195 -3.267) 3.595 4.823 ( 1.475 1.798 -2.312) 3.280 4.874 ( -0.036 -3.196 -1.512) 3.535 4.955 ( -1.333 -1.966 1.284) 2.700 5.021 ( -1.542 -1.578 0.359) 2.235 5.135 ( 6.003 -5.592 -0.033) 8.204 5.466 ( 1.404 5.261 -2.612) 6.039 5.675 ( -6.807 1.002 -0.087) 6.881 5.685 ( -0.895 1.213 0.802) 1.707 5.738 ( 6.821 -4.787 5.116) 9.778 5.912 ( -3.048 5.373 -4.346) 7.552 6.122 ( -4.595 -3.423 -2.696) 6.332 6.224 ( -1.415 -0.195 2.405) 2.797 6.318 ( -3.166 -3.181 3.712) 5.824 6.486 ( 6.641 3.168 -0.685) 7.390 6.575 ( 2.532 -0.699 -1.366) 2.961 6.870 ( 0.052 4.925 0.607) 4.962 7.156 ( 3.798 -10.983 -2.137) 11.816 7.321 ( 0.716 0.802 -1.726) 2.034 7.425 ( 1.231 -4.761 3.417) 5.988 7.980 ( 1.604 2.551 -0.388) 3.038 8.059 ( 1.733 -1.489 -1.589) 2.782 8.243 ( 2.528 10.283 7.762) 13.130 8.542 ( 2.446 1.208 4.257) 5.056 8.575 ( 1.714 6.568 -1.480) 6.947 8.689 ( 0.791 2.820 -0.665) 3.003 8.862 ( 1.029 -5.625 -4.635) 7.361 8.906 ( -1.376 -1.372 -2.010) 2.795 9.175 ( -3.674 1.334 -6.216) 7.343 9.319 ( 0.631 -7.595 -2.179) 7.926 9.341 ( -3.170 5.540 4.030) 7.548 9.523 ( -5.987 -2.092 -0.278) 6.349 9.683 ( 1.141 1.536 2.590) 3.221 9.777 ( 2.023 1.336 1.577) 2.893 9.927 ( 1.980 3.982 -2.990) 5.359 10.033 ( -2.503 2.221 -2.120) 3.962 10.122 ( 0.400 -0.676 0.654) 1.022 10.163 ( 2.979 -2.587 -2.245) 4.539 10.229 ( -8.583 1.564 0.949) 8.776 10.461 ( -4.073 -6.217 -3.212) 8.097 10.901 ( 1.751 4.780 -0.357) 5.103 11.121 ( 4.349 -5.637 1.068) 7.199 11.178 ( 0.219 2.414 0.235) 2.435 11.281 ( 0.421 -2.701 1.359) 3.053 11.556 ( 3.909 0.743 2.247) 4.570 11.606 ( 0.665 -2.245 0.241) 2.354 11.861 ( 0.629 1.287 2.961) 3.290 11.882 ( 1.056 0.305 -0.976) 1.471 12.057 ( -2.112 4.834 0.929) 5.357 12.197 ( -1.586 3.912 1.286) 4.413 12.315 ( -4.892 -0.966 -0.471) 5.009 12.479 ( -5.477 -3.573 -1.778) 6.777 12.965 ( 0.993 0.340 0.294) 1.090 13.064 ( -0.498 -2.456 0.237) 2.517 13.170 ( -1.511 2.162 1.309) 2.945 13.251 ( -3.227 -0.385 -0.683) 3.321 13.393 ( 3.909 -2.081 4.073) 6.016 13.474 ( 1.887 -3.011 -0.532) 3.593 13.655 ( 2.722 -1.758 0.956) 3.379 13.710 ( 2.269 -3.738 0.979) 4.481 14.103 ( -3.877 2.599 -1.209) 4.822 14.181 ( -5.019 -0.452 -2.777) 5.753 14.450 ( -1.049 0.973 -2.444) 2.832 14.503 ( -2.722 -2.110 -0.145) 3.447 14.812 ( 2.459 -1.801 -1.083) 3.235 14.838 ( -0.549 -2.859 2.276) 3.696 15.256 ( -0.952 4.007 -2.741) 4.947 15.322 ( -3.663 4.418 1.619) 5.963 15.501 ( 1.367 3.572 -3.555) 5.222 15.675 ( -5.019 7.741 5.331) 10.655 15.845 ( 3.119 -10.204 0.648) 10.689 15.855 ( -2.706 -0.732 -1.685) 3.271 16.207 ( 4.551 5.027 -1.126) 6.874 16.406 ( 6.247 -4.487 -2.780) 8.178 16.643 ( 0.139 4.910 -1.026) 5.018 16.725 ( -2.641 -0.305 0.528) 2.711 16.800 ( -3.459 -3.002 0.527) 4.610 16.847 ( 0.012 -3.638 -4.675) 5.924 17.052 ( 5.923 1.198 4.317) 7.427 17.102 ( 5.121 -0.887 3.332) 6.174 17.272 ( -6.199 4.870 0.302) 7.889 17.427 ( -4.346 -1.094 -2.483) 5.123 17.609 ( -0.715 6.257 2.988) 6.970 17.855 ( 0.298 -1.901 0.266) 1.942 17.964 ( -4.194 8.021 -4.777) 10.234 18.434 ( 1.848 -7.055 -0.860) 7.344 18.690 ( -3.922 7.590 -0.077) 8.544 19.085 ( 0.693 -8.491 2.096) 8.773 19.863 ( 2.992 -1.155 0.796) 3.305 19.914 ( 5.180 -3.969 -0.242) 6.531 20.173 ( 2.724 1.205 0.525) 3.024 20.229 ( 2.246 -1.534 1.556) 3.134 ======================= Grid point 27 (18/104) ======================= q-point: (-0.50 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.334 ( 0.000 2.189 0.000) 2.189 2.467 ( 0.000 -6.826 0.000) 6.826 2.531 ( 0.000 -1.531 0.000) 1.531 2.550 ( -0.000 -1.001 -0.000) 1.001 2.649 ( -0.000 -1.451 0.000) 1.451 2.808 ( -0.000 -6.286 0.000) 6.286 2.945 ( 0.000 1.427 0.000) 1.427 3.003 ( 0.000 -0.782 -0.000) 0.782 3.226 ( 0.000 2.552 0.000) 2.552 3.327 ( 0.000 3.165 0.000) 3.165 3.351 ( 0.000 1.462 0.000) 1.462 3.388 ( -0.000 10.649 -0.000) 10.649 3.510 ( -0.000 -1.245 0.000) 1.245 3.517 ( 0.000 4.397 -0.000) 4.397 3.687 ( 0.000 1.214 0.000) 1.214 3.735 ( 0.000 2.724 -0.000) 2.724 3.800 ( 0.000 -0.572 0.000) 0.572 3.867 ( 0.000 -1.086 0.000) 1.086 3.930 ( -0.000 -0.112 0.000) 0.112 3.938 ( 0.000 -0.682 -0.000) 0.682 4.009 ( 0.000 1.524 -0.000) 1.524 4.248 ( 0.000 -2.312 0.000) 2.312 4.322 ( 0.000 7.171 -0.000) 7.171 4.423 ( 0.000 0.997 0.000) 0.997 4.429 ( -0.000 1.584 0.000) 1.584 4.657 ( 0.000 -7.169 0.000) 7.169 4.707 ( 0.000 -2.633 0.000) 2.633 4.722 ( 0.000 -2.209 -0.000) 2.209 4.773 ( 0.000 -0.439 0.000) 0.439 4.809 ( 0.000 0.600 0.000) 0.600 4.878 ( 0.000 -5.462 0.000) 5.462 4.944 ( 0.000 -0.722 0.000) 0.722 5.012 ( 0.000 1.449 0.000) 1.449 5.202 ( 0.000 -7.266 0.000) 7.266 5.452 ( 0.000 6.115 0.000) 6.115 5.595 ( 0.000 1.338 -0.000) 1.338 5.742 ( 0.000 4.261 0.000) 4.261 5.763 ( 0.000 2.751 0.000) 2.751 5.932 ( 0.000 0.038 0.000) 0.038 6.040 ( -0.000 -5.434 0.000) 5.434 6.230 ( 0.000 -1.486 0.000) 1.486 6.287 ( 0.000 -4.012 0.000) 4.012 6.557 ( 0.000 1.421 0.000) 1.421 6.590 ( 0.000 0.651 -0.000) 0.651 6.870 ( 0.000 5.449 0.000) 5.449 7.180 ( 0.000 -11.760 0.000) 11.760 7.330 ( 0.000 2.087 0.000) 2.087 7.454 ( 0.000 -4.764 0.000) 4.764 7.999 ( 0.000 1.601 -0.000) 1.601 8.060 ( 0.000 -1.842 0.000) 1.842 8.331 ( 0.000 10.823 0.000) 10.823 8.547 ( 0.000 6.436 -0.000) 6.436 8.584 ( 0.000 8.320 0.000) 8.320 8.741 ( 0.000 -3.410 0.000) 3.410 8.830 ( 0.000 -6.305 0.000) 6.305 8.882 ( 0.000 -0.508 0.000) 0.508 9.100 ( -0.000 1.125 0.000) 1.125 9.306 ( 0.000 -5.746 0.000) 5.746 9.337 ( 0.000 1.178 0.000) 1.178 9.452 ( 0.000 -0.596 -0.000) 0.596 9.707 ( 0.000 1.078 0.000) 1.078 9.798 ( 0.000 4.122 -0.000) 4.122 9.949 ( 0.000 1.442 -0.000) 1.442 10.003 ( 0.000 2.465 0.000) 2.465 10.098 ( 0.000 5.049 0.000) 5.049 10.160 ( 0.000 -5.005 0.000) 5.005 10.194 ( 0.000 -1.717 0.000) 1.717 10.408 ( 0.000 -7.220 -0.000) 7.220 10.920 ( 0.000 6.631 0.000) 6.631 11.177 ( 0.000 -5.738 0.000) 5.738 11.185 ( 0.000 2.725 0.000) 2.725 11.289 ( 0.000 -3.669 0.000) 3.669 11.592 ( -0.000 -1.382 -0.000) 1.382 11.596 ( 0.000 -0.842 0.000) 0.842 11.883 ( 0.000 2.514 0.000) 2.514 11.897 ( 0.000 1.580 -0.000) 1.580 12.039 ( 0.000 5.182 0.000) 5.182 12.185 ( 0.000 7.306 0.000) 7.306 12.270 ( 0.000 -5.286 0.000) 5.286 12.425 ( 0.000 -3.590 0.000) 3.590 12.982 ( 0.000 -1.030 0.000) 1.030 13.044 ( 0.000 -2.385 0.000) 2.385 13.168 ( 0.000 1.998 0.000) 1.998 13.215 ( 0.000 0.412 0.000) 0.412 13.470 ( -0.000 -1.494 -0.000) 1.494 13.477 ( 0.000 -3.363 0.000) 3.363 13.686 ( 0.000 -2.365 -0.000) 2.365 13.737 ( 0.000 -4.416 0.000) 4.416 14.056 ( 0.000 2.402 0.000) 2.402 14.116 ( 0.000 0.097 -0.000) 0.097 14.430 ( 0.000 0.795 0.000) 0.795 14.471 ( 0.000 -1.818 0.000) 1.818 14.835 ( 0.000 -2.558 -0.000) 2.558 14.843 ( -0.000 -2.753 0.000) 2.753 15.243 ( 0.000 3.536 -0.000) 3.536 15.290 ( 0.000 4.418 0.000) 4.418 15.504 ( 0.000 5.064 0.000) 5.064 15.639 ( 0.000 8.347 -0.000) 8.347 15.824 ( 0.000 -0.492 0.000) 0.492 15.879 ( 0.000 -10.772 -0.000) 10.772 16.250 ( 0.000 6.195 0.000) 6.195 16.461 ( 0.000 -3.465 0.000) 3.465 16.635 ( 0.000 4.717 -0.000) 4.717 16.728 ( 0.000 -3.344 0.000) 3.344 16.730 ( 0.000 -3.691 -0.000) 3.691 16.833 ( 0.000 -4.462 0.000) 4.462 17.152 ( 0.000 3.517 0.000) 3.517 17.182 ( 0.000 3.798 0.000) 3.798 17.187 ( -0.000 0.637 -0.000) 0.637 17.356 ( 0.000 -3.109 -0.000) 3.109 17.621 ( 0.000 6.151 0.000) 6.151 17.846 ( 0.000 7.559 -0.000) 7.559 17.917 ( 0.000 0.318 0.000) 0.318 18.445 ( 0.000 -12.536 -0.000) 12.536 18.654 ( 0.000 12.587 0.000) 12.587 19.098 ( 0.000 -9.272 0.000) 9.272 19.890 ( 0.000 0.311 0.000) 0.311 19.960 ( 0.000 -3.444 0.000) 3.444 20.202 ( 0.000 0.945 0.000) 0.945 20.259 ( 0.000 -2.027 0.000) 2.027 ======================= Grid point 33 (19/104) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 52 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.724 ( 0.000 -26.059 0.000) 26.059 1.724 ( 0.000 26.059 0.000) 26.059 1.873 ( 0.000 -25.647 0.000) 25.647 1.873 ( 0.000 25.647 0.000) 25.647 2.365 ( 0.000 -14.897 0.000) 14.897 2.365 ( 0.000 14.897 0.000) 14.897 2.542 ( 0.000 -4.389 0.000) 4.389 2.542 ( 0.000 4.389 0.000) 4.389 2.799 ( 0.000 -9.876 0.000) 9.876 2.799 ( 0.000 9.876 0.000) 9.876 3.083 ( 0.000 -3.249 0.000) 3.249 3.083 ( 0.000 3.249 0.000) 3.249 3.319 ( 0.000 -0.802 0.000) 0.802 3.319 ( 0.000 0.802 0.000) 0.802 3.536 ( 0.000 -9.147 0.000) 9.147 3.536 ( 0.000 9.147 0.000) 9.147 3.740 ( 0.000 -4.679 0.000) 4.679 3.740 ( 0.000 4.679 0.000) 4.679 3.866 ( 0.000 -2.871 0.000) 2.871 3.866 ( 0.000 2.871 0.000) 2.871 4.116 ( 0.000 -5.819 0.000) 5.819 4.116 ( 0.000 5.819 0.000) 5.819 4.157 ( 0.000 -3.207 0.000) 3.207 4.157 ( 0.000 3.207 0.000) 3.207 4.501 ( 0.000 -0.490 0.000) 0.490 4.501 ( 0.000 0.490 0.000) 0.490 4.623 ( 0.000 -1.555 0.000) 1.555 4.623 ( 0.000 1.555 0.000) 1.555 4.811 ( 0.000 -0.562 0.000) 0.562 4.811 ( 0.000 0.562 0.000) 0.562 4.978 ( 0.000 -1.793 0.000) 1.793 4.978 ( 0.000 1.793 0.000) 1.793 5.334 ( 0.000 -3.152 0.000) 3.152 5.334 ( 0.000 3.152 0.000) 3.152 5.564 ( 0.000 -2.647 0.000) 2.647 5.564 ( 0.000 2.647 0.000) 2.647 5.882 ( 0.000 -0.453 0.000) 0.453 5.882 ( 0.000 0.453 0.000) 0.453 6.217 ( 0.000 -5.499 0.000) 5.499 6.217 ( 0.000 5.499 0.000) 5.499 6.387 ( 0.000 -7.505 0.000) 7.505 6.387 ( 0.000 7.505 0.000) 7.505 6.783 ( 0.000 -7.361 0.000) 7.361 6.783 ( 0.000 7.361 0.000) 7.361 6.961 ( 0.000 -2.737 0.000) 2.737 6.961 ( 0.000 2.737 0.000) 2.737 7.432 ( 0.000 -4.852 0.000) 4.852 7.432 ( 0.000 4.852 0.000) 4.852 7.951 ( 0.000 -4.338 0.000) 4.338 7.951 ( 0.000 4.338 0.000) 4.338 8.159 ( 0.000 -2.074 0.000) 2.074 8.159 ( 0.000 2.074 0.000) 2.074 8.662 ( 0.000 -8.177 0.000) 8.177 8.662 ( 0.000 8.177 0.000) 8.177 8.799 ( 0.000 -0.115 0.000) 0.115 8.799 ( 0.000 0.115 0.000) 0.115 9.088 ( 0.000 -7.363 0.000) 7.363 9.088 ( 0.000 7.363 0.000) 7.363 9.332 ( 0.000 -3.920 0.000) 3.920 9.332 ( 0.000 3.920 0.000) 3.920 9.681 ( 0.000 -1.004 0.000) 1.004 9.681 ( 0.000 1.004 0.000) 1.004 10.074 ( 0.000 -2.903 0.000) 2.903 10.074 ( 0.000 2.903 0.000) 2.903 10.360 ( 0.000 -0.050 0.000) 0.050 10.360 ( 0.000 0.050 0.000) 0.050 10.450 ( 0.000 -0.630 0.000) 0.630 10.450 ( 0.000 0.630 0.000) 0.630 10.665 ( 0.000 -3.709 0.000) 3.709 10.665 ( 0.000 3.709 0.000) 3.709 11.247 ( 0.000 -3.832 0.000) 3.832 11.247 ( 0.000 3.832 0.000) 3.832 11.515 ( 0.000 -2.205 0.000) 2.205 11.515 ( 0.000 2.205 0.000) 2.205 11.898 ( 0.000 -2.932 0.000) 2.932 11.898 ( 0.000 2.932 0.000) 2.932 12.349 ( 0.000 -8.510 0.000) 8.510 12.349 ( 0.000 8.510 0.000) 8.510 12.745 ( 0.000 -6.980 0.000) 6.980 12.745 ( 0.000 6.980 0.000) 6.980 13.075 ( 0.000 -8.792 0.000) 8.792 13.075 ( 0.000 8.792 0.000) 8.792 13.195 ( 0.000 -1.447 0.000) 1.447 13.195 ( 0.000 1.447 0.000) 1.447 13.413 ( 0.000 -3.299 0.000) 3.299 13.413 ( 0.000 3.299 0.000) 3.299 13.835 ( 0.000 -0.369 0.000) 0.369 13.835 ( 0.000 0.369 0.000) 0.369 14.196 ( 0.000 -5.690 0.000) 5.690 14.196 ( 0.000 5.690 0.000) 5.690 14.622 ( 0.000 -3.375 0.000) 3.375 14.622 ( 0.000 3.375 0.000) 3.375 14.887 ( 0.000 -2.123 0.000) 2.123 14.887 ( 0.000 2.123 0.000) 2.123 15.404 ( 0.000 -5.449 0.000) 5.449 15.404 ( 0.000 5.449 0.000) 5.449 15.539 ( 0.000 -2.678 0.000) 2.678 15.539 ( 0.000 2.678 0.000) 2.678 15.960 ( 0.000 -3.083 0.000) 3.083 15.960 ( 0.000 3.083 0.000) 3.083 16.189 ( 0.000 -4.704 0.000) 4.704 16.189 ( 0.000 4.704 0.000) 4.704 16.443 ( 0.000 -3.656 0.000) 3.656 16.443 ( 0.000 3.656 0.000) 3.656 16.781 ( 0.000 -1.699 0.000) 1.699 16.781 ( 0.000 1.699 0.000) 1.699 17.200 ( 0.000 -3.315 0.000) 3.315 17.200 ( 0.000 3.315 0.000) 3.315 17.346 ( 0.000 -8.107 0.000) 8.107 17.346 ( 0.000 8.107 0.000) 8.107 18.018 ( 0.000 -0.384 0.000) 0.384 18.018 ( 0.000 0.384 0.000) 0.384 18.405 ( 0.000 -6.435 0.000) 6.435 18.405 ( 0.000 6.435 0.000) 6.435 18.825 ( 0.000 -10.543 0.000) 10.543 18.825 ( 0.000 10.543 0.000) 10.543 19.166 ( 0.000 -7.193 0.000) 7.193 19.166 ( 0.000 7.193 0.000) 7.193 20.162 ( 0.000 -5.630 0.000) 5.630 20.162 ( 0.000 5.630 0.000) 5.630 ======================= Grid point 35 (20/104) ======================= q-point: ( 0.10 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.840 ( 8.857 -18.780 -1.580) 20.824 1.840 ( 8.857 18.780 -1.580) 20.824 1.930 ( 7.399 -19.261 4.553) 21.129 1.930 ( 7.399 19.261 4.553) 21.129 2.454 ( 8.036 -9.149 -0.131) 12.178 2.454 ( 8.036 9.149 -0.131) 12.178 2.644 ( 9.403 -3.580 0.533) 10.076 2.644 ( 9.403 3.580 0.533) 10.076 2.873 ( 7.131 -8.281 3.355) 11.432 2.873 ( 7.131 8.281 3.355) 11.432 3.123 ( 4.156 -3.185 2.121) 5.650 3.123 ( 4.156 3.185 2.121) 5.650 3.324 ( 1.252 -3.530 -3.103) 4.863 3.324 ( 1.252 3.530 -3.103) 4.863 3.550 ( 1.634 -10.301 -0.670) 10.451 3.550 ( 1.634 10.301 -0.670) 10.451 3.705 ( -0.813 -2.990 -2.355) 3.892 3.705 ( -0.813 2.990 -2.355) 3.892 3.934 ( 3.768 -5.810 2.688) 7.428 3.934 ( 3.768 5.810 2.688) 7.428 4.092 ( 1.610 -4.464 -2.346) 5.294 4.092 ( 1.610 4.464 -2.346) 5.294 4.208 ( 1.599 -2.960 5.801) 6.706 4.208 ( 1.599 2.960 5.801) 6.706 4.498 ( -1.464 -3.040 0.950) 3.506 4.498 ( -1.464 3.040 0.950) 3.506 4.616 ( 0.263 -0.499 -3.762) 3.804 4.616 ( 0.263 0.499 -3.762) 3.804 4.793 ( -0.894 -2.168 0.560) 2.411 4.793 ( -0.894 2.168 0.560) 2.411 4.956 ( -1.384 -1.185 -2.882) 3.409 4.956 ( -1.384 1.185 -2.882) 3.409 5.277 ( -5.856 -1.076 0.865) 6.017 5.277 ( -5.856 1.076 0.865) 6.017 5.553 ( -1.285 -0.984 -1.741) 2.377 5.553 ( -1.285 0.984 -1.741) 2.377 5.862 ( -1.775 -1.159 0.459) 2.169 5.862 ( -1.775 1.159 0.459) 2.169 6.222 ( -0.070 -5.430 0.629) 5.467 6.222 ( -0.070 5.430 0.629) 5.467 6.348 ( -3.099 -5.901 1.373) 6.805 6.348 ( -3.099 5.901 1.373) 6.805 6.727 ( -8.978 -4.906 2.023) 10.429 6.727 ( -8.978 4.906 2.023) 10.429 6.948 ( 0.706 -4.865 -1.281) 5.080 6.948 ( 0.706 4.865 -1.281) 5.080 7.428 ( -0.291 -4.849 -2.157) 5.315 7.428 ( -0.291 4.849 -2.157) 5.315 7.908 ( 0.333 -3.102 -4.788) 5.715 7.908 ( 0.333 3.102 -4.788) 5.715 8.219 ( 2.727 -2.227 4.556) 5.758 8.219 ( 2.727 2.227 4.556) 5.758 8.680 ( 0.808 -3.842 -1.612) 4.244 8.680 ( 0.808 3.842 -1.612) 4.244 8.788 ( 0.832 -4.730 -0.925) 4.891 8.788 ( 0.832 4.730 -0.925) 4.891 9.154 ( 5.149 -4.307 3.677) 7.654 9.154 ( 5.149 4.307 3.677) 7.654 9.369 ( 3.715 -1.696 -2.125) 4.603 9.369 ( 3.715 1.696 -2.125) 4.603 9.693 ( 1.575 -1.913 -1.147) 2.731 9.693 ( 1.575 1.913 -1.147) 2.731 10.034 ( -3.790 -2.436 2.472) 5.139 10.034 ( -3.790 2.436 2.472) 5.139 10.292 ( -4.363 -3.063 -3.308) 6.274 10.292 ( -4.363 3.063 -3.308) 6.274 10.487 ( 2.772 -4.956 0.070) 5.679 10.487 ( 2.772 4.956 0.070) 5.679 10.786 ( 10.436 -2.855 1.788) 10.966 10.786 ( 10.436 2.855 1.788) 10.966 11.213 ( -3.791 -4.269 0.720) 5.754 11.213 ( -3.791 4.269 0.720) 5.754 11.480 ( -3.608 -2.197 0.171) 4.228 11.480 ( -3.608 2.197 0.171) 4.228 11.887 ( -0.447 -2.862 -1.462) 3.244 11.887 ( -0.447 2.862 -1.462) 3.244 12.302 ( -3.926 -6.742 -0.733) 7.837 12.302 ( -3.926 6.742 -0.733) 7.837 12.789 ( 3.460 -6.742 -1.495) 7.724 12.789 ( 3.460 6.742 -1.495) 7.724 12.995 ( -7.469 -8.787 2.148) 11.731 12.995 ( -7.469 8.787 2.148) 11.731 13.227 ( 2.583 -2.238 -0.514) 3.456 13.227 ( 2.583 2.238 -0.514) 3.456 13.375 ( -3.123 -3.456 0.150) 4.661 13.375 ( -3.123 3.456 0.150) 4.661 13.783 ( -5.190 -1.409 -0.490) 5.400 13.783 ( -5.190 1.409 -0.490) 5.400 14.226 ( 3.200 -5.300 -0.962) 6.265 14.226 ( 3.200 5.300 -0.962) 6.265 14.578 ( -3.379 -1.507 -0.503) 3.734 14.578 ( -3.379 1.507 -0.503) 3.734 14.890 ( -1.233 -3.536 1.180) 3.927 14.890 ( -1.233 3.536 1.180) 3.927 15.398 ( 3.134 -1.489 -4.580) 5.745 15.398 ( 3.134 1.489 -4.580) 5.745 15.594 ( 0.553 -2.039 5.558) 5.946 15.594 ( 0.553 2.039 5.558) 5.946 15.912 ( -3.899 -6.593 0.220) 7.662 15.912 ( -3.899 6.593 0.220) 7.662 16.207 ( 1.390 -3.338 -0.722) 3.687 16.207 ( 1.390 3.338 -0.722) 3.687 16.483 ( 4.228 -1.613 0.202) 4.529 16.483 ( 4.228 1.613 0.202) 4.529 16.782 ( 0.965 -2.767 -0.275) 2.943 16.782 ( 0.965 2.767 -0.275) 2.943 17.107 ( -5.350 -0.856 -3.854) 6.649 17.107 ( -5.350 0.856 -3.854) 6.649 17.417 ( 4.245 -4.811 1.122) 6.513 17.417 ( 4.245 4.811 1.122) 6.513 17.960 ( -3.931 -0.433 -4.351) 5.880 17.960 ( -3.931 0.433 -4.351) 5.880 18.396 ( -0.690 -8.424 -0.850) 8.495 18.396 ( -0.690 8.424 -0.850) 8.495 18.858 ( 0.163 -5.331 5.414) 7.600 18.858 ( 0.163 5.331 5.414) 7.600 19.266 ( 9.527 -5.123 2.176) 11.033 19.266 ( 9.527 5.123 2.176) 11.033 20.147 ( -1.498 -4.823 0.637) 5.091 20.147 ( -1.498 4.823 0.637) 5.091 ======================= Grid point 37 (21/104) ======================= q-point: ( 0.20 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.969 ( 8.567 -18.535 -1.335) 20.462 1.969 ( 8.567 18.535 -1.335) 20.462 2.180 ( 10.869 -19.084 8.431) 23.525 2.180 ( 10.869 19.084 8.431) 23.525 2.592 ( 8.953 -5.112 -3.690) 10.950 2.592 ( 8.953 5.112 -3.690) 10.950 2.830 ( 9.548 -4.749 0.782) 10.693 2.830 ( 9.548 4.749 0.782) 10.693 3.043 ( 8.406 -2.489 -3.405) 9.405 3.043 ( 8.406 2.489 -3.405) 9.405 3.247 ( 3.351 -5.029 1.464) 6.218 3.247 ( 3.351 5.029 1.464) 6.218 3.346 ( 5.826 -4.980 1.703) 7.851 3.346 ( 5.826 4.980 1.703) 7.851 3.571 ( 0.169 -6.026 -1.476) 6.206 3.571 ( 0.169 6.026 -1.476) 6.206 3.699 ( 2.499 -6.972 1.820) 7.627 3.699 ( 2.499 6.972 1.820) 7.627 4.063 ( 8.906 -7.030 3.505) 11.876 4.063 ( 8.906 7.030 3.505) 11.876 4.142 ( 3.387 -3.813 -1.467) 5.307 4.142 ( 3.387 3.813 -1.467) 5.307 4.279 ( 1.783 -3.784 2.174) 4.714 4.279 ( 1.783 3.784 2.174) 4.714 4.462 ( -2.423 -5.479 2.994) 6.697 4.462 ( -2.423 5.479 2.994) 6.697 4.575 ( -0.109 -3.196 -5.293) 6.184 4.575 ( -0.109 3.196 -5.293) 6.184 4.821 ( 2.189 -2.880 2.470) 4.380 4.821 ( 2.189 2.880 2.470) 4.380 4.888 ( -2.822 -1.384 -4.826) 5.759 4.888 ( -2.822 1.384 -4.826) 5.759 5.162 ( -6.557 -4.103 0.077) 7.735 5.162 ( -6.557 4.103 0.077) 7.735 5.491 ( -3.088 -3.704 -1.508) 5.052 5.491 ( -3.088 3.704 -1.508) 5.052 5.839 ( -1.867 -1.729 1.568) 2.989 5.839 ( -1.867 1.729 1.568) 2.989 6.207 ( -2.548 -1.670 1.522) 3.405 6.207 ( -2.548 1.670 1.522) 3.405 6.338 ( 1.230 -3.031 -1.233) 3.496 6.338 ( 1.230 3.031 -1.233) 3.496 6.528 ( -12.187 -0.210 3.493) 12.680 6.528 ( -12.187 0.210 3.493) 12.680 6.954 ( 0.660 -5.964 -1.765) 6.254 6.954 ( 0.660 5.964 -1.765) 6.254 7.382 ( -1.834 -3.367 -3.572) 5.240 7.382 ( -1.834 3.367 -3.572) 5.240 7.940 ( 5.351 -1.401 -3.039) 6.312 7.940 ( 5.351 1.401 -3.039) 6.312 8.279 ( -0.283 -5.681 5.840) 8.152 8.279 ( -0.283 5.681 5.840) 8.152 8.683 ( 1.338 -7.128 0.083) 7.253 8.683 ( 1.338 7.128 0.083) 7.253 8.812 ( 2.613 -6.287 -3.531) 7.670 8.812 ( 2.613 6.287 -3.531) 7.670 9.277 ( 5.377 -1.352 -1.197) 5.673 9.277 ( 5.377 1.352 -1.197) 5.673 9.410 ( 1.931 -6.510 1.623) 6.982 9.410 ( 1.931 6.510 1.623) 6.982 9.710 ( 0.243 -2.104 0.325) 2.143 9.710 ( 0.243 2.104 0.325) 2.143 10.010 ( -0.040 -2.578 0.129) 2.582 10.010 ( -0.040 2.578 0.129) 2.582 10.189 ( -3.486 -2.739 -3.899) 5.904 10.189 ( -3.486 2.739 -3.899) 5.904 10.526 ( 0.724 -5.945 0.112) 5.990 10.526 ( 0.724 5.945 0.112) 5.990 10.958 ( 3.964 -5.243 -1.169) 6.676 10.958 ( 3.964 5.243 -1.169) 6.676 11.168 ( 0.241 -2.887 3.900) 4.858 11.168 ( 0.241 2.887 3.900) 4.858 11.419 ( -2.079 -2.946 0.806) 3.694 11.419 ( -2.079 2.946 0.806) 3.694 11.868 ( -0.482 -1.815 -1.151) 2.203 11.868 ( -0.482 1.815 -1.151) 2.203 12.227 ( -3.561 -4.382 -0.128) 5.648 12.227 ( -3.561 4.382 -0.128) 5.648 12.729 ( -8.422 -8.744 -2.377) 12.371 12.729 ( -8.422 8.744 -2.377) 12.371 12.955 ( 1.486 -4.064 2.176) 4.844 12.955 ( 1.486 4.064 2.176) 4.844 13.265 ( 1.101 -1.426 1.085) 2.103 13.265 ( 1.101 1.426 1.085) 2.103 13.332 ( -1.591 -0.548 0.559) 1.773 13.332 ( -1.591 0.548 0.559) 1.773 13.676 ( -4.914 -1.916 -0.623) 5.311 13.676 ( -4.914 1.916 -0.623) 5.311 14.269 ( 1.584 -4.353 -1.481) 4.863 14.269 ( 1.584 4.353 -1.481) 4.863 14.526 ( -1.448 -0.664 -0.811) 1.787 14.526 ( -1.448 0.664 -0.811) 1.787 14.849 ( -3.478 -3.624 0.579) 5.056 14.849 ( -3.478 3.624 0.579) 5.056 15.453 ( 4.053 -3.343 -2.614) 5.868 15.453 ( 4.053 3.343 -2.614) 5.868 15.573 ( -4.636 -6.243 2.061) 8.044 15.573 ( -4.636 6.243 2.061) 8.044 15.875 ( -1.838 -8.543 3.504) 9.415 15.875 ( -1.838 8.543 3.504) 9.415 16.205 ( 1.121 -2.719 -4.566) 5.431 16.205 ( 1.121 2.719 -4.566) 5.431 16.600 ( 7.537 -3.434 1.053) 8.349 16.600 ( 7.537 3.434 1.053) 8.349 16.827 ( 2.874 -1.775 2.584) 4.253 16.827 ( 2.874 1.775 2.584) 4.253 16.987 ( -4.641 -2.068 -4.448) 6.753 16.987 ( -4.641 2.068 -4.448) 6.753 17.477 ( 1.522 -4.348 0.349) 4.620 17.477 ( 1.522 4.348 0.349) 4.620 17.842 ( -5.709 -2.468 -2.196) 6.596 17.842 ( -5.709 2.468 -2.196) 6.596 18.362 ( -1.397 -5.439 -3.919) 6.848 18.362 ( -1.397 5.439 -3.919) 6.848 18.885 ( -1.660 -3.652 5.911) 7.143 18.885 ( -1.660 3.652 5.911) 7.143 19.494 ( 12.610 -1.121 2.159) 12.843 19.494 ( 12.610 1.121 2.159) 12.843 20.132 ( -0.387 -3.133 0.928) 3.290 20.132 ( -0.387 3.133 0.928) 3.290 ======================= Grid point 39 (22/104) ======================= q-point: ( 0.30 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.136 ( 9.400 -9.852 1.183) 13.668 2.136 ( 9.400 9.852 1.183) 13.668 2.376 ( 6.608 -11.373 2.221) 13.340 2.376 ( 6.608 11.373 2.221) 13.340 2.734 ( 5.697 -5.150 1.393) 7.805 2.734 ( 5.697 5.150 1.393) 7.805 2.969 ( 5.714 -4.079 -2.996) 7.633 2.969 ( 5.714 4.079 -2.996) 7.633 3.118 ( 6.877 -2.815 -7.296) 10.414 3.118 ( 6.877 2.815 -7.296) 10.414 3.259 ( 0.417 -0.344 0.454) 0.706 3.259 ( 0.417 0.344 0.454) 0.706 3.464 ( 3.320 -2.943 0.280) 4.446 3.464 ( 3.320 2.943 0.280) 4.446 3.589 ( 3.983 -6.693 0.383) 7.798 3.589 ( 3.983 6.693 0.383) 7.798 3.828 ( 4.593 -9.439 8.001) 13.199 3.828 ( 4.593 9.439 8.001) 13.199 4.106 ( -2.144 -2.498 -3.879) 5.087 4.106 ( -2.144 2.498 -3.879) 5.087 4.227 ( -4.609 -0.857 -0.969) 4.787 4.227 ( -4.609 0.857 -0.969) 4.787 4.308 ( 7.832 -5.654 4.705) 10.745 4.308 ( 7.832 5.654 4.705) 10.745 4.470 ( 0.445 -4.385 -2.395) 5.016 4.470 ( 0.445 4.385 -2.395) 5.016 4.612 ( 5.035 -0.395 3.455) 6.119 4.612 ( 5.035 0.395 3.455) 6.119 4.805 ( -1.249 -3.674 -4.577) 6.000 4.805 ( -1.249 3.674 -4.577) 6.000 4.878 ( 1.780 -1.024 0.983) 2.277 4.878 ( 1.780 1.024 0.983) 2.277 5.060 ( -3.649 -1.423 -0.929) 4.025 5.060 ( -3.649 1.423 -0.929) 4.025 5.480 ( 3.219 -4.635 0.796) 5.699 5.480 ( 3.219 4.635 0.796) 5.699 5.790 ( -5.085 -1.947 1.029) 5.542 5.790 ( -5.085 1.947 1.029) 5.542 6.136 ( -5.163 -4.870 -2.554) 7.544 6.136 ( -5.163 4.870 -2.554) 7.544 6.300 ( -4.687 -1.526 3.508) 6.050 6.300 ( -4.687 1.526 3.508) 6.050 6.468 ( 2.994 -5.041 0.285) 5.870 6.468 ( 2.994 5.041 0.285) 5.870 6.958 ( 1.343 -6.218 -1.022) 6.443 6.958 ( 1.343 6.218 -1.022) 6.443 7.340 ( -0.197 -1.669 -1.803) 2.465 7.340 ( -0.197 1.669 -1.803) 2.465 8.005 ( 2.887 -1.772 -1.936) 3.901 8.005 ( 2.887 1.772 -1.936) 3.901 8.324 ( 1.263 -8.068 6.948) 10.722 8.324 ( 1.263 8.068 6.948) 10.722 8.720 ( 1.873 -8.875 -0.349) 9.077 8.720 ( 1.873 8.875 -0.349) 9.077 8.824 ( 1.657 -7.585 -3.506) 8.519 8.824 ( 1.657 7.585 -3.506) 8.519 9.289 ( 0.320 -2.302 -7.005) 7.381 9.289 ( 0.320 2.302 -7.005) 7.381 9.475 ( 0.244 -7.539 4.882) 8.985 9.475 ( 0.244 7.539 4.882) 8.985 9.701 ( -1.175 -2.055 2.237) 3.257 9.701 ( -1.175 2.055 2.237) 3.257 10.021 ( 2.064 -3.484 -2.196) 4.607 10.021 ( 2.064 3.484 -2.196) 4.607 10.126 ( -0.912 -1.466 -3.481) 3.886 10.126 ( -0.912 1.466 -3.481) 3.886 10.476 ( -6.387 -5.711 -1.090) 8.637 10.476 ( -6.387 5.711 -1.090) 8.637 10.950 ( 0.699 -4.846 -0.480) 4.919 10.950 ( 0.699 4.846 -0.480) 4.919 11.227 ( 0.754 -1.832 0.951) 2.198 11.227 ( 0.754 1.832 0.951) 2.198 11.473 ( 5.465 -3.258 4.017) 7.524 11.473 ( 5.465 3.258 4.017) 7.524 11.858 ( 0.030 -1.025 -0.030) 1.026 11.858 ( 0.030 1.025 -0.030) 1.026 12.177 ( -2.211 -4.040 0.924) 4.697 12.177 ( -2.211 4.040 0.924) 4.697 12.544 ( -9.554 -6.516 -1.278) 11.634 12.544 ( -9.554 6.516 -1.278) 11.634 12.997 ( 1.151 -2.743 0.776) 3.075 12.997 ( 1.151 2.743 0.776) 3.075 13.256 ( -2.858 -3.343 1.561) 4.667 13.256 ( -2.858 3.343 1.561) 4.667 13.345 ( 2.334 -4.432 0.916) 5.092 13.345 ( 2.334 4.432 0.916) 5.092 13.630 ( 0.118 -1.825 0.032) 1.829 13.630 ( 0.118 1.825 0.032) 1.829 14.242 ( -3.299 -3.394 -1.525) 4.972 14.242 ( -3.299 3.394 -1.525) 4.972 14.507 ( -0.136 -1.539 -2.548) 2.980 14.507 ( -0.136 1.539 -2.548) 2.980 14.800 ( -1.951 -2.325 1.365) 3.328 14.800 ( -1.951 2.325 1.365) 3.328 15.409 ( -4.754 -3.197 -2.323) 6.182 15.409 ( -4.754 3.197 -2.323) 6.182 15.584 ( 3.360 -8.518 0.983) 9.210 15.584 ( 3.360 8.518 0.983) 9.210 15.853 ( -3.843 -6.416 3.545) 8.277 15.853 ( -3.843 6.416 3.545) 8.277 16.223 ( 5.066 -4.517 -4.690) 8.250 16.223 ( 5.066 4.517 -4.690) 8.250 16.717 ( 3.616 -5.200 0.169) 6.336 16.717 ( 3.616 5.200 0.169) 6.336 16.871 ( -4.602 -2.783 -4.295) 6.882 16.871 ( -4.602 2.783 -4.295) 6.882 16.928 ( 5.624 -2.113 4.719) 7.639 16.928 ( 5.624 2.113 4.719) 7.639 17.464 ( -3.003 -4.325 -1.125) 5.385 17.464 ( -3.003 4.325 -1.125) 5.385 17.752 ( -3.477 -5.712 1.985) 6.975 17.752 ( -3.477 5.712 1.985) 6.975 18.291 ( -2.322 -9.624 -5.762) 11.455 18.291 ( -2.322 9.624 -5.762) 11.455 18.890 ( -1.593 -8.615 4.339) 9.777 18.890 ( -1.593 8.615 4.339) 9.777 19.718 ( 10.123 -0.543 1.133) 10.201 19.718 ( 10.123 0.543 1.133) 10.201 20.152 ( 1.695 -1.882 1.135) 2.775 20.152 ( 1.695 1.882 1.135) 2.775 ======================= Grid point 41 (23/104) ======================= q-point: ( 0.40 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.300 ( 6.595 -3.695 2.208) 7.876 2.300 ( 6.595 3.695 2.208) 7.876 2.481 ( 5.103 -7.688 -1.203) 9.306 2.481 ( 5.103 7.688 -1.203) 9.306 2.746 ( -3.308 -3.219 -1.197) 4.768 2.746 ( -3.308 3.219 -1.197) 4.768 2.993 ( 0.264 -0.724 -4.015) 4.088 2.993 ( 0.264 0.724 -4.015) 4.088 3.221 ( 7.550 -4.643 -2.548) 9.222 3.221 ( 7.550 4.643 -2.548) 9.222 3.341 ( 6.372 -3.295 2.906) 7.740 3.341 ( 6.372 3.295 2.906) 7.740 3.525 ( 2.876 -2.302 1.741) 4.074 3.525 ( 2.876 2.302 1.741) 4.074 3.663 ( 3.419 -3.653 0.719) 5.054 3.663 ( 3.419 3.653 0.719) 5.054 3.865 ( -4.093 -2.878 -0.354) 5.016 3.865 ( -4.093 2.878 -0.354) 5.016 4.041 ( -4.437 -3.741 -2.184) 6.201 4.041 ( -4.437 3.741 -2.184) 6.201 4.122 ( -2.643 -4.669 1.107) 5.478 4.122 ( -2.643 4.669 1.107) 5.478 4.424 ( 2.004 -3.118 -0.769) 3.785 4.424 ( 2.004 3.118 -0.769) 3.785 4.472 ( 0.804 -2.889 4.058) 5.046 4.472 ( 0.804 2.889 4.058) 5.046 4.690 ( 0.592 -0.523 1.315) 1.534 4.690 ( 0.592 0.523 1.315) 1.534 4.783 ( 1.264 -4.004 -4.210) 5.946 4.783 ( 1.264 4.004 -4.210) 5.946 4.894 ( 0.429 -4.453 -0.087) 4.474 4.894 ( 0.429 4.453 -0.087) 4.474 5.046 ( 1.316 -3.374 0.906) 3.734 5.046 ( 1.316 3.374 0.906) 3.734 5.585 ( 2.942 -6.873 0.175) 7.478 5.585 ( 2.942 6.873 0.175) 7.478 5.709 ( -0.271 -1.075 2.293) 2.547 5.709 ( -0.271 1.075 2.293) 2.547 6.030 ( -3.920 -6.170 -3.153) 7.962 6.030 ( -3.920 6.170 -3.153) 7.962 6.252 ( -3.639 -3.087 2.802) 5.534 6.252 ( -3.639 3.087 2.802) 5.534 6.542 ( 4.423 -2.589 -0.950) 5.212 6.542 ( 4.423 2.589 -0.950) 5.212 6.983 ( 1.617 -7.301 -0.895) 7.531 6.983 ( 1.617 7.301 -0.895) 7.531 7.354 ( 1.703 -2.726 0.798) 3.311 7.354 ( 1.703 2.726 0.798) 3.311 8.022 ( 0.805 -2.110 -1.208) 2.561 8.022 ( 0.805 2.110 -1.208) 2.561 8.430 ( 3.968 -8.769 7.845) 12.417 8.430 ( 3.968 8.769 7.845) 12.417 8.727 ( 0.555 -6.285 -3.456) 7.194 8.727 ( 0.555 6.285 -3.456) 7.194 8.824 ( 0.079 -6.812 -1.687) 7.018 8.824 ( 0.079 6.812 -1.687) 7.018 9.217 ( -2.681 -3.330 -5.484) 6.953 9.217 ( -2.681 3.330 -5.484) 6.953 9.451 ( -4.052 -5.335 2.283) 7.078 9.451 ( -4.052 5.335 2.283) 7.078 9.733 ( 2.020 -3.669 1.925) 4.610 9.733 ( 2.020 3.669 1.925) 4.610 10.046 ( 2.040 -6.710 -3.188) 7.704 10.046 ( 2.040 6.710 -3.188) 7.704 10.089 ( -1.270 -3.443 -0.348) 3.686 10.089 ( -1.270 3.443 -0.348) 3.686 10.332 ( -6.353 -6.972 -1.426) 9.540 10.332 ( -6.353 6.972 -1.426) 9.540 11.006 ( 3.889 -6.008 0.968) 7.223 11.006 ( 3.889 6.008 0.968) 7.223 11.230 ( -0.090 -2.758 0.341) 2.780 11.230 ( -0.090 2.758 0.341) 2.780 11.573 ( 2.054 -1.265 1.133) 2.665 11.573 ( 2.054 1.265 1.133) 2.665 11.880 ( 1.757 -0.626 1.294) 2.270 11.880 ( 1.757 0.626 1.294) 2.270 12.157 ( -1.110 -5.316 1.425) 5.615 12.157 ( -1.110 5.316 1.425) 5.615 12.388 ( -6.127 -5.842 -1.033) 8.528 12.388 ( -6.127 5.842 -1.033) 8.528 13.002 ( -0.495 -3.247 -0.080) 3.285 13.002 ( -0.495 3.247 -0.080) 3.285 13.218 ( -1.971 -2.701 1.244) 3.568 13.218 ( -1.971 2.701 1.244) 3.568 13.408 ( 3.052 -3.109 1.723) 4.685 13.408 ( 3.052 3.109 1.723) 4.685 13.656 ( 1.930 -1.781 -0.096) 2.628 13.656 ( 1.930 1.781 -0.096) 2.628 14.152 ( -4.296 -2.349 -1.886) 5.247 14.152 ( -4.296 2.349 -1.886) 5.247 14.471 ( -1.721 -1.308 -1.664) 2.728 14.471 ( -1.721 1.308 -1.664) 2.728 14.801 ( 0.524 -0.806 1.041) 1.417 14.801 ( 0.524 0.806 1.041) 1.417 15.329 ( -2.098 -2.971 -1.576) 3.964 15.329 ( -2.098 2.971 -1.576) 3.964 15.640 ( 1.849 -10.308 0.100) 10.473 15.640 ( 1.849 10.308 0.100) 10.473 15.802 ( -3.296 -5.012 2.078) 6.349 15.802 ( -3.296 5.012 2.078) 6.349 16.309 ( 6.197 -5.410 -2.054) 8.480 16.309 ( 6.197 5.410 -2.054) 8.480 16.737 ( -1.974 -3.191 2.121) 4.310 16.737 ( -1.974 3.191 2.121) 4.310 16.762 ( -2.734 -3.888 -5.401) 7.194 16.762 ( -2.734 3.888 -5.401) 7.194 17.078 ( 6.620 -1.497 4.043) 7.900 17.078 ( 6.620 1.497 4.043) 7.900 17.367 ( -5.693 -4.630 -1.723) 7.538 17.367 ( -5.693 4.630 -1.723) 7.538 17.740 ( -0.569 -7.121 3.073) 7.777 17.740 ( -0.569 7.121 3.073) 7.777 18.210 ( -1.931 -14.034 -4.662) 14.914 18.210 ( -1.931 14.034 -4.662) 14.914 18.892 ( -0.782 -11.394 2.147) 11.621 18.892 ( -0.782 11.394 2.147) 11.621 19.862 ( 5.148 -1.330 0.317) 5.326 19.862 ( 5.148 1.330 0.317) 5.326 20.199 ( 2.102 -1.506 0.982) 2.766 20.199 ( 2.102 1.506 0.982) 2.766 ======================= Grid point 43 (24/104) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 52 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.375 ( 0.000 -2.953 0.000) 2.953 2.375 ( 0.000 2.953 -0.000) 2.953 2.536 ( 0.000 -1.221 0.000) 1.221 2.536 ( 0.000 1.221 0.000) 1.221 2.687 ( -0.000 -5.449 0.000) 5.449 2.687 ( -0.000 5.449 0.000) 5.449 2.972 ( 0.000 -1.662 0.000) 1.662 2.972 ( 0.000 1.662 0.000) 1.662 3.296 ( 0.000 -3.761 0.000) 3.761 3.296 ( 0.000 3.761 0.000) 3.761 3.421 ( 0.000 -4.237 0.000) 4.237 3.421 ( -0.000 4.237 0.000) 4.237 3.580 ( -0.000 -3.302 0.000) 3.302 3.580 ( 0.000 3.302 0.000) 3.302 3.706 ( 0.000 -2.333 0.000) 2.333 3.706 ( 0.000 2.333 0.000) 2.333 3.803 ( 0.000 -3.426 -0.000) 3.426 3.803 ( -0.000 3.426 0.000) 3.426 3.938 ( 0.000 -0.159 0.000) 0.159 3.938 ( 0.000 0.159 0.000) 0.159 4.129 ( 0.000 -8.217 0.000) 8.217 4.129 ( 0.000 8.217 0.000) 8.217 4.434 ( -0.000 -2.103 0.000) 2.103 4.434 ( 0.000 2.103 0.000) 2.103 4.504 ( -0.000 -7.859 0.000) 7.859 4.504 ( 0.000 7.859 0.000) 7.859 4.686 ( 0.000 -0.619 0.000) 0.619 4.686 ( 0.000 0.619 0.000) 0.619 4.777 ( 0.000 -1.726 0.000) 1.726 4.777 ( 0.000 1.726 0.000) 1.726 4.905 ( 0.000 -4.061 -0.000) 4.061 4.905 ( 0.000 4.061 0.000) 4.061 5.066 ( 0.000 -5.145 0.000) 5.145 5.066 ( 0.000 5.145 0.000) 5.145 5.563 ( 0.000 -4.409 0.000) 4.409 5.563 ( 0.000 4.409 0.000) 4.409 5.799 ( 0.000 -0.396 0.000) 0.396 5.799 ( 0.000 0.396 0.000) 0.396 5.956 ( -0.000 -2.692 -0.000) 2.692 5.956 ( -0.000 2.692 0.000) 2.692 6.223 ( 0.000 -1.740 0.000) 1.740 6.223 ( 0.000 1.740 0.000) 1.740 6.584 ( 0.000 -1.171 0.000) 1.171 6.584 ( 0.000 1.171 0.000) 1.171 6.994 ( 0.000 -7.912 0.000) 7.912 6.994 ( 0.000 7.912 0.000) 7.912 7.379 ( 0.000 -3.187 0.000) 3.187 7.379 ( 0.000 3.187 0.000) 3.187 8.026 ( 0.000 -1.589 0.000) 1.589 8.026 ( 0.000 1.589 0.000) 1.589 8.520 ( 0.000 -8.286 0.000) 8.286 8.520 ( 0.000 8.286 0.000) 8.286 8.708 ( 0.000 -6.318 0.000) 6.318 8.708 ( 0.000 6.318 0.000) 6.318 8.809 ( 0.000 -6.981 0.000) 6.981 8.809 ( 0.000 6.981 0.000) 6.981 9.162 ( -0.000 -5.604 0.000) 5.604 9.162 ( 0.000 5.604 0.000) 5.604 9.416 ( 0.000 -3.363 0.000) 3.363 9.416 ( 0.000 3.363 0.000) 3.363 9.762 ( 0.000 -4.508 0.000) 4.508 9.762 ( 0.000 4.508 0.000) 4.508 10.038 ( 0.000 -6.784 -0.000) 6.784 10.038 ( 0.000 6.784 -0.000) 6.784 10.089 ( 0.000 -4.654 0.000) 4.654 10.089 ( 0.000 4.654 0.000) 4.654 10.266 ( 0.000 -7.288 0.000) 7.288 10.266 ( 0.000 7.288 -0.000) 7.288 11.052 ( 0.000 -7.083 0.000) 7.083 11.052 ( 0.000 7.083 0.000) 7.083 11.233 ( 0.000 -2.493 0.000) 2.493 11.233 ( 0.000 2.493 0.000) 2.493 11.584 ( 0.000 -0.269 0.000) 0.269 11.584 ( 0.000 0.269 0.000) 0.269 11.908 ( 0.000 -0.309 0.000) 0.309 11.908 ( 0.000 0.309 0.000) 0.309 12.153 ( 0.000 -6.525 0.000) 6.525 12.153 ( 0.000 6.525 0.000) 6.525 12.326 ( 0.000 -6.814 0.000) 6.814 12.326 ( 0.000 6.814 0.000) 6.814 12.995 ( 0.000 -2.151 0.000) 2.151 12.995 ( 0.000 2.151 0.000) 2.151 13.205 ( 0.000 -1.491 0.000) 1.491 13.205 ( 0.000 1.491 0.000) 1.491 13.450 ( 0.000 -0.228 0.000) 0.228 13.450 ( 0.000 0.228 0.000) 0.228 13.675 ( 0.000 -1.556 0.000) 1.556 13.675 ( 0.000 1.556 0.000) 1.556 14.099 ( 0.000 -1.833 0.000) 1.833 14.099 ( 0.000 1.833 0.000) 1.833 14.446 ( 0.000 -0.924 0.000) 0.924 14.446 ( 0.000 0.924 0.000) 0.924 14.813 ( 0.000 -0.288 0.000) 0.288 14.813 ( 0.000 0.288 0.000) 0.288 15.307 ( 0.000 -2.295 0.000) 2.295 15.307 ( 0.000 2.295 0.000) 2.295 15.654 ( 0.000 -10.124 0.000) 10.124 15.654 ( 0.000 10.124 0.000) 10.124 15.779 ( 0.000 -4.238 -0.000) 4.238 15.779 ( 0.000 4.238 -0.000) 4.238 16.372 ( 0.000 -5.870 0.000) 5.870 16.372 ( 0.000 5.870 0.000) 5.870 16.690 ( 0.000 -0.223 -0.000) 0.223 16.690 ( 0.000 0.223 0.000) 0.223 16.739 ( 0.000 -5.305 0.000) 5.305 16.739 ( 0.000 5.305 0.000) 5.305 17.187 ( 0.000 -0.699 0.000) 0.699 17.187 ( 0.000 0.699 0.000) 0.699 17.275 ( 0.000 -5.137 0.000) 5.137 17.275 ( -0.000 5.137 -0.000) 5.137 17.750 ( 0.000 -7.188 0.000) 7.188 17.750 ( 0.000 7.188 0.000) 7.188 18.173 ( 0.000 -15.590 0.000) 15.590 18.173 ( 0.000 15.590 -0.000) 15.590 18.892 ( 0.000 -12.112 0.000) 12.112 18.892 ( 0.000 12.112 0.000) 12.112 19.909 ( 0.000 -1.822 -0.000) 1.822 19.909 ( 0.000 1.822 0.000) 1.822 20.224 ( 0.000 -1.490 0.000) 1.490 20.224 ( 0.000 1.490 0.000) 1.490 ======================= Grid point 77 (25/104) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.657 ( 3.989 0.000 33.017) 33.258 0.663 ( 10.949 0.000 32.823) 34.601 1.267 ( -10.697 0.000 62.564) 63.472 2.129 ( -4.164 0.000 -13.024) 13.674 2.343 ( -3.284 0.000 -19.840) 20.110 2.464 ( -0.774 0.000 3.814) 3.891 2.680 ( 2.045 0.000 0.888) 2.230 2.884 ( 3.840 0.000 11.475) 12.101 3.080 ( -2.157 0.000 8.132) 8.413 3.141 ( -0.164 0.000 -4.155) 4.158 3.164 ( 3.258 0.000 5.769) 6.626 3.236 ( 1.592 0.000 -0.033) 1.593 3.343 ( -3.205 0.000 -0.834) 3.312 3.346 ( 6.234 0.000 1.324) 6.373 3.416 ( -3.368 0.000 -1.650) 3.750 3.438 ( 14.047 0.000 -0.908) 14.076 3.544 ( 4.789 0.000 0.459) 4.811 3.680 ( 2.006 0.000 -0.748) 2.141 3.840 ( 12.063 0.000 12.158) 17.127 3.845 ( -5.165 0.000 -6.115) 8.004 4.027 ( 1.319 0.000 -8.295) 8.399 4.177 ( -0.438 0.000 -0.441) 0.622 4.248 ( -4.992 0.000 -5.005) 7.070 4.437 ( -5.582 0.000 -4.602) 7.234 4.445 ( -0.326 0.000 -0.441) 0.549 4.527 ( -0.505 0.000 -10.337) 10.350 4.581 ( 4.092 0.000 -5.024) 6.480 4.607 ( 1.677 0.000 1.362) 2.161 4.821 ( 5.909 0.000 2.292) 6.338 4.901 ( 1.238 0.000 2.905) 3.157 4.976 ( -0.699 0.000 -6.628) 6.665 5.080 ( -0.259 0.000 -0.007) 0.259 5.129 ( -6.594 0.000 -4.022) 7.724 5.274 ( 1.112 0.000 -0.505) 1.222 5.463 ( -4.077 0.000 0.630) 4.125 5.482 ( 0.809 0.000 1.436) 1.648 5.937 ( 2.372 0.000 -5.419) 5.915 5.947 ( 1.732 0.000 0.610) 1.837 6.036 ( -2.383 0.000 2.517) 3.466 6.249 ( 3.438 0.000 5.645) 6.609 6.273 ( 3.906 0.000 3.064) 4.964 6.353 ( -2.619 0.000 5.179) 5.803 6.837 ( -0.352 0.000 -5.099) 5.111 6.954 ( 1.211 0.000 -5.055) 5.198 6.973 ( -5.550 0.000 6.165) 8.295 7.178 ( -3.927 0.000 -2.328) 4.565 7.208 ( 3.587 0.000 1.670) 3.957 7.449 ( 3.647 0.000 -5.776) 6.832 7.746 ( -1.107 0.000 2.840) 3.048 7.768 ( -7.762 0.000 -0.720) 7.795 8.153 ( -2.438 0.000 0.137) 2.442 8.181 ( 0.390 0.000 5.025) 5.040 8.513 ( -8.489 0.000 0.132) 8.491 8.570 ( -3.458 0.000 -7.399) 8.167 8.808 ( 1.770 0.000 2.176) 2.805 8.857 ( 5.981 0.000 0.569) 6.008 9.050 ( -3.880 0.000 -0.685) 3.940 9.185 ( 9.465 0.000 2.675) 9.835 9.300 ( 10.137 0.000 -2.212) 10.376 9.457 ( -4.957 0.000 -5.119) 7.126 9.620 ( -8.936 0.000 -4.015) 9.797 9.629 ( 7.317 0.000 -2.588) 7.761 9.955 ( -3.983 0.000 5.229) 6.573 9.968 ( -0.558 0.000 0.725) 0.915 10.389 ( 9.130 0.000 0.857) 9.170 10.461 ( 0.981 0.000 3.056) 3.210 10.603 ( -2.501 0.000 -1.417) 2.875 10.621 ( -3.227 0.000 7.680) 8.330 10.672 ( -32.363 0.000 -8.345) 33.421 10.966 ( -0.041 0.000 0.581) 0.583 11.075 ( 0.277 0.000 7.384) 7.389 11.285 ( 3.081 0.000 0.515) 3.124 11.512 ( -3.420 0.000 -1.981) 3.952 11.661 ( -0.928 0.000 -4.733) 4.823 11.938 ( 1.333 0.000 1.739) 2.191 12.012 ( -0.258 0.000 0.108) 0.280 12.084 ( 1.740 0.000 1.506) 2.301 12.340 ( -1.311 0.000 -3.419) 3.662 12.532 ( 1.647 0.000 3.416) 3.792 12.734 ( -1.773 0.000 4.173) 4.534 12.935 ( -1.166 0.000 -10.180) 10.247 13.246 ( 2.220 0.000 -9.237) 9.500 13.283 ( 0.407 0.000 5.704) 5.718 13.374 ( 7.887 0.000 -0.392) 7.897 13.376 ( 3.003 0.000 -0.641) 3.070 13.485 ( -3.547 0.000 0.880) 3.654 13.556 ( 16.222 0.000 1.729) 16.314 13.715 ( 0.204 0.000 -1.789) 1.801 14.033 ( 5.465 0.000 11.544) 12.772 14.463 ( -1.683 0.000 2.560) 3.064 14.639 ( -5.151 0.000 0.288) 5.159 14.797 ( 2.289 0.000 4.469) 5.021 14.805 ( -14.139 0.000 -2.388) 14.339 14.982 ( 6.403 0.000 -0.271) 6.409 15.190 ( 0.089 0.000 -3.595) 3.596 15.252 ( -4.083 0.000 -9.397) 10.246 15.678 ( -1.884 0.000 1.610) 2.478 15.818 ( 6.475 0.000 2.653) 6.998 15.860 ( -7.895 0.000 -1.649) 8.066 15.967 ( -2.792 0.000 -4.664) 5.436 15.988 ( 4.923 0.000 7.088) 8.630 16.375 ( -3.775 0.000 0.416) 3.798 16.442 ( 8.713 0.000 -4.397) 9.760 16.494 ( -19.719 0.000 -4.641) 20.257 16.709 ( -4.686 0.000 1.738) 4.998 16.718 ( 0.139 0.000 1.142) 1.150 16.898 ( 1.936 0.000 11.004) 11.173 17.051 ( 6.673 0.000 -1.002) 6.748 17.136 ( 0.806 0.000 1.035) 1.312 17.415 ( -5.844 0.000 1.303) 5.987 17.734 ( -5.361 0.000 -7.849) 9.506 17.768 ( 1.667 0.000 -7.129) 7.321 18.080 ( -4.542 0.000 8.624) 9.747 18.477 ( -0.665 0.000 -3.598) 3.659 18.957 ( 2.569 0.000 2.038) 3.279 19.145 ( -1.296 0.000 -1.835) 2.247 19.582 ( 1.986 0.000 4.209) 4.654 19.825 ( 1.991 0.000 -1.790) 2.677 19.914 ( -1.573 0.000 4.303) 4.582 20.258 ( 12.150 0.000 -3.717) 12.706 ======================= Grid point 78 (26/104) ======================= q-point: ( 0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.142 ( 21.186 0.000 27.346) 34.592 1.290 ( 20.105 0.000 32.493) 38.210 1.809 ( 25.926 0.000 41.117) 48.608 2.081 ( 10.188 0.000 -15.907) 18.890 2.202 ( 5.505 0.000 -22.546) 23.208 2.503 ( 1.026 0.000 3.257) 3.415 2.734 ( 3.359 0.000 0.301) 3.372 3.049 ( 5.370 0.000 9.872) 11.238 3.119 ( 0.798 0.000 -3.824) 3.906 3.130 ( -0.395 0.000 7.368) 7.379 3.198 ( -1.482 0.000 3.119) 3.453 3.247 ( -1.727 0.000 0.737) 1.877 3.317 ( 3.923 0.000 1.946) 4.379 3.391 ( 1.605 0.000 -1.791) 2.405 3.461 ( 5.198 0.000 -1.877) 5.527 3.613 ( 7.209 0.000 3.252) 7.908 3.650 ( -7.921 0.000 -8.693) 11.761 3.769 ( 6.722 0.000 -5.732) 8.834 3.776 ( 12.725 0.000 1.486) 12.811 3.993 ( 3.378 0.000 -6.913) 7.694 4.025 ( -1.895 0.000 5.226) 5.559 4.124 ( -3.901 0.000 -2.799) 4.801 4.286 ( 8.049 0.000 1.774) 8.242 4.299 ( -0.715 0.000 -16.402) 16.417 4.425 ( -1.551 0.000 -6.233) 6.424 4.451 ( 3.277 0.000 -1.521) 3.613 4.543 ( -3.611 0.000 -3.972) 5.368 4.673 ( 4.246 0.000 -1.619) 4.544 4.838 ( -4.256 0.000 2.270) 4.824 4.892 ( -2.681 0.000 0.104) 2.684 4.946 ( 0.411 0.000 -4.294) 4.313 5.073 ( 3.459 0.000 -3.338) 4.807 5.075 ( -1.897 0.000 2.309) 2.989 5.286 ( 0.845 0.000 -1.348) 1.591 5.391 ( -4.098 0.000 -0.327) 4.112 5.523 ( 2.570 0.000 2.407) 3.521 5.888 ( -3.111 0.000 -4.004) 5.070 5.943 ( -1.302 0.000 -0.650) 1.455 6.028 ( -0.212 0.000 1.095) 1.115 6.170 ( -12.670 0.000 2.800) 12.976 6.313 ( -1.852 0.000 9.095) 9.281 6.453 ( 5.331 0.000 0.511) 5.355 6.737 ( -5.015 0.000 -3.039) 5.864 6.821 ( -13.761 0.000 5.984) 15.006 6.898 ( -5.229 0.000 -1.067) 5.336 7.139 ( 4.420 0.000 -6.072) 7.511 7.238 ( 1.313 0.000 3.386) 3.631 7.470 ( -0.094 0.000 -1.660) 1.663 7.694 ( -1.103 0.000 2.171) 2.435 7.742 ( 0.777 0.000 -0.517) 0.933 8.155 ( 4.555 0.000 -5.745) 7.332 8.264 ( 4.211 0.000 4.787) 6.376 8.517 ( -0.554 0.000 2.039) 2.112 8.596 ( 5.535 0.000 -1.227) 5.669 8.858 ( 2.713 0.000 6.165) 6.736 8.888 ( -3.986 0.000 1.799) 4.373 9.024 ( 7.532 0.000 -9.884) 12.427 9.273 ( -5.870 0.000 -1.000) 5.954 9.393 ( 2.789 0.000 -4.040) 4.909 9.431 ( 5.244 0.000 -5.945) 7.927 9.464 ( 1.687 0.000 3.110) 3.538 9.760 ( 6.891 0.000 -1.485) 7.049 9.911 ( -3.768 0.000 3.292) 5.003 9.970 ( -0.588 0.000 1.923) 2.011 10.306 ( -6.167 0.000 -4.439) 7.598 10.416 ( -7.046 0.000 9.268) 11.642 10.511 ( -0.044 0.000 6.509) 6.509 10.532 ( -2.587 0.000 -6.000) 6.534 10.778 ( 12.597 0.000 3.223) 13.003 10.991 ( 0.892 0.000 1.647) 1.873 11.149 ( 0.807 0.000 8.360) 8.399 11.350 ( 1.440 0.000 -3.478) 3.764 11.412 ( -2.668 0.000 2.736) 3.822 11.545 ( -7.247 0.000 -5.611) 9.165 11.965 ( -3.068 0.000 0.470) 3.104 11.979 ( 1.322 0.000 1.148) 1.751 12.123 ( 0.329 0.000 2.927) 2.946 12.241 ( -5.335 0.000 -4.871) 7.224 12.640 ( 6.135 0.000 5.470) 8.219 12.670 ( -6.352 0.000 3.936) 7.473 12.894 ( 2.315 0.000 -8.653) 8.957 13.153 ( -4.894 0.000 -8.268) 9.608 13.302 ( -7.907 0.000 -3.301) 8.568 13.304 ( 0.184 0.000 -1.611) 1.621 13.452 ( 3.290 0.000 4.984) 5.972 13.457 ( -1.736 0.000 1.364) 2.208 13.693 ( 0.793 0.000 -5.059) 5.121 13.737 ( 4.348 0.000 -1.518) 4.605 14.229 ( 2.511 0.000 11.421) 11.694 14.432 ( -4.126 0.000 2.250) 4.699 14.562 ( -1.909 0.000 -4.462) 4.853 14.610 ( -6.474 0.000 9.444) 11.450 14.853 ( -0.741 0.000 7.295) 7.333 14.981 ( -3.280 0.000 -4.042) 5.205 15.113 ( -2.660 0.000 -8.609) 9.011 15.283 ( 10.462 0.000 -4.000) 11.201 15.624 ( -4.198 0.000 0.114) 4.199 15.661 ( -5.695 0.000 -2.664) 6.287 15.916 ( -0.682 0.000 4.698) 4.747 15.929 ( -0.327 0.000 -3.222) 3.238 16.130 ( 4.191 0.000 4.998) 6.522 16.195 ( -8.060 0.000 -2.609) 8.471 16.451 ( 11.871 0.000 3.012) 12.248 16.582 ( 2.834 0.000 0.062) 2.835 16.704 ( -0.327 0.000 0.379) 0.501 16.755 ( 2.829 0.000 1.743) 3.322 17.002 ( 2.593 0.000 -6.743) 7.224 17.148 ( 2.046 0.000 4.515) 4.957 17.207 ( 5.609 0.000 6.390) 8.502 17.304 ( -4.641 0.000 -3.682) 5.924 17.658 ( -0.990 0.000 -2.898) 3.062 17.762 ( 3.289 0.000 -7.537) 8.223 18.105 ( -0.670 0.000 9.071) 9.096 18.390 ( -5.531 0.000 -4.155) 6.918 19.019 ( 2.536 0.000 3.510) 4.330 19.077 ( -4.173 0.000 -3.520) 5.459 19.672 ( 5.436 0.000 3.054) 6.235 19.867 ( 3.673 0.000 -1.688) 4.043 19.939 ( 1.673 0.000 4.296) 4.610 20.256 ( -4.312 0.000 -4.497) 6.230 ======================= Grid point 79 (27/104) ======================= q-point: ( 0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.735 ( 23.681 0.000 22.062) 32.366 1.814 ( 12.644 0.000 33.361) 35.677 2.221 ( 14.698 0.000 -20.219) 24.997 2.227 ( 15.505 0.000 -12.077) 19.653 2.529 ( 4.067 0.000 5.492) 6.834 2.547 ( 22.367 0.000 8.416) 23.898 2.786 ( 2.401 0.000 -1.506) 2.834 3.042 ( -6.186 0.000 3.098) 6.919 3.098 ( -0.762 0.000 -5.764) 5.815 3.188 ( -4.072 0.000 -0.680) 4.129 3.236 ( 6.314 0.000 3.458) 7.199 3.314 ( 6.354 0.000 8.691) 10.766 3.336 ( -4.569 0.000 -11.913) 12.759 3.465 ( -2.287 0.000 0.683) 2.386 3.478 ( 10.446 0.000 6.250) 12.173 3.552 ( 4.773 0.000 -3.767) 6.080 3.746 ( 3.339 0.000 5.078) 6.077 3.798 ( 2.339 0.000 -8.377) 8.698 3.972 ( 3.011 0.000 7.311) 7.907 4.045 ( 1.905 0.000 -4.246) 4.654 4.065 ( 6.070 0.000 6.276) 8.731 4.097 ( 2.414 0.000 -4.720) 5.302 4.269 ( 12.112 0.000 -10.769) 16.207 4.303 ( -4.425 0.000 2.215) 4.949 4.390 ( -6.592 0.000 -3.006) 7.246 4.412 ( 4.694 0.000 -4.732) 6.665 4.579 ( 5.604 0.000 -1.423) 5.782 4.698 ( 2.278 0.000 -9.590) 9.856 4.771 ( -4.878 0.000 2.248) 5.371 4.848 ( -1.753 0.000 0.863) 1.954 4.925 ( -0.131 0.000 -0.513) 0.529 5.035 ( -4.449 0.000 3.317) 5.550 5.143 ( 5.245 0.000 -2.575) 5.843 5.285 ( 0.831 0.000 -4.088) 4.172 5.311 ( -3.919 0.000 1.339) 4.141 5.608 ( 4.368 0.000 2.743) 5.158 5.797 ( -4.156 0.000 -1.431) 4.396 5.878 ( -4.185 0.000 -3.058) 5.183 5.950 ( -11.272 0.000 -0.166) 11.274 6.065 ( 4.844 0.000 -1.109) 4.970 6.339 ( -0.995 0.000 6.564) 6.639 6.430 ( -7.018 0.000 -4.931) 8.577 6.624 ( -10.911 0.000 4.112) 11.661 6.636 ( -7.008 0.000 4.827) 8.509 6.823 ( -1.713 0.000 2.283) 2.854 7.204 ( 7.002 0.000 -8.601) 11.091 7.364 ( 9.176 0.000 3.936) 9.985 7.417 ( -3.695 0.000 -0.957) 3.817 7.733 ( 1.968 0.000 6.134) 6.442 7.796 ( 4.240 0.000 2.086) 4.725 8.171 ( 1.696 0.000 -6.070) 6.303 8.364 ( 1.647 0.000 6.213) 6.427 8.543 ( 1.032 0.000 1.668) 1.962 8.559 ( -4.992 0.000 -4.194) 6.520 8.844 ( -1.365 0.000 1.919) 2.355 9.011 ( 7.520 0.000 3.781) 8.417 9.087 ( 6.705 0.000 -11.876) 13.638 9.207 ( -0.849 0.000 -1.723) 1.921 9.325 ( 1.576 0.000 -5.450) 5.673 9.480 ( 4.550 0.000 -5.658) 7.261 9.632 ( 6.215 0.000 4.504) 7.676 9.835 ( 1.132 0.000 1.877) 2.192 9.876 ( -3.048 0.000 4.431) 5.378 10.003 ( 3.428 0.000 0.797) 3.520 10.184 ( -7.033 0.000 -1.894) 7.284 10.354 ( -7.364 0.000 10.233) 12.608 10.453 ( 1.010 0.000 -11.092) 11.137 10.516 ( -4.912 0.000 7.320) 8.815 11.010 ( -1.667 0.000 3.436) 3.819 11.011 ( 7.970 0.000 2.268) 8.286 11.202 ( 0.063 0.000 1.618) 1.620 11.282 ( 0.768 0.000 -2.376) 2.497 11.381 ( -5.257 0.000 -0.500) 5.281 11.512 ( 5.961 0.000 3.421) 6.873 11.914 ( -2.295 0.000 -1.730) 2.874 11.991 ( -0.290 0.000 -0.482) 0.562 12.107 ( -5.218 0.000 -3.959) 6.550 12.119 ( -3.362 0.000 2.760) 4.350 12.583 ( -7.180 0.000 5.846) 9.259 12.759 ( -0.482 0.000 -0.095) 0.492 12.889 ( 3.978 0.000 -7.587) 8.567 12.993 ( -2.885 0.000 -3.351) 4.421 13.158 ( -4.551 0.000 -0.163) 4.554 13.290 ( 0.906 0.000 -4.348) 4.441 13.453 ( 0.283 0.000 2.412) 2.428 13.527 ( -0.281 0.000 0.976) 1.016 13.644 ( -0.932 0.000 0.406) 1.017 13.813 ( 4.284 0.000 -1.700) 4.609 14.277 ( -5.762 0.000 12.596) 13.851 14.348 ( -5.729 0.000 -0.161) 5.731 14.489 ( -2.233 0.000 -5.449) 5.889 14.628 ( -0.288 0.000 6.391) 6.398 14.873 ( -1.935 0.000 5.216) 5.564 14.893 ( -2.853 0.000 -1.906) 3.431 15.060 ( 1.656 0.000 -3.827) 4.170 15.447 ( 10.041 0.000 -4.296) 10.922 15.529 ( -5.556 0.000 -1.861) 5.860 15.546 ( -3.981 0.000 -7.490) 8.483 15.855 ( -7.817 0.000 3.896) 8.734 15.917 ( 0.162 0.000 -3.169) 3.173 16.098 ( -0.030 0.000 -0.887) 0.888 16.249 ( 6.437 0.000 0.954) 6.507 16.559 ( -3.561 0.000 1.158) 3.745 16.726 ( 12.086 0.000 3.641) 12.623 16.751 ( 3.854 0.000 0.469) 3.883 16.845 ( 4.841 0.000 4.701) 6.748 16.959 ( -1.557 0.000 -4.246) 4.522 17.126 ( -7.147 0.000 4.342) 8.362 17.272 ( 3.491 0.000 -2.455) 4.268 17.353 ( 5.548 0.000 3.673) 6.654 17.592 ( -5.828 0.000 0.357) 5.839 17.754 ( 0.997 0.000 -9.068) 9.122 18.175 ( 1.941 0.000 6.468) 6.753 18.251 ( -6.114 0.000 -1.482) 6.291 18.944 ( -6.835 0.000 -5.033) 8.488 19.102 ( 3.921 0.000 2.947) 4.905 19.807 ( 6.710 0.000 2.194) 7.060 19.934 ( 5.037 0.000 -0.947) 5.126 20.045 ( 6.420 0.000 3.346) 7.240 20.128 ( -5.745 0.000 -3.625) 6.793 ======================= Grid point 80 (28/104) ======================= q-point: ( 0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.199 ( 6.491 0.000 21.348) 22.313 2.272 ( 19.242 0.000 14.625) 24.169 2.429 ( 20.496 0.000 -11.992) 23.747 2.429 ( 13.676 0.000 -6.577) 15.176 2.563 ( 2.615 0.000 2.804) 3.834 2.820 ( 4.209 0.000 -1.690) 4.536 2.840 ( 6.100 0.000 -3.950) 7.267 2.964 ( -4.180 0.000 2.270) 4.757 2.993 ( -5.456 0.000 -4.848) 7.299 3.058 ( -5.839 0.000 -5.238) 7.845 3.248 ( 1.376 0.000 -5.619) 5.785 3.356 ( 5.073 0.000 1.119) 5.195 3.436 ( -1.912 0.000 -0.331) 1.940 3.503 ( 5.613 0.000 8.844) 10.474 3.622 ( 3.707 0.000 -1.288) 3.925 3.697 ( 3.524 0.000 9.214) 9.865 3.769 ( 0.327 0.000 -3.618) 3.633 3.817 ( 2.647 0.000 1.856) 3.232 3.950 ( -3.486 0.000 -5.648) 6.637 4.007 ( -5.025 0.000 8.512) 9.885 4.171 ( -5.948 0.000 -2.325) 6.386 4.240 ( 12.323 0.000 -5.626) 13.547 4.290 ( 4.708 0.000 4.559) 6.554 4.346 ( 2.013 0.000 -5.391) 5.755 4.358 ( 6.413 0.000 5.954) 8.750 4.559 ( 11.411 0.000 -6.894) 13.332 4.604 ( -1.523 0.000 -1.755) 2.324 4.661 ( 1.284 0.000 -3.564) 3.788 4.708 ( -1.103 0.000 -0.498) 1.211 4.850 ( 4.475 0.000 -4.548) 6.380 4.927 ( -2.144 0.000 1.819) 2.812 4.989 ( -1.593 0.000 3.006) 3.403 5.133 ( -3.408 0.000 -3.215) 4.685 5.280 ( 0.398 0.000 0.022) 0.398 5.328 ( 3.846 0.000 0.085) 3.847 5.669 ( -3.614 0.000 5.003) 6.172 5.710 ( -4.860 0.000 -2.175) 5.324 5.790 ( -2.558 0.000 -2.129) 3.328 5.837 ( 1.526 0.000 0.627) 1.650 6.190 ( 9.432 0.000 -0.986) 9.483 6.221 ( -7.645 0.000 -6.871) 10.279 6.346 ( -2.952 0.000 2.341) 3.768 6.481 ( -6.104 0.000 0.970) 6.181 6.587 ( -3.868 0.000 8.907) 9.711 6.824 ( -0.735 0.000 0.208) 0.764 7.259 ( 6.904 0.000 -10.369) 12.458 7.357 ( -2.008 0.000 0.137) 2.012 7.579 ( 9.867 0.000 3.493) 10.467 7.855 ( 5.934 0.000 8.293) 10.197 7.885 ( 1.040 0.000 6.161) 6.249 8.137 ( -1.579 0.000 -3.472) 3.814 8.404 ( -1.664 0.000 5.614) 5.856 8.433 ( -4.464 0.000 -3.872) 5.910 8.571 ( 4.853 0.000 -7.577) 8.998 8.855 ( 0.861 0.000 0.589) 1.043 9.103 ( 1.313 0.000 -1.584) 2.058 9.128 ( 3.541 0.000 0.046) 3.542 9.185 ( -0.777 0.000 -2.069) 2.210 9.364 ( 4.847 0.000 -4.814) 6.831 9.500 ( 2.550 0.000 -8.060) 8.454 9.737 ( 2.415 0.000 2.812) 3.707 9.845 ( -2.586 0.000 6.352) 6.858 9.869 ( -0.951 0.000 5.182) 5.269 9.994 ( -8.204 0.000 -1.110) 8.279 10.115 ( 3.402 0.000 2.406) 4.167 10.293 ( -7.098 0.000 8.620) 11.167 10.409 ( 3.249 0.000 -11.799) 12.238 10.443 ( -7.819 0.000 5.978) 9.842 10.938 ( -7.153 0.000 1.843) 7.387 11.066 ( 0.828 0.000 -0.546) 0.992 11.221 ( 4.161 0.000 -1.865) 4.559 11.378 ( 0.438 0.000 4.823) 4.843 11.392 ( 8.045 0.000 0.648) 8.071 11.621 ( 4.045 0.000 -0.915) 4.147 11.845 ( -3.246 0.000 -3.950) 5.113 11.970 ( -0.715 0.000 -1.865) 1.997 12.015 ( -2.495 0.000 -1.564) 2.945 12.040 ( -6.853 0.000 2.512) 7.299 12.500 ( -6.641 0.000 6.254) 9.123 12.611 ( -7.056 0.000 -5.377) 8.871 12.931 ( 5.269 0.000 -4.546) 6.959 13.042 ( 2.654 0.000 2.651) 3.751 13.136 ( 0.306 0.000 2.739) 2.756 13.268 ( -0.316 0.000 -4.884) 4.894 13.450 ( -3.378 0.000 -4.327) 5.490 13.519 ( 4.484 0.000 4.276) 6.196 13.693 ( 2.554 0.000 3.241) 4.126 13.848 ( 1.275 0.000 -3.314) 3.551 14.225 ( -8.140 0.000 9.934) 12.843 14.229 ( -6.452 0.000 -1.099) 6.545 14.419 ( -1.249 0.000 -4.067) 4.255 14.637 ( -3.095 0.000 3.108) 4.387 14.871 ( 0.016 0.000 0.641) 0.641 14.879 ( 1.381 0.000 1.642) 2.145 15.093 ( 2.482 0.000 0.288) 2.499 15.365 ( -7.874 0.000 -4.719) 9.180 15.411 ( -5.030 0.000 -2.645) 5.683 15.640 ( 11.943 0.000 -3.997) 12.594 15.728 ( -9.248 0.000 5.067) 10.545 15.866 ( -1.257 0.000 -5.341) 5.487 16.157 ( 4.223 0.000 -0.316) 4.235 16.362 ( 5.548 0.000 -0.476) 5.568 16.531 ( 0.629 0.000 0.799) 1.017 16.821 ( 2.884 0.000 1.316) 3.170 16.892 ( 6.589 0.000 -0.693) 6.626 16.898 ( -2.455 0.000 -1.843) 3.070 16.929 ( -2.248 0.000 2.344) 3.247 17.090 ( 2.073 0.000 3.723) 4.261 17.340 ( 3.548 0.000 3.993) 5.341 17.455 ( 2.740 0.000 2.651) 3.812 17.458 ( -9.878 0.000 4.355) 10.795 17.632 ( -5.681 0.000 -11.403) 12.740 18.184 ( -2.210 0.000 2.014) 2.990 18.251 ( 2.339 0.000 2.811) 3.657 18.785 ( -5.724 0.000 -4.482) 7.270 19.190 ( 3.934 0.000 0.718) 3.999 19.925 ( 3.708 0.000 1.926) 4.178 20.020 ( -2.310 0.000 -3.350) 4.070 20.031 ( 5.979 0.000 -1.252) 6.109 20.189 ( 6.368 0.000 2.393) 6.803 ======================= Grid point 81 (29/104) ======================= q-point: ( 0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.340 ( -1.243 0.000 8.178) 8.272 2.576 ( 10.504 0.000 -0.424) 10.512 2.604 ( 7.245 0.000 -1.921) 7.495 2.643 ( 8.162 0.000 -5.122) 9.636 2.745 ( 7.526 0.000 4.796) 8.924 2.861 ( 5.242 0.000 -0.003) 5.242 2.866 ( -4.426 0.000 -2.847) 5.262 2.908 ( -0.909 0.000 -0.115) 0.917 2.948 ( 2.406 0.000 -0.590) 2.477 3.033 ( 7.009 0.000 5.126) 8.684 3.254 ( 2.645 0.000 -2.298) 3.503 3.376 ( -3.761 0.000 0.533) 3.798 3.430 ( 2.620 0.000 -0.705) 2.714 3.583 ( -1.697 0.000 3.059) 3.498 3.646 ( -0.404 0.000 0.874) 0.963 3.739 ( -5.392 0.000 10.658) 11.945 3.786 ( 3.287 0.000 -3.956) 5.144 3.831 ( -3.266 0.000 1.452) 3.575 3.887 ( -0.015 0.000 0.501) 0.501 3.975 ( 1.241 0.000 -0.042) 1.242 4.044 ( -7.386 0.000 2.149) 7.692 4.278 ( 1.860 0.000 -10.070) 10.241 4.351 ( 0.522 0.000 3.828) 3.864 4.384 ( -9.737 0.000 3.643) 10.396 4.431 ( 4.276 0.000 1.910) 4.683 4.625 ( 5.638 0.000 -5.958) 8.202 4.674 ( 6.525 0.000 -5.797) 8.728 4.702 ( 2.592 0.000 -2.850) 3.852 4.768 ( 10.078 0.000 0.059) 10.078 4.862 ( -4.106 0.000 1.159) 4.266 4.948 ( 1.863 0.000 4.575) 4.940 5.032 ( 7.455 0.000 -5.225) 9.104 5.051 ( -2.649 0.000 -1.530) 3.059 5.255 ( -5.345 0.000 4.166) 6.776 5.396 ( 5.113 0.000 -4.437) 6.770 5.552 ( -10.525 0.000 1.334) 10.610 5.618 ( -2.151 0.000 -0.320) 2.175 5.760 ( -0.891 0.000 1.057) 1.383 5.947 ( 7.315 0.000 0.302) 7.321 6.136 ( 1.606 0.000 -3.314) 3.683 6.267 ( -5.458 0.000 2.522) 6.012 6.324 ( 2.329 0.000 -4.517) 5.082 6.467 ( 5.718 0.000 1.592) 5.936 6.599 ( -2.222 0.000 7.540) 7.861 6.788 ( -2.036 0.000 -2.060) 2.896 7.301 ( 3.498 0.000 -5.264) 6.320 7.364 ( 4.132 0.000 -3.026) 5.121 7.714 ( 3.522 0.000 -1.273) 3.745 7.897 ( -4.721 0.000 6.568) 8.088 8.053 ( 7.032 0.000 2.510) 7.466 8.071 ( -2.357 0.000 3.120) 3.911 8.374 ( -0.478 0.000 1.756) 1.820 8.397 ( -1.648 0.000 1.542) 2.257 8.624 ( 8.072 0.000 -10.077) 12.912 8.856 ( -0.577 0.000 -2.987) 3.043 9.125 ( -2.179 0.000 -6.035) 6.417 9.141 ( 0.751 0.000 8.636) 8.669 9.148 ( -1.247 0.000 -0.850) 1.509 9.394 ( 2.325 0.000 -4.572) 5.129 9.459 ( -0.306 0.000 -6.183) 6.191 9.733 ( -5.118 0.000 4.328) 6.703 9.844 ( -7.355 0.000 6.802) 10.018 9.873 ( 0.743 0.000 2.222) 2.343 9.944 ( 4.687 0.000 3.975) 6.146 10.194 ( 2.288 0.000 2.516) 3.401 10.207 ( -8.459 0.000 5.985) 10.362 10.347 ( -5.660 0.000 2.588) 6.223 10.413 ( 6.055 0.000 -9.659) 11.400 10.854 ( -3.498 0.000 3.822) 5.182 11.090 ( 1.539 0.000 0.332) 1.575 11.294 ( 2.895 0.000 1.155) 3.117 11.409 ( 0.363 0.000 -0.231) 0.430 11.494 ( 4.538 0.000 -3.914) 5.993 11.645 ( 2.279 0.000 -5.355) 5.820 11.763 ( -1.957 0.000 -2.242) 2.976 11.894 ( -7.588 0.000 -0.100) 7.588 11.986 ( -0.307 0.000 -0.907) 0.957 11.993 ( 0.588 0.000 1.707) 1.806 12.436 ( -5.041 0.000 5.379) 7.372 12.502 ( -2.190 0.000 -1.778) 2.821 13.004 ( 4.610 0.000 -1.274) 4.782 13.083 ( 0.474 0.000 1.122) 1.218 13.153 ( -0.978 0.000 1.579) 1.858 13.194 ( -3.208 0.000 -3.837) 5.001 13.410 ( 2.889 0.000 -5.920) 6.588 13.630 ( 2.286 0.000 1.331) 2.645 13.753 ( 1.406 0.000 2.686) 3.032 13.825 ( 1.046 0.000 -3.921) 4.059 14.129 ( -4.149 0.000 2.319) 4.754 14.147 ( -7.075 0.000 7.787) 10.522 14.392 ( 0.647 0.000 -1.771) 1.886 14.577 ( -4.425 0.000 1.457) 4.659 14.901 ( 3.257 0.000 -0.368) 3.278 14.936 ( 2.823 0.000 1.272) 3.097 15.126 ( 2.083 0.000 -3.375) 3.966 15.197 ( -6.997 0.000 -3.726) 7.928 15.339 ( -2.709 0.000 2.973) 4.022 15.606 ( -8.446 0.000 6.839) 10.868 15.799 ( 2.253 0.000 0.254) 2.267 15.854 ( 8.702 0.000 -4.680) 9.881 16.194 ( 1.495 0.000 -3.344) 3.663 16.439 ( 3.553 0.000 -1.054) 3.706 16.588 ( 3.543 0.000 1.289) 3.771 16.816 ( -2.329 0.000 -2.460) 3.388 16.848 ( -3.616 0.000 -2.505) 4.399 16.913 ( 3.415 0.000 3.406) 4.823 17.017 ( 5.055 0.000 1.053) 5.163 17.127 ( 0.076 0.000 -1.712) 1.713 17.289 ( -11.667 0.000 5.209) 12.777 17.395 ( -2.921 0.000 -6.943) 7.533 17.515 ( 0.802 0.000 4.259) 4.334 17.521 ( 2.988 0.000 7.424) 8.003 18.143 ( -3.120 0.000 -2.317) 3.886 18.288 ( 0.759 0.000 -0.952) 1.218 18.712 ( -0.693 0.000 1.375) 1.540 19.241 ( 2.090 0.000 -2.511) 3.267 19.923 ( -2.036 0.000 0.732) 2.164 20.046 ( 3.679 0.000 -0.173) 3.683 20.110 ( 3.759 0.000 -2.201) 4.356 20.285 ( 2.772 0.000 0.009) 2.772 ======================= Grid point 82 (30/104) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.311 ( -7.412 0.000 4.932) 8.903 2.633 ( -2.012 0.000 -3.384) 3.937 2.635 ( -4.304 0.000 -1.517) 4.563 2.695 ( -4.375 0.000 -1.770) 4.719 2.780 ( 0.337 0.000 -0.611) 0.697 2.800 ( 5.020 0.000 -1.075) 5.133 2.865 ( -1.237 0.000 -1.725) 2.122 3.060 ( 6.611 0.000 9.378) 11.474 3.090 ( 11.654 0.000 -2.275) 11.874 3.106 ( -2.081 0.000 2.869) 3.544 3.293 ( 2.760 0.000 1.062) 2.957 3.425 ( -1.627 0.000 -3.621) 3.969 3.462 ( 6.596 0.000 10.210) 12.156 3.524 ( -4.568 0.000 -0.335) 4.581 3.654 ( 1.184 0.000 1.670) 2.047 3.668 ( -9.750 0.000 7.717) 12.434 3.757 ( -4.932 0.000 1.089) 5.051 3.770 ( -0.358 0.000 -3.772) 3.789 3.925 ( -3.661 0.000 -1.002) 3.796 3.987 ( 6.098 0.000 5.360) 8.119 4.069 ( 5.166 0.000 1.827) 5.480 4.238 ( -7.492 0.000 2.774) 7.989 4.261 ( 3.430 0.000 -7.555) 8.297 4.381 ( 0.794 0.000 2.996) 3.099 4.453 ( -1.499 0.000 1.597) 2.190 4.651 ( -2.497 0.000 -9.278) 9.609 4.661 ( 1.551 0.000 -9.666) 9.790 4.733 ( 3.527 0.000 -0.189) 3.532 4.832 ( -0.267 0.000 2.443) 2.457 4.864 ( -0.895 0.000 -4.777) 4.860 4.958 ( -3.725 0.000 5.622) 6.744 5.088 ( 4.910 0.000 4.220) 6.474 5.132 ( 5.379 0.000 -2.970) 6.145 5.169 ( -4.395 0.000 2.263) 4.943 5.409 ( -2.897 0.000 -3.125) 4.261 5.449 ( 4.305 0.000 -4.730) 6.396 5.630 ( 2.230 0.000 2.287) 3.194 5.753 ( -1.715 0.000 3.239) 3.665 6.030 ( 0.831 0.000 -0.672) 1.068 6.185 ( 4.097 0.000 1.064) 4.233 6.205 ( -2.240 0.000 -0.512) 2.298 6.258 ( -2.481 0.000 -7.554) 7.950 6.549 ( -2.478 0.000 1.860) 3.098 6.641 ( 1.556 0.000 8.311) 8.456 6.737 ( -1.540 0.000 -2.718) 3.124 7.315 ( 2.042 0.000 -5.250) 5.634 7.436 ( 5.175 0.000 -2.775) 5.872 7.696 ( -2.351 0.000 -4.679) 5.236 7.836 ( -5.691 0.000 6.082) 8.329 7.988 ( -3.404 0.000 -2.260) 4.085 8.168 ( -1.476 0.000 5.191) 5.397 8.367 ( -2.777 0.000 1.215) 3.031 8.468 ( 5.732 0.000 8.057) 9.888 8.705 ( 6.791 0.000 -9.636) 11.788 8.793 ( -2.062 0.000 -3.241) 3.841 9.021 ( -0.563 0.000 -12.543) 12.556 9.121 ( -0.944 0.000 0.672) 1.159 9.257 ( 3.811 0.000 11.405) 12.025 9.397 ( 2.062 0.000 -5.507) 5.881 9.454 ( 2.811 0.000 0.381) 2.836 9.652 ( -6.353 0.000 4.425) 7.742 9.758 ( -4.114 0.000 0.087) 4.115 9.974 ( 4.584 0.000 8.880) 9.993 10.051 ( 3.305 0.000 4.337) 5.453 10.078 ( -8.551 0.000 1.684) 8.715 10.221 ( -0.933 0.000 2.122) 2.318 10.277 ( -3.259 0.000 0.192) 3.264 10.489 ( 8.232 0.000 -6.272) 10.349 10.866 ( -0.385 0.000 8.255) 8.264 11.105 ( -0.068 0.000 0.311) 0.319 11.317 ( -1.236 0.000 -0.201) 1.252 11.364 ( -2.920 0.000 -4.209) 5.123 11.559 ( 4.027 0.000 -2.954) 4.994 11.605 ( -0.165 0.000 -10.631) 10.632 11.770 ( -4.206 0.000 0.202) 4.210 11.782 ( 4.256 0.000 1.679) 4.576 11.977 ( -0.106 0.000 -1.005) 1.011 12.014 ( 0.101 0.000 0.890) 0.896 12.394 ( -3.101 0.000 3.795) 4.900 12.502 ( 2.570 0.000 0.663) 2.654 13.050 ( 0.499 0.000 0.192) 0.535 13.072 ( -1.814 0.000 -0.425) 1.863 13.124 ( -2.388 0.000 -0.761) 2.507 13.173 ( 3.975 0.000 -1.445) 4.230 13.441 ( 4.330 0.000 -5.254) 6.808 13.551 ( -5.730 0.000 -7.611) 9.527 13.769 ( -1.947 0.000 2.095) 2.860 13.872 ( 2.296 0.000 1.487) 2.736 14.086 ( -5.667 0.000 6.812) 8.861 14.132 ( 2.023 0.000 3.995) 4.478 14.422 ( 2.683 0.000 1.899) 3.287 14.526 ( -1.103 0.000 -0.189) 1.119 14.951 ( 0.765 0.000 0.181) 0.786 14.965 ( -2.496 0.000 0.509) 2.547 15.084 ( 0.633 0.000 -5.651) 5.687 15.163 ( 7.677 0.000 -6.628) 10.143 15.318 ( -5.267 0.000 8.120) 9.679 15.551 ( -2.638 0.000 7.615) 8.059 15.812 ( 1.070 0.000 -0.246) 1.098 16.005 ( 6.245 0.000 1.271) 6.373 16.183 ( 0.944 0.000 -4.748) 4.841 16.468 ( 0.262 0.000 -1.395) 1.419 16.634 ( -0.457 0.000 3.392) 3.423 16.770 ( 0.526 0.000 -4.899) 4.927 16.777 ( -1.428 0.000 -3.998) 4.245 16.984 ( -4.012 0.000 -7.143) 8.192 17.027 ( 5.603 0.000 4.393) 7.120 17.126 ( -9.850 0.000 5.470) 11.267 17.167 ( 1.720 0.000 1.830) 2.511 17.297 ( -0.448 0.000 -4.336) 4.359 17.553 ( -0.209 0.000 5.378) 5.382 17.703 ( 6.908 0.000 12.367) 14.166 18.051 ( -2.549 0.000 -6.841) 7.301 18.260 ( -1.820 0.000 -4.448) 4.806 18.763 ( 2.533 0.000 6.127) 6.630 19.226 ( -0.557 0.000 -5.385) 5.414 19.910 ( -0.482 0.000 1.559) 1.632 20.098 ( 1.333 0.000 1.613) 2.092 20.126 ( 0.127 0.000 -3.229) 3.231 20.283 ( -1.921 0.000 -2.606) 3.238 ======================= Grid point 83 (31/104) ======================= q-point: (-0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.111 ( -18.607 0.000 4.685) 19.188 2.331 ( -23.744 0.000 -4.373) 24.144 2.558 ( -2.780 0.000 -0.251) 2.791 2.612 ( -2.498 0.000 -2.511) 3.542 2.787 ( 0.856 0.000 -0.526) 1.005 2.834 ( -0.902 0.000 -1.607) 1.842 2.947 ( 8.393 0.000 -1.972) 8.621 3.138 ( 1.910 0.000 6.556) 6.828 3.155 ( -4.107 0.000 -0.191) 4.111 3.204 ( -3.197 0.000 12.610) 13.009 3.347 ( -3.105 0.000 -5.415) 6.242 3.374 ( 3.586 0.000 2.686) 4.480 3.420 ( -5.519 0.000 -2.966) 6.266 3.555 ( -4.756 0.000 3.649) 5.994 3.562 ( -0.680 0.000 5.379) 5.422 3.684 ( -1.719 0.000 -1.050) 2.015 3.735 ( 0.512 0.000 2.649) 2.698 3.769 ( 4.979 0.000 1.363) 5.162 3.885 ( -1.841 0.000 -2.455) 3.069 4.128 ( -2.818 0.000 1.364) 3.131 4.131 ( 5.549 0.000 5.991) 8.166 4.176 ( 2.193 0.000 -1.671) 2.758 4.276 ( 1.231 0.000 -3.327) 3.548 4.382 ( -10.152 0.000 -0.666) 10.174 4.449 ( 0.741 0.000 0.633) 0.974 4.507 ( 2.146 0.000 -6.373) 6.724 4.597 ( -2.233 0.000 -6.135) 6.528 4.758 ( -6.515 0.000 -0.224) 6.519 4.759 ( -0.267 0.000 -1.366) 1.392 4.815 ( -2.575 0.000 -4.221) 4.944 4.962 ( 1.160 0.000 7.101) 7.195 5.097 ( -0.187 0.000 -1.855) 1.865 5.206 ( 3.709 0.000 2.272) 4.350 5.243 ( 4.819 0.000 1.158) 4.956 5.384 ( 1.774 0.000 -4.635) 4.963 5.489 ( 2.184 0.000 0.434) 2.227 5.687 ( 0.963 0.000 0.774) 1.236 5.763 ( 1.276 0.000 3.140) 3.390 6.013 ( -1.035 0.000 3.117) 3.285 6.126 ( -1.660 0.000 -10.224) 10.357 6.201 ( -0.091 0.000 -3.398) 3.399 6.289 ( 5.961 0.000 3.379) 6.852 6.481 ( -5.557 0.000 3.272) 6.448 6.681 ( -2.782 0.000 -3.917) 4.804 6.682 ( -3.474 0.000 7.829) 8.565 7.296 ( 2.783 0.000 -11.297) 11.634 7.478 ( -0.391 0.000 1.950) 1.989 7.594 ( -5.181 0.000 -3.314) 6.150 7.822 ( -0.425 0.000 6.076) 6.091 7.902 ( -5.713 0.000 2.422) 6.205 8.165 ( -0.379 0.000 2.901) 2.926 8.317 ( -4.110 0.000 2.833) 4.992 8.591 ( 1.914 0.000 3.063) 3.612 8.624 ( -5.852 0.000 -5.834) 8.263 8.840 ( 5.986 0.000 -3.293) 6.832 8.961 ( 3.502 0.000 -11.291) 11.822 9.128 ( 0.436 0.000 1.693) 1.748 9.369 ( 1.059 0.000 -9.656) 9.714 9.423 ( 4.082 0.000 9.341) 10.194 9.557 ( 6.589 0.000 1.338) 6.724 9.596 ( -3.120 0.000 5.998) 6.761 9.692 ( -2.964 0.000 0.174) 2.969 9.938 ( -6.832 0.000 -0.039) 6.832 10.116 ( 0.422 0.000 3.681) 3.705 10.136 ( 4.219 0.000 7.494) 8.600 10.211 ( -0.603 0.000 4.426) 4.467 10.238 ( -0.036 0.000 -1.435) 1.435 10.608 ( 8.538 0.000 -3.654) 9.287 10.931 ( -0.549 0.000 9.940) 9.955 11.113 ( 0.219 0.000 1.964) 1.976 11.214 ( -5.240 0.000 -6.711) 8.514 11.324 ( -0.736 0.000 1.158) 1.372 11.395 ( -8.241 0.000 -9.272) 12.405 11.639 ( -0.720 0.000 -5.166) 5.216 11.774 ( 6.816 0.000 -2.331) 7.204 11.911 ( 6.654 0.000 3.694) 7.611 11.968 ( 0.759 0.000 -1.603) 1.773 12.010 ( -0.565 0.000 0.144) 0.583 12.384 ( -0.301 0.000 2.592) 2.609 12.607 ( 7.838 0.000 2.259) 8.157 13.010 ( -4.470 0.000 -2.122) 4.948 13.069 ( 1.094 0.000 2.558) 2.782 13.076 ( -1.045 0.000 -1.224) 1.609 13.271 ( 6.689 0.000 -1.143) 6.786 13.395 ( -4.428 0.000 -7.024) 8.303 13.480 ( 3.279 0.000 -3.586) 4.859 13.705 ( -6.112 0.000 0.600) 6.141 13.882 ( -1.423 0.000 0.266) 1.447 14.030 ( -5.531 0.000 5.639) 7.898 14.239 ( 6.223 0.000 2.731) 6.796 14.502 ( 2.546 0.000 5.391) 5.962 14.545 ( 3.628 0.000 -1.366) 3.877 14.856 ( -6.316 0.000 -1.963) 6.614 14.927 ( -2.423 0.000 -0.580) 2.492 15.157 ( 9.914 0.000 -5.390) 11.285 15.254 ( -4.462 0.000 9.112) 10.146 15.321 ( 10.439 0.000 -6.793) 12.455 15.600 ( 0.853 0.000 7.906) 7.952 15.822 ( 0.223 0.000 -1.935) 1.948 16.050 ( -2.509 0.000 -0.328) 2.530 16.182 ( 0.824 0.000 1.914) 2.084 16.412 ( -4.550 0.000 -3.593) 5.797 16.652 ( -0.387 0.000 4.551) 4.567 16.741 ( 1.232 0.000 -5.697) 5.829 16.753 ( 0.791 0.000 -3.653) 3.737 16.881 ( -2.015 0.000 -4.467) 4.900 17.004 ( -5.968 0.000 4.986) 7.777 17.097 ( -7.243 0.000 -2.208) 7.572 17.195 ( 8.895 0.000 2.076) 9.134 17.349 ( 4.064 0.000 2.875) 4.978 17.593 ( -0.314 0.000 7.808) 7.815 17.912 ( 3.957 0.000 9.280) 10.089 17.986 ( 3.788 0.000 -5.720) 6.861 18.162 ( -4.135 0.000 -7.168) 8.275 18.870 ( 3.859 0.000 6.737) 7.764 19.149 ( -2.781 0.000 -6.954) 7.490 19.910 ( -1.274 0.000 0.957) 1.593 20.074 ( -2.997 0.000 -3.382) 4.519 20.120 ( -0.533 0.000 3.209) 3.253 20.189 ( -5.303 0.000 -3.962) 6.620 ======================= Grid point 84 (32/104) ======================= q-point: (-0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.733 ( -27.023 0.000 7.481) 28.040 1.807 ( -30.066 0.000 -3.329) 30.250 2.513 ( -3.345 0.000 0.156) 3.349 2.555 ( -2.725 0.000 0.211) 2.733 2.762 ( -5.624 0.000 -2.907) 6.331 2.795 ( -2.285 0.000 -2.093) 3.099 2.991 ( -14.734 0.000 2.085) 14.881 3.055 ( 5.457 0.000 -2.516) 6.009 3.080 ( -14.023 0.000 11.328) 18.027 3.190 ( -9.179 0.000 -6.203) 11.078 3.221 ( 1.750 0.000 4.169) 4.522 3.330 ( -4.150 0.000 -1.042) 4.279 3.403 ( -1.143 0.000 -2.472) 2.724 3.522 ( -5.674 0.000 3.780) 6.818 3.623 ( 2.582 0.000 6.659) 7.142 3.652 ( -5.297 0.000 -7.363) 9.070 3.725 ( -0.653 0.000 1.149) 1.321 3.770 ( -1.814 0.000 -1.395) 2.289 3.885 ( 4.068 0.000 2.333) 4.689 4.032 ( -9.657 0.000 -2.407) 9.952 4.141 ( 3.835 0.000 -3.884) 5.459 4.237 ( -1.025 0.000 3.884) 4.017 4.275 ( -3.828 0.000 5.374) 6.598 4.282 ( 1.874 0.000 -3.434) 3.913 4.397 ( 0.257 0.000 -4.686) 4.693 4.544 ( 1.030 0.000 -3.613) 3.757 4.577 ( 0.694 0.000 3.476) 3.545 4.669 ( -5.028 0.000 -4.581) 6.802 4.688 ( -1.170 0.000 2.141) 2.440 4.782 ( 2.865 0.000 -8.033) 8.528 5.044 ( 1.562 0.000 5.969) 6.170 5.105 ( 2.776 0.000 -2.499) 3.735 5.284 ( 0.283 0.000 6.865) 6.871 5.289 ( 1.039 0.000 -1.328) 1.686 5.399 ( 4.911 0.000 -6.896) 8.466 5.530 ( -0.762 0.000 5.977) 6.026 5.652 ( -2.078 0.000 -3.039) 3.681 5.859 ( 5.244 0.000 3.849) 6.505 6.039 ( -0.036 0.000 -10.219) 10.219 6.086 ( 3.618 0.000 8.179) 8.944 6.180 ( 2.952 0.000 -5.259) 6.031 6.416 ( -3.982 0.000 3.034) 5.006 6.427 ( 3.350 0.000 0.557) 3.396 6.590 ( 0.429 0.000 -4.710) 4.729 6.681 ( -1.464 0.000 8.623) 8.746 7.273 ( 4.493 0.000 -12.915) 13.674 7.467 ( -7.356 0.000 -0.524) 7.375 7.480 ( -1.904 0.000 6.288) 6.570 7.846 ( -4.453 0.000 8.546) 9.637 7.867 ( 0.097 0.000 3.273) 3.274 8.205 ( 3.304 0.000 -0.523) 3.345 8.261 ( -4.452 0.000 1.878) 4.832 8.495 ( -3.657 0.000 -1.235) 3.860 8.591 ( 0.371 0.000 -6.069) 6.081 8.895 ( 0.783 0.000 0.155) 0.798 8.963 ( 1.504 0.000 -2.573) 2.981 9.145 ( -0.266 0.000 1.535) 1.558 9.266 ( -2.554 0.000 -13.810) 14.044 9.471 ( -3.186 0.000 -0.113) 3.188 9.604 ( -0.441 0.000 -3.401) 3.430 9.667 ( 3.061 0.000 11.193) 11.604 9.710 ( 2.775 0.000 1.094) 2.983 9.861 ( -2.436 0.000 3.313) 4.112 10.123 ( -1.205 0.000 2.122) 2.441 10.132 ( -3.855 0.000 2.398) 4.540 10.262 ( 3.760 0.000 -2.818) 4.698 10.348 ( 5.208 0.000 9.796) 11.095 10.736 ( 7.614 0.000 -2.585) 8.041 10.971 ( -2.245 0.000 9.284) 9.551 11.087 ( -4.083 0.000 -2.845) 4.976 11.097 ( -5.513 0.000 -0.280) 5.520 11.243 ( -0.077 0.000 -4.691) 4.691 11.360 ( 4.135 0.000 1.204) 4.307 11.527 ( -5.909 0.000 -3.743) 6.995 11.895 ( 7.593 0.000 -4.632) 8.894 11.943 ( -1.300 0.000 0.179) 1.312 12.002 ( -0.282 0.000 -0.175) 0.331 12.093 ( 8.932 0.000 1.795) 9.110 12.427 ( 3.191 0.000 2.255) 3.907 12.758 ( 1.667 0.000 0.554) 1.756 12.925 ( 2.675 0.000 -3.022) 4.036 13.087 ( 2.739 0.000 0.359) 2.762 13.120 ( 1.361 0.000 4.390) 4.597 13.323 ( 0.975 0.000 -3.128) 3.277 13.368 ( 5.197 0.000 -4.100) 6.619 13.501 ( 0.688 0.000 -1.448) 1.603 13.566 ( -8.445 0.000 -1.257) 8.538 13.842 ( -2.416 0.000 -1.324) 2.755 13.971 ( -4.468 0.000 3.912) 5.938 14.376 ( 7.021 0.000 1.750) 7.236 14.562 ( -1.398 0.000 6.738) 6.881 14.613 ( 2.999 0.000 0.981) 3.155 14.761 ( -0.201 0.000 -4.509) 4.513 14.877 ( -2.610 0.000 0.279) 2.625 15.241 ( -2.382 0.000 7.570) 7.936 15.334 ( 12.991 0.000 -5.469) 14.095 15.471 ( 10.141 0.000 -7.131) 12.397 15.669 ( 0.857 0.000 5.754) 5.818 15.773 ( -2.324 0.000 -7.610) 7.956 15.958 ( -6.466 0.000 3.806) 7.503 16.225 ( 0.672 0.000 4.245) 4.298 16.270 ( -6.930 0.000 -5.359) 8.761 16.646 ( -3.674 0.000 3.354) 4.975 16.737 ( 2.267 0.000 -5.340) 5.802 16.774 ( 1.993 0.000 2.498) 3.196 16.834 ( -1.638 0.000 -1.118) 1.983 16.924 ( -8.971 0.000 -2.378) 9.281 16.974 ( -0.299 0.000 1.842) 1.866 17.384 ( 10.651 0.000 0.692) 10.673 17.436 ( 2.217 0.000 4.668) 5.168 17.657 ( -0.429 0.000 11.428) 11.436 17.900 ( -0.833 0.000 -4.302) 4.382 18.022 ( -4.718 0.000 -7.631) 8.972 18.169 ( 9.586 0.000 5.108) 10.862 18.989 ( 4.275 0.000 5.205) 6.735 19.036 ( -3.616 0.000 -7.549) 8.370 19.856 ( -5.241 0.000 -0.149) 5.243 19.979 ( -4.929 0.000 -2.394) 5.479 20.061 ( -5.193 0.000 -3.315) 6.161 20.130 ( -0.775 0.000 2.690) 2.799 ======================= Grid point 85 (33/104) ======================= q-point: (-0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.225 ( -32.663 0.000 1.727) 32.708 1.277 ( -30.856 0.000 14.280) 34.000 2.198 ( -43.893 0.000 6.797) 44.417 2.512 ( -4.277 0.000 3.089) 5.276 2.524 ( -7.330 0.000 0.528) 7.349 2.708 ( -4.623 0.000 -3.801) 5.985 2.757 ( -9.446 0.000 3.261) 9.993 2.970 ( -9.567 0.000 -8.189) 12.593 3.037 ( 0.852 0.000 2.913) 3.035 3.123 ( 4.422 0.000 -2.782) 5.225 3.238 ( -5.544 0.000 1.972) 5.884 3.244 ( -0.990 0.000 0.772) 1.255 3.330 ( -3.165 0.000 -4.550) 5.542 3.366 ( -11.007 0.000 4.688) 11.964 3.508 ( -3.205 0.000 -5.100) 6.023 3.645 ( -3.213 0.000 1.756) 3.661 3.728 ( -3.727 0.000 -5.524) 6.664 3.753 ( -0.405 0.000 -1.032) 1.109 3.934 ( 1.031 0.000 1.263) 1.630 4.004 ( 3.971 0.000 2.093) 4.488 4.099 ( -9.713 0.000 1.891) 9.896 4.143 ( 0.423 0.000 -15.195) 15.201 4.281 ( 1.698 0.000 8.264) 8.436 4.284 ( 2.888 0.000 -0.171) 2.893 4.513 ( 5.763 0.000 -0.089) 5.764 4.534 ( 0.633 0.000 -1.517) 1.644 4.566 ( -1.691 0.000 0.055) 1.692 4.575 ( -1.813 0.000 -3.077) 3.571 4.687 ( -1.209 0.000 1.805) 2.173 4.795 ( 4.201 0.000 -6.514) 7.751 5.089 ( -0.198 0.000 3.046) 3.052 5.157 ( 4.233 0.000 -1.822) 4.608 5.269 ( -6.634 0.000 1.705) 6.850 5.290 ( 0.140 0.000 -0.414) 0.437 5.433 ( 2.290 0.000 -2.494) 3.386 5.539 ( -2.076 0.000 4.065) 4.564 5.678 ( 8.939 0.000 -4.123) 9.844 5.910 ( -1.622 0.000 -0.851) 1.832 6.011 ( 4.928 0.000 -4.837) 6.905 6.192 ( -4.897 0.000 3.356) 5.937 6.202 ( 1.086 0.000 7.119) 7.201 6.338 ( -2.323 0.000 -7.814) 8.152 6.487 ( 13.676 0.000 -0.855) 13.703 6.733 ( 10.448 0.000 1.847) 10.610 6.761 ( 2.706 0.000 8.893) 9.296 7.269 ( 3.191 0.000 -8.493) 9.073 7.327 ( -8.457 0.000 2.060) 8.705 7.501 ( -0.894 0.000 4.818) 4.900 7.830 ( -4.869 0.000 -1.363) 5.056 7.859 ( -2.528 0.000 11.607) 11.879 8.194 ( -2.906 0.000 1.174) 3.134 8.231 ( 0.981 0.000 -7.964) 8.024 8.517 ( 4.302 0.000 4.039) 5.901 8.576 ( 4.241 0.000 -3.886) 5.752 8.870 ( -3.669 0.000 1.529) 3.975 8.976 ( 0.331 0.000 2.707) 2.727 9.099 ( -4.389 0.000 -13.141) 13.854 9.122 ( -3.182 0.000 -1.137) 3.379 9.360 ( -6.246 0.000 -3.941) 7.386 9.579 ( 0.131 0.000 -1.708) 1.713 9.689 ( -3.422 0.000 -5.590) 6.555 9.796 ( 1.007 0.000 9.680) 9.732 9.876 ( 0.313 0.000 5.573) 5.581 10.076 ( -3.698 0.000 0.946) 3.817 10.131 ( 1.221 0.000 1.472) 1.912 10.317 ( 4.754 0.000 -3.230) 5.748 10.495 ( 3.614 0.000 8.870) 9.578 10.828 ( 4.972 0.000 -2.847) 5.730 10.938 ( -10.264 0.000 -0.636) 10.283 11.000 ( -1.420 0.000 4.379) 4.604 11.064 ( 0.059 0.000 12.887) 12.887 11.251 ( 1.631 0.000 -4.603) 4.884 11.452 ( 0.181 0.000 1.845) 1.853 11.486 ( 8.693 0.000 0.098) 8.693 11.905 ( -2.618 0.000 -1.564) 3.049 11.956 ( 1.962 0.000 -4.007) 4.461 12.008 ( 1.778 0.000 -0.470) 1.839 12.249 ( 6.716 0.000 0.341) 6.724 12.535 ( 6.827 0.000 2.492) 7.268 12.649 ( -7.733 0.000 -0.953) 7.791 13.062 ( 10.049 0.000 -4.756) 11.118 13.164 ( 0.143 0.000 2.612) 2.616 13.178 ( 6.826 0.000 -1.526) 6.995 13.346 ( -3.389 0.000 -12.016) 12.485 13.396 ( 6.628 0.000 3.350) 7.427 13.402 ( -6.174 0.000 -1.661) 6.393 13.495 ( -2.293 0.000 2.972) 3.754 13.778 ( -3.203 0.000 -2.082) 3.821 13.935 ( -2.437 0.000 3.872) 4.575 14.501 ( 1.852 0.000 4.001) 4.408 14.563 ( 0.759 0.000 3.242) 3.330 14.657 ( 0.522 0.000 6.427) 6.448 14.814 ( 9.409 0.000 -7.224) 11.863 14.834 ( -3.467 0.000 1.803) 3.908 15.280 ( 1.598 0.000 4.755) 5.016 15.470 ( 2.168 0.000 -5.674) 6.074 15.577 ( 7.259 0.000 -6.505) 9.747 15.666 ( 1.067 0.000 -8.360) 8.428 15.701 ( -0.737 0.000 2.670) 2.770 15.936 ( 0.366 0.000 6.777) 6.787 16.102 ( -7.224 0.000 -4.755) 8.649 16.251 ( -0.406 0.000 2.220) 2.257 16.598 ( -3.220 0.000 1.937) 3.758 16.666 ( -9.814 0.000 1.951) 10.006 16.784 ( -3.261 0.000 -0.151) 3.264 16.826 ( -0.634 0.000 7.198) 7.226 16.847 ( 5.146 0.000 -6.171) 8.035 17.006 ( 2.831 0.000 0.082) 2.832 17.488 ( -0.392 0.000 4.764) 4.780 17.548 ( 4.682 0.000 -4.920) 6.792 17.716 ( 0.700 0.000 6.336) 6.374 17.852 ( -0.807 0.000 -4.945) 5.011 17.956 ( 1.066 0.000 6.862) 6.944 18.353 ( 7.752 0.000 1.726) 7.942 18.926 ( -2.110 0.000 -7.710) 7.993 19.091 ( 3.504 0.000 2.880) 4.536 19.723 ( -8.789 0.000 -0.395) 8.798 19.879 ( -4.085 0.000 -1.229) 4.266 19.969 ( -3.268 0.000 -0.913) 3.393 20.116 ( -2.141 0.000 -0.641) 2.235 ======================= Grid point 86 (34/104) ======================= q-point: (-0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.711 ( -27.830 0.000 16.450) 32.328 0.834 ( -32.272 0.000 18.162) 37.032 1.415 ( -48.561 0.000 38.401) 61.910 2.362 ( -12.085 0.000 -3.720) 12.645 2.451 ( -2.280 0.000 1.062) 2.515 2.607 ( -8.556 0.000 -9.176) 12.546 2.649 ( 0.737 0.000 -0.847) 1.123 2.787 ( -3.109 0.000 0.567) 3.160 3.068 ( -0.385 0.000 2.415) 2.445 3.157 ( -8.560 0.000 10.675) 13.683 3.170 ( 2.361 0.000 -4.741) 5.297 3.219 ( -0.636 0.000 0.069) 0.640 3.271 ( 0.962 0.000 -2.230) 2.429 3.295 ( 2.245 0.000 0.224) 2.257 3.417 ( -4.968 0.000 -2.458) 5.543 3.539 ( -8.504 0.000 -0.128) 8.505 3.649 ( -1.785 0.000 -1.271) 2.191 3.687 ( -1.656 0.000 -2.332) 2.860 3.811 ( -12.903 0.000 -16.753) 21.146 3.938 ( -2.816 0.000 0.726) 2.908 4.038 ( 1.302 0.000 -2.784) 3.073 4.167 ( 2.951 0.000 1.418) 3.274 4.336 ( -1.630 0.000 0.576) 1.728 4.398 ( 7.330 0.000 1.674) 7.519 4.520 ( -1.040 0.000 0.097) 1.044 4.523 ( 1.027 0.000 -3.263) 3.421 4.530 ( 1.018 0.000 -2.680) 2.867 4.612 ( 1.649 0.000 -2.292) 2.824 4.706 ( 1.250 0.000 5.764) 5.898 4.838 ( 3.745 0.000 -0.847) 3.840 5.084 ( -2.333 0.000 -1.542) 2.796 5.107 ( -6.121 0.000 -4.065) 7.348 5.208 ( 2.345 0.000 -2.847) 3.689 5.279 ( -0.887 0.000 -1.714) 1.930 5.460 ( 0.996 0.000 0.903) 1.344 5.518 ( -2.450 0.000 1.286) 2.767 5.848 ( 11.093 0.000 -4.953) 12.149 5.889 ( 1.615 0.000 -0.352) 1.653 6.089 ( -3.840 0.000 5.146) 6.421 6.125 ( 4.325 0.000 -0.008) 4.325 6.198 ( 0.579 0.000 -1.078) 1.224 6.346 ( 0.725 0.000 4.294) 4.355 6.747 ( 11.394 0.000 0.011) 11.394 6.894 ( 5.007 0.000 8.357) 9.742 6.906 ( 6.839 0.000 -0.116) 6.840 7.204 ( -6.562 0.000 3.686) 7.526 7.250 ( -0.908 0.000 -3.861) 3.966 7.477 ( -1.791 0.000 -4.525) 4.867 7.748 ( -2.240 0.000 1.565) 2.732 7.883 ( -4.813 0.000 7.792) 9.159 8.148 ( 0.290 0.000 -7.882) 7.887 8.171 ( -2.197 0.000 4.032) 4.592 8.648 ( 5.387 0.000 -1.472) 5.584 8.700 ( 8.044 0.000 0.394) 8.054 8.789 ( -2.773 0.000 -3.841) 4.737 8.931 ( -12.884 0.000 -13.323) 18.534 9.000 ( 0.788 0.000 1.659) 1.836 9.071 ( 6.239 0.000 6.702) 9.157 9.217 ( -5.343 0.000 -5.538) 7.696 9.559 ( -4.850 0.000 -2.985) 5.695 9.585 ( 2.100 0.000 -4.605) 5.061 9.775 ( -6.361 0.000 1.556) 6.549 9.953 ( -0.834 0.000 9.746) 9.782 10.009 ( -3.750 0.000 -0.105) 3.752 10.211 ( 8.506 0.000 -1.847) 8.704 10.390 ( 4.479 0.000 -0.101) 4.481 10.597 ( 1.581 0.000 4.748) 5.004 10.740 ( -11.596 0.000 3.337) 12.066 10.892 ( 3.540 0.000 -1.538) 3.859 11.005 ( -0.395 0.000 3.834) 3.854 11.220 ( 1.758 0.000 2.776) 3.286 11.248 ( 1.716 0.000 -2.430) 2.975 11.515 ( 2.824 0.000 1.548) 3.221 11.648 ( 6.777 0.000 0.451) 6.792 11.854 ( 1.539 0.000 5.385) 5.600 11.935 ( -1.138 0.000 -0.930) 1.470 12.045 ( 2.233 0.000 -0.380) 2.265 12.329 ( 3.123 0.000 -2.195) 3.817 12.538 ( -3.924 0.000 0.997) 4.049 12.684 ( 6.777 0.000 -0.344) 6.785 13.103 ( -6.461 0.000 -9.027) 11.101 13.181 ( -3.274 0.000 -5.368) 6.287 13.196 ( 9.031 0.000 -7.007) 11.430 13.282 ( 6.339 0.000 -2.125) 6.685 13.284 ( -5.191 0.000 5.683) 7.697 13.475 ( -3.287 0.000 5.946) 6.794 13.523 ( 1.301 0.000 3.140) 3.399 13.717 ( -0.662 0.000 -1.663) 1.790 13.942 ( -0.544 0.000 6.157) 6.181 14.482 ( -3.358 0.000 3.856) 5.113 14.669 ( 4.164 0.000 2.959) 5.109 14.767 ( -4.460 0.000 1.589) 4.735 14.768 ( 6.055 0.000 7.911) 9.962 14.940 ( 9.027 0.000 -9.772) 13.303 15.329 ( -8.758 0.000 -6.047) 10.642 15.331 ( 1.282 0.000 -2.714) 3.002 15.652 ( 4.456 0.000 -2.640) 5.180 15.711 ( 1.523 0.000 3.138) 3.488 15.747 ( 9.325 0.000 0.499) 9.339 15.965 ( -4.415 0.000 -1.189) 4.573 16.025 ( 2.650 0.000 2.216) 3.455 16.268 ( 3.641 0.000 0.002) 3.641 16.496 ( -9.885 0.000 3.001) 10.330 16.571 ( -1.032 0.000 2.744) 2.931 16.732 ( -2.282 0.000 0.555) 2.348 16.851 ( -3.124 0.000 9.689) 10.180 16.935 ( 7.830 0.000 -4.395) 8.979 17.065 ( 3.267 0.000 -1.565) 3.622 17.345 ( -17.559 0.000 -17.864) 25.049 17.484 ( -3.543 0.000 3.762) 5.168 17.803 ( -0.135 0.000 -6.100) 6.102 17.821 ( 5.499 0.000 -4.596) 7.166 18.126 ( 3.128 0.000 9.681) 10.174 18.464 ( 4.152 0.000 -1.532) 4.426 18.878 ( 2.944 0.000 -2.922) 4.148 19.149 ( 1.446 0.000 0.400) 1.500 19.564 ( -7.769 0.000 4.366) 8.912 19.826 ( -0.996 0.000 -0.976) 1.394 19.925 ( -2.184 0.000 2.007) 2.966 20.062 ( -0.838 0.000 2.066) 2.230 ======================= Grid point 87 (35/104) ======================= q-point: ( 0.00 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.842 ( -1.954 23.355 18.741) 30.008 0.976 ( 2.871 21.571 26.744) 34.479 1.577 ( -3.435 28.465 47.181) 55.209 2.137 ( -1.990 1.431 -12.693) 12.928 2.377 ( -4.435 1.995 -15.912) 16.638 2.447 ( -0.322 -2.361 3.881) 4.554 2.659 ( 3.025 -3.590 -0.386) 4.711 2.798 ( 3.132 -7.297 9.967) 12.743 2.863 ( -0.611 -14.645 6.785) 16.152 3.027 ( 3.367 -6.734 5.455) 9.298 3.163 ( 0.437 -0.627 -6.363) 6.409 3.268 ( -0.144 -3.304 0.828) 3.409 3.292 ( -4.401 -0.631 -0.944) 4.545 3.356 ( -0.890 1.513 0.036) 1.756 3.458 ( 1.987 -3.830 1.292) 4.504 3.518 ( -0.465 7.796 0.872) 7.858 3.610 ( 7.133 3.857 -6.107) 10.151 3.716 ( 5.454 4.075 -2.384) 7.214 3.841 ( 5.944 0.779 9.760) 11.454 3.879 ( -3.614 1.728 -8.031) 8.974 4.097 ( -1.301 1.937 -5.450) 5.929 4.129 ( -3.004 -3.682 -5.336) 7.145 4.156 ( 0.345 -2.297 0.969) 2.516 4.407 ( 0.326 -2.578 -1.430) 2.966 4.512 ( -0.367 1.407 -5.070) 5.274 4.552 ( -0.087 -0.549 1.524) 1.623 4.567 ( -0.840 0.572 -6.118) 6.202 4.573 ( 2.202 -1.755 -1.679) 3.278 4.757 ( -0.384 -0.742 6.415) 6.469 4.826 ( 2.039 -5.100 4.259) 6.951 4.976 ( -0.761 -0.308 -5.408) 5.470 5.079 ( -1.219 -1.893 -1.604) 2.764 5.218 ( 0.490 4.245 -3.205) 5.341 5.289 ( -4.696 2.653 -3.267) 6.306 5.494 ( 4.769 2.537 2.144) 5.811 5.543 ( -2.342 3.774 0.597) 4.481 5.890 ( 1.920 -1.091 -2.080) 3.034 5.949 ( 1.524 -3.902 -0.879) 4.280 6.052 ( -3.511 2.351 0.910) 4.322 6.259 ( 4.745 1.928 3.660) 6.295 6.319 ( 0.831 1.662 -0.583) 1.947 6.428 ( 0.844 7.293 3.453) 8.113 6.762 ( 1.047 -3.874 -4.706) 6.185 6.801 ( -2.726 -9.655 1.666) 10.170 6.994 ( -0.240 -2.006 1.341) 2.425 7.152 ( -4.202 -1.203 2.579) 5.075 7.263 ( 0.871 4.990 1.473) 5.275 7.483 ( 0.067 1.304 -4.882) 5.054 7.794 ( -7.356 2.325 0.235) 7.719 7.904 ( 5.286 8.927 -9.527) 14.086 8.077 ( -1.510 -4.890 0.219) 5.122 8.201 ( 2.633 -0.292 0.410) 2.681 8.506 ( -4.469 0.738 2.424) 5.137 8.632 ( -3.293 4.766 -5.734) 8.151 8.740 ( -0.355 -1.647 -1.366) 2.169 8.928 ( 6.375 0.421 -4.184) 7.636 9.034 ( -0.094 -1.641 4.548) 4.836 9.111 ( 9.254 -4.021 -1.925) 10.271 9.311 ( 2.221 0.466 -0.696) 2.373 9.424 ( -5.511 -3.537 -3.993) 7.670 9.614 ( 0.943 1.115 -3.595) 3.880 9.688 ( -1.066 2.721 -2.320) 3.731 9.994 ( 0.612 4.055 5.315) 6.713 10.025 ( -2.788 4.551 1.884) 5.660 10.364 ( 4.010 -2.159 0.978) 4.659 10.445 ( 1.318 -1.381 2.334) 3.015 10.508 ( -5.975 -3.988 3.309) 7.909 10.598 ( -2.512 -0.780 -0.771) 2.741 10.723 ( -14.608 -1.424 2.299) 14.856 10.912 ( 1.314 -6.502 2.846) 7.219 11.086 ( 0.221 4.127 5.404) 6.803 11.299 ( 1.915 1.150 0.719) 2.347 11.508 ( -1.984 -0.788 -1.405) 2.556 11.625 ( -0.430 -3.336 -3.441) 4.812 11.847 ( 0.207 -2.497 1.941) 3.170 12.028 ( -0.256 -4.200 -4.100) 5.875 12.116 ( 0.212 4.500 3.457) 5.679 12.434 ( -0.877 7.181 -5.644) 9.176 12.579 ( -2.208 2.126 1.220) 3.299 12.727 ( 1.409 1.933 6.259) 6.700 12.904 ( -0.333 -3.302 -9.931) 10.471 13.246 ( 4.071 -3.647 3.255) 6.361 13.252 ( -0.038 0.413 -6.424) 6.438 13.309 ( 3.810 -1.227 5.316) 6.654 13.325 ( 1.440 -3.544 0.121) 3.827 13.504 ( -2.946 0.876 0.964) 3.221 13.677 ( 4.074 6.481 -4.711) 8.988 13.740 ( 1.001 2.100 -1.956) 3.039 14.057 ( 2.054 2.695 9.782) 10.352 14.390 ( -2.223 -5.567 2.410) 6.461 14.593 ( -4.719 -0.602 3.677) 6.013 14.761 ( -3.037 -1.592 3.337) 4.785 14.858 ( -1.355 0.999 -1.113) 2.018 14.971 ( 4.780 -1.070 0.285) 4.906 15.209 ( 0.253 1.840 -3.960) 4.374 15.273 ( -2.883 1.560 -10.828) 11.314 15.669 ( 4.070 -2.375 2.139) 5.175 15.727 ( -0.051 -4.474 5.830) 7.349 15.871 ( -0.772 0.471 -1.485) 1.739 15.958 ( 1.727 1.198 -4.945) 5.373 16.063 ( 0.320 4.258 5.380) 6.868 16.368 ( -4.918 -0.489 -0.709) 4.993 16.403 ( 6.606 -5.354 -2.452) 8.850 16.599 ( -4.435 -1.319 -4.126) 6.200 16.711 ( -12.905 3.077 -3.262) 13.662 16.736 ( 6.213 2.423 -0.502) 6.688 17.019 ( -2.432 9.118 3.988) 10.245 17.097 ( 0.311 1.961 -2.142) 2.921 17.192 ( 2.380 3.633 -6.329) 7.676 17.486 ( 1.942 5.214 -1.967) 5.901 17.697 ( -6.689 2.665 -6.912) 9.981 17.860 ( -0.445 5.351 -6.555) 8.473 18.128 ( -5.398 5.205 6.045) 9.632 18.466 ( -0.106 -1.030 -3.284) 3.443 18.938 ( 4.468 -2.883 2.934) 6.073 19.100 ( -0.911 -4.255 0.258) 4.359 19.390 ( 9.176 -18.987 15.654) 26.264 19.523 ( -0.366 -11.416 4.606) 12.315 19.976 ( -1.427 6.080 5.143) 8.091 20.308 ( 3.120 0.204 -2.086) 3.759 ======================= Grid point 88 (36/104) ======================= q-point: ( 0.10 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.192 ( 17.288 7.910 23.361) 30.120 1.418 ( 18.750 12.682 28.529) 36.418 2.051 ( 18.632 19.517 29.616) 40.065 2.134 ( 12.556 6.023 -13.026) 19.069 2.247 ( 5.516 4.045 -17.525) 18.813 2.496 ( 1.790 -0.567 3.781) 4.222 2.713 ( 2.875 -2.371 -0.507) 3.761 2.923 ( 2.574 -13.120 5.968) 14.641 2.953 ( 6.304 -10.762 6.159) 13.910 3.109 ( 0.138 -4.391 2.637) 5.124 3.189 ( 5.034 -3.227 1.410) 6.144 3.220 ( -1.539 0.736 -0.481) 1.772 3.289 ( -1.273 0.658 -0.314) 1.467 3.382 ( 4.738 -3.646 2.666) 6.546 3.554 ( 3.586 7.596 -1.416) 8.518 3.574 ( 3.803 -3.206 2.550) 5.590 3.633 ( -0.920 -2.971 -0.842) 3.222 3.694 ( -0.265 -3.427 -10.084) 10.654 3.851 ( 8.757 3.989 -2.553) 9.955 4.018 ( 1.423 1.120 -1.167) 2.154 4.047 ( 0.471 3.757 -2.959) 4.805 4.092 ( 3.813 -3.574 -1.748) 5.511 4.187 ( 4.741 -3.555 -0.104) 5.927 4.361 ( -2.341 2.640 -9.801) 10.417 4.458 ( -0.631 1.229 -3.241) 3.524 4.469 ( 0.053 1.975 -2.549) 3.226 4.567 ( -1.887 1.750 -3.484) 4.331 4.637 ( 4.390 -3.195 0.765) 5.484 4.776 ( -2.846 -3.062 4.991) 6.511 4.878 ( -0.329 -3.701 3.818) 5.327 4.929 ( -0.181 -1.177 -5.291) 5.424 5.023 ( -1.781 -2.327 -1.732) 3.404 5.126 ( -5.203 2.058 -2.456) 6.110 5.275 ( 0.292 1.147 1.777) 2.135 5.455 ( -4.596 4.730 -1.516) 6.767 5.612 ( 4.855 4.579 0.844) 6.727 5.862 ( -3.492 -2.320 -3.607) 5.531 5.926 ( -1.607 -2.442 -0.132) 2.926 6.033 ( 0.231 1.993 1.300) 2.391 6.222 ( -9.346 3.792 -0.806) 10.118 6.329 ( -1.300 1.172 4.195) 4.546 6.483 ( 1.351 2.910 4.457) 5.491 6.703 ( -3.246 -2.365 -1.865) 4.428 6.749 ( -6.669 -4.819 -1.608) 8.384 6.907 ( -6.550 -1.654 0.854) 6.809 7.072 ( -3.284 -1.704 2.527) 4.480 7.329 ( 4.353 4.344 1.826) 6.414 7.455 ( -0.059 -0.202 -4.547) 4.551 7.710 ( -3.396 0.791 2.013) 4.026 7.817 ( -0.825 4.810 -3.798) 6.184 8.165 ( 7.117 1.079 -4.490) 8.484 8.280 ( 5.084 1.427 2.892) 6.020 8.549 ( 1.811 3.131 -2.262) 4.266 8.596 ( 1.456 -0.089 -0.196) 1.472 8.740 ( 0.360 -5.004 2.055) 5.421 8.984 ( 6.706 -3.903 -8.651) 11.621 9.033 ( -0.951 6.946 3.094) 7.663 9.259 ( -1.506 -0.380 -0.451) 1.617 9.294 ( 1.490 -5.582 -4.898) 7.574 9.399 ( 7.553 -2.349 2.362) 8.255 9.561 ( 0.192 5.212 -4.945) 7.187 9.760 ( 6.295 -0.466 -0.959) 6.385 9.944 ( -4.825 3.141 1.898) 6.062 10.031 ( -2.951 5.090 3.816) 7.012 10.299 ( -4.556 -0.510 -3.203) 5.592 10.386 ( -7.573 -3.192 8.778) 12.025 10.501 ( -0.937 -0.973 3.507) 3.758 10.549 ( -0.282 1.474 -3.523) 3.830 10.777 ( 9.855 -0.634 2.513) 10.190 10.977 ( 4.222 -2.143 3.034) 5.623 11.140 ( 0.273 0.640 6.973) 7.008 11.345 ( 1.190 -0.857 -1.053) 1.805 11.416 ( -4.989 0.649 0.207) 5.035 11.527 ( -5.616 -1.417 -4.070) 7.079 11.884 ( 1.056 -3.970 2.041) 4.587 11.983 ( -1.408 -3.467 -3.134) 4.880 12.132 ( -1.636 2.899 3.051) 4.515 12.325 ( -5.295 6.274 -3.379) 8.878 12.601 ( 0.407 -1.964 3.318) 3.877 12.745 ( -0.295 5.900 5.338) 7.962 12.877 ( 2.544 -1.859 -7.884) 8.490 13.146 ( -5.854 -0.643 -8.222) 10.114 13.255 ( -3.394 -3.099 -0.944) 4.692 13.299 ( -0.382 -1.304 -0.907) 1.634 13.442 ( 1.953 -0.495 3.721) 4.232 13.478 ( -0.281 -1.083 2.136) 2.411 13.653 ( -1.246 0.108 -0.769) 1.468 13.740 ( 0.073 -0.273 -2.407) 2.424 14.180 ( 2.280 -2.168 9.167) 9.692 14.385 ( -1.109 -3.738 1.848) 4.315 14.548 ( -2.368 1.098 1.138) 2.848 14.657 ( -6.301 0.333 2.523) 6.795 14.858 ( -2.661 0.559 5.093) 5.773 14.978 ( -2.048 -0.810 -2.316) 3.196 15.166 ( 0.360 4.211 -9.734) 10.612 15.297 ( 9.978 1.136 -3.582) 10.662 15.613 ( -10.310 -0.339 0.047) 10.316 15.739 ( 0.860 4.065 -0.478) 4.182 15.859 ( 1.001 -5.273 3.032) 6.165 15.935 ( -0.559 2.275 -5.973) 6.416 16.147 ( -0.690 2.538 4.344) 5.078 16.290 ( -5.741 3.699 -3.309) 7.589 16.426 ( 4.918 -1.897 1.705) 5.541 16.521 ( 5.360 -2.338 0.960) 5.926 16.684 ( 2.892 -0.276 0.825) 3.020 16.825 ( 3.019 3.012 0.736) 4.328 16.995 ( 0.045 -0.231 -5.119) 5.124 17.110 ( -3.518 -1.840 6.752) 7.832 17.232 ( 5.503 3.495 -2.975) 7.166 17.497 ( -0.440 14.702 -1.382) 14.773 17.596 ( 0.160 -4.147 -3.528) 5.447 17.826 ( 0.635 4.241 -5.263) 6.789 18.128 ( -1.241 2.676 6.799) 7.411 18.402 ( -4.141 1.149 -3.300) 5.418 19.006 ( 1.759 -1.821 2.220) 3.367 19.051 ( -3.182 -2.254 -1.815) 4.301 19.557 ( 6.049 -9.205 1.435) 11.108 19.686 ( 9.702 -16.057 3.724) 19.127 19.993 ( -0.584 5.818 5.201) 7.825 20.275 ( -3.974 0.159 -2.188) 4.539 ======================= Grid point 89 (37/104) ======================= q-point: ( 0.20 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.698 ( 19.327 -0.381 22.254) 29.478 1.933 ( 14.600 9.792 26.434) 31.746 2.217 ( 11.067 0.573 -12.321) 16.572 2.320 ( 17.078 7.650 -16.134) 24.708 2.520 ( 3.896 -1.873 0.413) 4.342 2.661 ( 15.112 9.097 7.873) 19.316 2.751 ( 3.711 -2.540 -0.229) 4.503 2.978 ( 1.566 -5.870 -0.517) 6.097 3.091 ( -0.061 -0.017 -0.270) 0.277 3.151 ( 5.403 -10.773 3.092) 12.442 3.180 ( -4.316 -2.845 -0.417) 5.186 3.260 ( 1.579 2.125 0.173) 2.653 3.302 ( 3.027 -2.024 2.377) 4.349 3.468 ( -0.658 0.416 -0.474) 0.912 3.500 ( 5.397 0.381 1.838) 5.714 3.626 ( 4.394 4.063 -1.394) 6.145 3.698 ( 1.764 -7.579 -0.610) 7.805 3.754 ( 6.522 1.964 4.919) 8.402 3.984 ( 8.054 0.730 -4.298) 9.158 4.070 ( 2.480 1.849 -0.088) 3.095 4.085 ( 2.847 1.034 -1.564) 3.409 4.126 ( 2.068 4.052 1.545) 4.805 4.280 ( 3.790 0.620 -5.401) 6.627 4.288 ( 6.563 -3.052 -3.710) 8.133 4.403 ( -2.689 0.422 -0.637) 2.795 4.453 ( -0.566 4.952 -4.134) 6.476 4.571 ( 4.644 -0.541 -1.046) 4.791 4.689 ( 2.508 -0.554 -8.265) 8.655 4.725 ( -4.036 -3.143 2.783) 5.823 4.854 ( -2.495 -1.050 1.076) 2.913 4.907 ( -1.027 -2.167 -0.354) 2.424 5.007 ( -2.432 -0.469 2.441) 3.477 5.058 ( 1.661 -7.736 -1.395) 8.035 5.271 ( -3.895 0.066 4.622) 6.044 5.355 ( -3.163 4.054 -4.894) 7.098 5.698 ( 4.250 3.144 0.312) 5.295 5.762 ( -4.591 -2.702 -0.313) 5.336 5.890 ( -2.939 0.541 -0.463) 3.024 5.989 ( -8.632 5.845 -4.113) 11.207 6.097 ( 2.845 2.466 -0.589) 3.811 6.316 ( -1.740 -1.725 0.992) 2.643 6.457 ( -8.150 2.179 0.389) 8.445 6.573 ( -9.622 -4.882 3.634) 11.385 6.641 ( -4.747 1.035 4.534) 6.645 6.824 ( -1.255 -1.149 -1.717) 2.418 7.103 ( 4.150 -5.638 -1.275) 7.116 7.379 ( -2.241 -2.926 0.793) 3.770 7.479 ( 7.254 6.773 -0.242) 9.927 7.688 ( 0.370 -1.387 2.680) 3.041 7.879 ( 5.685 4.705 2.719) 7.864 8.207 ( 1.266 2.903 -3.929) 5.047 8.393 ( 3.359 3.159 4.471) 6.423 8.534 ( -2.646 -1.471 -1.644) 3.445 8.572 ( -0.450 2.227 -3.035) 3.791 8.773 ( 2.315 -4.662 -1.082) 5.316 9.031 ( 1.466 -3.981 -4.931) 6.505 9.083 ( 5.228 2.766 -1.552) 6.115 9.206 ( 3.145 0.950 -4.276) 5.392 9.337 ( 2.237 1.775 0.981) 3.019 9.522 ( 4.335 1.611 -4.341) 6.343 9.599 ( 5.796 -1.205 1.004) 6.004 9.847 ( 1.873 0.646 2.072) 2.867 9.879 ( -3.782 0.858 2.299) 4.508 10.018 ( 1.361 0.781 -0.451) 1.632 10.185 ( -7.438 -0.272 -0.708) 7.476 10.321 ( -6.684 -3.253 9.280) 11.890 10.481 ( 0.448 1.617 -4.641) 4.935 10.527 ( -4.023 2.164 2.713) 5.313 10.920 ( 3.348 -4.038 2.161) 5.673 11.111 ( 2.901 4.962 3.729) 6.852 11.158 ( -0.425 -4.156 -0.366) 4.194 11.304 ( 1.317 2.134 -1.343) 2.844 11.345 ( -3.755 -2.835 2.257) 5.218 11.512 ( 4.262 -0.514 1.678) 4.609 11.889 ( -1.087 -2.050 -0.914) 2.494 11.940 ( -1.176 -4.199 -1.809) 4.721 12.091 ( -3.671 2.299 0.480) 4.358 12.236 ( -3.907 6.233 0.360) 7.365 12.569 ( -6.184 -0.923 4.684) 7.812 12.787 ( -4.468 2.171 -1.747) 5.266 12.871 ( 3.526 -1.272 -5.530) 6.681 12.994 ( -0.589 0.224 -1.922) 2.023 13.185 ( -2.813 2.409 -0.322) 3.718 13.275 ( 0.691 -1.002 -3.317) 3.533 13.461 ( -0.381 -1.057 0.862) 1.416 13.504 ( -1.509 -1.516 1.694) 2.728 13.620 ( -0.840 -1.573 1.009) 2.049 13.762 ( 2.584 -4.440 0.652) 5.179 14.241 ( -2.352 -2.165 6.973) 7.671 14.347 ( -4.051 -0.601 0.587) 4.137 14.489 ( -3.180 0.307 -2.789) 4.241 14.620 ( -1.813 -1.011 5.226) 5.623 14.830 ( -2.821 -1.141 3.468) 4.614 14.920 ( -2.098 -0.424 -1.944) 2.892 15.149 ( 2.551 7.782 -4.213) 9.210 15.440 ( -7.259 -2.317 -1.760) 7.820 15.450 ( 8.196 -0.144 -4.087) 9.160 15.672 ( -4.887 4.505 -3.874) 7.693 15.864 ( -1.505 3.142 -5.284) 6.329 15.954 ( 3.584 -0.783 5.691) 6.771 16.048 ( -6.508 -0.569 -2.219) 6.899 16.280 ( 4.107 0.418 -0.532) 4.162 16.507 ( 0.983 -3.020 1.655) 3.582 16.704 ( 9.385 -1.203 3.334) 10.032 16.747 ( 4.202 0.026 0.179) 4.206 16.888 ( 1.118 2.640 3.222) 4.313 16.959 ( 1.396 -0.266 -3.354) 3.643 17.073 ( -4.558 -3.543 4.174) 7.124 17.306 ( 3.443 3.592 -0.026) 4.975 17.491 ( 0.374 9.809 1.295) 9.901 17.572 ( -2.643 -0.040 -0.807) 2.764 17.790 ( -0.540 2.977 -6.579) 7.241 18.134 ( -2.939 -2.139 1.725) 4.023 18.324 ( -1.491 5.233 1.874) 5.755 18.916 ( -6.848 -2.683 -4.666) 8.711 19.089 ( 3.388 -1.426 2.416) 4.398 19.701 ( 8.684 -7.887 0.452) 11.740 19.855 ( 7.651 -11.210 -0.570) 13.584 20.033 ( 1.030 4.083 3.933) 5.762 20.190 ( -2.416 2.287 -1.221) 3.543 ======================= Grid point 90 (38/104) ======================= q-point: ( 0.30 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.174 ( 16.374 -4.772 18.350) 25.052 2.240 ( 5.894 1.892 9.268) 11.145 2.407 ( 11.713 -2.249 -3.341) 12.386 2.517 ( 14.888 6.209 -12.048) 20.134 2.600 ( 4.640 2.698 5.408) 7.620 2.756 ( 5.850 -2.198 -3.837) 7.334 2.885 ( 4.753 -0.845 -2.625) 5.496 2.952 ( -3.010 -2.022 -3.688) 5.172 3.053 ( -2.757 6.729 1.925) 7.522 3.067 ( -1.914 2.716 -4.962) 5.971 3.198 ( 1.015 -4.625 -3.462) 5.866 3.322 ( 3.321 -1.959 0.949) 3.971 3.387 ( 3.340 -4.534 4.588) 7.263 3.556 ( 3.119 2.861 5.103) 6.630 3.625 ( 5.754 0.364 0.817) 5.823 3.692 ( 2.714 -1.337 1.983) 3.617 3.726 ( 0.550 -0.229 1.731) 1.830 3.869 ( 1.264 3.821 2.826) 4.917 3.956 ( -3.495 1.362 -4.238) 5.660 4.066 ( -4.719 2.918 4.722) 7.285 4.177 ( 2.136 2.401 -3.836) 5.004 4.232 ( 1.535 -2.217 -1.503) 3.087 4.279 ( 10.253 0.434 3.179) 10.743 4.370 ( 2.149 1.050 -1.365) 2.754 4.390 ( 0.596 2.429 -1.403) 2.868 4.542 ( 9.472 -0.584 -5.642) 11.041 4.607 ( 1.229 -0.715 -2.348) 2.745 4.659 ( 3.317 0.717 -1.912) 3.896 4.715 ( 0.078 0.198 -0.277) 0.350 4.834 ( 1.538 -2.604 -1.661) 3.451 4.881 ( -1.088 -2.295 0.230) 2.550 4.988 ( -0.329 0.011 1.979) 2.006 5.118 ( 2.091 -4.909 -0.799) 5.395 5.199 ( -5.174 -5.906 3.636) 8.653 5.312 ( 1.812 2.521 -3.334) 4.556 5.703 ( -2.784 -0.337 -0.223) 2.813 5.762 ( 0.401 2.041 0.198) 2.090 5.808 ( -5.242 1.428 -0.749) 5.485 5.826 ( -3.193 2.476 -0.357) 4.056 6.192 ( -3.481 -1.286 -4.230) 5.627 6.229 ( 6.114 2.499 -2.493) 7.060 6.347 ( -4.153 0.063 2.363) 4.779 6.459 ( -4.710 -2.130 1.008) 5.267 6.603 ( -4.099 1.035 7.869) 8.933 6.817 ( 0.847 -0.736 -2.895) 3.105 7.170 ( 6.140 -7.219 -5.802) 11.112 7.343 ( -2.187 -0.156 2.438) 3.279 7.616 ( 4.199 -1.625 5.034) 6.754 7.780 ( 6.954 1.629 3.130) 7.798 7.998 ( 3.665 4.370 4.702) 7.391 8.172 ( -2.112 3.274 -2.339) 4.544 8.447 ( -0.877 2.784 -2.551) 3.876 8.456 ( -1.258 4.203 1.733) 4.717 8.579 ( 4.079 1.109 -5.637) 7.046 8.804 ( 2.086 -3.880 -1.703) 4.723 8.997 ( -0.636 -6.838 -2.541) 7.322 9.148 ( 2.070 0.625 -0.920) 2.350 9.256 ( 2.232 3.505 -1.164) 4.316 9.388 ( 3.239 3.151 -1.901) 4.903 9.542 ( 2.104 2.553 -5.881) 6.748 9.694 ( 1.690 -3.295 3.149) 4.861 9.853 ( -0.342 -0.384 3.109) 3.151 9.861 ( -2.852 0.869 6.262) 6.936 9.985 ( -5.871 -0.430 -3.901) 7.062 10.122 ( 3.288 -0.555 1.233) 3.555 10.273 ( -5.836 -2.251 7.896) 10.073 10.418 ( -6.706 1.048 -1.866) 7.039 10.462 ( -1.465 1.867 -0.743) 2.487 10.915 ( -4.821 -1.527 2.084) 5.469 11.091 ( 0.720 1.494 -1.173) 2.031 11.180 ( 2.822 -3.124 -0.680) 4.265 11.355 ( 0.231 -2.058 3.971) 4.479 11.429 ( 7.901 2.953 1.230) 8.524 11.595 ( 3.616 -2.254 -1.842) 4.642 11.843 ( -2.073 -0.188 -2.739) 3.440 11.919 ( -0.401 -3.343 0.199) 3.373 12.027 ( -3.433 3.153 -0.486) 4.686 12.157 ( -5.298 7.633 0.352) 9.298 12.478 ( -6.545 -2.260 4.081) 8.037 12.604 ( -7.702 -0.648 -3.862) 8.641 12.921 ( 4.496 -0.424 -2.440) 5.133 13.061 ( 3.032 1.291 1.744) 3.728 13.161 ( -0.726 2.632 1.578) 3.153 13.273 ( 0.129 0.066 -3.597) 3.599 13.415 ( -2.443 -3.275 -3.709) 5.518 13.498 ( 2.097 -1.980 3.175) 4.289 13.667 ( 2.656 -2.269 2.604) 4.357 13.803 ( 1.414 -4.503 -0.616) 4.760 14.197 ( -5.968 -1.516 3.777) 7.224 14.256 ( -6.759 1.723 2.405) 7.378 14.423 ( -1.376 0.363 -3.409) 3.694 14.615 ( -2.992 -2.361 3.239) 5.002 14.830 ( 0.321 -1.617 3.081) 3.495 14.887 ( 0.104 -0.731 -1.405) 1.587 15.181 ( 2.518 8.081 -0.280) 8.468 15.293 ( -6.385 -3.381 -2.916) 7.791 15.458 ( -4.661 0.884 -3.947) 6.171 15.672 ( 7.203 3.076 -0.588) 7.854 15.794 ( -3.664 4.952 -1.289) 6.293 15.881 ( -4.842 1.522 -3.741) 6.305 16.115 ( 5.997 -3.265 2.181) 7.168 16.357 ( 4.477 -1.491 -0.206) 4.723 16.530 ( 1.703 0.895 -0.618) 2.021 16.780 ( 1.914 -2.563 1.823) 3.682 16.859 ( -1.435 -2.312 -1.812) 3.270 16.884 ( 3.105 -1.018 -0.823) 3.369 16.976 ( 0.097 2.417 2.237) 3.295 17.092 ( 3.440 -0.021 4.374) 5.565 17.354 ( 0.264 1.441 3.360) 3.666 17.453 ( -6.085 -0.120 -0.457) 6.103 17.551 ( -0.135 7.952 5.965) 9.941 17.682 ( -4.361 5.814 -10.013) 12.373 18.084 ( -2.503 -5.979 1.411) 6.633 18.368 ( 2.577 7.024 3.331) 8.190 18.751 ( -6.559 -3.014 -4.878) 8.712 19.162 ( 3.202 -3.064 0.136) 4.434 19.854 ( 7.069 -5.467 0.244) 8.940 19.935 ( 1.937 -7.215 -1.607) 7.641 20.078 ( 3.202 3.294 0.256) 4.601 20.210 ( 3.493 0.933 1.380) 3.870 ======================= Grid point 91 (39/104) ======================= q-point: ( 0.40 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.344 ( -0.061 0.229 5.694) 5.699 2.518 ( 10.354 -5.414 7.323) 13.789 2.536 ( 6.947 -6.396 -2.786) 9.846 2.646 ( 0.067 -0.006 -0.320) 0.327 2.679 ( 7.620 -1.240 -3.546) 8.496 2.816 ( -4.902 -3.485 -2.717) 6.600 2.906 ( 7.875 4.391 1.513) 9.143 2.955 ( 0.570 -1.269 -0.284) 1.420 3.064 ( 5.649 9.926 -4.451) 12.258 3.126 ( 6.253 9.812 5.982) 13.082 3.201 ( 3.017 -4.808 -0.156) 5.678 3.341 ( -1.675 -0.689 -0.464) 1.869 3.457 ( 2.127 -0.092 1.098) 2.395 3.597 ( -1.800 -0.137 2.239) 2.876 3.659 ( -0.796 3.249 0.111) 3.347 3.753 ( 3.404 -0.812 1.302) 3.734 3.766 ( -3.007 0.871 7.786) 8.392 3.869 ( 1.315 0.479 -1.695) 2.198 3.886 ( -2.384 1.660 0.515) 2.951 3.999 ( -2.610 2.083 -1.938) 3.861 4.078 ( -7.516 2.722 3.058) 8.558 4.261 ( -0.377 0.424 -4.654) 4.688 4.332 ( -2.643 -2.994 1.416) 4.238 4.384 ( -0.747 1.175 0.206) 1.408 4.443 ( 1.363 0.060 3.243) 3.518 4.634 ( 6.912 0.951 -4.971) 8.567 4.658 ( 4.543 -1.081 -5.379) 7.123 4.707 ( 2.207 -0.170 -3.177) 3.872 4.776 ( 6.884 0.214 -0.940) 6.951 4.833 ( -1.106 -2.672 3.186) 4.302 4.915 ( 0.575 -3.312 2.689) 4.304 5.014 ( 1.339 -0.352 -1.089) 1.762 5.094 ( 2.182 1.271 -3.369) 4.211 5.166 ( -3.657 -5.880 2.419) 7.335 5.360 ( 4.678 -1.870 -2.868) 5.797 5.617 ( -7.368 4.067 -1.505) 8.550 5.655 ( -3.647 3.202 1.170) 4.992 5.766 ( -1.312 1.179 0.054) 1.764 5.907 ( 6.716 -3.336 1.898) 7.735 6.102 ( -0.072 -3.048 -4.507) 5.442 6.274 ( -4.173 -0.147 1.510) 4.440 6.337 ( 0.328 0.671 -3.110) 3.199 6.477 ( 7.189 1.016 1.750) 7.469 6.596 ( -2.276 -0.815 5.012) 5.564 6.798 ( -0.669 1.554 -1.971) 2.597 7.241 ( 7.070 -7.503 -8.228) 13.190 7.341 ( -0.949 1.130 4.937) 5.153 7.679 ( -1.202 -5.888 4.290) 7.383 7.905 ( 2.668 4.145 1.494) 5.151 8.065 ( 0.824 0.736 -1.659) 1.993 8.139 ( 0.769 4.463 2.618) 5.231 8.410 ( 0.845 3.666 -0.523) 3.798 8.472 ( -1.172 7.689 3.968) 8.732 8.629 ( 7.554 0.385 -10.473) 12.919 8.808 ( 0.094 -3.879 -4.117) 5.657 8.995 ( 0.217 -7.627 2.686) 8.089 9.151 ( -0.444 -0.399 0.915) 1.093 9.241 ( -2.477 5.400 -2.287) 6.366 9.402 ( 0.331 2.331 -2.470) 3.412 9.523 ( 0.314 2.282 -3.292) 4.018 9.694 ( -3.897 -2.246 4.409) 6.298 9.829 ( -5.705 -1.924 5.663) 8.265 9.895 ( 0.731 2.042 1.094) 2.429 9.935 ( 4.684 0.314 1.911) 5.068 10.195 ( -7.313 -1.346 4.509) 8.696 10.208 ( 1.980 0.290 2.974) 3.585 10.294 ( -4.747 -3.222 0.275) 5.743 10.442 ( 1.630 1.153 -4.197) 4.648 10.866 ( -1.966 1.611 3.670) 4.464 11.117 ( 1.721 2.409 0.193) 2.967 11.250 ( 3.110 -3.920 1.276) 5.164 11.369 ( -0.515 -3.487 0.049) 3.526 11.525 ( 3.525 2.278 -3.898) 5.728 11.619 ( 2.118 -2.624 -3.314) 4.728 11.782 ( -1.446 2.077 -4.116) 4.831 11.903 ( -3.539 -0.715 0.284) 3.622 11.976 ( -0.670 3.498 -0.028) 3.561 12.084 ( -2.116 6.006 0.185) 6.371 12.410 ( -4.022 -3.034 3.599) 6.192 12.494 ( -3.220 -0.794 -0.304) 3.331 12.991 ( 3.822 -0.998 -0.100) 3.952 13.088 ( -0.847 -0.089 0.230) 0.882 13.157 ( -0.896 0.651 0.573) 1.247 13.199 ( -2.886 0.611 -3.087) 4.270 13.407 ( 3.223 -0.205 -5.040) 5.986 13.571 ( 1.569 -5.247 1.672) 5.726 13.728 ( 2.334 -2.583 1.587) 3.826 13.803 ( 0.533 -2.526 -2.469) 3.573 14.127 ( -4.502 -0.693 5.775) 7.355 14.159 ( -5.712 1.748 3.916) 7.143 14.394 ( 0.632 0.237 -2.285) 2.382 14.558 ( -4.357 -2.203 1.128) 5.011 14.866 ( 0.979 -3.643 1.836) 4.196 14.914 ( 3.171 0.069 0.324) 3.188 15.164 ( -3.312 -0.423 -5.786) 6.680 15.233 ( 1.276 7.217 1.576) 7.497 15.359 ( -3.212 1.341 -0.563) 3.526 15.667 ( -8.397 5.298 5.794) 11.496 15.805 ( 0.798 0.251 -1.130) 1.406 15.863 ( 9.473 -0.109 -5.425) 10.917 16.188 ( 1.182 0.149 -0.177) 1.204 16.446 ( 4.859 -0.300 0.845) 4.941 16.559 ( 2.099 -0.992 -1.418) 2.720 16.801 ( -2.418 -2.517 -1.605) 3.841 16.825 ( -2.396 -2.019 -0.225) 3.141 16.866 ( 2.843 -2.070 1.479) 3.815 17.073 ( 5.133 3.633 1.275) 6.417 17.147 ( 0.469 1.428 -0.061) 1.504 17.281 ( -10.421 -0.517 4.749) 11.463 17.387 ( -1.872 -0.524 -3.589) 4.081 17.529 ( -1.642 3.244 -1.482) 3.927 17.647 ( 2.309 10.516 7.621) 13.191 18.044 ( -2.478 -7.052 -1.906) 7.714 18.417 ( 0.663 9.836 -0.966) 9.906 18.653 ( -1.487 -6.038 0.899) 6.283 19.197 ( 1.613 -4.617 -2.875) 5.673 19.906 ( -0.453 -1.619 0.604) 1.786 19.985 ( 4.407 -4.635 -0.864) 6.454 20.142 ( 3.290 1.966 -1.147) 4.001 20.275 ( 2.140 -1.051 0.020) 2.385 ======================= Grid point 92 (40/104) ======================= q-point: (-0.50 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.330 ( -5.551 1.597 4.200) 7.142 2.541 ( -8.408 -4.735 -1.005) 9.702 2.599 ( -1.272 -6.555 -2.461) 7.117 2.678 ( -0.272 -1.887 1.866) 2.667 2.699 ( 2.530 -2.116 0.141) 3.301 2.838 ( 7.542 0.825 -3.412) 8.319 2.961 ( -0.270 4.977 2.171) 5.437 3.059 ( 4.594 -0.249 7.352) 8.673 3.120 ( -4.900 3.614 0.969) 6.165 3.178 ( 6.867 7.594 -2.399) 10.515 3.273 ( 2.194 -1.259 1.656) 3.024 3.398 ( 4.597 -1.280 2.239) 5.271 3.469 ( -1.567 1.088 -1.453) 2.398 3.553 ( -3.140 -2.066 2.142) 4.326 3.658 ( -0.671 4.818 1.428) 5.069 3.722 ( -4.760 2.821 6.866) 8.818 3.768 ( -3.055 2.164 0.642) 3.799 3.811 ( -2.542 2.454 -2.060) 4.090 3.928 ( -5.084 0.837 -1.418) 5.344 3.977 ( 6.103 -0.920 3.539) 7.114 4.054 ( 5.452 -2.753 0.742) 6.153 4.234 ( -2.783 2.784 4.346) 5.863 4.285 ( 0.996 0.352 -3.667) 3.816 4.381 ( -0.060 0.699 0.124) 0.712 4.453 ( -1.401 -0.726 2.468) 2.929 4.631 ( -1.623 -0.663 -8.273) 8.457 4.676 ( -0.135 0.703 -7.840) 7.872 4.737 ( 2.804 -0.145 -1.062) 3.002 4.801 ( 0.325 -2.697 2.218) 3.507 4.875 ( 1.316 -0.228 -4.493) 4.687 4.915 ( -3.032 -4.545 4.687) 7.198 5.046 ( -0.792 -2.674 2.776) 3.935 5.082 ( -2.066 -5.708 2.719) 6.652 5.176 ( 6.489 2.455 -4.362) 8.195 5.382 ( -0.127 -1.444 -3.428) 3.722 5.531 ( 1.384 5.802 -1.542) 6.160 5.663 ( 1.914 2.823 1.186) 3.611 5.753 ( -1.657 0.334 3.183) 3.604 5.969 ( -0.899 -4.267 -0.352) 4.375 6.122 ( 3.837 -4.626 -1.457) 6.185 6.221 ( -1.760 0.448 -1.676) 2.471 6.282 ( -1.428 0.214 -4.605) 4.826 6.557 ( -2.715 0.644 1.406) 3.124 6.623 ( 1.849 -1.285 4.524) 5.054 6.777 ( -0.605 3.827 -0.065) 3.875 7.283 ( 3.738 -5.263 -9.339) 11.353 7.386 ( 1.534 -1.620 6.386) 6.764 7.634 ( -5.702 -5.551 1.744) 8.146 7.903 ( -1.650 5.989 -0.795) 6.262 8.028 ( -1.255 3.318 -3.658) 5.096 8.164 ( -2.318 -0.228 3.649) 4.329 8.436 ( -2.057 5.759 1.279) 6.248 8.513 ( 3.641 4.409 4.892) 7.525 8.670 ( 3.183 -3.023 -9.070) 10.076 8.783 ( 3.046 -0.216 -4.448) 5.396 8.997 ( 0.487 -4.095 -4.633) 6.202 9.149 ( -2.757 5.052 -0.696) 5.797 9.228 ( 4.041 -2.483 6.443) 8.000 9.421 ( 3.219 2.361 0.184) 3.996 9.511 ( 0.220 1.986 -1.373) 2.425 9.638 ( -5.052 0.178 3.761) 6.301 9.765 ( -3.088 0.020 -0.415) 3.116 9.972 ( 2.940 0.500 7.079) 7.681 10.032 ( 1.658 -2.288 1.808) 3.355 10.079 ( -4.074 1.537 4.215) 6.060 10.228 ( -2.688 -0.667 1.624) 3.211 10.254 ( -0.766 -1.612 0.924) 2.010 10.479 ( 5.806 -1.420 -3.941) 7.159 10.891 ( -0.247 2.573 7.452) 7.888 11.131 ( -0.167 2.473 0.054) 2.479 11.269 ( -1.820 -4.436 -0.971) 4.892 11.335 ( -1.986 -2.478 -1.955) 3.729 11.565 ( 4.257 0.076 -3.895) 5.770 11.597 ( -1.822 -1.139 -6.546) 6.890 11.752 ( 0.833 1.025 -2.657) 2.968 11.842 ( -0.024 2.898 -1.135) 3.112 11.975 ( -0.372 1.840 0.634) 1.981 12.073 ( 0.143 4.477 -0.010) 4.480 12.376 ( -2.617 -2.236 3.342) 4.798 12.482 ( 2.093 -1.928 0.608) 2.909 13.016 ( -1.266 -2.343 0.047) 2.664 13.081 ( 0.596 -0.033 0.512) 0.787 13.129 ( -2.030 0.625 -1.097) 2.391 13.183 ( 3.057 0.963 -1.538) 3.555 13.421 ( 1.690 -1.916 -5.177) 5.773 13.524 ( -3.290 -2.515 -5.558) 6.931 13.750 ( -1.925 -2.095 1.624) 3.276 13.820 ( 0.798 -4.183 1.085) 4.395 14.103 ( -3.459 1.235 6.641) 7.589 14.148 ( 1.461 1.455 4.435) 4.891 14.424 ( 3.311 0.057 0.964) 3.449 14.503 ( -1.074 -2.243 -0.544) 2.546 14.879 ( -0.446 -4.585 -0.313) 4.617 14.962 ( -1.220 -1.141 3.020) 3.451 15.099 ( 2.216 2.555 -5.798) 6.712 15.266 ( 5.002 8.444 -5.736) 11.368 15.329 ( -3.569 0.783 6.324) 7.304 15.588 ( -3.932 3.443 5.735) 7.760 15.817 ( 1.562 0.230 -0.470) 1.647 15.984 ( 5.537 -4.424 -3.909) 8.094 16.185 ( -0.923 2.689 1.389) 3.164 16.513 ( 1.288 3.814 0.082) 4.027 16.590 ( 1.570 -3.458 0.953) 3.916 16.730 ( -1.985 -3.090 -3.639) 5.171 16.783 ( -0.675 0.060 -1.754) 1.880 16.984 ( 5.368 -3.199 4.856) 7.914 17.046 ( -4.088 4.399 -6.007) 8.494 17.131 ( -8.153 0.665 3.746) 8.997 17.183 ( 0.209 1.146 1.290) 1.738 17.328 ( 1.246 2.780 -3.916) 4.961 17.547 ( 0.831 -0.070 4.193) 4.275 17.785 ( 4.850 8.062 11.538) 14.888 17.970 ( -2.072 -6.399 -5.756) 8.853 18.371 ( -2.409 9.345 -5.647) 11.181 18.703 ( 2.818 -6.166 6.373) 9.304 19.178 ( -0.307 -5.018 -5.502) 7.453 19.903 ( -0.643 -0.650 1.185) 1.497 20.031 ( 0.858 -4.355 -0.446) 4.461 20.167 ( 0.390 1.899 -1.073) 2.216 20.271 ( -1.714 -1.183 -2.262) 3.075 ======================= Grid point 93 (41/104) ======================= q-point: (-0.40 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.168 ( -17.103 5.745 4.889) 18.693 2.275 ( -17.814 -3.882 -2.159) 18.360 2.560 ( -1.994 -4.975 -2.328) 5.844 2.613 ( -3.882 2.801 -0.133) 4.789 2.769 ( 2.440 -2.792 0.837) 3.801 2.869 ( -4.691 5.768 -5.941) 9.516 2.966 ( 5.538 0.971 -0.036) 5.622 3.097 ( 0.059 -1.924 6.341) 6.627 3.185 ( -1.577 -0.799 9.649) 9.810 3.228 ( -3.043 5.997 2.220) 7.082 3.333 ( -0.040 -3.359 0.930) 3.486 3.373 ( -3.550 1.185 -2.087) 4.285 3.410 ( -1.202 -2.604 -0.806) 2.979 3.531 ( -1.444 -3.458 0.575) 3.791 3.601 ( -4.983 4.184 3.147) 7.228 3.658 ( -5.042 0.709 1.805) 5.402 3.755 ( -1.281 2.015 -0.069) 2.389 3.828 ( 2.742 2.358 0.327) 3.631 3.875 ( 2.534 1.637 -1.068) 3.201 4.081 ( -0.676 -0.664 2.813) 2.969 4.157 ( 4.466 -1.724 -1.479) 5.011 4.238 ( 3.788 4.079 2.556) 6.125 4.307 ( -1.224 1.774 -0.483) 2.209 4.386 ( -4.643 1.571 1.328) 5.078 4.416 ( 1.222 -1.738 -3.914) 4.454 4.539 ( -0.046 2.608 -2.423) 3.560 4.593 ( -3.334 -0.318 -5.383) 6.339 4.734 ( -3.659 -1.073 -0.640) 3.867 4.761 ( -3.426 -2.392 -3.165) 5.242 4.815 ( -2.957 0.367 -2.406) 3.830 4.949 ( 0.848 -0.150 6.353) 6.411 5.003 ( 1.666 -6.617 -1.185) 6.926 5.140 ( 1.960 -5.604 1.731) 6.184 5.234 ( 0.721 -4.979 -0.632) 5.071 5.391 ( 4.851 4.404 -2.509) 7.016 5.581 ( 2.989 6.327 -0.261) 7.002 5.693 ( -0.635 0.012 0.035) 0.636 5.733 ( -0.908 -3.204 0.602) 3.384 5.981 ( 2.533 -1.600 4.988) 5.819 6.123 ( 0.074 -0.260 -8.377) 8.382 6.211 ( 0.090 0.084 -3.490) 3.492 6.266 ( 4.196 -2.302 1.406) 4.988 6.486 ( -5.751 0.638 2.339) 6.242 6.631 ( -2.788 -1.972 1.460) 3.714 6.759 ( -2.825 4.605 1.633) 5.644 7.256 ( 1.628 -4.725 -9.467) 10.705 7.458 ( 0.648 -1.641 5.869) 6.128 7.524 ( -6.673 -4.412 1.075) 8.071 7.878 ( -0.265 4.973 0.117) 4.982 7.974 ( -3.563 5.690 1.527) 6.885 8.149 ( -0.837 -1.610 2.420) 3.024 8.385 ( -4.247 6.799 2.278) 8.334 8.522 ( -1.514 -5.237 -7.155) 8.995 8.672 ( -0.336 2.772 1.406) 3.126 8.836 ( 4.799 0.349 -5.272) 7.138 8.985 ( 2.631 0.193 -4.508) 5.223 9.126 ( 0.726 2.126 -0.679) 2.347 9.369 ( 4.949 -1.312 1.801) 5.427 9.447 ( -0.965 2.439 0.633) 2.699 9.557 ( 2.547 -0.550 -0.166) 2.611 9.592 ( -0.151 0.521 5.505) 5.532 9.712 ( -2.047 0.925 -1.359) 2.625 9.943 ( -4.695 1.066 1.682) 5.099 10.091 ( 2.146 -1.560 4.690) 5.389 10.154 ( -0.178 0.716 4.116) 4.182 10.218 ( 3.741 0.475 2.008) 4.273 10.236 ( -1.312 0.356 2.538) 2.879 10.581 ( 7.714 -2.700 -2.644) 8.590 10.941 ( -1.339 1.017 9.338) 9.488 11.134 ( -0.269 1.771 1.210) 2.162 11.188 ( -3.303 -2.655 -3.836) 5.716 11.293 ( -1.664 -2.245 0.210) 2.802 11.417 ( -7.991 1.873 -8.897) 12.104 11.614 ( -0.475 -2.463 -4.636) 5.271 11.770 ( 4.760 -0.291 -3.219) 5.753 11.904 ( 4.996 -0.862 0.694) 5.117 11.974 ( 0.050 2.407 0.596) 2.481 12.087 ( 2.137 5.705 -0.257) 6.098 12.369 ( -0.063 -1.664 2.217) 2.773 12.583 ( 7.890 -2.588 1.967) 8.534 12.995 ( -1.987 -1.423 0.985) 2.635 13.043 ( -3.141 -0.055 -1.902) 3.673 13.122 ( 1.868 2.015 0.076) 2.749 13.263 ( 5.379 -0.722 -1.246) 5.569 13.357 ( -2.639 -3.162 -5.205) 6.637 13.478 ( 1.561 -0.816 -3.691) 4.090 13.684 ( -5.959 -1.862 0.310) 6.251 13.807 ( -3.162 -5.238 2.243) 6.516 14.089 ( -2.564 3.910 3.839) 6.050 14.248 ( 5.791 0.769 3.158) 6.641 14.499 ( 2.538 -0.509 2.879) 3.871 14.534 ( 3.989 -1.137 0.613) 4.193 14.838 ( -2.681 -1.805 -2.338) 3.989 14.920 ( -3.861 -1.381 2.122) 4.617 15.153 ( 6.494 1.852 -3.995) 7.846 15.303 ( -3.135 3.473 7.255) 8.633 15.358 ( 9.465 4.170 -8.169) 13.180 15.606 ( 0.323 0.815 6.348) 6.409 15.830 ( 0.405 -0.633 -4.028) 4.098 15.993 ( -0.714 -5.494 -2.201) 5.961 16.190 ( -1.450 2.240 5.054) 5.715 16.476 ( -5.019 4.725 -1.520) 7.058 16.611 ( -0.058 -2.884 0.921) 3.028 16.722 ( 2.853 -1.629 -1.758) 3.726 16.773 ( 1.072 2.448 -1.695) 3.165 16.925 ( -4.020 2.955 -3.766) 6.251 16.995 ( -5.570 -1.028 2.815) 6.325 17.096 ( -4.809 -0.913 -0.247) 4.901 17.202 ( 7.889 1.616 1.714) 8.233 17.376 ( 3.452 3.012 0.586) 4.618 17.605 ( 1.279 0.412 6.662) 6.796 17.895 ( -1.123 -4.345 -3.862) 5.921 17.981 ( 7.493 4.184 8.508) 12.085 18.265 ( -3.864 8.658 -7.624) 12.166 18.816 ( 4.137 -5.515 6.493) 9.470 19.110 ( -2.032 -4.266 -7.226) 8.633 19.886 ( -2.443 -2.150 0.364) 3.274 20.004 ( -3.303 -5.207 -0.966) 6.241 20.142 ( -2.984 1.192 -0.090) 3.215 20.200 ( -2.901 0.528 -2.288) 3.732 ======================= Grid point 94 (42/104) ======================= q-point: (-0.30 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.804 ( -25.754 7.059 6.349) 27.448 1.878 ( -24.351 7.018 -1.154) 25.369 2.505 ( -2.465 -4.334 0.041) 4.987 2.555 ( -3.279 2.304 -0.202) 4.012 2.735 ( -5.961 -0.402 -4.938) 7.751 2.809 ( 0.888 -1.679 1.016) 2.154 3.007 ( -13.387 0.785 1.624) 13.508 3.043 ( -3.535 0.392 -0.802) 3.646 3.104 ( -6.624 2.179 7.502) 10.243 3.169 ( -9.828 -2.009 -5.871) 11.623 3.211 ( -4.694 0.813 4.926) 6.853 3.312 ( -2.865 -1.449 -1.217) 3.433 3.432 ( -4.275 2.358 -2.390) 5.436 3.508 ( 2.871 -5.734 1.570) 6.603 3.529 ( -9.227 -1.187 5.192) 10.653 3.649 ( 3.334 -3.208 1.708) 4.932 3.735 ( -0.934 2.301 -0.272) 2.499 3.804 ( -3.193 3.534 -2.657) 5.454 3.917 ( 0.893 -0.806 -1.914) 2.261 4.050 ( -2.307 3.801 3.799) 5.848 4.117 ( -2.475 2.168 -4.352) 5.456 4.258 ( 0.925 -1.516 -2.605) 3.153 4.308 ( -2.122 1.485 1.607) 3.048 4.351 ( -6.515 2.458 -2.827) 7.515 4.419 ( 5.172 3.049 -0.741) 6.049 4.496 ( 0.279 0.683 0.904) 1.167 4.605 ( 0.548 -0.246 3.315) 3.368 4.618 ( -3.522 -2.799 -1.718) 4.815 4.716 ( -1.938 1.426 -2.692) 3.611 4.765 ( 2.235 -1.330 -6.124) 6.653 5.006 ( -0.340 -3.695 5.185) 6.376 5.054 ( 4.360 -4.789 -2.116) 6.813 5.172 ( 0.920 -5.868 0.992) 6.022 5.229 ( -1.328 -5.827 3.738) 7.049 5.484 ( 6.157 4.831 -2.407) 8.188 5.602 ( -0.723 3.038 2.024) 3.722 5.631 ( -1.764 0.014 -3.728) 4.125 5.810 ( 5.297 -4.076 3.111) 7.373 6.055 ( 0.197 1.488 -9.941) 10.054 6.105 ( 4.685 1.618 7.507) 8.996 6.194 ( 3.780 1.182 -5.363) 6.666 6.394 ( -5.747 -1.040 1.467) 6.022 6.413 ( 7.391 -2.363 3.007) 8.322 6.575 ( -1.133 -1.606 -3.179) 3.738 6.721 ( -2.110 4.018 4.970) 6.731 7.233 ( 2.887 -5.159 -7.937) 9.897 7.403 ( -6.629 -1.108 1.782) 6.953 7.511 ( 0.039 0.119 5.437) 5.439 7.885 ( -0.635 3.035 2.060) 3.723 7.933 ( -4.421 6.214 6.529) 10.039 8.168 ( 2.274 -3.255 -1.598) 4.280 8.314 ( -4.751 5.074 -0.765) 6.993 8.464 ( 0.788 -2.682 -1.232) 3.055 8.635 ( -1.539 3.722 -4.983) 6.407 8.859 ( 0.639 -1.188 -2.827) 3.132 9.007 ( 0.523 0.978 0.620) 1.270 9.138 ( 0.812 0.552 -2.228) 2.435 9.319 ( -3.766 4.601 -8.697) 10.535 9.456 ( -3.267 -0.949 1.348) 3.659 9.576 ( 1.958 -5.038 3.370) 6.369 9.632 ( -1.585 1.565 -2.523) 3.366 9.747 ( 4.930 0.159 6.168) 7.898 9.907 ( -1.666 4.214 2.223) 5.047 10.111 ( -1.246 -0.810 1.386) 2.032 10.125 ( -3.429 -0.780 2.383) 4.248 10.265 ( 4.096 0.170 -1.269) 4.291 10.356 ( 3.847 1.243 8.555) 9.462 10.704 ( 7.090 -3.165 -2.325) 8.105 10.974 ( -2.091 0.157 9.329) 9.562 11.083 ( -3.105 0.059 -1.712) 3.546 11.139 ( -5.456 3.162 -1.114) 6.403 11.259 ( 0.208 1.655 -3.978) 4.314 11.299 ( 1.563 -5.189 1.121) 5.534 11.516 ( -4.390 -1.568 -3.733) 5.972 11.842 ( 4.392 -3.206 -3.799) 6.633 11.966 ( 0.702 -0.789 1.988) 2.252 12.003 ( 3.111 2.309 -0.918) 3.981 12.165 ( 6.223 5.927 0.453) 8.606 12.410 ( 3.142 -1.442 1.479) 3.760 12.755 ( 5.659 -0.916 0.629) 5.767 12.920 ( -0.795 -0.071 -2.738) 2.852 13.033 ( 1.195 -2.713 1.928) 3.536 13.177 ( 2.841 3.060 1.683) 4.502 13.277 ( 0.622 -2.630 -1.849) 3.274 13.370 ( 4.894 -2.315 -5.305) 7.580 13.489 ( 0.495 -1.189 0.673) 1.453 13.550 ( -7.772 -0.225 -1.379) 7.897 13.764 ( -2.750 -4.978 2.203) 6.098 14.066 ( -1.817 6.408 0.934) 6.726 14.381 ( 6.506 0.004 1.958) 6.794 14.562 ( 0.524 0.005 4.897) 4.925 14.588 ( 0.643 -1.930 1.916) 2.794 14.773 ( -1.872 0.581 -3.076) 3.647 14.887 ( -0.022 -0.016 0.415) 0.416 15.238 ( 2.770 1.121 2.111) 3.659 15.360 ( 7.319 2.185 -0.685) 7.669 15.465 ( 7.404 0.823 -6.535) 9.910 15.662 ( 1.003 -0.511 4.538) 4.675 15.745 ( -3.896 -4.038 -9.161) 10.743 15.983 ( -0.280 2.141 2.944) 3.651 16.198 ( -1.327 -1.789 4.020) 4.596 16.338 ( -7.233 5.244 -3.570) 9.621 16.588 ( -3.535 -2.887 2.072) 5.012 16.762 ( 3.581 -0.136 -4.311) 5.605 16.807 ( 0.358 3.238 4.262) 5.365 16.862 ( -1.065 2.172 -1.296) 2.744 16.876 ( -8.418 -1.974 -1.137) 8.721 17.027 ( -1.096 2.692 1.395) 3.224 17.383 ( 7.920 -0.763 2.656) 8.388 17.443 ( 4.089 2.387 1.351) 4.923 17.678 ( 0.636 0.836 7.172) 7.248 17.866 ( 1.017 -2.010 -1.506) 2.710 18.116 ( -4.023 7.848 -5.401) 10.341 18.197 ( 7.665 3.594 3.857) 9.303 18.935 ( 4.331 -5.320 4.259) 8.075 19.009 ( -2.740 -3.307 -7.736) 8.848 19.801 ( -6.806 -4.896 -1.229) 8.474 19.897 ( -7.454 -7.502 -1.642) 10.702 20.064 ( -4.189 2.020 -0.542) 4.682 20.167 ( -0.659 1.401 0.719) 1.707 ======================= Grid point 95 (43/104) ======================= q-point: (-0.20 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.374 ( -25.878 13.971 5.401) 29.900 1.420 ( -27.449 13.923 9.679) 32.264 2.356 ( -37.159 15.570 4.589) 40.550 2.454 ( -4.767 -5.430 0.166) 7.228 2.531 ( -6.378 -0.047 3.154) 7.115 2.679 ( -7.723 -2.350 -1.600) 8.230 2.785 ( -5.932 0.255 0.796) 5.991 2.904 ( -9.578 -6.195 -9.036) 14.552 2.972 ( -6.224 -4.975 5.477) 9.669 3.060 ( -5.959 -5.936 0.466) 8.424 3.194 ( 1.840 0.885 1.056) 2.299 3.254 ( -1.146 -1.090 -1.579) 2.235 3.337 ( -3.792 1.381 -4.469) 6.021 3.411 ( -6.723 0.857 5.034) 8.443 3.501 ( -1.858 0.901 -2.872) 3.537 3.680 ( -2.463 0.933 0.342) 2.656 3.693 ( -3.115 0.410 1.078) 3.322 3.799 ( 1.562 -0.615 -3.824) 4.176 3.897 ( -1.091 -0.637 -4.178) 4.365 4.071 ( 1.546 -2.414 -0.463) 2.904 4.082 ( -1.030 6.000 0.446) 6.104 4.145 ( -7.368 2.934 -0.419) 7.942 4.194 ( -3.750 -4.353 -1.595) 5.963 4.343 ( 3.081 -1.634 1.478) 3.787 4.493 ( 1.606 -0.278 -2.166) 2.710 4.520 ( -1.519 -3.048 -0.288) 3.418 4.580 ( 1.243 0.545 -0.209) 1.373 4.616 ( 1.522 4.982 0.142) 5.212 4.699 ( -0.678 1.493 1.834) 2.460 4.772 ( 2.489 -1.839 -4.810) 5.720 5.018 ( -0.091 -5.557 2.346) 6.033 5.107 ( 1.167 -4.576 -1.239) 4.882 5.182 ( 0.294 -3.202 -0.421) 3.242 5.260 ( 2.156 -3.954 3.513) 5.712 5.523 ( 0.210 3.762 -5.524) 6.686 5.590 ( -2.514 3.304 3.835) 5.652 5.671 ( 9.244 1.066 -2.838) 9.729 5.892 ( 0.487 -2.198 1.470) 2.689 6.020 ( 4.958 1.113 -6.642) 8.363 6.203 ( -4.923 2.333 2.447) 5.972 6.234 ( 3.023 2.146 5.436) 6.580 6.372 ( 1.636 1.199 -4.490) 4.927 6.470 ( 9.763 -0.926 -4.566) 10.818 6.686 ( 10.380 -4.630 1.529) 11.468 6.769 ( 1.336 1.475 7.644) 7.899 7.225 ( -1.144 -6.070 -1.933) 6.472 7.314 ( -2.795 2.618 -1.044) 3.970 7.549 ( -0.512 2.428 5.171) 5.736 7.860 ( -2.854 2.671 -1.533) 4.199 7.905 ( -4.300 4.416 9.844) 11.614 8.176 ( 0.788 -2.670 -7.543) 8.041 8.234 ( -2.500 1.320 -0.079) 2.828 8.542 ( 5.054 1.397 3.948) 6.564 8.592 ( 2.670 2.739 -4.077) 5.590 8.822 ( -2.463 -2.171 -1.653) 3.676 8.995 ( -2.649 -2.278 -0.465) 3.525 9.093 ( -3.436 -0.206 -5.172) 6.213 9.178 ( -4.470 5.791 -6.301) 9.655 9.376 ( -3.868 1.144 -2.680) 4.843 9.573 ( -2.880 -2.937 1.762) 4.475 9.629 ( 1.158 -1.069 -3.332) 3.686 9.839 ( -1.685 1.421 4.123) 4.675 9.898 ( 0.115 2.203 4.549) 5.056 10.085 ( -2.864 -0.055 2.900) 4.076 10.120 ( 2.523 -0.089 0.137) 2.528 10.325 ( 3.762 1.379 -2.739) 4.854 10.469 ( 2.319 -2.529 8.055) 8.756 10.780 ( 3.060 -4.432 -2.181) 5.811 10.959 ( -9.925 1.561 -0.177) 10.049 11.004 ( -2.375 0.300 6.730) 7.143 11.055 ( -2.020 -0.034 4.414) 4.855 11.282 ( 1.401 1.429 -1.114) 2.290 11.379 ( 6.236 -5.205 1.005) 8.185 11.493 ( 3.926 -0.776 0.244) 4.009 11.861 ( 0.118 -1.980 -1.076) 2.256 11.990 ( 1.951 -0.057 -1.259) 2.323 12.049 ( 2.240 3.768 -0.003) 4.383 12.293 ( 6.974 5.699 0.454) 9.017 12.502 ( 5.832 -2.530 1.178) 6.466 12.680 ( -7.220 3.110 -1.365) 7.979 13.031 ( 9.392 -3.205 -5.247) 11.226 13.095 ( 3.423 -4.195 2.573) 5.995 13.194 ( -1.211 0.352 -2.273) 2.599 13.337 ( -0.358 -2.236 1.408) 2.667 13.378 ( 0.327 -1.594 -7.843) 8.010 13.407 ( 0.853 -0.019 2.356) 2.505 13.523 ( 0.168 4.104 3.352) 5.301 13.748 ( -0.066 -2.446 0.062) 2.448 14.036 ( -2.125 7.968 0.631) 8.270 14.487 ( 0.701 -2.431 2.935) 3.875 14.567 ( 0.032 0.257 3.589) 3.598 14.622 ( 0.653 -2.260 4.633) 5.196 14.756 ( 2.020 -0.979 -1.622) 2.769 14.916 ( 3.172 2.425 -2.177) 4.548 15.304 ( 3.103 2.631 2.056) 4.559 15.460 ( 0.302 -0.601 -5.280) 5.323 15.534 ( 5.141 -1.594 -2.196) 5.813 15.626 ( 0.579 -3.979 -6.644) 7.766 15.696 ( 0.673 -0.278 0.994) 1.232 16.016 ( 1.082 5.163 0.907) 5.353 16.194 ( -4.317 0.775 2.380) 4.990 16.202 ( -0.340 2.065 -4.016) 4.528 16.539 ( -3.410 -2.714 3.835) 5.806 16.680 ( -10.745 -1.486 1.132) 10.907 16.782 ( -3.832 -0.396 0.583) 3.896 16.811 ( 4.483 -0.609 -4.258) 6.213 16.899 ( 1.159 6.257 5.346) 8.311 17.059 ( 3.283 3.115 0.136) 4.528 17.459 ( -0.552 -2.113 4.832) 5.302 17.538 ( 2.153 -1.169 -4.787) 5.377 17.735 ( 4.976 2.128 0.619) 5.447 17.942 ( 2.680 6.770 6.808) 9.968 17.991 ( -2.164 4.388 -2.213) 5.370 18.372 ( 7.441 2.302 3.132) 8.395 18.893 ( -2.175 -3.769 -9.586) 10.527 19.041 ( 3.459 -5.106 2.883) 6.808 19.616 ( -12.584 -10.061 -2.792) 16.352 19.729 ( -9.669 -9.921 0.206) 13.854 20.000 ( -3.168 3.875 1.440) 5.208 20.175 ( 1.406 2.162 -0.241) 2.590 ======================= Grid point 96 (44/104) ======================= q-point: (-0.10 0.17 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.994 ( -19.846 23.251 12.034) 32.853 1.060 ( -23.636 20.942 14.279) 34.657 1.666 ( -40.245 24.605 30.478) 56.161 2.331 ( -8.861 -2.640 -4.334) 10.211 2.452 ( -4.377 -0.090 1.516) 4.632 2.612 ( -4.268 -5.879 -6.487) 9.740 2.633 ( -4.541 0.963 -4.165) 6.236 2.727 ( -1.751 -4.176 0.347) 4.541 2.893 ( -7.835 -13.342 8.782) 17.791 2.997 ( -2.114 -7.294 1.691) 7.780 3.192 ( -0.531 -0.864 -2.463) 2.664 3.269 ( 1.186 -0.148 -3.350) 3.557 3.308 ( 0.942 1.150 3.299) 3.618 3.377 ( 2.902 3.456 0.224) 4.519 3.438 ( -2.179 3.849 0.100) 4.424 3.595 ( -6.596 -0.505 -2.111) 6.944 3.628 ( -4.813 3.402 -4.582) 7.466 3.719 ( -3.680 -1.405 -4.372) 5.885 3.777 ( -3.321 3.829 -4.300) 6.646 4.002 ( -4.238 4.542 -1.928) 6.505 4.114 ( 2.560 4.553 -2.135) 5.643 4.124 ( 2.287 -2.652 -0.523) 3.541 4.204 ( -2.084 -8.810 4.634) 10.170 4.386 ( 2.057 -5.986 -2.223) 6.709 4.480 ( 2.283 -1.106 0.076) 2.538 4.509 ( 0.561 -0.466 -0.756) 1.051 4.612 ( -0.988 4.606 -0.831) 4.784 4.618 ( 0.845 -0.504 -2.426) 2.618 4.721 ( 0.392 2.938 3.444) 4.544 4.780 ( 0.716 -4.888 0.337) 4.952 5.033 ( -1.114 -2.946 -2.283) 3.890 5.073 ( 0.331 -1.274 -0.672) 1.478 5.206 ( 2.558 -0.578 -2.982) 3.971 5.348 ( 4.465 0.890 1.853) 4.915 5.444 ( -3.525 1.551 -4.500) 5.923 5.578 ( -2.129 4.145 2.706) 5.388 5.830 ( 8.216 -1.028 -2.959) 8.793 5.897 ( 2.026 -0.261 -0.280) 2.062 6.109 ( -2.191 0.209 1.822) 2.857 6.135 ( 4.973 4.067 -0.165) 6.427 6.284 ( 2.121 4.083 -2.006) 5.020 6.381 ( 2.086 3.603 1.739) 4.512 6.687 ( 11.362 -4.930 -3.388) 12.841 6.814 ( -0.306 -5.393 5.813) 7.935 6.890 ( 7.689 -1.794 2.535) 8.293 7.172 ( -3.157 -3.176 3.101) 5.447 7.281 ( -0.659 3.392 -2.423) 4.220 7.537 ( -2.934 3.755 -0.353) 4.778 7.823 ( 2.966 5.420 -3.041) 6.886 7.901 ( -4.941 1.965 7.141) 8.903 8.117 ( -0.099 -1.927 -6.435) 6.718 8.189 ( -1.893 0.241 -0.317) 1.935 8.623 ( -0.364 -2.313 3.427) 4.151 8.700 ( 4.834 0.373 -0.240) 4.855 8.764 ( -1.153 2.202 -5.359) 5.907 8.907 ( -3.403 -2.142 -4.723) 6.203 8.964 ( -2.602 -3.328 -3.106) 5.243 9.097 ( -1.437 0.047 -2.511) 2.894 9.308 ( -0.126 5.667 -4.769) 7.408 9.519 ( -4.559 -4.197 1.224) 6.317 9.604 ( 1.414 2.070 -5.528) 6.070 9.787 ( -5.705 0.993 1.789) 6.061 9.938 ( 0.294 0.727 4.364) 4.434 10.063 ( -3.310 2.752 5.376) 6.887 10.219 ( 8.736 1.155 -1.330) 8.912 10.374 ( 3.473 -0.766 -0.583) 3.604 10.546 ( 0.141 -4.510 5.322) 6.977 10.717 ( -10.055 -1.935 0.431) 10.249 10.855 ( 1.374 -3.593 -0.920) 3.955 10.984 ( -8.298 -8.900 9.097) 15.194 11.067 ( -0.876 1.644 3.171) 3.678 11.289 ( -0.497 1.555 -0.010) 1.633 11.489 ( 3.808 -2.584 0.780) 4.668 11.589 ( 5.346 -4.277 -1.817) 7.083 11.853 ( -1.068 0.401 1.529) 1.908 12.025 ( 3.376 -1.688 -3.224) 4.964 12.085 ( 1.092 5.111 1.927) 5.571 12.418 ( 6.581 10.196 -2.118) 12.319 12.580 ( -1.407 4.714 2.515) 5.525 12.622 ( 4.957 -4.718 0.937) 6.907 13.043 ( -5.251 -5.955 -7.785) 11.120 13.144 ( 3.952 -1.643 -3.772) 5.705 13.196 ( 3.157 0.395 3.877) 5.015 13.265 ( 0.243 1.930 -3.383) 3.903 13.349 ( -1.461 -1.168 0.198) 1.881 13.519 ( 0.706 -0.591 3.561) 3.678 13.577 ( 6.377 7.384 -0.185) 9.759 13.747 ( 0.808 1.814 -2.817) 3.447 14.010 ( -2.118 6.604 4.734) 8.397 14.440 ( -4.843 -4.360 2.528) 6.990 14.629 ( -0.503 -2.972 4.224) 5.189 14.698 ( 3.674 -1.178 4.519) 5.942 14.805 ( 4.140 0.531 2.084) 4.665 14.951 ( 2.684 -0.363 -5.811) 6.411 15.314 ( -6.443 0.523 -2.988) 7.122 15.362 ( 0.608 2.102 -6.304) 6.673 15.586 ( 4.034 -3.447 -2.469) 5.852 15.664 ( 0.759 -4.487 4.885) 6.676 15.768 ( 8.377 1.624 -0.899) 8.580 15.984 ( -2.276 3.324 -1.531) 4.310 16.121 ( -4.856 2.711 0.680) 5.603 16.275 ( 8.834 -0.811 -4.166) 9.801 16.506 ( -8.831 -1.658 0.651) 9.009 16.553 ( 2.170 0.851 4.611) 5.166 16.712 ( -3.955 -0.519 1.760) 4.360 16.858 ( 1.326 -2.728 -1.495) 3.382 16.960 ( 1.880 7.454 5.248) 9.308 17.128 ( 3.857 2.808 -0.760) 4.831 17.373 ( -9.655 -0.178 -12.007) 15.408 17.487 ( -1.187 0.738 0.401) 1.454 17.816 ( 1.535 3.203 -7.121) 7.958 17.893 ( 1.541 5.816 -4.977) 7.809 18.168 ( 4.994 3.425 9.148) 10.971 18.487 ( 2.550 3.110 -2.379) 4.673 18.804 ( 0.647 -8.919 -1.921) 9.146 19.096 ( 0.477 -5.003 1.658) 5.292 19.329 ( -15.832 -14.897 8.186) 23.229 19.579 ( -7.472 -9.877 2.639) 12.663 19.972 ( -1.919 5.347 3.675) 6.766 20.226 ( 5.000 3.706 -1.173) 6.333 ======================= Grid point 97 (45/104) ======================= q-point: ( 0.00 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.361 ( -4.822 28.203 7.591) 29.602 1.422 ( -0.514 25.249 17.939) 30.977 2.116 ( 1.395 16.196 16.328) 23.041 2.184 ( -1.580 5.206 5.871) 8.004 2.284 ( -2.035 -11.178 -6.302) 12.993 2.360 ( 4.324 -11.363 -0.747) 12.181 2.528 ( -0.567 -1.992 -0.674) 2.178 2.668 ( -2.615 -4.765 4.976) 7.369 2.723 ( 2.608 0.256 4.412) 5.132 2.947 ( 1.280 -0.817 8.289) 8.427 3.136 ( -0.729 -2.784 -3.107) 4.235 3.228 ( -0.534 -1.744 -2.125) 2.800 3.235 ( -0.767 -3.593 0.385) 3.694 3.348 ( 1.054 -5.061 -1.434) 5.365 3.421 ( -1.506 3.635 0.822) 4.020 3.617 ( 1.178 3.005 -1.944) 3.768 3.653 ( -1.187 0.361 -1.504) 1.950 3.752 ( -0.360 -3.117 -8.160) 8.743 3.826 ( 6.284 0.184 4.575) 7.775 3.920 ( -2.644 3.287 -6.474) 7.727 4.059 ( -1.155 -1.058 -1.564) 2.213 4.098 ( 3.000 -7.033 2.965) 8.201 4.192 ( -0.334 3.474 -3.051) 4.635 4.286 ( 2.875 -4.323 5.449) 7.526 4.504 ( 1.177 -1.942 -5.761) 6.193 4.546 ( 1.272 -0.149 -1.359) 1.867 4.555 ( -1.000 -1.784 -1.756) 2.696 4.570 ( -2.249 1.529 0.263) 2.733 4.781 ( -1.406 1.991 0.949) 2.616 4.803 ( 1.530 1.805 2.376) 3.353 4.959 ( -2.069 -1.181 -2.581) 3.512 5.027 ( -2.140 -3.260 -2.292) 4.524 5.271 ( 3.404 2.899 0.273) 4.480 5.356 ( -6.001 2.227 -1.763) 6.639 5.522 ( 6.055 1.070 1.598) 6.353 5.591 ( -3.517 0.489 0.479) 3.583 5.875 ( 0.260 -0.507 -0.807) 0.988 5.901 ( 0.051 -0.817 0.322) 0.880 6.092 ( -1.277 2.915 -2.014) 3.766 6.275 ( 3.369 -3.141 -2.306) 5.151 6.342 ( 0.162 3.804 4.553) 5.935 6.572 ( 7.627 1.418 1.377) 7.879 6.641 ( -5.554 -1.197 1.723) 5.937 6.739 ( 1.510 0.519 -5.430) 5.660 6.948 ( 0.030 -1.899 0.379) 1.937 7.085 ( -2.317 -6.072 3.049) 7.179 7.370 ( -0.267 5.930 2.237) 6.343 7.503 ( -2.450 0.282 -1.484) 2.878 7.842 ( -7.716 2.776 -0.577) 8.220 7.977 ( -6.499 -3.040 -6.289) 9.541 8.032 ( 11.258 2.946 -4.940) 12.642 8.166 ( 5.870 -3.102 -3.687) 7.594 8.558 ( -1.296 4.436 2.508) 5.259 8.685 ( -2.911 0.293 -3.997) 4.953 8.743 ( -3.047 1.252 -4.014) 5.193 8.884 ( 0.452 -4.139 -2.631) 4.925 9.005 ( 8.284 -0.108 2.500) 8.654 9.069 ( 7.849 -1.329 -1.813) 8.165 9.323 ( -3.167 0.478 -0.201) 3.210 9.362 ( -2.163 -1.736 -2.759) 3.912 9.637 ( 0.810 1.180 -2.643) 3.005 9.709 ( -2.275 -0.845 -0.578) 2.494 10.072 ( 0.170 3.898 6.267) 7.383 10.111 ( 0.535 3.519 2.699) 4.467 10.342 ( -0.471 0.116 0.387) 0.620 10.406 ( -4.549 -2.609 2.762) 5.927 10.474 ( 2.883 -0.010 1.123) 3.094 10.563 ( -3.909 -2.970 1.488) 5.130 10.676 ( -5.941 -1.652 5.053) 7.973 10.778 ( 3.166 -6.665 1.985) 7.641 11.188 ( -0.733 5.554 3.448) 6.578 11.312 ( -0.011 -0.223 1.549) 1.565 11.491 ( -0.020 -0.514 -0.597) 0.788 11.555 ( 1.006 -3.562 -1.876) 4.150 11.841 ( -1.275 1.067 -1.105) 1.996 11.940 ( -0.415 -4.236 -2.839) 5.116 12.226 ( -0.901 6.945 3.010) 7.623 12.516 ( -4.279 -6.242 0.069) 7.568 12.558 ( 2.469 5.721 -3.893) 7.347 12.805 ( 1.600 -5.413 -5.543) 7.911 12.884 ( 1.068 10.339 1.147) 10.457 13.195 ( 5.035 -2.534 -0.167) 5.639 13.222 ( -1.040 -2.639 0.484) 2.877 13.262 ( -4.308 -3.346 0.773) 5.509 13.338 ( 1.386 3.767 1.704) 4.361 13.491 ( -1.601 -2.392 1.293) 3.156 13.763 ( 2.298 3.014 -4.557) 5.928 13.785 ( -0.179 2.110 -2.524) 3.295 14.131 ( -1.135 4.798 5.982) 7.751 14.302 ( -1.341 -3.927 1.876) 4.554 14.601 ( -2.301 1.136 2.318) 3.458 14.711 ( -3.101 -3.614 1.594) 5.021 14.874 ( 1.183 1.175 1.470) 2.223 14.942 ( 3.463 -1.878 1.075) 4.084 15.254 ( -0.421 2.680 -5.342) 5.991 15.301 ( -2.466 1.059 -10.197) 10.545 15.621 ( 5.061 -2.108 2.804) 6.158 15.648 ( 1.649 -3.527 5.348) 6.615 15.899 ( -0.731 2.418 -1.012) 2.721 15.987 ( -0.047 0.805 -2.447) 2.576 16.121 ( 2.395 2.164 2.498) 4.082 16.273 ( -1.254 -6.217 -1.747) 6.579 16.394 ( 1.275 2.272 0.646) 2.684 16.532 ( -1.686 -4.154 0.480) 4.509 16.743 ( -1.635 1.603 -0.719) 2.400 16.780 ( -0.987 0.741 -2.261) 2.576 17.122 ( -3.492 1.589 -3.893) 5.465 17.166 ( -6.153 2.841 -0.083) 6.778 17.229 ( 5.171 4.282 -1.435) 6.865 17.471 ( 2.641 -4.651 -1.963) 5.697 17.848 ( -2.868 8.250 -7.560) 11.552 17.939 ( -1.435 2.640 -5.013) 5.844 18.264 ( -3.969 8.037 1.208) 9.045 18.447 ( 0.881 -1.096 -2.888) 3.212 18.845 ( 7.901 -4.294 7.519) 11.722 19.006 ( 0.357 -6.692 -0.079) 6.702 19.186 ( 3.025 -2.493 10.268) 10.991 19.346 ( -0.521 -8.084 2.210) 8.397 20.093 ( -1.005 5.932 4.404) 7.456 20.274 ( 0.400 -3.254 1.050) 3.443 ======================= Grid point 98 (46/104) ======================= q-point: ( 0.10 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( 8.250 19.511 11.319) 24.018 1.727 ( 15.482 18.461 20.728) 31.783 2.194 ( -0.045 -5.482 -2.642) 6.086 2.289 ( 13.940 5.503 -12.411) 19.459 2.347 ( 6.744 4.403 6.436) 10.310 2.518 ( 10.483 -5.564 5.060) 12.902 2.631 ( 9.290 -5.618 7.249) 13.054 2.674 ( 0.342 -5.996 1.871) 6.290 2.821 ( 5.014 2.768 3.196) 6.559 3.037 ( 1.518 -3.433 3.337) 5.022 3.153 ( 6.130 0.450 3.755) 7.203 3.221 ( 0.509 0.401 -1.126) 1.299 3.276 ( 4.155 -3.096 2.044) 5.570 3.395 ( -0.502 5.407 -0.235) 5.435 3.447 ( 4.112 -8.394 3.754) 10.072 3.578 ( -3.117 -0.522 -3.812) 4.952 3.652 ( 1.109 2.611 -0.104) 2.839 3.702 ( 3.103 1.232 -4.017) 5.224 3.901 ( 4.987 0.495 -2.850) 5.765 3.974 ( 6.266 -3.689 -2.007) 7.544 4.026 ( 1.264 -0.514 -2.874) 3.181 4.170 ( 4.379 -1.887 -1.039) 4.880 4.188 ( 1.598 7.587 1.811) 7.962 4.372 ( 2.404 -5.121 2.935) 6.373 4.406 ( -3.380 0.208 -10.724) 11.246 4.498 ( -0.703 0.109 -3.993) 4.056 4.577 ( -0.037 -0.761 -0.182) 0.783 4.591 ( 1.528 -2.755 2.083) 3.776 4.753 ( -2.122 1.640 2.599) 3.734 4.841 ( -0.013 0.641 2.465) 2.547 4.898 ( -1.542 -2.507 -4.012) 4.976 4.953 ( -2.890 -4.003 -3.304) 5.941 5.206 ( -8.511 5.878 -0.330) 10.349 5.313 ( -1.047 1.907 3.571) 4.181 5.499 ( -4.914 -0.032 -1.533) 5.148 5.626 ( 2.638 -3.675 0.717) 4.580 5.831 ( -3.617 1.045 -0.734) 3.835 5.900 ( -0.150 -0.661 0.523) 0.856 6.088 ( 2.267 3.688 -1.459) 4.569 6.273 ( -2.731 -1.801 -2.889) 4.365 6.323 ( -3.274 1.893 0.703) 3.847 6.524 ( -8.464 -2.359 6.165) 10.733 6.674 ( 0.940 2.947 2.461) 3.953 6.743 ( -0.447 3.899 -7.791) 8.723 6.848 ( -7.699 -3.641 1.271) 8.611 7.023 ( -4.315 -5.549 1.229) 7.135 7.373 ( -2.217 3.008 3.677) 5.243 7.495 ( 2.330 1.387 -1.365) 3.036 7.728 ( -2.946 2.347 -1.797) 4.173 7.856 ( 0.496 -0.652 -4.223) 4.302 8.193 ( 7.881 1.874 -3.098) 8.673 8.292 ( 9.208 -1.105 -1.513) 9.396 8.601 ( 0.498 2.594 -0.503) 2.689 8.620 ( 0.037 2.734 -2.558) 3.744 8.680 ( -0.891 -1.332 -1.134) 1.963 8.883 ( 3.710 -6.777 -6.041) 9.808 9.122 ( 3.055 3.027 1.231) 4.474 9.214 ( 3.720 -2.880 -1.183) 4.851 9.285 ( 2.292 2.820 -0.430) 3.659 9.367 ( 5.673 -0.910 -1.770) 6.012 9.631 ( 1.258 2.499 -2.847) 3.992 9.733 ( 4.309 -2.464 -0.105) 4.964 10.020 ( -5.854 4.489 2.153) 7.685 10.109 ( -6.057 2.453 3.838) 7.579 10.280 ( -5.057 -1.967 0.176) 5.429 10.315 ( -7.071 -3.171 4.820) 9.126 10.490 ( -0.138 0.207 2.154) 2.169 10.558 ( 2.400 -1.363 -0.574) 2.819 10.768 ( 7.467 1.167 1.875) 7.787 10.915 ( 9.308 -4.029 3.603) 10.763 11.189 ( -1.933 3.756 4.802) 6.395 11.314 ( -1.735 -2.270 2.015) 3.496 11.437 ( -4.800 1.412 -1.393) 5.193 11.499 ( -3.532 -1.575 -2.380) 4.541 11.838 ( 1.076 -0.743 0.289) 1.340 11.906 ( -0.837 -3.734 -2.912) 4.809 12.210 ( -2.928 4.908 2.383) 6.192 12.387 ( -6.825 -1.306 -0.697) 6.984 12.612 ( 2.818 4.143 -0.886) 5.088 12.817 ( 3.779 -4.047 -7.332) 9.188 12.882 ( -2.303 7.698 5.147) 9.543 13.118 ( -7.765 -2.914 -5.298) 9.842 13.218 ( -0.486 -0.398 0.213) 0.663 13.266 ( 2.536 -1.899 0.242) 3.177 13.400 ( 1.901 -2.345 5.651) 6.407 13.448 ( -3.732 -1.938 0.991) 4.321 13.707 ( -3.962 3.467 -2.510) 5.833 13.740 ( -2.771 0.483 -2.317) 3.644 14.179 ( 1.625 1.758 4.473) 5.073 14.313 ( 0.328 -3.914 1.311) 4.141 14.573 ( -2.869 1.203 2.039) 3.719 14.631 ( -4.848 -2.160 1.792) 5.601 14.878 ( -3.233 1.643 3.169) 4.815 14.953 ( -2.286 -1.685 -0.626) 2.908 15.242 ( 3.781 3.469 -8.102) 9.590 15.308 ( 8.845 -0.202 -4.576) 9.961 15.613 ( -6.851 0.570 -0.244) 6.879 15.741 ( 3.082 -5.301 2.911) 6.788 15.820 ( -3.304 4.592 0.900) 5.729 15.992 ( 0.974 1.792 -3.592) 4.131 16.179 ( -1.273 0.169 0.550) 1.397 16.214 ( -2.058 -6.571 -0.883) 6.942 16.469 ( 1.055 3.154 -0.759) 3.411 16.508 ( 5.690 0.003 2.053) 6.049 16.713 ( 2.584 3.118 -0.056) 4.050 16.830 ( 4.663 -1.836 0.109) 5.012 17.010 ( -4.523 1.629 -2.698) 5.513 17.083 ( -4.641 -1.579 1.210) 5.050 17.321 ( 4.906 5.508 -0.360) 7.385 17.513 ( 2.753 -4.258 -2.270) 5.556 17.759 ( -1.879 10.570 -3.395) 11.260 17.885 ( -1.560 1.621 -3.302) 3.995 18.219 ( -2.809 7.002 1.407) 7.675 18.423 ( -1.873 0.240 -1.990) 2.743 18.943 ( -0.001 -3.601 0.774) 3.683 19.005 ( 0.360 -3.246 0.824) 3.368 19.386 ( 9.241 -7.425 2.942) 12.214 19.434 ( 8.633 -9.066 4.293) 13.234 20.100 ( -1.521 5.198 4.369) 6.959 20.250 ( -3.216 -2.500 0.744) 4.141 ======================= Grid point 99 (47/104) ======================= q-point: ( 0.20 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.769 ( 14.305 8.133 12.722) 20.799 2.149 ( 12.972 8.269 15.672) 21.960 2.197 ( 2.975 -0.793 -1.273) 3.332 2.465 ( 13.294 4.664 -10.884) 17.802 2.481 ( 6.572 -1.249 1.024) 6.767 2.640 ( 5.945 -1.146 -4.040) 7.279 2.815 ( 9.000 -6.510 2.765) 11.446 2.888 ( 2.904 0.822 5.208) 6.020 2.913 ( 12.445 -7.455 -2.753) 14.766 3.064 ( 0.257 -5.605 -0.396) 5.624 3.199 ( -1.478 4.928 1.855) 5.469 3.274 ( 0.885 0.032 1.449) 1.698 3.343 ( -1.289 5.036 -4.054) 6.593 3.416 ( 5.880 -4.032 1.466) 7.278 3.545 ( 1.027 -3.844 0.949) 4.091 3.587 ( 10.399 3.354 8.598) 13.904 3.659 ( 1.217 1.560 -0.119) 1.982 3.848 ( 9.314 6.575 4.921) 12.418 4.010 ( 7.422 2.379 -6.131) 9.917 4.042 ( 1.962 -4.015 -0.551) 4.502 4.109 ( 9.936 -0.521 -1.155) 10.016 4.224 ( -1.032 4.189 0.241) 4.321 4.239 ( 1.983 -0.154 -1.953) 2.788 4.306 ( 4.187 3.260 -6.343) 8.270 4.395 ( -0.326 -3.800 1.079) 3.964 4.502 ( 3.563 -2.555 -3.731) 5.757 4.532 ( -1.668 0.190 -0.709) 1.822 4.644 ( 1.572 -4.568 2.365) 5.379 4.734 ( -0.194 3.484 -5.621) 6.616 4.810 ( -2.799 -2.685 -1.163) 4.049 4.873 ( 0.055 -0.929 1.259) 1.566 4.910 ( -0.703 -5.419 0.877) 5.535 5.069 ( -6.142 5.272 0.677) 8.122 5.263 ( -7.240 -2.118 3.409) 8.279 5.414 ( -2.770 2.673 -0.779) 3.928 5.634 ( -1.429 -7.068 1.807) 7.434 5.775 ( -1.672 3.579 -1.194) 4.127 5.901 ( -0.906 -0.346 0.972) 1.373 6.117 ( -9.416 5.293 -5.073) 11.934 6.147 ( 5.288 3.604 -1.094) 6.492 6.283 ( -1.378 -1.549 -3.103) 3.732 6.449 ( -4.568 -5.980 3.841) 8.449 6.518 ( -12.060 2.701 -1.774) 12.485 6.661 ( -8.017 -0.863 7.009) 10.684 6.797 ( 2.831 1.093 -6.102) 6.815 7.009 ( 1.009 -5.521 0.630) 5.647 7.357 ( -2.249 1.465 4.214) 4.996 7.509 ( -1.941 -3.232 4.657) 5.992 7.750 ( 7.180 6.959 -3.997) 10.768 7.924 ( 6.382 -0.189 0.036) 6.385 8.259 ( 1.322 2.855 -0.473) 3.182 8.420 ( 4.964 -3.205 -3.558) 6.898 8.551 ( -1.528 6.030 3.091) 6.946 8.633 ( 1.389 3.650 -3.586) 5.302 8.706 ( 3.826 -2.586 -3.299) 5.676 8.914 ( 2.115 -7.919 -3.762) 9.018 9.131 ( 1.877 3.270 -5.678) 6.816 9.235 ( 2.262 0.501 -1.390) 2.702 9.390 ( 4.753 3.416 4.032) 7.108 9.492 ( 7.465 -2.340 -1.498) 7.965 9.643 ( 2.376 3.815 -3.568) 5.738 9.814 ( 1.604 -3.670 4.059) 5.703 9.933 ( -3.871 3.881 -0.195) 5.485 10.025 ( -2.420 0.073 -1.106) 2.662 10.166 ( -7.033 -1.398 -0.741) 7.208 10.242 ( -5.462 -4.556 6.963) 9.953 10.507 ( -0.269 1.728 2.172) 2.789 10.573 ( -1.885 0.817 -1.264) 2.413 10.880 ( 3.305 0.767 1.738) 3.812 11.059 ( 0.542 -5.721 -0.825) 5.806 11.193 ( -0.316 3.508 3.563) 5.010 11.296 ( -1.706 -2.280 4.243) 5.110 11.358 ( 1.631 3.338 -0.846) 3.810 11.484 ( 2.656 -2.400 0.127) 3.582 11.855 ( 0.177 -1.284 -0.537) 1.403 11.875 ( -0.697 -2.443 -1.080) 2.761 12.159 ( -3.487 4.406 0.642) 5.656 12.301 ( -3.536 -0.202 2.491) 4.330 12.584 ( -5.765 3.245 0.948) 6.683 12.769 ( -6.634 -4.039 -5.674) 9.619 12.906 ( 1.324 4.556 0.091) 4.745 13.000 ( 1.514 0.138 -0.001) 1.520 13.229 ( 1.785 1.861 0.027) 2.578 13.273 ( -1.391 1.230 -1.702) 2.519 13.390 ( -2.799 -4.727 0.418) 5.510 13.454 ( -0.400 -4.438 3.573) 5.712 13.627 ( -2.621 1.992 -0.660) 3.357 13.692 ( -0.988 -2.351 0.942) 2.718 14.224 ( 0.004 0.384 1.620) 1.665 14.313 ( -1.049 -2.877 0.046) 3.062 14.509 ( -4.611 1.740 1.118) 5.053 14.590 ( -3.043 -2.063 4.073) 5.487 14.832 ( -2.990 1.077 2.229) 3.881 14.896 ( -2.440 -1.690 -1.318) 3.248 15.289 ( 5.361 5.854 -5.412) 9.608 15.419 ( 2.636 -1.213 -4.944) 5.732 15.458 ( -5.113 2.663 -1.222) 5.893 15.694 ( -3.520 -2.752 -1.155) 4.615 15.894 ( 2.307 -0.065 6.997) 7.368 15.953 ( 0.985 4.056 -7.856) 8.896 16.084 ( -7.271 1.143 -0.969) 7.424 16.204 ( 3.007 -7.061 -0.384) 7.684 16.528 ( 4.587 4.500 -0.042) 6.426 16.683 ( 8.956 -1.976 2.415) 9.484 16.768 ( 2.034 2.904 -0.411) 3.569 16.915 ( -2.019 -1.247 -3.891) 4.558 16.942 ( 4.090 0.161 5.704) 7.021 17.019 ( -3.903 -2.444 3.163) 5.587 17.389 ( 2.211 4.633 0.353) 5.145 17.515 ( -0.767 -1.830 -2.568) 3.246 17.724 ( -2.244 8.738 1.568) 9.157 17.840 ( -0.601 1.649 -1.794) 2.509 18.141 ( -5.529 4.156 -3.134) 7.594 18.388 ( -0.599 -0.288 0.774) 1.020 18.876 ( -5.129 0.025 -2.836) 5.861 19.041 ( 1.787 -3.913 1.213) 4.470 19.568 ( 10.909 -5.219 -0.319) 12.098 19.643 ( 10.006 -9.537 1.716) 13.929 20.110 ( -0.276 3.612 3.122) 4.782 20.200 ( -1.859 -0.854 0.633) 2.141 ======================= Grid point 100 (48/104) ======================= q-point: ( 0.30 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.116 ( 13.949 -0.162 9.353) 16.796 2.281 ( 6.723 -1.631 0.599) 6.944 2.345 ( 3.121 -0.268 4.069) 5.136 2.550 ( 3.955 -5.404 -2.230) 7.058 2.684 ( 6.622 8.034 3.735) 11.061 2.779 ( 11.206 3.896 -2.777) 12.185 2.865 ( 3.862 1.145 -7.689) 8.680 2.882 ( -2.182 -3.780 -3.000) 5.296 3.070 ( 1.247 -6.147 0.024) 6.272 3.124 ( 7.905 -2.972 -0.838) 8.487 3.217 ( 1.339 7.367 2.543) 7.908 3.293 ( 4.502 -0.349 3.307) 5.597 3.343 ( 2.248 2.885 0.663) 3.717 3.543 ( 3.233 -2.826 3.167) 5.335 3.612 ( 5.446 -1.808 1.914) 6.049 3.693 ( 3.219 -2.695 0.168) 4.201 3.775 ( 2.537 7.369 2.027) 8.053 3.920 ( -2.628 3.073 -3.763) 5.523 4.042 ( -3.057 5.206 2.289) 6.456 4.102 ( 0.705 0.120 7.222) 7.257 4.181 ( -4.075 -1.694 -4.964) 6.642 4.200 ( 3.245 -1.902 -2.524) 4.530 4.300 ( 8.949 2.630 1.365) 9.427 4.370 ( 2.949 -0.057 0.349) 2.970 4.438 ( -0.435 2.196 -4.214) 4.772 4.545 ( 5.530 -1.994 -4.498) 7.402 4.578 ( 6.755 -0.194 1.380) 6.897 4.669 ( 0.236 0.064 1.300) 1.323 4.716 ( 3.265 0.064 -1.885) 3.771 4.760 ( -0.831 -4.089 -4.359) 6.034 4.879 ( -0.042 0.797 0.447) 0.915 4.953 ( 3.500 -6.660 2.457) 7.915 5.017 ( 0.069 1.364 1.081) 1.742 5.133 ( -7.489 -3.441 1.353) 8.352 5.389 ( 0.451 5.409 -0.733) 5.477 5.662 ( 3.497 -6.955 2.919) 8.314 5.732 ( -2.530 2.396 -1.284) 3.713 5.852 ( -7.099 -0.274 2.875) 7.664 5.918 ( -5.539 6.449 -6.972) 10.994 6.149 ( -5.333 -3.542 -5.609) 8.512 6.290 ( 5.534 3.025 0.768) 6.353 6.363 ( -4.264 2.248 0.197) 4.825 6.410 ( -1.257 -2.464 1.022) 2.949 6.577 ( -3.912 -4.548 1.985) 6.319 6.828 ( 3.154 3.028 -2.529) 5.051 7.041 ( 2.534 -6.409 -0.800) 6.938 7.361 ( -1.250 2.248 5.877) 6.415 7.525 ( -1.093 -5.636 7.520) 9.461 7.877 ( 7.990 5.767 -1.858) 10.028 8.023 ( 3.270 -1.290 1.193) 3.712 8.253 ( -0.460 5.367 -1.334) 5.550 8.448 ( 4.484 -2.469 -7.148) 8.792 8.597 ( 1.001 7.827 5.359) 9.538 8.631 ( 1.163 4.797 -2.795) 5.673 8.740 ( 3.096 -2.914 -5.099) 6.639 8.884 ( -1.477 -5.082 -3.048) 6.107 9.152 ( 2.301 0.734 -3.099) 3.929 9.268 ( 2.874 -2.686 -0.680) 3.992 9.468 ( -0.623 4.778 3.984) 6.252 9.560 ( 0.361 0.496 -1.568) 1.684 9.680 ( 4.403 1.115 -2.855) 5.365 9.816 ( -5.170 -4.029 6.921) 9.532 9.887 ( -0.785 2.329 -0.537) 2.516 9.998 ( 0.063 0.706 -4.962) 5.012 10.088 ( 0.916 -1.492 -0.029) 1.751 10.210 ( -3.462 -4.127 5.987) 8.054 10.447 ( -10.414 1.953 3.436) 11.139 10.497 ( -2.739 0.984 -1.809) 3.427 10.908 ( -1.179 1.175 2.223) 2.777 11.052 ( 3.395 -4.832 -0.288) 5.913 11.182 ( -0.736 2.903 0.253) 3.006 11.307 ( -0.663 -2.893 2.362) 3.793 11.478 ( 6.981 1.986 0.900) 7.313 11.553 ( 3.805 -2.063 -1.603) 4.616 11.839 ( -0.236 -0.018 -1.959) 1.974 11.872 ( 0.455 -1.694 0.665) 1.876 12.107 ( -2.485 5.178 0.296) 5.751 12.271 ( -2.864 1.975 3.356) 4.834 12.442 ( -8.960 0.557 -1.200) 9.057 12.581 ( -8.251 -2.185 -1.696) 8.702 12.938 ( 2.575 2.540 -0.507) 3.652 13.070 ( 2.017 -1.034 1.401) 2.665 13.219 ( -2.644 2.288 -0.869) 3.603 13.269 ( 0.162 0.691 -1.049) 1.266 13.349 ( 1.216 -2.951 -1.380) 3.477 13.450 ( -0.550 -3.283 1.389) 3.607 13.631 ( 1.652 -0.935 1.566) 2.461 13.706 ( 0.992 -4.723 1.355) 5.012 14.189 ( -4.111 0.843 0.617) 4.241 14.267 ( -4.645 -1.101 1.153) 4.911 14.443 ( -2.562 2.056 -0.840) 3.391 14.557 ( -3.523 -3.338 2.792) 5.599 14.816 ( -0.765 0.178 2.352) 2.480 14.868 ( 0.035 -1.257 0.888) 1.539 15.270 ( -4.145 1.490 -4.746) 6.475 15.366 ( 1.811 10.607 -0.368) 10.766 15.426 ( -2.212 -3.827 -4.477) 6.291 15.702 ( 4.944 -2.407 -1.747) 5.769 15.863 ( -3.821 2.661 -0.392) 4.673 15.899 ( -5.858 0.497 -2.766) 6.497 16.096 ( 6.949 1.946 2.302) 7.575 16.285 ( 5.233 -5.688 1.096) 7.806 16.592 ( 2.770 5.325 -1.912) 6.300 16.764 ( -1.427 0.578 -0.144) 1.546 16.802 ( 2.427 -3.314 -0.449) 4.132 16.861 ( -2.172 -1.690 -1.311) 3.048 17.008 ( 2.642 1.372 4.060) 5.034 17.079 ( 4.131 -1.492 5.472) 7.017 17.391 ( -3.290 2.333 1.502) 4.304 17.454 ( -3.332 -0.211 -2.973) 4.471 17.682 ( -3.710 6.039 2.132) 7.401 17.842 ( 1.007 6.048 -0.281) 6.137 18.009 ( -5.487 1.724 -2.317) 6.201 18.408 ( 1.444 -5.422 1.657) 5.850 18.751 ( -5.241 5.484 -3.795) 8.482 19.070 ( 1.199 -6.674 -1.040) 6.860 19.759 ( 9.776 -3.832 -0.570) 10.515 19.800 ( 6.536 -6.036 0.008) 8.897 20.135 ( 1.581 2.659 0.984) 3.246 20.208 ( 1.639 -0.962 1.134) 2.213 ======================= Grid point 101 (49/104) ======================= q-point: ( 0.40 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.332 ( 4.311 -1.475 2.159) 5.042 2.403 ( 4.771 -5.722 -2.857) 7.979 2.471 ( 7.939 0.531 10.076) 12.838 2.597 ( 0.838 -3.613 1.724) 4.090 2.708 ( -1.749 1.327 -0.161) 2.201 2.761 ( -1.700 -2.159 -3.872) 4.748 2.922 ( 3.930 -0.323 -1.183) 4.117 2.991 ( 5.220 2.589 2.228) 6.238 3.109 ( 4.710 -1.623 -0.078) 4.982 3.233 ( 7.031 3.566 -3.910) 8.800 3.309 ( 5.173 7.426 4.186) 9.972 3.383 ( 1.720 6.295 0.168) 6.528 3.437 ( 4.913 -0.523 2.139) 5.383 3.572 ( -1.485 -1.561 1.071) 2.406 3.722 ( 4.384 -0.773 1.450) 4.682 3.736 ( 0.049 -1.760 1.700) 2.448 3.777 ( 0.785 2.579 0.574) 2.756 3.837 ( -2.649 -0.720 -2.550) 3.747 3.972 ( -5.653 4.213 3.845) 8.031 4.030 ( -6.814 0.769 -5.562) 8.829 4.116 ( -4.203 2.026 7.039) 8.445 4.253 ( 1.323 -3.926 0.480) 4.171 4.330 ( -3.061 4.144 -1.540) 5.377 4.414 ( 0.624 1.471 -2.580) 3.035 4.441 ( 2.127 1.444 3.196) 4.102 4.635 ( 6.179 -0.768 -4.267) 7.549 4.650 ( 3.696 -0.737 -2.960) 4.792 4.687 ( 0.839 -1.722 -0.978) 2.151 4.734 ( -0.322 -4.092 0.873) 4.197 4.783 ( 3.774 -3.415 -3.383) 6.111 4.860 ( -2.545 -0.322 2.296) 3.442 4.996 ( -1.478 -3.287 1.105) 3.769 5.043 ( -0.152 -0.841 1.974) 2.151 5.115 ( 5.804 -3.417 -1.800) 6.971 5.404 ( 1.886 7.030 -2.887) 7.830 5.659 ( -5.007 -1.068 -2.251) 5.593 5.707 ( -0.881 2.787 1.937) 3.506 5.820 ( -3.490 3.599 -1.042) 5.120 5.843 ( 7.922 -2.317 2.355) 8.583 6.037 ( -2.538 -3.883 -6.073) 7.642 6.256 ( -4.066 -0.906 0.735) 4.231 6.327 ( -3.778 -1.911 -1.918) 4.648 6.498 ( 7.949 1.141 0.961) 8.088 6.562 ( 0.834 -2.268 0.121) 2.419 6.858 ( 1.087 4.490 -0.230) 4.626 7.090 ( 3.885 -7.693 -2.207) 8.896 7.386 ( -0.977 3.215 5.675) 6.595 7.556 ( -2.033 -6.030 6.908) 9.392 7.978 ( 3.229 2.806 0.249) 4.285 8.064 ( 0.734 -1.324 1.507) 2.136 8.247 ( 1.752 7.604 -5.165) 9.358 8.474 ( 4.071 0.842 -7.244) 8.352 8.633 ( 1.911 3.245 -5.574) 6.727 8.648 ( 0.353 6.799 4.446) 8.131 8.746 ( 2.528 -2.282 -5.881) 6.796 8.864 ( 0.103 -5.723 2.412) 6.211 9.152 ( -0.136 1.266 0.597) 1.406 9.315 ( 1.661 -0.693 -1.291) 2.215 9.429 ( -5.480 0.756 5.226) 7.610 9.507 ( -4.189 0.111 0.603) 4.233 9.717 ( 0.936 2.093 -1.751) 2.885 9.776 ( -1.575 -2.821 1.469) 3.549 9.920 ( 2.991 0.830 2.076) 3.734 9.975 ( 0.792 2.745 -1.997) 3.486 10.133 ( 1.757 -3.811 -0.770) 4.267 10.193 ( -2.526 -2.251 4.427) 5.572 10.287 ( -8.056 2.668 4.388) 9.553 10.431 ( -2.790 -2.348 0.136) 3.649 10.925 ( 1.041 4.578 2.555) 5.345 11.133 ( 3.742 -3.721 0.181) 5.280 11.197 ( 1.021 1.229 1.517) 2.203 11.302 ( -0.973 -3.226 0.903) 3.489 11.553 ( 1.858 0.530 -3.037) 3.600 11.572 ( 1.313 -1.757 -2.853) 3.599 11.824 ( 0.838 2.154 -4.342) 4.919 11.890 ( 0.599 -0.793 -0.888) 1.333 12.071 ( -1.960 5.952 0.887) 6.329 12.217 ( -4.057 7.783 -0.168) 8.779 12.322 ( -3.282 -5.843 1.492) 6.866 12.462 ( -4.582 -3.092 0.254) 5.533 12.981 ( 1.603 0.359 0.926) 1.885 13.063 ( -2.100 -2.445 0.009) 3.223 13.182 ( -0.913 1.861 -0.618) 2.163 13.219 ( -1.962 1.043 -2.185) 3.116 13.406 ( 2.894 0.066 -3.234) 4.340 13.469 ( 1.373 -4.629 1.076) 4.947 13.675 ( 2.002 -2.175 0.767) 3.054 13.732 ( 1.058 -4.322 0.383) 4.466 14.128 ( -3.314 1.111 4.048) 5.348 14.183 ( -5.152 0.151 3.090) 6.010 14.406 ( -0.185 1.201 -2.199) 2.513 14.500 ( -3.637 -3.395 0.356) 4.988 14.826 ( -0.237 -0.189 2.285) 2.305 14.902 ( 0.790 -1.889 4.035) 4.525 15.187 ( -0.697 3.692 -4.519) 5.877 15.357 ( -2.148 -1.711 -0.777) 2.854 15.406 ( 2.755 9.854 -2.115) 10.448 15.749 ( -4.937 0.006 -1.500) 5.160 15.788 ( 1.765 -2.012 0.569) 2.736 15.830 ( 0.757 -0.931 -4.082) 4.255 16.229 ( 4.665 4.057 3.043) 6.890 16.400 ( 5.786 -3.787 2.281) 7.282 16.601 ( 0.850 4.315 -2.933) 5.286 16.735 ( -1.940 -3.240 -0.393) 3.797 16.792 ( -3.490 -1.325 0.993) 3.863 16.839 ( 1.741 -1.674 2.041) 3.162 17.124 ( 5.479 1.781 2.211) 6.171 17.161 ( 1.740 -0.039 1.997) 2.649 17.289 ( -8.073 1.604 1.552) 8.376 17.371 ( -3.363 -1.421 -2.742) 4.566 17.622 ( -2.298 6.279 -2.452) 7.121 17.873 ( 0.434 4.503 4.213) 6.182 17.927 ( -1.961 2.993 -0.829) 3.673 18.457 ( 1.515 -11.157 3.879) 11.909 18.651 ( -2.481 11.099 -4.200) 12.124 19.069 ( 0.490 -8.755 -3.520) 9.449 19.873 ( 2.698 -1.487 0.283) 3.093 19.903 ( 5.475 -3.523 -0.799) 6.559 20.176 ( 2.190 1.730 -0.391) 2.818 20.246 ( 1.350 -1.843 0.068) 2.285 ======================= Grid point 102 (50/104) ======================= q-point: (-0.50 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.345 ( -3.125 -0.142 0.714) 3.209 2.437 ( -0.473 -6.024 -2.060) 6.384 2.545 ( -7.948 1.781 3.383) 8.819 2.645 ( -0.340 -2.535 3.501) 4.335 2.670 ( 3.886 0.588 3.092) 5.001 2.820 ( 5.158 -3.224 0.635) 6.115 2.990 ( 3.575 0.382 4.941) 6.110 3.057 ( 1.732 -1.218 4.793) 5.239 3.196 ( 1.153 3.322 -1.352) 3.768 3.297 ( -0.493 2.239 -1.893) 2.973 3.330 ( -0.374 6.188 -1.036) 6.285 3.416 ( 0.514 4.478 0.449) 4.530 3.474 ( -0.172 -0.388 -2.852) 2.884 3.528 ( -3.500 1.171 -0.185) 3.695 3.710 ( -4.586 -0.196 1.700) 4.894 3.768 ( 2.783 0.651 2.504) 3.799 3.787 ( -0.648 -0.712 -0.718) 1.201 3.868 ( -6.311 2.859 -1.127) 7.020 3.929 ( 9.802 -3.067 0.909) 10.310 3.959 ( 0.071 2.165 2.777) 3.522 4.050 ( -4.015 3.820 5.291) 7.662 4.243 ( -1.919 -2.535 -0.750) 3.267 4.351 ( 4.374 5.777 0.952) 7.309 4.407 ( -0.477 1.150 -2.108) 2.448 4.421 ( -3.142 -0.843 1.405) 3.544 4.633 ( -3.448 -3.545 -3.149) 5.862 4.657 ( -0.627 -1.759 -2.102) 2.812 4.724 ( 3.592 0.610 -4.509) 5.797 4.735 ( -0.224 -3.513 0.349) 3.537 4.819 ( 4.072 -3.513 -0.706) 5.424 4.862 ( -0.393 -0.131 -0.378) 0.561 4.993 ( 0.889 -3.381 1.099) 3.665 5.026 ( -3.648 0.207 3.773) 5.252 5.160 ( 0.707 -4.621 -4.025) 6.168 5.424 ( 3.111 5.969 -2.387) 7.142 5.597 ( 1.141 0.389 -1.600) 2.003 5.723 ( -1.871 3.236 0.029) 3.738 5.771 ( -2.105 1.258 1.396) 2.822 5.921 ( -0.709 -0.272 -1.143) 1.372 6.034 ( 6.356 -4.494 -0.603) 7.808 6.207 ( -1.609 -1.511 -2.202) 3.118 6.247 ( -1.493 -3.169 -3.575) 5.005 6.568 ( -1.373 0.683 0.680) 1.677 6.605 ( 2.116 -0.787 1.067) 2.497 6.868 ( -0.192 5.512 1.007) 5.607 7.134 ( 2.452 -8.614 -2.959) 9.432 7.403 ( -1.420 2.298 6.058) 6.633 7.533 ( -4.942 -4.608 5.005) 8.409 7.996 ( -0.713 3.479 -0.217) 3.558 8.082 ( 0.810 0.326 -0.564) 1.040 8.200 ( -3.072 5.773 -4.281) 7.816 8.474 ( 0.778 -4.312 -9.423) 10.392 8.609 ( -0.521 6.479 -3.548) 7.405 8.680 ( 1.320 4.791 4.143) 6.470 8.783 ( 5.875 -0.373 -6.313) 8.631 8.896 ( 1.213 -5.949 1.455) 6.243 9.212 ( 4.248 1.622 6.683) 8.084 9.278 ( -2.359 7.109 -2.840) 8.011 9.414 ( -1.062 -4.396 6.675) 8.063 9.479 ( -0.432 -2.226 3.566) 4.226 9.692 ( -2.082 2.856 -2.184) 4.155 9.756 ( -0.629 -0.700 -3.187) 3.323 9.982 ( 0.401 -1.286 2.058) 2.460 10.007 ( 2.932 2.225 2.265) 4.321 10.123 ( 0.818 0.815 1.036) 1.551 10.180 ( -2.313 -2.477 2.457) 4.186 10.252 ( -1.347 1.717 4.860) 5.328 10.426 ( 2.152 -4.099 0.921) 4.720 10.961 ( -0.429 4.635 4.715) 6.626 11.161 ( -0.384 -3.852 -1.060) 4.013 11.194 ( -2.292 1.051 0.236) 2.533 11.286 ( -1.256 -2.568 0.007) 2.858 11.559 ( 2.488 -0.326 -3.563) 4.358 11.572 ( -0.313 -1.048 -2.393) 2.631 11.794 ( 0.373 2.747 -6.562) 7.123 11.871 ( 0.106 -0.055 -4.080) 4.082 12.050 ( -1.297 5.500 1.658) 5.889 12.173 ( -0.131 5.786 -0.934) 5.862 12.304 ( -0.985 -4.733 2.886) 5.630 12.427 ( 1.141 -4.124 -0.073) 4.279 12.987 ( -1.108 -0.247 0.965) 1.490 13.060 ( 0.941 -2.157 1.288) 2.683 13.151 ( -1.690 1.605 -1.761) 2.921 13.197 ( 1.530 0.160 -1.866) 2.418 13.389 ( -1.266 -0.657 -4.137) 4.376 13.468 ( -0.537 -3.271 -3.465) 4.795 13.702 ( -0.936 -2.042 1.818) 2.890 13.746 ( -0.333 -3.483 0.964) 3.629 14.127 ( -1.376 1.455 5.881) 6.213 14.168 ( 0.922 0.265 4.579) 4.679 14.422 ( 3.596 -0.209 -0.912) 3.716 14.455 ( -0.255 -2.379 -1.402) 2.773 14.829 ( -1.212 -0.322 1.703) 2.115 14.918 ( -2.979 -3.134 4.933) 6.560 15.186 ( 3.820 5.938 -4.435) 8.339 15.336 ( -0.217 -0.468 0.416) 0.663 15.437 ( 2.403 9.123 -2.157) 9.677 15.660 ( -3.526 3.735 1.110) 5.255 15.796 ( 0.419 -4.221 -2.761) 5.062 15.849 ( 2.721 -6.761 -3.122) 7.929 16.288 ( -1.015 6.724 3.900) 7.839 16.501 ( 1.969 -4.060 2.997) 5.417 16.612 ( 2.546 3.851 -2.051) 5.051 16.678 ( -1.488 -1.959 -1.926) 3.124 16.779 ( -0.047 0.152 3.189) 3.193 16.912 ( 2.362 -4.241 6.021) 7.734 17.117 ( -5.500 2.634 -4.125) 7.363 17.156 ( -5.266 1.301 -1.841) 5.729 17.211 ( 1.051 2.677 2.269) 3.663 17.355 ( 4.065 -1.177 -0.705) 4.290 17.582 ( -0.480 4.473 -0.986) 4.605 17.839 ( -1.711 -7.184 -4.538) 8.668 17.990 ( 3.019 12.993 9.307) 16.265 18.489 ( -1.800 -7.032 2.283) 7.609 18.620 ( 2.436 7.395 -1.705) 7.970 19.039 ( -0.025 -9.403 -5.774) 11.035 19.894 ( -0.647 -0.050 0.459) 0.795 19.955 ( 0.577 -3.414 -0.538) 3.504 20.193 ( -0.031 1.044 -0.749) 1.286 20.243 ( -1.234 -1.639 -1.533) 2.561 ======================= Grid point 103 (51/104) ======================= q-point: (-0.40 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.229 ( -10.591 -0.114 -0.900) 10.629 2.303 ( -13.167 5.858 4.273) 15.031 2.449 ( -3.750 -3.830 -0.247) 5.365 2.636 ( -2.940 -1.449 1.820) 3.749 2.723 ( 0.181 -0.446 0.033) 0.483 2.880 ( 0.002 -5.413 -0.233) 5.418 3.069 ( -8.011 8.544 -2.936) 12.075 3.100 ( 1.374 1.171 7.009) 7.238 3.166 ( 3.734 -0.518 8.375) 9.184 3.248 ( -3.459 -3.445 0.997) 4.982 3.349 ( -3.351 -2.712 -0.636) 4.358 3.360 ( -3.732 -0.007 0.053) 3.732 3.385 ( -3.711 6.119 -1.805) 7.381 3.506 ( 0.957 0.111 0.051) 0.965 3.626 ( -6.396 -0.278 2.277) 6.795 3.714 ( -5.196 4.807 -2.650) 7.558 3.766 ( -3.290 -2.505 1.698) 4.470 3.875 ( -0.073 1.712 -1.627) 2.363 3.951 ( 5.844 5.921 -1.023) 8.382 4.103 ( -1.167 2.730 4.348) 5.265 4.117 ( 7.733 -2.123 -0.262) 8.023 4.223 ( 3.079 -3.367 -0.735) 4.622 4.305 ( -5.605 -1.003 -1.651) 5.928 4.429 ( 0.929 0.839 -1.321) 1.820 4.451 ( 2.394 3.419 4.895) 6.433 4.558 ( -0.772 -3.585 -0.911) 3.779 4.603 ( -3.304 3.149 -2.691) 5.299 4.669 ( -6.939 -3.748 -2.579) 8.297 4.745 ( 2.220 2.155 -3.649) 4.784 4.827 ( -0.683 1.187 -0.790) 1.581 4.890 ( 2.074 -5.128 -1.592) 5.756 4.978 ( -4.129 0.952 3.015) 5.200 5.033 ( 2.564 -4.040 1.266) 4.949 5.126 ( -0.868 -4.894 -0.272) 4.978 5.476 ( 3.202 3.511 -1.432) 4.963 5.630 ( -0.456 -4.851 -5.745) 7.533 5.685 ( -1.718 2.328 1.495) 3.257 5.692 ( -0.311 -0.003 1.573) 1.603 5.996 ( 5.786 3.140 4.569) 8.014 6.123 ( 3.967 0.172 -5.772) 7.006 6.177 ( 1.698 -3.324 -0.054) 3.733 6.216 ( 1.078 -2.679 -4.615) 5.444 6.509 ( -5.421 1.850 0.918) 5.801 6.596 ( -2.829 -1.954 0.280) 3.449 6.855 ( -2.337 5.560 0.992) 6.112 7.124 ( -0.612 -8.258 -3.383) 8.945 7.438 ( -0.129 -0.187 7.719) 7.722 7.472 ( -5.081 -1.654 4.797) 7.181 7.971 ( -0.754 4.300 -2.073) 4.833 8.088 ( 1.609 3.338 -3.748) 5.271 8.116 ( -4.845 1.193 3.269) 5.965 8.396 ( -0.754 -7.259 -8.668) 11.331 8.558 ( -3.071 9.971 -1.366) 10.522 8.727 ( 0.689 3.181 -0.378) 3.277 8.833 ( 3.169 -1.468 -3.032) 4.625 8.939 ( 2.731 -4.315 0.019) 5.107 9.233 ( 0.593 8.080 -4.470) 9.253 9.364 ( 4.782 0.929 7.461) 8.911 9.439 ( -2.840 -2.128 7.203) 8.030 9.527 ( 2.762 -3.713 0.035) 4.628 9.625 ( -1.790 2.316 -1.529) 3.302 9.704 ( -1.800 -1.631 -4.189) 4.842 9.990 ( -0.110 3.838 1.784) 4.233 10.073 ( 1.832 -0.299 3.468) 3.934 10.147 ( -2.771 -1.062 1.940) 3.546 10.193 ( 3.165 -2.714 -0.448) 4.194 10.297 ( 3.312 5.339 7.155) 9.522 10.510 ( 6.024 -4.664 0.419) 7.630 10.967 ( -3.083 1.795 6.743) 7.629 11.098 ( -3.997 -4.752 -0.634) 6.242 11.189 ( 1.180 2.397 1.518) 3.073 11.260 ( -1.343 -1.352 -0.382) 1.944 11.461 ( -6.827 2.703 -7.202) 10.285 11.561 ( -1.952 -2.788 -4.147) 5.365 11.776 ( 2.586 1.222 -4.414) 5.260 11.871 ( 2.694 -2.567 -2.428) 4.443 12.053 ( 0.551 5.360 1.312) 5.545 12.189 ( 1.941 3.440 0.131) 3.952 12.332 ( 2.675 -0.801 1.246) 3.058 12.509 ( 7.585 -5.089 0.822) 9.171 12.983 ( -0.638 0.564 2.091) 2.257 13.048 ( -3.157 -0.378 -1.252) 3.417 13.142 ( 2.675 0.741 -1.438) 3.126 13.239 ( 4.077 -2.384 -2.011) 5.133 13.322 ( -2.740 0.538 -2.158) 3.529 13.435 ( -0.025 -3.504 -2.923) 4.563 13.657 ( -4.466 -0.395 0.788) 4.552 13.723 ( -3.096 -3.508 1.977) 5.080 14.154 ( 0.232 3.112 3.262) 4.514 14.251 ( 4.298 -0.949 3.504) 5.626 14.483 ( 4.149 -0.615 -1.155) 4.350 14.514 ( 4.658 -1.071 2.584) 5.433 14.807 ( -1.555 -0.706 -0.078) 1.709 14.875 ( -4.861 -2.940 4.247) 7.093 15.238 ( 5.044 5.991 -4.328) 8.948 15.348 ( 0.605 1.087 2.227) 2.551 15.471 ( 3.950 6.422 -4.113) 8.589 15.643 ( 0.194 3.506 1.597) 3.857 15.749 ( -2.317 -7.019 -5.757) 9.369 15.890 ( 3.430 -5.312 -0.485) 6.342 16.264 ( -4.124 5.119 4.162) 7.780 16.474 ( -5.946 -4.636 3.164) 8.177 16.638 ( 1.225 4.866 -1.935) 5.378 16.708 ( 4.274 0.073 -1.607) 4.566 16.825 ( 2.274 2.941 4.487) 5.827 16.947 ( -4.991 -1.721 2.578) 5.875 16.977 ( -5.237 0.376 -2.835) 5.967 17.055 ( -3.480 -2.803 0.055) 4.469 17.276 ( 5.805 5.792 0.706) 8.231 17.439 ( 4.594 1.822 -1.399) 5.136 17.602 ( 2.107 0.567 2.958) 3.676 17.789 ( 0.555 -6.154 -4.910) 7.892 18.129 ( 4.320 10.467 10.193) 15.235 18.426 ( -3.788 5.299 -3.713) 7.497 18.699 ( 4.780 -3.886 2.637) 6.701 18.984 ( -0.698 -8.912 -7.914) 11.939 19.849 ( -4.685 -1.164 -0.305) 4.837 19.911 ( -5.070 -4.199 -0.488) 6.601 20.162 ( -2.758 0.970 -0.511) 2.968 20.198 ( -1.834 -0.686 -1.110) 2.251 ======================= Grid point 104 (52/104) ======================= q-point: (-0.30 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.961 ( -17.458 8.914 2.732) 19.792 2.068 ( -16.973 12.422 2.993) 21.245 2.369 ( -4.467 -8.906 -0.238) 9.966 2.564 ( -5.804 -4.439 0.362) 7.316 2.691 ( -3.633 -2.033 -0.787) 4.237 2.800 ( -4.304 -0.917 -2.085) 4.869 2.946 ( -5.936 -1.443 -1.045) 6.197 3.076 ( -11.075 -4.645 0.153) 12.010 3.160 ( -3.540 5.073 2.296) 6.598 3.194 ( -8.854 6.372 1.396) 10.997 3.233 ( -5.753 0.258 2.937) 6.464 3.312 ( -1.171 1.193 2.696) 3.172 3.431 ( 2.421 0.415 0.272) 2.471 3.473 ( -10.263 0.325 0.591) 10.285 3.551 ( -5.701 -3.546 -0.736) 6.754 3.572 ( 0.534 4.462 4.998) 6.721 3.742 ( -1.874 -3.220 2.557) 4.519 3.861 ( 0.057 -4.137 -3.340) 5.317 3.919 ( -4.399 7.922 -5.147) 10.421 4.128 ( -2.313 1.954 0.327) 3.045 4.177 ( 3.808 2.674 -2.969) 5.520 4.207 ( -1.255 -3.124 -5.977) 6.860 4.286 ( -1.484 0.253 3.196) 3.533 4.371 ( -5.232 -1.494 -1.838) 5.743 4.464 ( -5.001 -1.534 1.871) 5.556 4.530 ( -1.998 1.558 -1.544) 2.967 4.562 ( -1.242 -0.699 1.692) 2.212 4.616 ( 3.445 0.829 3.786) 5.185 4.745 ( 0.477 1.927 -4.819) 5.212 4.775 ( 0.310 2.705 -4.042) 4.873 4.933 ( -1.833 -3.273 3.230) 4.950 4.949 ( 3.649 -5.637 0.469) 6.731 5.095 ( 2.021 -2.309 1.175) 3.286 5.137 ( 1.612 -3.239 1.575) 3.946 5.518 ( 1.346 -1.389 3.241) 3.775 5.543 ( -1.375 -4.133 -1.276) 4.539 5.713 ( 2.828 3.733 -3.593) 5.902 5.758 ( 4.736 -0.645 0.323) 4.790 6.091 ( 0.525 2.269 -8.292) 8.612 6.136 ( 4.441 1.342 4.498) 6.462 6.209 ( 6.417 0.495 -5.154) 8.246 6.338 ( 10.272 -5.024 2.721) 11.754 6.404 ( -6.417 2.262 0.908) 6.864 6.531 ( -3.280 -2.966 -1.724) 4.746 6.820 ( -1.470 6.161 1.815) 6.589 7.098 ( 0.251 -7.977 -1.637) 8.147 7.428 ( -3.297 2.460 3.686) 5.523 7.499 ( 0.492 -1.091 7.750) 7.842 7.945 ( -0.734 3.323 -1.630) 3.773 8.050 ( -5.376 3.771 4.885) 8.185 8.109 ( 2.704 -0.838 -3.182) 4.259 8.329 ( -1.418 -5.269 -6.672) 8.619 8.511 ( -0.512 8.970 1.207) 9.065 8.700 ( -0.895 2.695 -4.228) 5.093 8.849 ( -0.263 -0.954 -1.355) 1.678 8.967 ( 0.003 -4.332 -0.436) 4.354 9.201 ( -0.987 6.210 -6.082) 8.748 9.394 ( -5.057 2.261 0.589) 5.571 9.441 ( -3.347 -0.627 3.203) 4.675 9.497 ( 0.455 -3.767 -1.283) 4.006 9.654 ( 0.325 0.621 -3.147) 3.224 9.712 ( 5.362 -2.826 5.767) 8.366 9.986 ( -1.968 3.625 0.229) 4.131 10.091 ( -2.271 -1.928 1.381) 3.283 10.127 ( 0.176 2.161 1.354) 2.556 10.251 ( 3.822 -2.026 2.103) 4.810 10.413 ( 2.340 4.788 4.941) 7.267 10.625 ( 5.644 -5.013 -0.780) 7.589 10.977 ( -0.950 0.393 7.758) 7.826 11.063 ( 0.422 -2.879 1.113) 3.116 11.193 ( -6.230 1.993 0.006) 6.541 11.222 ( -3.315 -1.386 0.102) 3.595 11.308 ( -0.395 3.305 -3.951) 5.166 11.462 ( -2.810 -3.853 -4.051) 6.257 11.811 ( 3.303 0.167 -2.527) 4.162 11.911 ( 2.133 -3.796 0.205) 4.359 12.087 ( 2.295 5.341 0.503) 5.835 12.245 ( 3.496 0.254 2.278) 4.180 12.418 ( 6.454 4.351 -0.840) 7.829 12.694 ( 10.977 -5.732 0.244) 12.386 12.944 ( -5.147 2.489 -1.575) 5.930 13.001 ( 0.146 -0.869 1.287) 1.560 13.202 ( 4.268 -0.272 -0.985) 4.388 13.253 ( -1.014 -0.402 -2.076) 2.345 13.318 ( 3.371 -1.477 -0.705) 3.747 13.418 ( -1.874 -5.068 0.058) 5.404 13.590 ( -1.598 3.017 -0.120) 3.416 13.688 ( -1.738 -2.986 2.148) 4.068 14.176 ( 0.627 5.302 0.660) 5.379 14.352 ( 4.307 -3.248 1.770) 5.677 14.559 ( 3.206 0.145 0.365) 3.230 14.574 ( -1.608 0.133 5.741) 5.964 14.774 ( -2.092 -0.017 -0.649) 2.191 14.852 ( 1.692 -3.225 1.287) 3.862 15.304 ( 5.341 5.237 -3.804) 8.391 15.403 ( 4.554 1.847 0.374) 4.929 15.513 ( 3.316 2.708 -3.418) 5.478 15.636 ( -3.610 -5.986 -5.986) 9.203 15.678 ( 0.709 3.059 0.896) 3.266 15.954 ( 3.723 -5.918 -0.667) 7.024 16.216 ( -3.939 3.968 3.248) 6.466 16.380 ( -6.032 -1.878 2.125) 6.666 16.603 ( -3.873 4.598 -0.968) 6.089 16.757 ( 2.324 -0.544 -1.972) 3.097 16.824 ( -8.429 -1.700 -3.230) 9.186 16.855 ( -2.943 0.485 -0.303) 2.998 16.925 ( 2.853 3.676 5.759) 7.404 17.047 ( -0.139 -0.787 3.523) 3.612 17.394 ( 4.295 2.694 1.742) 5.361 17.498 ( 3.569 1.659 -2.009) 4.419 17.678 ( 3.886 0.582 2.015) 4.416 17.821 ( 5.241 -3.426 1.021) 6.344 18.275 ( 1.895 8.572 6.879) 11.153 18.322 ( -1.189 8.594 -4.563) 9.803 18.809 ( 5.026 -6.992 2.307) 8.915 18.901 ( -1.494 -7.950 -9.796) 12.704 19.711 ( -9.992 -3.373 -1.671) 10.678 19.769 ( -9.899 -5.421 -0.217) 11.288 20.107 ( -2.669 2.252 0.216) 3.499 20.171 ( -0.865 -0.801 0.506) 1.283 ======================= Grid point 105 (53/104) ======================= q-point: (-0.20 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.692 ( -15.041 18.219 5.885) 24.347 1.746 ( -20.335 19.183 5.745) 28.539 2.295 ( -4.047 -11.034 0.843) 11.783 2.443 ( -6.813 -12.692 -0.641) 14.419 2.607 ( -5.247 2.642 1.455) 6.052 2.691 ( -19.319 3.809 -1.284) 19.733 2.772 ( -13.629 0.736 0.785) 13.671 2.797 ( -7.879 -3.795 -5.439) 10.298 2.904 ( -17.450 5.681 5.096) 19.046 3.050 ( -10.975 3.824 3.362) 12.099 3.198 ( -1.972 -0.462 -0.209) 2.036 3.254 ( -1.495 1.068 -0.123) 1.842 3.369 ( -3.474 -3.281 0.743) 4.836 3.400 ( -1.519 3.934 -1.005) 4.335 3.503 ( -2.797 -2.718 1.873) 4.326 3.659 ( 2.488 1.305 4.193) 5.047 3.707 ( -3.469 -0.384 -0.412) 3.515 3.827 ( -1.484 3.655 -6.428) 7.542 3.859 ( -0.021 -6.139 0.493) 6.158 4.054 ( -2.029 -0.214 -2.778) 3.447 4.079 ( -4.289 -3.027 -6.692) 8.505 4.175 ( -1.620 -1.843 -3.063) 3.925 4.221 ( -7.541 2.153 2.256) 8.161 4.314 ( -6.415 -3.388 -0.752) 7.294 4.374 ( 2.604 -0.644 3.161) 4.145 4.553 ( 0.873 -2.979 1.185) 3.323 4.568 ( 1.223 4.206 -0.548) 4.414 4.659 ( 0.367 -0.075 -0.216) 0.433 4.743 ( 1.241 0.788 -0.074) 1.472 4.776 ( 1.023 1.975 -3.033) 3.761 4.956 ( 2.435 -0.603 3.075) 3.969 5.013 ( 1.452 -4.436 0.357) 4.681 5.146 ( 4.244 -0.462 1.090) 4.406 5.197 ( 3.901 -2.408 0.181) 4.588 5.537 ( 1.406 -0.757 -2.327) 2.823 5.597 ( 1.524 -1.788 5.667) 6.135 5.742 ( 4.292 4.106 -3.441) 6.864 5.838 ( 3.435 -2.627 0.953) 4.428 6.060 ( 2.959 3.128 -6.687) 7.954 6.224 ( 3.493 -3.041 0.193) 4.635 6.289 ( -2.573 4.845 1.780) 5.767 6.377 ( 6.518 1.289 0.288) 6.651 6.457 ( 3.597 -1.192 -5.775) 6.907 6.579 ( 11.342 -5.962 0.792) 12.838 6.837 ( 0.438 5.600 3.843) 6.806 7.098 ( -0.412 -6.994 0.485) 7.023 7.398 ( -1.909 5.567 0.980) 5.967 7.558 ( -0.077 -1.447 6.235) 6.401 7.915 ( -1.257 2.912 -1.546) 3.528 7.985 ( -4.996 2.460 5.000) 7.484 8.131 ( 1.432 -0.633 -3.857) 4.163 8.242 ( -2.783 -1.521 -4.989) 5.911 8.576 ( 4.602 3.499 3.776) 6.905 8.668 ( 1.191 3.618 -2.808) 4.732 8.803 ( -2.691 -0.310 -2.075) 3.412 8.925 ( -3.299 -4.797 -2.855) 6.484 9.097 ( -5.328 2.160 -6.599) 8.752 9.248 ( -6.968 -0.156 -6.896) 9.804 9.406 ( -1.567 2.261 0.912) 2.898 9.499 ( -2.576 -3.103 2.858) 4.943 9.657 ( 1.234 2.584 -1.925) 3.450 9.813 ( -0.268 -3.788 4.948) 6.237 9.950 ( -0.553 2.901 1.428) 3.281 10.045 ( -2.140 -2.646 0.144) 3.406 10.169 ( 3.608 4.297 0.612) 5.644 10.350 ( 4.755 -1.752 2.111) 5.490 10.439 ( -2.003 2.268 3.534) 4.653 10.674 ( 0.641 -6.611 -0.827) 6.693 10.984 ( -10.878 1.104 3.837) 11.587 11.011 ( -9.013 0.252 2.912) 9.476 11.073 ( 1.869 1.819 0.058) 2.609 11.221 ( 4.878 -5.948 1.529) 7.843 11.356 ( 4.385 1.854 -0.626) 4.802 11.456 ( 3.018 -2.771 -0.678) 4.153 11.848 ( 1.772 0.622 -0.123) 1.881 11.945 ( 1.376 -3.632 0.032) 3.884 12.139 ( 2.889 5.593 0.700) 6.333 12.350 ( 5.475 -3.209 3.994) 7.498 12.551 ( 9.299 9.711 -2.118) 13.611 12.757 ( -5.024 4.440 -1.753) 6.930 12.946 ( 8.198 -5.465 -4.289) 10.746 13.013 ( -0.492 -4.943 2.187) 5.427 13.204 ( -0.327 1.166 -2.211) 2.521 13.291 ( 2.859 -2.325 1.853) 4.124 13.344 ( -3.096 -1.184 -1.183) 3.520 13.393 ( 2.924 -1.745 2.479) 4.212 13.614 ( 3.169 4.554 0.390) 5.562 13.710 ( 3.147 -1.398 0.059) 3.444 14.178 ( -1.166 6.800 0.403) 6.911 14.406 ( -0.812 -5.330 1.482) 5.592 14.568 ( -0.813 -0.070 3.908) 3.992 14.594 ( 0.186 -1.217 3.544) 3.752 14.774 ( 2.427 2.635 -0.162) 3.586 14.907 ( 2.943 -2.643 -1.231) 4.143 15.371 ( 4.479 3.977 -2.897) 6.654 15.467 ( -0.235 1.419 -3.677) 3.948 15.533 ( 1.916 -1.807 -7.013) 7.491 15.541 ( -0.754 -2.740 1.780) 3.353 15.715 ( 3.324 3.571 -0.042) 4.879 16.011 ( 3.000 -7.570 -0.686) 8.171 16.162 ( -3.450 4.013 -0.455) 5.311 16.300 ( -3.333 0.982 0.250) 3.484 16.527 ( -3.555 1.846 0.878) 4.101 16.640 ( -9.009 -2.195 0.584) 9.290 16.774 ( -1.136 0.424 -0.118) 1.218 16.817 ( -0.065 -0.146 -1.036) 1.049 17.016 ( 2.601 5.198 4.947) 7.633 17.093 ( 2.737 0.570 2.298) 3.619 17.435 ( -1.066 -0.101 2.068) 2.329 17.502 ( -0.892 -2.460 -3.970) 4.755 17.801 ( 8.195 4.636 -0.220) 9.418 17.969 ( 6.227 -2.017 7.494) 9.950 18.180 ( -3.317 12.358 -6.535) 14.368 18.443 ( 5.570 3.934 6.773) 9.611 18.779 ( -2.958 -6.962 -13.265) 15.270 18.910 ( 3.958 -8.157 2.052) 9.296 19.464 ( -15.369 -3.691 -1.369) 15.865 19.577 ( -10.968 -6.829 0.959) 12.955 20.076 ( -1.524 3.791 1.694) 4.423 20.179 ( 1.425 -1.278 0.784) 2.068 ======================= Grid point 106 (54/104) ======================= q-point: (-0.10 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.456 ( -14.446 24.702 9.151) 30.043 1.518 ( -13.035 25.329 9.208) 29.938 2.179 ( -23.304 20.786 14.642) 34.490 2.242 ( -5.191 -8.911 2.714) 10.664 2.366 ( -5.179 -15.779 0.635) 16.619 2.441 ( -10.833 -1.809 -6.671) 12.851 2.607 ( -3.594 -1.571 -3.825) 5.479 2.687 ( -3.029 1.530 1.180) 3.593 2.732 ( -8.093 -3.878 5.036) 10.290 2.929 ( -5.530 1.379 6.471) 8.623 3.150 ( -1.639 -3.063 0.264) 3.483 3.241 ( -1.121 -5.377 1.202) 5.622 3.295 ( -2.762 0.390 -4.493) 5.289 3.426 ( 1.478 1.879 -0.132) 2.394 3.440 ( -4.806 -2.372 0.959) 5.445 3.603 ( -1.839 4.596 -5.249) 7.215 3.691 ( -1.289 0.029 0.340) 1.333 3.764 ( -2.080 4.812 -0.091) 5.243 3.827 ( -0.238 -1.616 -7.664) 7.836 4.009 ( -1.166 -3.896 -1.538) 4.348 4.037 ( 0.721 -6.902 -1.376) 7.075 4.109 ( -3.803 -3.230 -0.236) 4.995 4.191 ( 0.473 1.467 1.122) 1.907 4.219 ( -0.624 -4.007 3.185) 5.156 4.474 ( 3.929 1.879 3.118) 5.357 4.526 ( -1.003 1.072 -3.237) 3.555 4.584 ( 0.304 -2.124 -1.193) 2.455 4.649 ( -2.670 -0.802 -2.288) 3.607 4.750 ( 1.928 1.940 0.094) 2.737 4.791 ( 0.573 2.724 0.393) 2.811 4.996 ( -0.750 -1.150 0.168) 1.383 5.039 ( 1.407 -2.156 0.890) 2.724 5.211 ( 4.010 1.482 -3.347) 5.430 5.320 ( 7.344 -2.652 3.304) 8.479 5.506 ( -2.410 4.214 -3.274) 5.855 5.627 ( -1.529 0.331 3.008) 3.390 5.828 ( 5.453 0.991 -1.153) 5.661 5.886 ( 1.301 -0.988 0.506) 1.711 6.106 ( 2.993 1.058 -1.071) 3.350 6.222 ( 1.403 2.122 -2.345) 3.460 6.309 ( 1.050 0.188 0.951) 1.429 6.436 ( 5.158 -0.353 0.123) 5.171 6.609 ( 10.355 -0.316 -4.454) 11.276 6.746 ( 3.471 -2.831 0.615) 4.521 6.880 ( 2.908 1.903 2.647) 4.369 7.085 ( -1.567 -5.885 2.696) 6.660 7.374 ( -0.974 6.136 -0.001) 6.212 7.562 ( -3.105 -1.414 2.374) 4.156 7.909 ( 3.407 3.546 -3.073) 5.799 7.951 ( -3.395 2.545 4.202) 5.971 8.087 ( -1.224 -0.913 -6.641) 6.815 8.167 ( -2.157 -2.426 -3.932) 5.099 8.618 ( -4.228 2.170 2.398) 5.324 8.733 ( 4.280 2.327 -0.991) 4.971 8.802 ( 2.142 0.896 -1.476) 2.752 8.833 ( -0.023 -5.977 0.756) 6.025 8.937 ( -5.106 1.819 -6.723) 8.636 9.085 ( -3.749 -1.668 -8.585) 9.515 9.379 ( -1.630 2.403 -1.416) 3.230 9.437 ( -5.236 -3.150 1.322) 6.252 9.649 ( -0.083 2.632 -2.667) 3.748 9.785 ( -4.966 -2.028 2.609) 5.965 9.979 ( 2.478 2.930 2.790) 4.744 10.071 ( 2.226 -1.510 4.021) 4.838 10.267 ( 6.592 3.958 0.253) 7.693 10.399 ( -0.341 3.715 0.265) 3.740 10.454 ( 0.675 -4.997 4.348) 6.658 10.646 ( -3.646 -6.323 -0.994) 7.366 10.791 ( -7.869 -1.835 2.180) 8.369 10.849 ( -12.792 -4.640 5.833) 14.805 11.145 ( 2.931 4.846 2.799) 6.317 11.298 ( 0.765 -1.396 2.382) 2.865 11.444 ( 5.360 -1.013 -0.957) 5.539 11.513 ( 3.891 -3.433 -2.136) 5.611 11.866 ( -0.363 1.023 0.439) 1.171 11.956 ( 0.526 -3.890 -1.794) 4.316 12.196 ( 2.016 6.747 2.035) 7.330 12.479 ( 4.676 -6.439 3.349) 8.633 12.611 ( -1.744 6.441 -6.972) 9.651 12.752 ( 6.402 10.770 4.470) 13.303 12.913 ( -3.512 -6.690 -7.020) 10.313 13.098 ( 6.450 -4.065 -1.474) 7.765 13.215 ( 0.357 1.413 2.590) 2.972 13.301 ( -1.380 0.014 1.227) 1.847 13.319 ( 0.143 0.643 -0.132) 0.672 13.472 ( 2.329 -3.843 2.634) 5.209 13.698 ( 6.235 5.082 -2.126) 8.320 13.770 ( 3.481 0.710 -2.178) 4.167 14.143 ( -3.291 6.693 2.944) 8.018 14.350 ( -4.760 -4.641 1.442) 6.802 14.602 ( 0.395 -0.139 3.338) 3.364 14.668 ( 3.792 -2.356 4.376) 6.251 14.823 ( 2.870 1.749 0.573) 3.409 14.920 ( 0.342 -2.457 -3.088) 3.961 15.352 ( -4.839 3.158 -3.643) 6.831 15.410 ( -0.097 2.614 -7.914) 8.335 15.536 ( 3.273 -2.429 -2.930) 5.020 15.568 ( 0.798 -4.828 5.896) 7.662 15.817 ( 7.141 3.847 -0.159) 8.113 16.032 ( -1.106 -2.743 -0.601) 3.018 16.106 ( -0.955 1.674 -0.844) 2.104 16.269 ( 0.475 -1.240 -1.575) 2.060 16.454 ( -5.389 -0.925 -0.479) 5.489 16.551 ( -2.146 -2.296 2.311) 3.901 16.743 ( -1.517 2.997 1.384) 3.633 16.824 ( 0.087 -1.326 -0.555) 1.440 17.094 ( 3.071 5.581 3.052) 7.064 17.165 ( 3.476 1.292 0.511) 3.744 17.348 ( -7.803 -0.552 -4.145) 8.852 17.466 ( -0.315 -3.194 -1.683) 3.625 17.906 ( 3.230 5.368 -3.923) 7.392 18.002 ( -2.149 3.795 -4.796) 6.482 18.232 ( 7.314 4.325 3.811) 9.312 18.571 ( -8.300 -8.221 -10.970) 16.026 18.613 ( 7.103 4.950 8.100) 11.857 18.979 ( 2.277 -7.901 1.070) 8.292 19.209 ( -11.187 0.164 4.752) 12.156 19.410 ( -7.802 -8.240 1.862) 11.500 20.076 ( -0.502 5.291 3.262) 6.236 20.229 ( 2.970 -2.138 0.895) 3.767 ======================= Grid point 107 (55/104) ======================= q-point: ( 0.00 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.828 ( -4.249 -13.529 6.819) 15.735 1.828 ( -4.249 13.529 6.819) 15.735 1.943 ( -0.156 -15.557 8.647) 17.799 1.943 ( -0.156 15.557 8.647) 17.799 2.322 ( 5.519 -1.900 -5.016) 7.696 2.322 ( 5.519 1.900 -5.016) 7.696 2.564 ( -3.193 -5.387 2.585) 6.775 2.564 ( -3.193 5.387 2.585) 6.775 2.903 ( -0.082 -9.529 8.830) 12.992 2.903 ( -0.082 9.529 8.830) 12.992 3.118 ( 0.766 -4.571 3.919) 6.069 3.118 ( 0.766 4.571 3.919) 6.069 3.261 ( -0.532 -3.312 -4.838) 5.887 3.261 ( -0.532 3.312 -4.838) 5.887 3.547 ( -1.111 -9.072 1.075) 9.203 3.547 ( -1.111 9.072 1.075) 9.203 3.677 ( -0.341 -3.010 -4.334) 5.288 3.677 ( -0.341 3.010 -4.334) 5.288 3.892 ( 2.912 -5.968 1.764) 6.870 3.892 ( 2.912 5.968 1.764) 6.870 4.020 ( 0.633 -4.124 -4.916) 6.448 4.020 ( 0.633 4.124 -4.916) 6.448 4.258 ( 1.538 -2.425 5.076) 5.832 4.258 ( 1.538 2.425 5.076) 5.832 4.499 ( -0.296 -1.905 -5.117) 5.468 4.499 ( -0.296 1.905 -5.117) 5.468 4.574 ( -0.474 -1.198 -0.470) 1.371 4.574 ( -0.474 1.198 -0.470) 1.371 4.815 ( -0.018 -1.140 0.181) 1.154 4.815 ( -0.018 1.140 0.181) 1.154 4.967 ( -2.778 -2.430 -1.431) 3.958 4.967 ( -2.778 2.430 -1.431) 3.958 5.337 ( 1.723 -3.393 0.834) 3.896 5.337 ( 1.723 3.393 0.834) 3.896 5.562 ( -2.145 -2.741 -0.394) 3.503 5.562 ( -2.145 2.741 -0.394) 3.503 5.885 ( -0.127 -1.061 0.431) 1.152 5.885 ( -0.127 1.061 0.431) 1.152 6.178 ( 1.134 -5.699 -3.174) 6.621 6.178 ( 1.134 5.699 -3.174) 6.621 6.451 ( 1.351 -7.024 5.140) 8.808 6.451 ( 1.351 7.024 5.140) 8.808 6.736 ( 2.632 -2.659 -4.703) 6.010 6.736 ( 2.632 2.659 -4.703) 6.010 6.964 ( -2.141 -4.664 2.216) 5.590 6.964 ( -2.141 4.664 2.216) 5.590 7.469 ( -1.468 -3.965 1.789) 4.591 7.469 ( -1.468 3.965 1.789) 4.591 7.905 ( -6.640 -3.808 -3.648) 8.480 7.905 ( -6.640 3.808 -3.648) 8.480 8.098 ( 8.274 -3.711 -5.683) 10.701 8.098 ( 8.274 3.711 -5.683) 10.701 8.647 ( -1.069 -4.041 -0.645) 4.229 8.647 ( -1.069 4.041 -0.645) 4.229 8.794 ( -2.695 -4.412 -2.458) 5.725 8.794 ( -2.695 4.412 -2.458) 5.725 9.033 ( 8.052 -2.375 -0.898) 8.443 9.033 ( 8.052 2.375 -0.898) 8.443 9.342 ( -2.131 -1.335 -1.009) 2.710 9.342 ( -2.131 1.335 -1.009) 2.710 9.669 ( -1.094 -2.414 -0.874) 2.791 9.669 ( -1.094 2.414 -0.874) 2.791 10.130 ( 1.294 -1.575 4.664) 5.090 10.130 ( 1.294 1.575 4.664) 5.090 10.361 ( -4.326 -1.814 1.285) 4.864 10.361 ( -4.326 1.814 1.285) 4.864 10.503 ( -0.860 -2.833 2.112) 3.637 10.503 ( -0.860 2.833 2.112) 3.637 10.685 ( 0.992 -2.727 2.775) 4.015 10.685 ( 0.992 2.727 2.775) 4.015 11.277 ( -0.855 -3.524 2.687) 4.513 11.277 ( -0.855 3.524 2.687) 4.513 11.502 ( 1.110 -1.772 -1.141) 2.382 11.502 ( 1.110 1.772 -1.141) 2.382 11.876 ( -0.927 -2.552 -2.066) 3.412 11.876 ( -0.927 2.552 -2.066) 3.412 12.372 ( -2.199 -8.085 2.218) 8.667 12.372 ( -2.199 8.085 2.218) 8.667 12.681 ( 2.275 -6.825 -5.559) 9.091 12.681 ( 2.275 6.825 -5.559) 9.091 13.081 ( 2.037 -9.052 0.506) 9.292 13.081 ( 2.037 9.052 0.506) 9.292 13.214 ( -2.677 -1.242 1.253) 3.206 13.214 ( -2.677 1.242 1.253) 3.206 13.422 ( -0.281 -4.533 1.085) 4.670 13.422 ( -0.281 4.533 1.085) 4.670 13.800 ( 0.904 -0.679 -3.526) 3.703 13.800 ( 0.904 0.679 -3.526) 3.703 14.224 ( -1.573 -4.612 3.012) 5.729 14.224 ( -1.573 4.612 3.012) 5.729 14.641 ( -2.286 -3.212 1.468) 4.207 14.641 ( -2.286 3.212 1.468) 4.207 14.904 ( 2.349 -1.949 1.821) 3.555 14.904 ( 2.349 1.949 1.821) 3.555 15.298 ( -1.863 -1.543 -7.943) 8.303 15.298 ( -1.863 1.543 -7.943) 8.303 15.605 ( 3.894 -0.798 3.875) 5.551 15.605 ( 3.894 0.798 3.875) 5.551 15.959 ( -0.496 -3.314 0.001) 3.351 15.959 ( -0.496 3.314 0.001) 3.351 16.176 ( 0.824 -3.987 -1.186) 4.241 16.176 ( 0.824 3.987 -1.186) 4.241 16.455 ( -0.222 -3.829 1.319) 4.056 16.455 ( -0.222 3.829 1.319) 4.056 16.772 ( -1.077 -1.263 -1.090) 1.986 16.772 ( -1.077 1.263 -1.090) 1.986 17.153 ( -3.720 -1.674 -3.607) 5.445 17.153 ( -3.720 1.674 -3.607) 5.445 17.358 ( 2.197 -6.936 0.874) 7.328 17.358 ( 2.197 6.936 0.874) 7.328 17.946 ( -1.999 -2.205 -5.462) 6.220 17.946 ( -1.999 2.205 -5.462) 6.220 18.393 ( 0.762 -5.077 -0.715) 5.184 18.393 ( 0.762 5.077 -0.715) 5.184 18.864 ( 3.230 -6.158 2.865) 7.521 18.864 ( 3.230 6.158 2.865) 7.521 19.222 ( 0.364 -4.798 4.250) 6.420 19.222 ( 0.364 4.798 4.250) 6.420 20.196 ( -0.501 -4.840 2.980) 5.706 20.196 ( -0.501 4.840 2.980) 5.706 ======================= Grid point 109 (56/104) ======================= q-point: ( 0.10 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.848 ( 3.316 -17.152 2.659) 17.671 1.848 ( 3.316 17.152 2.659) 17.671 2.158 ( 12.113 -16.080 15.610) 25.475 2.158 ( 12.113 16.080 15.610) 25.475 2.421 ( 5.071 -2.472 -2.998) 6.389 2.421 ( 5.071 2.472 -2.998) 6.389 2.586 ( 8.317 -3.823 -4.597) 10.243 2.586 ( 8.317 3.823 -4.597) 10.243 2.965 ( 1.498 -5.410 1.744) 5.879 2.965 ( 1.498 5.410 1.744) 5.879 3.204 ( 4.501 -3.613 4.347) 7.225 3.204 ( 4.501 3.613 4.347) 7.225 3.288 ( 3.413 -6.735 2.354) 7.909 3.288 ( 3.413 6.735 2.354) 7.909 3.546 ( 0.463 -5.969 -0.628) 6.020 3.546 ( 0.463 5.969 -0.628) 6.020 3.684 ( 2.658 -2.250 1.840) 3.938 3.684 ( 2.658 2.250 1.840) 3.938 3.916 ( 3.899 -3.865 -2.985) 6.249 3.916 ( 3.899 3.865 -2.985) 6.249 4.056 ( 4.147 -5.152 -1.139) 6.711 4.056 ( 4.147 5.152 -1.139) 6.711 4.316 ( 0.793 -3.649 4.243) 5.652 4.316 ( 0.793 3.649 4.243) 5.652 4.449 ( 1.105 -4.243 -11.245) 12.069 4.449 ( 1.105 4.243 -11.245) 12.069 4.557 ( -2.009 -0.949 2.854) 3.617 4.557 ( -2.009 0.949 2.854) 3.617 4.819 ( 0.178 -4.067 0.793) 4.147 4.819 ( 0.178 4.067 0.793) 4.147 4.891 ( -3.492 -2.729 -2.689) 5.184 4.891 ( -3.492 2.729 -2.689) 5.184 5.306 ( -6.096 -3.462 2.072) 7.310 5.306 ( -6.096 3.462 2.072) 7.310 5.527 ( -1.387 -4.435 -0.574) 4.682 5.527 ( -1.387 4.435 -0.574) 4.682 5.875 ( -1.147 -2.193 0.898) 2.632 5.875 ( -1.147 2.193 0.898) 2.632 6.177 ( 1.839 -5.626 -3.735) 6.999 6.177 ( 1.839 5.626 -3.735) 6.999 6.420 ( -6.559 -6.357 3.282) 9.706 6.420 ( -6.559 6.357 3.282) 9.706 6.766 ( -2.156 -4.427 0.040) 4.924 6.766 ( -2.156 4.427 0.040) 4.924 6.876 ( -3.955 -8.484 -1.817) 9.535 6.876 ( -3.955 8.484 -1.817) 9.535 7.456 ( -2.768 -4.519 3.379) 6.285 7.456 ( -2.768 4.519 3.379) 6.285 7.804 ( 1.377 -4.373 -4.822) 6.653 7.804 ( 1.377 4.373 -4.822) 6.653 8.241 ( 8.927 -3.222 -2.869) 9.915 8.241 ( 8.927 3.222 -2.869) 9.915 8.641 ( 0.265 -0.890 -1.027) 1.385 8.641 ( 0.265 0.890 -1.027) 1.385 8.740 ( 0.182 -7.383 -3.439) 8.146 8.740 ( 0.182 7.383 -3.439) 8.146 9.169 ( 5.335 -2.263 0.074) 5.796 9.169 ( 5.335 2.263 0.074) 5.796 9.342 ( 4.024 -2.422 -2.272) 5.217 9.342 ( 4.024 2.422 -2.272) 5.217 9.677 ( 2.289 -2.854 -0.158) 3.662 9.677 ( 2.289 2.854 -0.158) 3.662 10.100 ( -6.616 -3.335 3.522) 8.204 10.100 ( -6.616 3.335 3.522) 8.204 10.270 ( -6.258 -1.674 1.126) 6.575 10.270 ( -6.258 1.674 1.126) 6.575 10.514 ( 1.486 -2.261 1.744) 3.218 10.514 ( 1.486 2.261 1.744) 3.218 10.831 ( 9.460 -4.540 2.325) 10.747 10.831 ( 9.460 4.540 2.325) 10.747 11.260 ( -2.947 -3.450 3.634) 5.813 11.260 ( -2.947 3.450 3.634) 5.813 11.467 ( -3.408 -1.724 -1.483) 4.097 11.467 ( -3.408 1.724 -1.483) 4.097 11.852 ( 0.040 -1.944 -1.687) 2.575 11.852 ( 0.040 1.944 -1.687) 2.575 12.311 ( -4.772 -5.400 1.589) 7.379 12.311 ( -4.772 5.400 1.589) 7.379 12.719 ( 3.732 -5.948 -4.623) 8.406 12.719 ( 3.732 5.948 -4.623) 8.406 13.025 ( -5.784 -6.715 0.590) 8.882 13.025 ( -5.784 6.715 0.590) 8.882 13.231 ( 2.364 -1.535 0.884) 2.954 13.231 ( 2.364 1.535 0.884) 2.954 13.402 ( -2.687 -2.187 2.174) 4.090 13.402 ( -2.687 2.187 2.174) 4.090 13.746 ( -3.662 -0.497 -3.073) 4.806 13.746 ( -3.662 0.497 -3.073) 4.806 14.236 ( 0.492 -3.928 2.179) 4.519 14.236 ( 0.492 3.928 2.179) 4.519 14.595 ( -3.454 -1.444 2.047) 4.267 14.595 ( -3.454 1.444 2.047) 4.267 14.916 ( -2.755 -2.149 1.292) 3.725 14.916 ( -2.755 2.149 1.292) 3.725 15.290 ( 6.254 -1.659 -6.110) 8.899 15.290 ( 6.254 1.659 -6.110) 8.899 15.651 ( -1.728 -3.620 0.321) 4.025 15.651 ( -1.728 3.620 0.321) 4.025 15.939 ( -0.743 -6.594 2.344) 7.037 15.939 ( -0.743 6.594 2.344) 7.037 16.164 ( -1.719 -0.933 -3.347) 3.876 16.164 ( -1.719 0.933 -3.347) 3.876 16.504 ( 4.492 -0.753 1.819) 4.904 16.504 ( 4.492 0.753 1.819) 4.904 16.779 ( 3.067 -3.347 -0.321) 4.551 16.779 ( 3.067 3.347 -0.321) 4.551 17.047 ( -5.007 -2.093 -1.369) 5.597 17.047 ( -5.007 2.093 -1.369) 5.597 17.425 ( 3.788 -5.153 -0.331) 6.404 17.425 ( 3.788 5.153 -0.331) 6.404 17.879 ( -2.062 -2.645 -3.010) 4.506 17.879 ( -2.062 2.645 -3.010) 4.506 18.365 ( -2.645 -6.688 -1.725) 7.395 18.365 ( -2.645 6.688 -1.725) 7.395 18.931 ( 1.668 -2.916 1.598) 3.720 18.931 ( 1.668 2.916 1.598) 3.720 19.332 ( 8.172 -1.732 3.135) 8.922 19.332 ( 8.172 1.732 3.135) 8.922 20.187 ( -2.420 -4.009 2.835) 5.475 20.187 ( -2.420 4.009 2.835) 5.475 ======================= Grid point 111 (57/104) ======================= q-point: ( 0.20 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.982 ( 8.747 -12.976 2.771) 15.892 1.982 ( 8.747 12.976 2.771) 15.892 2.390 ( 0.067 -8.758 5.267) 10.220 2.390 ( 0.067 8.758 5.267) 10.220 2.574 ( 15.150 -10.362 7.068) 19.668 2.574 ( 15.150 10.362 7.068) 19.668 2.768 ( 13.415 -8.286 -6.116) 16.912 2.768 ( 13.415 8.286 -6.116) 16.912 2.965 ( -0.998 -4.370 -3.382) 5.616 2.965 ( -0.998 4.370 -3.382) 5.616 3.275 ( -0.185 -1.573 1.376) 2.098 3.275 ( -0.185 1.573 1.376) 2.098 3.377 ( 6.056 -1.475 0.069) 6.233 3.377 ( 6.056 1.475 0.069) 6.233 3.541 ( 0.953 -4.726 -0.496) 4.847 3.541 ( 0.953 4.726 -0.496) 4.847 3.824 ( 7.246 -9.642 7.913) 14.425 3.824 ( 7.246 9.642 7.913) 14.425 4.066 ( 7.303 -2.375 -3.846) 8.589 4.066 ( 7.303 2.375 -3.846) 8.589 4.108 ( 7.175 -9.966 0.996) 12.320 4.108 ( 7.175 9.966 0.996) 12.320 4.309 ( -2.875 -3.566 -0.700) 4.634 4.309 ( -2.875 3.566 -0.700) 4.634 4.421 ( 3.009 -6.440 -4.750) 8.549 4.421 ( 3.009 6.440 -4.750) 8.549 4.562 ( 1.548 -2.912 1.590) 3.662 4.562 ( 1.548 2.912 1.590) 3.662 4.774 ( -2.800 -1.024 -5.526) 6.279 4.774 ( -2.800 1.024 -5.526) 6.279 4.868 ( 0.505 -1.003 2.515) 2.754 4.868 ( 0.505 1.003 2.515) 2.754 5.180 ( -8.175 -5.848 1.328) 10.139 5.180 ( -8.175 5.848 1.328) 10.139 5.498 ( -2.003 -6.380 2.308) 7.074 5.498 ( -2.003 6.380 2.308) 7.074 5.857 ( -1.644 -4.067 0.206) 4.392 5.857 ( -1.644 4.067 0.206) 4.392 6.177 ( -1.266 -2.000 -3.468) 4.199 6.177 ( -1.266 2.000 -3.468) 4.199 6.324 ( -2.496 -6.196 -1.565) 6.860 6.324 ( -2.496 6.196 -1.565) 6.860 6.594 ( -11.048 -4.641 1.288) 12.052 6.594 ( -11.048 4.641 1.288) 12.052 6.887 ( 2.278 -6.683 -0.931) 7.121 6.887 ( 2.278 6.683 -0.931) 7.121 7.424 ( -3.500 -4.790 5.725) 8.244 7.424 ( -3.500 4.790 5.725) 8.244 7.873 ( 7.457 -5.044 -3.510) 9.663 7.873 ( 7.457 5.044 -3.510) 9.663 8.331 ( 2.834 -4.802 -1.541) 5.785 8.331 ( 2.834 4.802 -1.541) 5.785 8.656 ( 2.764 -3.032 -2.071) 4.595 8.656 ( 2.764 3.032 -2.071) 4.595 8.747 ( 1.831 -8.839 -1.046) 9.087 8.747 ( 1.831 8.839 -1.046) 9.087 9.204 ( 1.533 -3.478 -5.032) 6.306 9.204 ( 1.533 3.478 -5.032) 6.306 9.449 ( 6.968 -2.584 0.839) 7.479 9.449 ( 6.968 2.584 0.839) 7.479 9.726 ( 1.612 -4.975 1.204) 5.367 9.726 ( 1.612 4.975 1.204) 5.367 10.002 ( -4.672 -2.869 -0.203) 5.486 10.002 ( -4.672 2.869 -0.203) 5.486 10.170 ( -5.113 -2.442 1.858) 5.963 10.170 ( -5.113 2.442 1.858) 5.963 10.549 ( -0.263 -2.378 1.449) 2.798 10.549 ( -0.263 2.378 1.449) 2.798 10.949 ( 1.164 -5.502 0.240) 5.629 10.949 ( 1.164 5.502 0.240) 5.629 11.250 ( -1.003 -2.638 3.718) 4.668 11.250 ( -1.003 2.638 3.718) 4.668 11.426 ( 1.885 -3.549 -0.365) 4.035 11.426 ( 1.885 3.549 -0.365) 4.035 11.847 ( 0.134 -0.514 -0.641) 0.832 11.847 ( 0.134 0.514 -0.641) 0.832 12.247 ( -3.439 -4.487 1.994) 5.995 12.247 ( -3.439 4.487 1.994) 5.995 12.675 ( -5.984 -5.427 -2.761) 8.538 12.675 ( -5.984 5.427 -2.761) 8.538 12.982 ( 0.927 -2.544 0.460) 2.747 12.982 ( 0.927 2.544 0.460) 2.747 13.270 ( 1.120 -2.670 -0.309) 2.912 13.270 ( 1.120 2.670 -0.309) 2.912 13.368 ( -2.474 -3.541 2.221) 4.857 13.368 ( -2.474 3.541 2.221) 4.857 13.662 ( -2.961 -1.418 -0.748) 3.367 13.662 ( -2.961 1.418 -0.748) 3.367 14.255 ( 0.041 -2.717 0.196) 2.725 14.255 ( 0.041 2.717 0.196) 2.725 14.548 ( -3.985 -2.222 3.075) 5.502 14.548 ( -3.985 2.222 3.075) 5.502 14.862 ( -2.923 -1.861 0.500) 3.501 14.862 ( -2.923 1.861 0.500) 3.501 15.369 ( 4.690 -3.381 -5.535) 8.004 15.369 ( 4.690 3.381 -5.535) 8.004 15.575 ( -3.745 -7.850 -1.072) 8.763 15.575 ( -3.745 7.850 -1.072) 8.763 15.964 ( -1.412 -4.225 3.964) 5.963 15.964 ( -1.412 4.225 3.964) 5.963 16.098 ( 0.669 -2.561 -4.768) 5.453 16.098 ( 0.669 2.561 -4.768) 5.453 16.620 ( 6.202 -4.423 0.616) 7.642 16.620 ( 6.202 4.423 0.616) 7.642 16.847 ( 2.711 -4.636 -1.189) 5.501 16.847 ( 2.711 4.636 -1.189) 5.501 16.974 ( -2.523 -2.226 3.896) 5.148 16.974 ( -2.523 2.226 3.896) 5.148 17.467 ( 1.040 -3.397 -1.267) 3.772 17.467 ( 1.040 3.397 -1.267) 3.772 17.828 ( -2.555 -2.902 0.870) 3.963 17.828 ( -2.555 2.902 0.870) 3.963 18.287 ( -3.617 -8.970 -3.325) 10.227 18.287 ( -3.617 8.970 -3.325) 10.227 18.942 ( -0.856 -5.798 -0.008) 5.861 18.942 ( -0.856 5.798 -0.008) 5.861 19.531 ( 11.337 -1.871 1.001) 11.533 19.531 ( 11.337 1.871 1.001) 11.533 20.167 ( -1.243 -2.471 2.084) 3.463 20.167 ( -1.243 2.471 2.084) 3.463 ======================= Grid point 113 (58/104) ======================= q-point: ( 0.30 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.175 ( 9.568 -5.782 2.350) 11.424 2.175 ( 9.568 5.782 2.350) 11.424 2.428 ( 2.685 -6.210 2.121) 7.090 2.428 ( 2.685 6.210 2.121) 7.090 2.789 ( 0.215 -3.076 0.391) 3.108 2.789 ( 0.215 3.076 0.391) 3.108 2.918 ( 3.095 -4.837 -2.249) 6.167 2.918 ( 3.095 4.837 -2.249) 6.167 2.985 ( 12.179 -6.348 -0.612) 13.747 2.985 ( 12.179 6.348 -0.612) 13.747 3.295 ( 2.934 -1.506 2.367) 4.060 3.295 ( 2.934 1.506 2.367) 4.060 3.465 ( 3.730 -6.508 0.063) 7.502 3.465 ( 3.730 6.508 0.063) 7.502 3.614 ( 4.880 -3.198 1.958) 6.155 3.614 ( 4.880 3.198 1.958) 6.155 3.930 ( -1.289 -6.017 -1.495) 6.333 3.930 ( -1.289 6.017 -1.495) 6.333 4.060 ( -0.195 -1.678 1.460) 2.233 4.060 ( -0.195 1.678 1.460) 2.233 4.193 ( -2.686 -0.488 -0.898) 2.874 4.193 ( -2.686 0.488 -0.898) 2.874 4.358 ( 6.060 -3.407 0.434) 6.966 4.358 ( 6.060 3.407 0.434) 6.966 4.467 ( 3.777 -2.305 1.364) 4.630 4.467 ( 3.777 2.305 1.364) 4.630 4.646 ( 6.443 -5.114 -3.503) 8.941 4.646 ( 6.443 5.114 -3.503) 8.941 4.700 ( -0.960 -1.154 -2.419) 2.847 4.700 ( -0.960 1.154 -2.419) 2.847 4.891 ( 0.401 -0.743 1.241) 1.501 4.891 ( 0.401 0.743 1.241) 1.501 5.066 ( -4.021 -3.243 0.697) 5.213 5.066 ( -4.021 3.243 0.697) 5.213 5.515 ( 2.264 -7.704 2.597) 8.439 5.515 ( 2.264 7.704 2.597) 8.439 5.803 ( -4.644 -4.075 0.498) 6.199 5.803 ( -4.644 4.075 0.498) 6.199 6.049 ( -5.550 -6.722 -6.335) 10.776 6.049 ( -5.550 6.722 -6.335) 10.776 6.343 ( 0.498 -2.934 1.190) 3.205 6.343 ( 0.498 2.934 1.190) 3.205 6.464 ( -1.798 -6.167 -1.448) 6.585 6.464 ( -1.798 6.167 -1.448) 6.585 6.921 ( 1.969 -6.045 0.122) 6.359 6.921 ( 1.969 6.045 0.122) 6.359 7.427 ( -1.486 -4.496 7.511) 8.879 7.427 ( -1.486 4.496 7.511) 8.879 7.969 ( 4.647 -3.990 -1.491) 6.304 7.969 ( 4.647 3.990 -1.491) 6.304 8.365 ( 3.620 -5.785 -3.329) 7.593 8.365 ( 3.620 5.785 -3.329) 7.593 8.681 ( 1.759 -3.209 -2.941) 4.694 8.681 ( 1.759 3.209 -2.941) 4.694 8.775 ( 0.881 -7.272 0.103) 7.326 8.775 ( 0.881 7.272 0.103) 7.326 9.195 ( 1.450 -3.700 -3.136) 5.062 9.195 ( 1.450 3.700 -3.136) 5.062 9.548 ( 0.699 -2.723 2.446) 3.726 9.548 ( 0.699 2.723 2.446) 3.726 9.726 ( -1.266 -4.255 0.471) 4.464 9.726 ( -1.266 4.255 0.471) 4.464 9.952 ( 0.631 -4.097 -2.820) 5.013 9.952 ( 0.631 4.097 -2.820) 5.013 10.127 ( -1.647 -4.249 2.707) 5.301 10.127 ( -1.647 4.249 2.707) 5.301 10.486 ( -7.497 -1.793 1.515) 7.856 10.486 ( -7.497 1.793 1.515) 7.856 10.962 ( 1.936 -4.212 1.406) 4.845 10.962 ( 1.936 4.212 1.406) 4.845 11.246 ( -0.866 -3.479 0.825) 3.679 11.246 ( -0.866 3.479 0.825) 3.679 11.514 ( 5.119 -2.022 -0.232) 5.509 11.514 ( 5.119 2.022 -0.232) 5.509 11.848 ( 0.782 -0.907 -0.713) 1.394 11.848 ( 0.782 0.907 -0.713) 1.394 12.214 ( -2.105 -5.587 2.300) 6.398 12.214 ( -2.105 5.587 2.300) 6.398 12.514 ( -8.903 -4.726 -1.438) 10.182 12.514 ( -8.903 4.726 -1.438) 10.182 13.011 ( 0.730 -4.459 0.407) 4.536 13.011 ( 0.730 4.459 0.407) 4.536 13.256 ( -1.321 -2.494 -1.784) 3.339 13.256 ( -1.321 2.494 -1.784) 3.339 13.370 ( 1.393 -4.516 1.772) 5.047 13.370 ( 1.393 4.516 1.772) 5.047 13.642 ( 0.347 -2.052 0.750) 2.212 13.642 ( 0.347 2.052 0.750) 2.212 14.225 ( -3.383 -2.633 0.078) 4.288 14.225 ( -3.383 2.633 0.078) 4.288 14.495 ( -3.614 -3.159 1.552) 5.045 14.495 ( -3.614 3.159 1.552) 5.045 14.837 ( -0.768 -1.782 2.175) 2.915 14.837 ( -0.768 1.782 2.175) 2.915 15.336 ( -2.284 -4.879 -4.884) 7.271 15.336 ( -2.284 4.879 -4.884) 7.271 15.568 ( 2.782 -9.998 -1.666) 10.511 15.568 ( 2.782 9.998 -1.666) 10.511 15.902 ( -4.894 -0.915 -0.387) 4.994 15.902 ( -4.894 0.915 -0.387) 4.994 16.171 ( 6.980 -5.556 0.931) 8.970 16.171 ( 6.980 5.556 0.931) 8.970 16.703 ( 2.619 -5.639 -1.667) 6.438 16.703 ( 2.619 5.639 -1.667) 6.438 16.816 ( -2.904 -2.771 -0.633) 4.064 16.816 ( -2.904 2.771 -0.633) 4.064 17.041 ( 3.908 -2.147 5.687) 7.227 17.041 ( 3.908 2.147 5.687) 7.227 17.434 ( -3.490 -1.900 -1.679) 4.314 17.434 ( -3.490 1.900 -1.679) 4.314 17.797 ( -2.395 -5.887 1.926) 6.641 17.797 ( -2.395 5.887 1.926) 6.641 18.208 ( -2.249 -13.400 -1.986) 13.732 18.208 ( -2.249 13.400 -1.986) 13.732 18.913 ( -1.338 -9.492 -1.861) 9.765 18.913 ( -1.338 9.492 -1.861) 9.765 19.730 ( 9.598 -1.068 -0.045) 9.657 19.730 ( 9.598 1.068 -0.045) 9.657 20.179 ( 1.106 -1.998 1.173) 2.568 20.179 ( 1.106 1.998 1.173) 2.568 ======================= Grid point 115 (59/104) ======================= q-point: ( 0.40 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.328 ( 5.499 -1.833 0.202) 5.800 2.328 ( 5.499 1.833 0.202) 5.800 2.522 ( 4.243 -3.930 5.100) 7.711 2.522 ( 4.243 3.930 5.100) 7.711 2.727 ( -2.865 -1.354 -1.021) 3.330 2.727 ( -2.865 1.354 -1.021) 3.330 2.959 ( 1.848 -3.419 0.391) 3.906 2.959 ( 1.848 3.419 0.391) 3.906 3.180 ( 8.353 -5.953 -0.405) 10.265 3.180 ( 8.353 5.953 -0.405) 10.265 3.402 ( 4.173 -2.385 2.445) 5.392 3.402 ( 4.173 2.385 2.445) 5.392 3.544 ( 4.820 -5.148 0.052) 7.052 3.544 ( 4.820 5.148 0.052) 7.052 3.682 ( 2.055 -0.913 0.701) 2.356 3.682 ( 2.055 0.913 0.701) 2.356 3.831 ( -5.782 -1.422 -1.818) 6.226 3.831 ( -5.782 1.422 -1.818) 6.226 4.024 ( -4.073 -1.449 0.169) 4.326 4.024 ( -4.073 1.449 0.169) 4.326 4.172 ( -1.677 -3.965 3.766) 5.720 4.172 ( -1.677 3.965 3.766) 5.720 4.398 ( 0.598 -2.416 -0.540) 2.547 4.398 ( 0.598 2.416 -0.540) 2.547 4.544 ( 0.975 -7.481 1.016) 7.612 4.544 ( 0.975 7.481 1.016) 7.612 4.654 ( 1.548 -1.814 -4.821) 5.379 4.654 ( 1.548 1.814 -4.821) 5.379 4.717 ( 1.890 -2.673 -1.388) 3.556 4.717 ( 1.890 2.673 -1.388) 3.556 4.913 ( 0.540 -4.716 1.580) 5.003 4.913 ( 0.540 4.716 1.580) 5.003 5.058 ( 1.230 -1.800 0.190) 2.188 5.058 ( 1.230 1.800 0.190) 2.188 5.562 ( 0.066 -8.019 -1.927) 8.247 5.562 ( 0.066 8.019 -1.927) 8.247 5.770 ( 2.172 -3.569 3.551) 5.483 5.770 ( 2.172 3.569 3.551) 5.483 5.939 ( -2.115 -6.361 -5.797) 8.862 5.939 ( -2.115 6.361 -5.797) 8.862 6.274 ( -5.329 -2.767 -0.569) 6.031 6.274 ( -5.329 2.767 -0.569) 6.031 6.524 ( 5.546 -1.664 -0.645) 5.826 6.524 ( 5.546 1.664 -0.645) 5.826 6.959 ( 1.877 -6.105 0.231) 6.391 6.959 ( 1.877 6.105 0.231) 6.391 7.458 ( -1.429 -4.384 6.714) 8.145 7.458 ( -1.429 4.384 6.714) 8.145 8.025 ( 1.778 -2.379 1.433) 3.297 8.025 ( 1.778 2.379 1.433) 3.297 8.399 ( 3.738 -7.349 -8.919) 12.146 8.399 ( 3.738 7.349 -8.919) 12.146 8.692 ( 2.488 -3.352 -3.479) 5.434 8.692 ( 2.488 3.352 -3.479) 5.434 8.777 ( -0.704 -4.566 1.525) 4.865 8.777 ( -0.704 4.566 1.525) 4.865 9.217 ( 1.221 -5.682 2.502) 6.327 9.217 ( 1.221 5.682 2.502) 6.327 9.491 ( -6.479 -3.099 2.694) 7.671 9.491 ( -6.479 3.099 2.694) 7.671 9.737 ( 1.707 -1.564 -1.553) 2.788 9.737 ( 1.707 1.564 -1.553) 2.788 9.964 ( 2.240 -3.388 -2.167) 4.604 9.964 ( 2.240 3.388 -2.167) 4.604 10.132 ( -0.519 -3.317 2.853) 4.406 10.132 ( -0.519 3.317 2.853) 4.406 10.362 ( -6.386 -4.437 3.403) 8.488 10.362 ( -6.386 4.437 3.403) 8.488 11.029 ( 3.085 -5.999 1.238) 6.858 11.029 ( 3.085 5.999 1.238) 6.858 11.246 ( -0.178 -2.886 1.333) 3.184 11.246 ( -0.178 2.886 1.333) 3.184 11.555 ( 1.243 -0.232 -2.771) 3.046 11.555 ( 1.243 0.232 -2.771) 3.046 11.864 ( 1.653 -1.916 -2.872) 3.828 11.864 ( 1.653 1.916 -2.872) 3.828 12.194 ( -2.058 -6.781 1.892) 7.334 12.194 ( -2.058 6.781 1.892) 7.334 12.366 ( -5.490 -6.812 -0.910) 8.796 12.366 ( -5.490 6.812 -0.910) 8.796 13.011 ( -0.687 -2.553 0.817) 2.768 13.011 ( -0.687 2.553 0.817) 2.768 13.217 ( -1.567 -1.379 -1.435) 2.533 13.217 ( -1.567 1.379 -1.435) 2.533 13.414 ( 2.050 -1.256 -1.062) 2.628 13.414 ( 2.050 1.256 -1.062) 2.628 13.669 ( 1.550 -1.754 1.093) 2.583 13.669 ( 1.550 1.754 1.093) 2.583 14.162 ( -3.658 -1.978 2.797) 5.012 14.162 ( -3.658 1.978 2.797) 5.012 14.442 ( -2.175 -2.598 -0.908) 3.508 14.442 ( -2.175 2.598 -0.908) 3.508 14.853 ( -0.474 -2.606 3.957) 4.762 14.853 ( -0.474 2.606 3.957) 4.762 15.282 ( 0.207 -5.385 -3.394) 6.369 15.282 ( 0.207 5.385 -3.394) 6.369 15.602 ( 2.252 -10.279 -2.421) 10.798 15.602 ( 2.252 10.279 -2.421) 10.798 15.817 ( -3.506 -1.417 -1.404) 4.034 15.817 ( -3.506 1.417 -1.404) 4.034 16.318 ( 6.728 -4.790 3.048) 8.803 16.318 ( 6.728 4.790 3.048) 8.803 16.679 ( -2.148 -3.292 -2.770) 4.809 16.679 ( -2.148 3.292 -2.770) 4.809 16.797 ( -0.638 -2.052 3.502) 4.109 16.797 ( -0.638 2.052 3.502) 4.109 17.150 ( 4.179 -1.028 2.685) 5.073 17.150 ( 4.179 1.028 2.685) 5.073 17.332 ( -5.807 -2.500 -1.544) 6.508 17.332 ( -5.807 2.500 -1.544) 6.508 17.756 ( -2.234 -7.513 -1.838) 8.051 17.756 ( -2.234 7.513 -1.838) 8.051 18.195 ( 0.270 -15.326 3.513) 15.726 18.195 ( 0.270 15.326 3.513) 15.726 18.874 ( -0.685 -11.501 -3.776) 12.124 18.874 ( -0.685 11.501 -3.776) 12.124 19.863 ( 5.071 -0.659 -0.267) 5.120 19.863 ( 5.071 0.659 -0.267) 5.120 20.210 ( 1.337 -1.908 -0.003) 2.330 20.210 ( 1.337 1.908 -0.003) 2.330 ======================= Grid point 117 (60/104) ======================= q-point: (-0.50 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.357 ( -1.716 -2.176 -1.244) 3.038 2.357 ( -1.716 2.176 -1.244) 3.038 2.595 ( -1.515 -2.661 4.272) 5.256 2.595 ( -1.515 2.661 4.272) 5.256 2.730 ( 1.815 -5.160 4.054) 6.808 2.730 ( 1.815 5.160 4.054) 6.808 3.016 ( 3.185 -2.249 4.451) 5.917 3.016 ( 3.185 2.249 4.451) 5.917 3.269 ( 1.616 -3.756 -1.867) 4.495 3.269 ( 1.616 3.756 -1.867) 4.495 3.412 ( -2.762 -3.663 -1.539) 4.838 3.412 ( -2.762 3.663 -1.539) 4.838 3.554 ( -2.961 -3.813 -2.306) 5.350 3.554 ( -2.961 3.813 -2.306) 5.350 3.704 ( -2.250 -1.200 0.175) 2.556 3.704 ( -2.250 1.200 0.175) 2.556 3.826 ( 6.489 -4.201 1.882) 7.956 3.826 ( 6.489 4.201 1.882) 7.956 3.965 ( -1.451 -3.167 1.393) 3.752 3.965 ( -1.451 3.167 1.393) 3.752 4.155 ( -2.751 -6.208 3.627) 7.698 4.155 ( -2.751 6.208 3.627) 7.698 4.421 ( 2.251 -0.756 -1.144) 2.636 4.421 ( 2.251 0.756 -1.144) 2.636 4.480 ( -4.717 -7.355 -1.587) 8.881 4.480 ( -4.717 7.355 -1.587) 8.881 4.675 ( 1.028 -2.194 -0.693) 2.520 4.675 ( 1.028 2.194 -0.693) 2.520 4.764 ( 4.293 -2.784 -2.812) 5.838 4.764 ( 4.293 2.784 -2.812) 5.838 4.918 ( -0.771 -4.773 0.434) 4.854 4.918 ( -0.771 4.773 0.434) 4.854 5.064 ( -0.988 -3.908 0.915) 4.133 5.064 ( -0.988 3.908 0.915) 4.133 5.545 ( 1.620 -5.411 -2.790) 6.300 5.545 ( 1.620 5.411 -2.790) 6.300 5.772 ( -5.664 -1.561 -0.593) 5.905 5.772 ( -5.664 1.561 -0.593) 5.905 5.956 ( 6.578 -3.458 -0.385) 7.441 5.956 ( 6.578 3.458 -0.385) 7.441 6.197 ( -1.685 -1.254 -2.487) 3.255 6.197 ( -1.685 1.254 -2.487) 3.255 6.587 ( 0.804 -1.134 0.144) 1.398 6.587 ( 0.804 1.134 0.144) 1.398 6.985 ( 0.544 -6.959 0.293) 6.987 6.985 ( 0.544 6.959 0.293) 6.987 7.458 ( -3.237 -3.427 5.766) 7.448 7.458 ( -3.237 3.427 5.766) 7.448 8.052 ( -0.260 -2.534 1.720) 3.074 8.052 ( -0.260 2.534 1.720) 3.074 8.345 ( -1.348 -8.081 -10.625) 13.417 8.345 ( -1.348 8.081 -10.625) 13.417 8.729 ( 4.189 -4.512 -5.781) 8.446 8.729 ( 4.189 4.512 -5.781) 8.446 8.788 ( 0.430 -4.869 3.676) 6.116 8.788 ( 0.430 4.869 3.676) 6.116 9.284 ( 2.735 -5.353 6.342) 8.738 9.284 ( 2.735 5.353 6.342) 8.738 9.419 ( -3.008 -4.699 2.848) 6.264 9.419 ( -3.008 4.699 2.848) 6.264 9.728 ( -0.970 -1.971 -3.470) 4.107 9.728 ( -0.970 1.971 -3.470) 4.107 10.006 ( 3.511 -2.732 -0.373) 4.464 10.006 ( 3.511 2.732 -0.373) 4.464 10.135 ( -1.309 -2.451 2.469) 3.718 10.135 ( -1.309 2.451 2.469) 3.718 10.332 ( -0.282 -5.449 4.897) 7.331 10.332 ( -0.282 5.449 4.897) 7.331 11.059 ( -1.103 -5.542 1.309) 5.800 11.059 ( -1.103 5.542 1.309) 5.800 11.239 ( -1.305 -2.468 0.326) 2.811 11.239 ( -1.305 2.468 0.326) 2.811 11.560 ( 1.241 -0.367 -2.270) 2.613 11.560 ( 1.241 0.367 -2.270) 2.613 11.844 ( -0.009 -2.364 -6.144) 6.583 11.844 ( -0.009 2.364 -6.144) 6.583 12.165 ( -1.979 -6.082 1.448) 6.557 12.165 ( -1.979 6.082 1.448) 6.557 12.325 ( 1.293 -6.200 -0.252) 6.338 12.325 ( 1.293 6.200 -0.252) 6.338 13.011 ( -0.200 -2.479 1.573) 2.942 13.011 ( -0.200 2.479 1.573) 2.942 13.183 ( -0.529 -1.522 -2.199) 2.726 13.183 ( -0.529 1.522 -2.199) 2.726 13.409 ( -0.695 -2.503 -3.066) 4.018 13.409 ( -0.695 2.503 -3.066) 4.018 13.696 ( -0.336 -1.436 1.637) 2.204 13.696 ( -0.336 1.436 1.637) 2.204 14.156 ( -0.044 -1.357 4.902) 5.087 14.156 ( -0.044 1.357 4.902) 5.087 14.425 ( 1.953 -0.743 -1.874) 2.807 14.425 ( 1.953 0.743 -1.874) 2.807 14.858 ( -2.555 -2.835 4.286) 5.739 14.858 ( -2.555 2.835 4.286) 5.739 15.291 ( 2.522 -4.346 -2.169) 5.473 15.291 ( 2.522 4.346 -2.169) 5.473 15.611 ( 0.768 -9.073 -2.801) 9.526 15.611 ( 0.768 9.073 -2.801) 9.526 15.766 ( -0.649 -3.852 -1.584) 4.215 15.766 ( -0.649 3.852 -1.584) 4.215 16.409 ( -0.403 -5.716 3.231) 6.578 16.409 ( -0.403 5.716 3.231) 6.578 16.653 ( 2.174 -1.210 -1.530) 2.921 16.653 ( 2.174 1.210 -1.530) 2.921 16.825 ( 0.062 -4.449 6.175) 7.611 16.825 ( 0.062 4.449 6.175) 7.611 17.154 ( -5.539 -1.247 -3.165) 6.500 17.154 ( -5.539 1.247 -3.165) 6.500 17.290 ( 3.659 -4.705 1.264) 6.093 17.290 ( 3.659 4.705 1.264) 6.093 17.700 ( -1.195 -7.209 -3.945) 8.304 17.700 ( -1.195 7.209 -3.945) 8.304 18.255 ( 1.603 -14.226 7.358) 16.097 18.255 ( 1.603 14.226 7.358) 16.097 18.834 ( -0.003 -11.896 -5.746) 13.211 18.834 ( -0.003 11.896 -5.746) 13.211 19.907 ( -0.060 -1.573 -0.163) 1.582 19.907 ( -0.060 1.573 -0.163) 1.582 20.214 ( -0.637 -1.293 -0.935) 1.718 20.214 ( -0.637 1.293 -0.935) 1.718 ======================= Grid point 119 (61/104) ======================= q-point: (-0.40 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.273 ( -6.414 -4.311 -0.268) 7.732 2.273 ( -6.414 4.311 -0.268) 7.732 2.537 ( -7.689 -7.948 3.616) 11.635 2.537 ( -7.689 7.948 3.616) 11.635 2.771 ( -0.454 -4.778 0.830) 4.871 2.771 ( -0.454 4.778 0.830) 4.871 3.120 ( -0.277 -1.030 8.235) 8.304 3.120 ( -0.277 1.030 8.235) 8.304 3.207 ( -3.226 -2.510 -3.637) 5.471 3.207 ( -3.226 2.510 -3.637) 5.471 3.330 ( -4.274 -1.180 0.857) 4.516 3.330 ( -4.274 1.180 0.857) 4.516 3.496 ( -1.384 -2.708 -0.729) 3.127 3.496 ( -1.384 2.708 -0.729) 3.127 3.655 ( -3.385 -4.638 0.043) 5.742 3.655 ( -3.385 4.638 0.043) 5.742 3.841 ( -4.344 -5.148 -1.478) 6.896 3.841 ( -4.344 5.148 -1.478) 6.896 4.062 ( 7.974 -4.215 -0.917) 9.066 4.062 ( 7.974 4.215 -0.917) 9.066 4.157 ( 0.736 -2.787 3.430) 4.481 4.157 ( 0.736 2.787 3.430) 4.481 4.356 ( -4.690 -6.490 -2.383) 8.354 4.356 ( -4.690 6.490 -2.383) 8.354 4.495 ( 2.279 -1.482 2.736) 3.857 4.495 ( 2.279 1.482 2.736) 3.857 4.648 ( -2.656 -0.466 -2.578) 3.731 4.648 ( -2.656 0.466 -2.578) 3.731 4.803 ( 1.985 -3.748 -2.196) 4.776 4.803 ( 1.985 3.748 -2.196) 4.776 4.893 ( -1.552 -5.481 -1.533) 5.899 4.893 ( -1.552 5.481 -1.533) 5.899 5.059 ( -0.407 -2.836 2.873) 4.058 5.059 ( -0.407 2.836 2.873) 4.058 5.538 ( -1.981 -3.914 -3.566) 5.653 5.538 ( -1.981 3.914 -3.566) 5.653 5.702 ( 0.658 -0.467 0.998) 1.283 5.702 ( 0.658 0.467 0.998) 1.283 6.077 ( 6.177 -4.652 2.006) 7.988 6.077 ( 6.177 4.652 2.006) 7.988 6.166 ( 0.967 -2.189 -5.482) 5.981 6.166 ( 0.967 2.189 -5.482) 5.981 6.553 ( -4.015 -2.519 -0.029) 4.740 6.553 ( -4.015 2.519 -0.029) 4.740 6.974 ( -1.686 -7.159 -0.070) 7.355 6.974 ( -1.686 7.159 -0.070) 7.355 7.447 ( -2.544 -0.967 7.253) 7.746 7.447 ( -2.544 0.967 7.253) 7.746 8.043 ( -0.930 -3.437 -0.676) 3.624 8.043 ( -0.930 3.437 -0.676) 3.624 8.249 ( -1.575 -8.035 -6.183) 10.260 8.249 ( -1.575 8.035 -6.183) 10.260 8.724 ( -0.296 -6.089 -4.321) 7.472 8.724 ( -0.296 6.089 -4.321) 7.472 8.842 ( 2.389 -4.821 1.285) 5.532 8.842 ( 2.389 4.821 1.285) 5.532 9.376 ( 2.767 -3.013 0.957) 4.201 9.376 ( 2.767 3.013 0.957) 4.201 9.424 ( -0.609 -4.115 6.120) 7.399 9.424 ( -0.609 4.115 6.120) 7.399 9.665 ( -1.814 -2.117 -3.777) 4.694 9.665 ( -1.814 2.117 -3.777) 4.694 10.061 ( 1.053 -2.222 0.448) 2.499 10.061 ( 1.053 2.222 0.448) 2.499 10.140 ( 0.966 -1.430 2.223) 2.814 10.140 ( 0.966 1.430 2.223) 2.814 10.409 ( 4.563 -5.912 4.456) 8.697 10.409 ( 4.563 5.912 4.456) 8.697 11.016 ( -4.152 -3.523 2.849) 6.145 11.016 ( -4.152 3.523 2.849) 6.145 11.231 ( 0.396 -1.870 0.587) 2.000 11.231 ( 0.396 1.870 0.587) 2.000 11.512 ( -4.730 -2.515 -4.904) 7.263 11.512 ( -4.730 2.515 -4.904) 7.263 11.816 ( 1.988 -2.841 -4.369) 5.578 11.816 ( 1.988 2.841 -4.369) 5.578 12.158 ( 0.040 -5.024 1.504) 5.244 12.158 ( 0.040 5.024 1.504) 5.244 12.398 ( 6.715 -6.104 -0.135) 9.076 12.398 ( 6.715 6.104 -0.135) 9.076 13.015 ( -0.894 -2.411 1.067) 2.784 13.015 ( -0.894 2.411 1.067) 2.784 13.181 ( 2.274 -3.126 -2.133) 4.415 13.181 ( 2.274 3.126 -2.133) 4.415 13.365 ( -1.701 -3.388 -1.914) 4.247 13.365 ( -1.701 3.388 -1.914) 4.247 13.672 ( -2.873 -1.843 1.244) 3.633 13.672 ( -2.873 1.843 1.244) 3.633 14.211 ( 2.292 -2.866 3.279) 4.921 14.211 ( 2.292 2.866 3.279) 4.921 14.490 ( 5.389 -1.195 -0.035) 5.520 14.490 ( 5.389 1.195 -0.035) 5.520 14.823 ( -3.951 -2.193 3.316) 5.605 14.823 ( -3.951 2.193 3.316) 5.605 15.333 ( 3.823 -3.076 -2.170) 5.366 15.333 ( 3.823 3.076 -2.170) 5.366 15.589 ( -0.853 -6.920 -2.988) 7.586 15.589 ( -0.853 6.920 -2.988) 7.586 15.771 ( 2.072 -6.977 -1.350) 7.402 15.771 ( 2.072 6.977 -1.350) 7.402 16.370 ( -5.024 -5.821 3.466) 8.435 16.370 ( -5.024 5.821 3.466) 8.435 16.703 ( 2.960 -1.410 -1.439) 3.581 16.703 ( 2.960 1.410 -1.439) 3.581 16.887 ( 0.810 -3.646 6.224) 7.259 16.887 ( 0.810 3.646 6.224) 7.259 17.005 ( -6.733 -2.262 -2.669) 7.588 17.005 ( -6.733 2.262 -2.669) 7.588 17.393 ( 5.761 -5.612 0.612) 8.066 17.393 ( 5.761 5.612 0.612) 8.066 17.672 ( 1.381 -5.879 -2.962) 6.726 17.672 ( 1.381 5.879 -2.962) 6.726 18.343 ( 1.581 -10.757 7.878) 13.427 18.343 ( 1.581 10.757 7.878) 13.427 18.791 ( 0.679 -10.376 -7.596) 12.877 18.791 ( 0.679 10.376 -7.596) 12.877 19.854 ( -5.720 -1.725 -0.415) 5.989 19.854 ( -5.720 1.725 -0.415) 5.989 20.181 ( -2.024 -0.997 -0.617) 2.339 20.181 ( -2.024 0.997 -0.617) 2.339 ======================= Grid point 121 (62/104) ======================= q-point: (-0.30 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.139 ( -8.276 -8.975 1.598) 12.312 2.139 ( -8.276 8.975 1.598) 12.312 2.369 ( -12.595 -12.517 1.293) 17.804 2.369 ( -12.595 12.517 1.293) 17.804 2.731 ( -3.296 -4.365 -0.146) 5.472 2.731 ( -3.296 4.365 -0.146) 5.472 2.987 ( -10.941 -4.130 -1.938) 11.854 2.987 ( -10.941 4.130 -1.938) 11.854 3.217 ( -1.921 -1.770 3.505) 4.372 3.217 ( -1.921 1.770 3.505) 4.372 3.302 ( -1.856 -3.487 3.532) 5.299 3.302 ( -1.856 3.487 3.532) 5.299 3.456 ( -5.800 -3.686 0.088) 6.873 3.456 ( -5.800 3.686 0.088) 6.873 3.589 ( -2.200 -8.432 0.918) 8.762 3.589 ( -2.200 8.432 0.918) 8.762 3.745 ( -3.448 -7.293 0.253) 8.071 3.745 ( -3.448 7.293 0.253) 8.071 4.084 ( -3.138 -7.399 -4.662) 9.291 4.084 ( -3.138 7.399 -4.662) 9.291 4.184 ( -1.565 -1.400 -6.700) 7.021 4.184 ( -1.565 1.400 -6.700) 7.021 4.303 ( 0.071 -2.207 4.817) 5.299 4.303 ( 0.071 2.207 4.817) 5.299 4.494 ( -4.973 -4.206 0.266) 6.519 4.494 ( -4.973 4.206 0.266) 6.519 4.602 ( 0.110 -2.704 2.132) 3.445 4.602 ( 0.110 2.704 2.132) 3.445 4.796 ( 0.167 -2.473 -5.165) 5.729 4.796 ( 0.167 2.473 -5.165) 5.729 4.889 ( 2.150 -0.908 2.322) 3.292 4.889 ( 2.150 0.908 2.322) 3.292 5.093 ( 2.326 -1.717 1.253) 3.151 5.093 ( 2.326 1.717 1.253) 3.151 5.493 ( -0.525 -0.652 2.357) 2.501 5.493 ( -0.525 0.652 2.357) 2.501 5.754 ( 3.876 -0.866 -2.530) 4.709 5.754 ( 3.876 0.866 -2.530) 4.709 6.133 ( 0.969 -1.729 -4.331) 4.763 6.133 ( 0.969 1.729 -4.331) 4.763 6.247 ( 10.224 -3.928 0.562) 10.967 6.247 ( 10.224 3.928 0.562) 10.967 6.466 ( -4.763 -3.749 -0.369) 6.073 6.466 ( -4.763 3.749 -0.369) 6.073 6.950 ( -0.421 -7.456 0.434) 7.480 6.950 ( -0.421 7.456 0.434) 7.480 7.471 ( -1.019 -1.914 7.412) 7.723 7.471 ( -1.019 1.914 7.412) 7.723 8.011 ( -1.455 -3.629 -1.958) 4.372 8.011 ( -1.455 3.629 -1.958) 4.372 8.205 ( -0.317 -6.914 -2.383) 7.320 8.205 ( -0.317 6.914 -2.383) 7.320 8.678 ( -1.010 -6.401 -3.439) 7.336 8.678 ( -1.010 6.401 -3.439) 7.336 8.868 ( -0.338 -4.578 0.122) 4.592 8.868 ( -0.338 4.578 0.122) 4.592 9.353 ( -4.156 -7.898 -6.663) 11.138 9.353 ( -4.156 7.898 -6.663) 11.138 9.438 ( -1.420 -0.845 5.789) 6.021 9.438 ( -1.420 0.845 5.789) 6.021 9.671 ( 3.219 -1.504 0.508) 3.589 9.671 ( 3.219 1.504 0.508) 3.589 10.045 ( -2.342 -2.769 0.221) 3.633 10.045 ( -2.342 2.769 0.221) 3.633 10.192 ( 2.456 -3.847 2.147) 5.044 10.192 ( 2.456 3.847 2.147) 5.044 10.520 ( 3.500 -5.930 2.006) 7.172 10.520 ( 3.500 5.930 2.006) 7.172 11.002 ( 0.554 -2.516 4.769) 5.420 11.002 ( 0.554 2.516 4.769) 5.420 11.216 ( -5.562 -0.598 0.066) 5.595 11.216 ( -5.562 0.598 0.066) 5.595 11.382 ( -1.808 -4.311 -4.235) 6.308 11.382 ( -1.808 4.311 -4.235) 6.308 11.843 ( 2.664 -2.944 -1.314) 4.182 11.843 ( 2.664 2.944 -1.314) 4.182 12.187 ( 1.930 -4.877 1.754) 5.530 12.187 ( 1.930 4.877 1.754) 5.530 12.554 ( 10.333 -8.303 -0.322) 13.260 12.554 ( 10.333 8.303 -0.322) 13.260 12.985 ( -2.730 -1.289 -0.315) 3.035 12.985 ( -2.730 1.289 -0.315) 3.035 13.218 ( 2.516 -2.328 -1.876) 3.908 13.218 ( 2.516 2.328 -1.876) 3.908 13.338 ( -0.379 -2.957 0.605) 3.042 13.338 ( -0.379 2.957 0.605) 3.042 13.641 ( -0.532 -2.361 0.782) 2.543 13.641 ( -0.532 2.361 0.782) 2.543 14.272 ( 2.364 -4.830 1.170) 5.503 14.272 ( 2.364 4.830 1.170) 5.503 14.570 ( 0.719 -0.664 2.968) 3.125 14.570 ( 0.719 0.664 2.968) 3.125 14.794 ( 0.268 -2.308 1.063) 2.555 14.794 ( 0.268 2.308 1.063) 2.555 15.399 ( 5.737 -3.318 -4.610) 8.074 15.399 ( 5.737 3.318 -4.610) 8.074 15.545 ( -2.098 -2.517 -1.006) 3.428 15.545 ( -2.098 2.517 -1.006) 3.428 15.805 ( 2.381 -8.649 -1.493) 9.094 15.805 ( 2.381 8.649 -1.493) 9.094 16.307 ( -4.327 -4.909 3.093) 7.238 16.307 ( -4.327 4.909 3.093) 7.238 16.703 ( -3.167 -4.840 -1.338) 5.937 16.703 ( -3.167 4.840 -1.338) 5.937 16.832 ( -3.769 -1.900 -2.644) 4.981 16.832 ( -3.769 1.900 -2.644) 4.981 17.001 ( 1.812 -3.707 6.350) 7.573 17.001 ( 1.812 3.707 6.350) 7.573 17.468 ( 1.863 -3.996 -0.915) 4.503 17.468 ( 1.863 3.996 -0.915) 4.503 17.737 ( 7.007 -4.797 0.621) 8.515 17.737 ( 7.007 4.797 0.621) 8.515 18.407 ( -0.008 -2.710 4.870) 5.573 18.407 ( -0.008 2.710 4.870) 5.573 18.757 ( 1.924 -4.203 -7.653) 8.941 18.757 ( 1.924 4.204 -7.653) 8.941 19.697 ( -10.854 -1.872 -0.602) 11.031 19.697 ( -10.854 1.872 -0.602) 11.031 20.145 ( -1.540 -1.725 0.484) 2.363 20.145 ( -1.540 1.725 0.484) 2.363 ======================= Grid point 123 (63/104) ======================= q-point: (-0.20 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.021 ( -6.274 -13.809 3.749) 15.624 2.021 ( -6.274 13.809 3.749) 15.624 2.127 ( -14.298 -16.628 1.882) 22.011 2.127 ( -14.298 16.628 1.882) 22.011 2.668 ( -5.591 -3.208 1.262) 6.568 2.668 ( -5.591 3.208 1.262) 6.568 2.740 ( -12.836 -0.768 -4.401) 13.591 2.740 ( -12.836 0.768 -4.401) 13.591 3.113 ( -13.559 -2.071 4.396) 14.404 3.113 ( -13.559 2.071 4.396) 14.404 3.210 ( -7.718 -5.229 -0.731) 9.351 3.210 ( -7.718 5.229 -0.731) 9.351 3.372 ( -1.115 -5.408 2.749) 6.168 3.372 ( -1.115 5.408 2.749) 6.168 3.598 ( -0.367 -11.188 1.904) 11.355 3.598 ( -0.367 11.188 1.904) 11.355 3.731 ( -0.896 -3.898 2.362) 4.645 3.731 ( -0.896 3.898 2.362) 4.645 3.935 ( -5.573 -8.598 -8.009) 13.005 3.935 ( -5.573 8.598 -8.009) 13.005 4.089 ( -1.539 -2.377 -5.638) 6.310 4.089 ( -1.539 2.377 -5.638) 6.310 4.265 ( -6.546 -2.354 1.181) 7.056 4.265 ( -6.546 2.354 1.181) 7.056 4.471 ( 1.827 -5.736 3.439) 6.933 4.471 ( 1.827 5.736 3.439) 6.933 4.637 ( 0.546 -2.468 0.152) 2.533 4.637 ( 0.546 2.468 0.152) 2.533 4.766 ( 0.898 -1.970 -3.119) 3.797 4.766 ( 0.898 1.970 -3.119) 3.797 4.964 ( 2.577 -1.040 3.233) 4.264 4.964 ( 2.577 1.040 3.233) 4.264 5.162 ( 5.093 -1.567 -0.595) 5.361 5.162 ( 5.093 1.567 -0.595) 5.361 5.547 ( 2.570 -2.291 3.843) 5.159 5.547 ( 2.570 2.291 3.843) 5.159 5.799 ( 3.484 -2.091 -2.186) 4.614 5.799 ( 3.484 2.091 -2.186) 4.614 6.137 ( 2.970 -4.857 -4.324) 7.149 6.137 ( 2.970 4.857 -4.324) 7.149 6.373 ( -2.163 -3.277 1.068) 4.069 6.373 ( -2.163 3.277 1.068) 4.069 6.476 ( 11.846 -4.395 -1.717) 12.751 6.476 ( 11.846 4.395 -1.717) 12.751 6.962 ( 0.327 -7.182 1.544) 7.354 6.962 ( 0.327 7.182 1.544) 7.354 7.499 ( -1.031 -4.568 4.431) 6.447 7.499 ( -1.031 4.568 4.431) 6.447 7.970 ( -1.701 -2.755 -0.495) 3.275 7.970 ( -1.701 2.755 -0.495) 3.275 8.178 ( -1.347 -4.254 -2.657) 5.193 8.178 ( -1.347 4.254 -2.657) 5.193 8.667 ( 1.851 -4.251 -0.306) 4.646 8.667 ( 1.851 4.251 -0.306) 4.646 8.829 ( -2.889 -4.049 -2.036) 5.374 8.829 ( -2.889 4.049 -2.036) 5.374 9.184 ( -7.344 -5.499 -7.843) 12.070 9.184 ( -7.344 5.499 -7.843) 12.070 9.451 ( -1.482 -2.397 2.867) 4.020 9.451 ( -1.482 2.397 2.867) 4.020 9.726 ( 0.902 -4.590 2.103) 5.128 9.726 ( 0.902 4.590 2.103) 5.128 10.000 ( -1.473 -2.339 -0.613) 2.831 10.000 ( -1.473 2.339 -0.613) 2.831 10.265 ( 3.851 -5.474 2.733) 7.229 10.265 ( 3.851 5.474 2.733) 7.229 10.542 ( -1.485 -6.886 0.741) 7.083 10.542 ( -1.485 6.886 0.741) 7.083 11.004 ( -11.815 -0.932 2.999) 12.225 11.004 ( -11.815 0.932 2.999) 12.225 11.126 ( 5.275 -3.868 0.534) 6.563 11.126 ( 5.275 3.868 0.534) 6.563 11.402 ( 3.397 -2.753 -0.821) 4.449 11.402 ( 3.397 2.753 -0.821) 4.449 11.881 ( 1.736 -2.735 0.040) 3.240 11.881 ( 1.736 2.735 0.040) 3.240 12.252 ( 3.550 -6.022 2.156) 7.316 12.252 ( 3.550 6.022 2.156) 7.316 12.745 ( 9.830 -8.268 -1.525) 12.935 12.745 ( 9.830 8.268 -1.525) 12.935 12.914 ( -3.560 -4.349 -1.048) 5.717 12.914 ( -3.560 4.349 -1.048) 5.717 13.242 ( 1.594 -2.625 -0.498) 3.111 13.242 ( 1.594 2.625 -0.498) 3.111 13.353 ( 0.436 -1.855 2.079) 2.820 13.353 ( 0.436 1.855 2.079) 2.820 13.680 ( 4.416 -2.294 -0.405) 4.993 13.680 ( 4.416 2.294 -0.405) 4.993 14.298 ( -0.901 -6.006 0.992) 6.153 14.298 ( -0.901 6.006 0.992) 6.153 14.573 ( -0.910 -0.784 3.805) 3.990 14.573 ( -0.910 0.784 3.805) 3.990 14.841 ( 3.042 -3.918 -0.415) 4.977 14.841 ( 3.042 3.918 -0.415) 4.977 15.448 ( 3.389 -4.219 -5.162) 7.478 15.448 ( 3.389 4.219 -5.162) 7.478 15.510 ( -1.286 -2.470 -1.146) 3.011 15.510 ( -1.286 2.470 -1.146) 3.011 15.842 ( 3.057 -8.865 -0.118) 9.378 15.842 ( 3.057 8.865 -0.118) 9.378 16.253 ( -3.210 -4.538 0.151) 5.561 16.253 ( -3.210 4.538 0.151) 5.561 16.588 ( -6.732 -3.457 -0.184) 7.570 16.588 ( -6.732 3.457 -0.184) 7.570 16.797 ( -0.407 -1.594 -0.073) 1.647 16.797 ( -0.407 1.594 -0.073) 1.647 17.083 ( 2.835 -1.841 4.338) 5.499 17.083 ( 2.835 1.841 4.338) 5.499 17.456 ( -1.755 -2.094 -1.664) 3.199 17.456 ( -1.755 2.094 -1.664) 3.199 17.897 ( 7.844 -5.026 2.617) 9.677 17.897 ( 7.844 5.026 2.617) 9.677 18.400 ( -1.583 -9.351 -1.940) 9.681 18.400 ( -1.583 9.351 -1.940) 9.681 18.761 ( 2.815 -6.035 -3.524) 7.534 18.761 ( 2.815 6.035 -3.524) 7.534 19.473 ( -12.986 -3.673 0.254) 13.498 19.473 ( -12.986 3.673 0.254) 13.498 20.139 ( 0.143 -2.834 1.429) 3.177 20.139 ( 0.143 2.834 1.429) 3.177 ======================= Grid point 125 (64/104) ======================= q-point: (-0.10 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.913 ( -10.776 -22.283 5.958) 25.459 1.913 ( -10.776 22.283 5.958) 25.459 1.969 ( -4.960 -20.423 5.983) 21.852 1.969 ( -4.960 20.423 5.983) 21.852 2.407 ( -11.862 -2.121 -5.394) 13.202 2.407 ( -11.862 2.121 -5.394) 13.202 2.630 ( -4.984 -4.105 2.527) 6.934 2.630 ( -4.984 4.105 2.527) 6.934 2.914 ( -9.062 -10.325 6.860) 15.355 2.914 ( -9.062 10.325 6.860) 15.355 3.121 ( -3.155 -3.890 1.656) 5.275 3.121 ( -3.155 3.890 1.656) 5.275 3.339 ( -3.120 -4.332 -2.826) 6.040 3.339 ( -3.120 4.332 -2.826) 6.040 3.579 ( -3.287 -11.021 2.176) 11.705 3.579 ( -3.287 11.021 2.176) 11.705 3.718 ( 0.498 -6.428 -3.981) 7.578 3.718 ( 0.498 6.428 -3.981) 7.578 3.840 ( -0.259 -3.774 -1.663) 4.132 3.840 ( -0.259 3.774 -1.663) 4.132 4.054 ( 0.583 -3.463 -5.126) 6.214 4.054 ( 0.583 3.463 -5.126) 6.214 4.208 ( -1.069 -1.266 4.552) 4.845 4.208 ( -1.069 1.266 4.552) 4.845 4.520 ( 0.467 -2.076 1.647) 2.691 4.520 ( 0.467 2.076 1.647) 2.691 4.599 ( -1.538 -3.544 -3.652) 5.317 4.599 ( -1.538 3.544 -3.652) 5.317 4.796 ( 2.381 -1.864 -0.450) 3.058 4.796 ( 2.381 1.864 -0.450) 3.058 5.000 ( -0.596 -1.531 1.436) 2.182 5.000 ( -0.596 1.531 1.436) 2.182 5.260 ( 5.845 -3.303 -0.845) 6.767 5.260 ( 5.845 3.303 -0.845) 6.767 5.589 ( -0.627 -3.894 1.693) 4.292 5.589 ( -0.627 3.894 1.693) 4.292 5.858 ( 3.119 -1.786 0.015) 3.594 5.858 ( 3.119 1.786 0.015) 3.594 6.167 ( 2.646 -4.906 -2.906) 6.286 6.167 ( 2.646 4.906 -2.906) 6.286 6.369 ( 2.223 -4.661 1.214) 5.305 6.369 ( 2.223 4.661 1.214) 5.305 6.674 ( 9.617 -4.610 -3.218) 11.140 6.674 ( 9.617 4.610 -3.218) 11.140 6.964 ( -1.493 -6.207 2.739) 6.947 6.964 ( -1.493 6.207 2.739) 6.947 7.491 ( -1.957 -5.553 1.663) 6.118 7.491 ( -1.957 5.553 1.663) 6.118 7.960 ( 0.907 -1.662 -0.377) 1.931 7.960 ( 0.907 1.662 -0.377) 1.931 8.108 ( -3.005 -3.060 -5.103) 6.666 8.108 ( -3.005 3.060 -5.103) 6.666 8.698 ( -2.350 -5.676 0.358) 6.153 8.698 ( -2.350 5.676 0.358) 6.153 8.791 ( 2.417 -1.748 0.699) 3.064 8.791 ( 2.417 1.748 0.699) 3.064 9.014 ( -3.341 -5.199 -8.537) 10.539 9.014 ( -3.341 5.199 -8.537) 10.539 9.409 ( -4.082 -0.862 0.395) 4.191 9.409 ( -4.082 0.862 0.395) 4.191 9.715 ( -2.930 -4.348 0.684) 5.287 9.715 ( -2.930 4.348 0.684) 5.287 10.032 ( 4.329 -2.463 2.528) 5.585 10.032 ( 4.329 2.463 2.528) 5.585 10.357 ( 3.269 -5.136 2.590) 6.616 10.357 ( 3.269 5.136 2.590) 6.616 10.507 ( -2.083 -7.208 0.495) 7.519 10.507 ( -2.083 7.208 0.495) 7.519 10.792 ( -12.015 -1.618 2.947) 12.477 10.792 ( -12.015 1.618 2.947) 12.477 11.236 ( 3.463 -4.498 2.906) 6.377 11.236 ( 3.463 4.498 2.906) 6.377 11.460 ( 3.937 -2.148 -1.815) 4.838 11.460 ( 3.937 2.148 -1.815) 4.838 11.896 ( 0.022 -2.340 -0.618) 2.421 11.896 ( 0.022 2.340 -0.618) 2.421 12.336 ( 3.349 -7.828 2.508) 8.876 12.336 ( 3.349 7.828 2.508) 8.876 12.746 ( -3.704 -7.357 -5.373) 9.834 12.746 ( -3.704 7.357 -5.373) 9.834 12.976 ( 7.655 -8.601 0.539) 11.527 12.976 ( 7.655 8.601 0.539) 11.527 13.254 ( -1.697 -2.685 2.045) 3.778 13.254 ( -1.697 2.685 2.045) 3.778 13.389 ( 2.345 -4.557 1.126) 5.248 13.389 ( 2.345 4.557 1.126) 5.248 13.764 ( 4.974 -1.747 -2.383) 5.786 13.764 ( 4.974 1.747 -2.383) 5.786 14.257 ( -3.755 -5.387 1.956) 6.852 14.257 ( -3.755 5.387 1.956) 6.852 14.621 ( 2.122 -2.069 3.662) 4.711 14.621 ( 2.122 2.069 3.662) 4.711 14.868 ( 1.105 -2.797 -1.130) 3.212 14.868 ( 1.105 2.797 -1.130) 3.212 15.418 ( -3.615 -2.916 -6.772) 8.211 15.418 ( -3.615 2.916 -6.772) 8.211 15.508 ( 3.130 -1.371 2.032) 3.976 15.508 ( 3.130 1.371 2.032) 3.976 15.917 ( 4.174 -6.512 0.610) 7.759 15.917 ( 4.174 6.512 0.610) 7.759 16.196 ( -1.973 -5.380 -1.666) 5.968 16.196 ( -1.973 5.380 -1.666) 5.968 16.490 ( -4.222 -3.467 0.829) 5.526 16.490 ( -4.222 3.467 0.829) 5.526 16.793 ( -0.670 -2.098 0.600) 2.283 16.793 ( -0.670 2.098 0.600) 2.283 17.161 ( 3.237 -1.855 0.945) 3.849 17.161 ( 3.237 1.855 0.945) 3.849 17.388 ( -4.027 -4.200 -1.378) 5.980 17.388 ( -4.027 4.200 -1.378) 5.980 17.996 ( 1.327 -3.539 -1.766) 4.172 17.996 ( 1.327 3.539 -1.766) 4.172 18.369 ( 1.614 -9.616 -3.067) 10.221 18.369 ( 1.614 9.616 -3.067) 10.221 18.799 ( 2.295 -10.519 1.113) 10.824 18.799 ( 2.295 10.519 1.113) 10.824 19.274 ( -8.738 -5.796 2.500) 10.779 19.274 ( -8.738 5.796 2.500) 10.779 20.167 ( 1.138 -4.164 2.307) 4.895 20.167 ( 1.138 4.164 2.307) 4.895 ======================= Grid point 147 (65/104) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.274 ( 9.324 0.000 28.805) 30.277 1.290 ( 4.084 0.000 31.100) 31.367 1.779 ( -6.953 0.000 -22.114) 23.181 1.868 ( -4.178 0.000 -27.143) 27.462 2.414 ( -10.799 0.000 51.511) 52.631 2.564 ( -1.615 0.000 5.579) 5.807 2.658 ( 2.475 0.000 -3.350) 4.165 3.046 ( 3.427 0.000 -8.935) 9.570 3.104 ( 1.627 0.000 8.933) 9.080 3.178 ( 4.289 0.000 3.592) 5.595 3.219 ( 2.879 0.000 -2.518) 3.825 3.319 ( 2.237 0.000 -4.331) 4.875 3.329 ( -6.797 0.000 0.267) 6.802 3.369 ( -2.798 0.000 11.915) 12.239 3.369 ( 0.819 0.000 -6.057) 6.112 3.455 ( 7.362 0.000 3.167) 8.014 3.584 ( -2.314 0.000 -14.252) 14.438 3.614 ( 9.952 0.000 6.223) 11.737 3.622 ( 3.517 0.000 -12.996) 13.463 3.767 ( -9.093 0.000 -10.097) 13.588 4.056 ( 8.251 0.000 8.508) 11.852 4.158 ( -3.148 0.000 -3.727) 4.879 4.184 ( 2.204 0.000 2.168) 3.092 4.292 ( -9.701 0.000 -7.947) 12.541 4.422 ( -3.080 0.000 0.288) 3.094 4.461 ( 0.038 0.000 2.260) 2.261 4.479 ( 3.114 0.000 -4.099) 5.148 4.559 ( 2.516 0.000 -5.629) 6.165 4.860 ( 1.332 0.000 1.677) 2.141 4.894 ( -0.160 0.000 -2.177) 2.182 4.969 ( -0.071 0.000 3.593) 3.594 5.048 ( -2.584 0.000 -4.211) 4.941 5.123 ( 0.554 0.000 4.441) 4.475 5.218 ( 0.630 0.000 -4.460) 4.504 5.492 ( -3.301 0.000 1.578) 3.659 5.503 ( 1.944 0.000 0.502) 2.008 5.880 ( 0.068 0.000 -0.370) 0.376 5.910 ( 2.412 0.000 -2.768) 3.672 6.149 ( -6.738 0.000 6.915) 9.655 6.260 ( 7.336 0.000 -3.711) 8.222 6.416 ( 8.200 0.000 11.001) 13.721 6.482 ( -7.915 0.000 6.520) 10.255 6.696 ( -3.595 0.000 -7.521) 8.336 6.743 ( 4.263 0.000 -13.466) 14.125 7.134 ( -6.698 0.000 7.547) 10.091 7.179 ( -2.952 0.000 1.177) 3.178 7.241 ( 0.858 0.000 2.158) 2.323 7.336 ( 6.855 0.000 -5.879) 9.031 7.770 ( -3.106 0.000 1.188) 3.325 7.792 ( -3.411 0.000 0.341) 3.428 8.148 ( -5.395 0.000 -0.055) 5.395 8.181 ( 6.087 0.000 -3.294) 6.921 8.521 ( -0.056 0.000 0.998) 1.000 8.526 ( -0.113 0.000 0.725) 0.733 8.840 ( 3.744 0.000 0.920) 3.855 8.856 ( -0.536 0.000 -0.808) 0.970 9.052 ( -5.217 0.000 5.144) 7.327 9.212 ( 7.856 0.000 -7.940) 11.170 9.292 ( 8.028 0.000 4.963) 9.438 9.356 ( -4.867 0.000 -3.188) 5.818 9.556 ( -10.504 0.000 -1.955) 10.684 9.569 ( 7.081 0.000 -2.831) 7.626 9.989 ( 1.222 0.000 1.358) 1.827 10.006 ( -3.978 0.000 0.227) 3.984 10.430 ( 14.588 0.000 3.429) 14.986 10.523 ( -19.691 0.000 -5.951) 20.570 10.524 ( 4.427 0.000 2.977) 5.334 10.574 ( -4.769 0.000 -2.189) 5.248 10.808 ( -5.605 0.000 9.565) 11.087 10.944 ( 3.124 0.000 -3.700) 4.842 11.203 ( 1.898 0.000 5.347) 5.673 11.278 ( 1.991 0.000 -1.944) 2.783 11.489 ( -1.956 0.000 0.672) 2.068 11.553 ( -1.226 0.000 -5.301) 5.441 11.975 ( 1.512 0.000 1.798) 2.350 12.003 ( -1.103 0.000 -1.007) 1.493 12.142 ( 2.180 0.000 4.427) 4.935 12.246 ( -1.800 0.000 -5.597) 5.879 12.622 ( 3.025 0.000 5.582) 6.348 12.752 ( -3.841 0.000 -7.617) 8.531 12.863 ( -1.006 0.000 8.154) 8.216 13.049 ( 2.556 0.000 -10.233) 10.547 13.345 ( -1.946 0.000 0.934) 2.159 13.360 ( 1.795 0.000 -0.826) 1.976 13.409 ( 6.145 0.000 3.653) 7.149 13.470 ( -3.315 0.000 -2.138) 3.944 13.599 ( 2.606 0.000 2.688) 3.744 13.661 ( -0.157 0.000 -3.398) 3.401 14.289 ( 4.351 0.000 12.805) 13.524 14.471 ( -2.468 0.000 -4.174) 4.849 14.663 ( -6.904 0.000 3.050) 7.548 14.741 ( -0.021 0.000 -3.975) 3.975 14.913 ( 4.538 0.000 6.725) 8.113 14.982 ( 1.952 0.000 0.211) 1.963 15.082 ( -5.824 0.000 -6.179) 8.491 15.088 ( 2.049 0.000 -6.035) 6.374 15.729 ( -4.213 0.000 3.557) 5.514 15.809 ( 2.898 0.000 -3.869) 4.834 15.847 ( 10.326 0.000 1.038) 10.378 15.880 ( -10.858 0.000 -2.953) 11.253 16.164 ( 8.277 0.000 9.626) 12.696 16.338 ( -7.451 0.000 -7.468) 10.549 16.391 ( -6.310 0.000 1.190) 6.422 16.421 ( 3.413 0.000 -2.055) 3.984 16.736 ( -2.221 0.000 0.813) 2.365 16.738 ( 0.805 0.000 0.627) 1.020 17.011 ( -6.702 0.000 1.093) 6.790 17.027 ( 8.801 0.000 -1.112) 8.871 17.274 ( 3.271 0.000 11.911) 12.352 17.439 ( -7.873 0.000 -0.832) 7.917 17.596 ( 2.955 0.000 -7.709) 8.256 17.601 ( -0.094 0.000 -5.237) 5.238 18.242 ( -1.177 0.000 7.731) 7.821 18.380 ( -0.365 0.000 -6.140) 6.151 19.015 ( 3.261 0.000 3.666) 4.906 19.090 ( -2.533 0.000 -3.587) 4.391 19.681 ( -0.868 0.000 5.223) 5.295 19.771 ( 1.728 0.000 -3.751) 4.130 20.026 ( -2.130 0.000 6.632) 6.966 20.157 ( 4.630 0.000 -6.284) 7.806 ======================= Grid point 148 (66/104) ======================= q-point: ( 0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.666 ( 14.490 0.000 3.786) 14.976 1.707 ( 8.788 0.000 -25.944) 27.392 1.730 ( 16.505 0.000 1.859) 16.609 1.823 ( 24.825 0.000 21.571) 32.888 2.567 ( -1.794 0.000 7.392) 7.607 2.642 ( -1.328 0.000 32.071) 32.098 2.687 ( 3.719 0.000 -4.974) 6.210 3.038 ( 1.911 0.000 -6.647) 6.917 3.176 ( 1.824 0.000 3.606) 4.041 3.197 ( -1.300 0.000 -16.232) 16.284 3.199 ( -5.476 0.000 1.044) 5.574 3.241 ( 1.231 0.000 -8.664) 8.751 3.315 ( 5.819 0.000 7.722) 9.669 3.423 ( 0.930 0.000 -5.099) 5.183 3.449 ( 2.735 0.000 10.672) 11.017 3.454 ( 3.469 0.000 -11.620) 12.127 3.558 ( -1.194 0.000 -8.455) 8.539 3.670 ( 12.315 0.000 4.338) 13.057 3.723 ( 12.713 0.000 -12.313) 17.698 3.864 ( 10.511 0.000 5.492) 11.859 4.016 ( -5.850 0.000 -9.177) 10.883 4.125 ( -0.116 0.000 5.182) 5.183 4.171 ( -1.369 0.000 2.481) 2.834 4.354 ( -3.006 0.000 -1.323) 3.284 4.366 ( 3.298 0.000 3.640) 4.911 4.455 ( 1.425 0.000 1.503) 2.072 4.484 ( -0.319 0.000 0.850) 0.908 4.555 ( 1.805 0.000 -6.769) 7.006 4.858 ( -1.934 0.000 -2.357) 3.049 4.861 ( -2.611 0.000 0.567) 2.671 5.006 ( -0.113 0.000 6.354) 6.355 5.019 ( 3.001 0.000 -2.137) 3.684 5.144 ( -2.162 0.000 4.003) 4.549 5.189 ( 0.920 0.000 -5.769) 5.842 5.443 ( -3.977 0.000 2.704) 4.809 5.553 ( 3.323 0.000 0.455) 3.354 5.838 ( -3.247 0.000 -0.437) 3.276 5.875 ( -3.377 0.000 -4.962) 6.002 6.090 ( -3.616 0.000 4.177) 5.524 6.199 ( -13.072 0.000 -0.547) 13.084 6.403 ( 2.953 0.000 -5.705) 6.424 6.480 ( -7.069 0.000 4.290) 8.269 6.690 ( 5.192 0.000 2.649) 5.829 6.778 ( 2.073 0.000 -7.200) 7.493 6.970 ( -14.237 0.000 7.824) 16.245 7.112 ( -2.736 0.000 0.607) 2.803 7.304 ( 3.826 0.000 3.300) 5.052 7.405 ( 3.501 0.000 -5.220) 6.285 7.769 ( 0.830 0.000 3.499) 3.596 7.792 ( 1.274 0.000 6.369) 6.495 8.079 ( -0.538 0.000 -1.513) 1.606 8.292 ( 7.214 0.000 -2.455) 7.620 8.572 ( 1.447 0.000 2.418) 2.818 8.575 ( 1.460 0.000 -1.333) 1.977 8.837 ( 2.957 0.000 -4.779) 5.619 8.908 ( 4.071 0.000 -1.159) 4.233 8.993 ( -5.104 0.000 6.361) 8.156 9.181 ( -1.413 0.000 -6.150) 6.310 9.306 ( 3.253 0.000 -7.415) 8.097 9.313 ( -4.692 0.000 -1.050) 4.808 9.551 ( 6.692 0.000 3.125) 7.386 9.744 ( 10.356 0.000 0.791) 10.386 9.962 ( -1.688 0.000 1.879) 2.526 10.036 ( 0.141 0.000 4.370) 4.372 10.226 ( -7.750 0.000 -4.084) 8.760 10.450 ( -6.888 0.000 -2.766) 7.422 10.571 ( -1.783 0.000 5.869) 6.134 10.669 ( 1.034 0.000 8.391) 8.454 10.873 ( 9.619 0.000 6.718) 11.733 10.991 ( 4.451 0.000 -2.622) 5.166 11.233 ( -2.169 0.000 -0.268) 2.185 11.247 ( -1.574 0.000 -5.884) 6.091 11.474 ( -3.820 0.000 0.119) 3.822 11.494 ( 1.004 0.000 4.611) 4.719 11.953 ( -3.228 0.000 -1.321) 3.488 11.996 ( -0.334 0.000 0.400) 0.521 12.145 ( -4.400 0.000 -4.647) 6.399 12.191 ( -0.590 0.000 3.925) 3.969 12.687 ( 1.718 0.000 -5.063) 5.347 12.750 ( 4.139 0.000 4.735) 6.289 12.846 ( -6.162 0.000 6.470) 8.935 12.967 ( -2.217 0.000 -8.652) 8.931 13.256 ( -7.769 0.000 -2.099) 8.048 13.276 ( -3.815 0.000 -1.016) 3.948 13.453 ( 0.821 0.000 -1.631) 1.826 13.523 ( 3.499 0.000 2.336) 4.207 13.647 ( 0.401 0.000 0.179) 0.439 13.676 ( 4.834 0.000 -4.417) 6.548 14.394 ( -0.480 0.000 -9.569) 9.581 14.452 ( 2.920 0.000 9.935) 10.356 14.556 ( -9.182 0.000 6.740) 11.390 14.726 ( -0.574 0.000 2.833) 2.890 14.884 ( -4.573 0.000 -5.844) 7.421 14.948 ( -3.145 0.000 -4.421) 5.425 15.037 ( 2.277 0.000 7.557) 7.893 15.221 ( 10.217 0.000 -2.231) 10.458 15.625 ( -11.576 0.000 -0.173) 11.578 15.652 ( -6.906 0.000 2.498) 7.344 15.845 ( 2.381 0.000 -4.595) 5.175 15.981 ( 0.826 0.000 2.384) 2.523 16.115 ( -5.706 0.000 -5.395) 7.853 16.200 ( -2.147 0.000 2.420) 3.235 16.557 ( 13.399 0.000 6.114) 14.728 16.584 ( 8.033 0.000 -0.278) 8.038 16.720 ( -1.798 0.000 1.016) 2.066 16.802 ( 5.826 0.000 3.500) 6.796 16.903 ( -2.952 0.000 -3.406) 4.507 17.153 ( 5.419 0.000 -2.631) 6.024 17.289 ( -6.297 0.000 -1.471) 6.466 17.401 ( 1.329 0.000 11.751) 11.826 17.601 ( 2.124 0.000 -2.768) 3.489 17.615 ( 3.323 0.000 -4.217) 5.369 18.270 ( -1.817 0.000 7.563) 7.778 18.302 ( -3.298 0.000 -4.640) 5.693 18.992 ( -5.185 0.000 -4.810) 7.072 19.088 ( 2.214 0.000 3.270) 3.949 19.741 ( 3.676 0.000 3.509) 5.082 19.806 ( 4.971 0.000 -4.473) 6.687 20.033 ( -0.305 0.000 4.520) 4.531 20.131 ( -1.463 0.000 -7.229) 7.375 ======================= Grid point 149 (67/104) ======================= q-point: ( 0.20 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.799 ( 20.005 0.000 -21.524) 29.386 1.927 ( 22.433 0.000 -15.657) 27.356 2.192 ( 17.238 0.000 20.670) 26.915 2.362 ( 15.846 0.000 18.249) 24.168 2.566 ( 0.103 0.000 2.275) 2.277 2.702 ( 3.242 0.000 -6.337) 7.118 2.803 ( -0.498 0.000 14.295) 14.304 2.970 ( -2.390 0.000 -8.616) 8.942 3.091 ( -5.950 0.000 2.317) 6.385 3.093 ( -3.842 0.000 -7.171) 8.135 3.186 ( 1.996 0.000 -3.410) 3.951 3.275 ( 5.077 0.000 0.905) 5.157 3.392 ( 6.547 0.000 -12.669) 14.260 3.508 ( 6.772 0.000 9.550) 11.707 3.524 ( 7.142 0.000 -2.191) 7.471 3.599 ( 7.408 0.000 -6.270) 9.705 3.609 ( 8.346 0.000 5.488) 9.988 3.833 ( 8.959 0.000 -12.932) 15.732 3.895 ( 3.645 0.000 9.548) 10.220 3.907 ( 1.421 0.000 -7.630) 7.761 4.069 ( 10.862 0.000 1.869) 11.022 4.210 ( 3.226 0.000 9.234) 9.781 4.236 ( 6.111 0.000 1.673) 6.336 4.276 ( -6.417 0.000 -1.603) 6.615 4.299 ( 0.009 0.000 -6.495) 6.495 4.427 ( -4.833 0.000 5.006) 6.958 4.551 ( 2.834 0.000 -4.130) 5.009 4.576 ( 2.729 0.000 0.574) 2.789 4.774 ( -5.869 0.000 -1.859) 6.156 4.797 ( -2.368 0.000 -2.761) 3.638 5.034 ( -2.559 0.000 5.400) 5.976 5.116 ( -3.522 0.000 5.516) 6.545 5.123 ( 6.008 0.000 0.806) 6.062 5.182 ( 2.664 0.000 -3.408) 4.326 5.383 ( -4.536 0.000 3.143) 5.519 5.631 ( 5.084 0.000 -0.521) 5.111 5.762 ( -2.516 0.000 -7.439) 7.853 5.782 ( -3.367 0.000 1.421) 3.654 5.978 ( -9.509 0.000 1.472) 9.622 6.095 ( 1.952 0.000 3.491) 3.999 6.333 ( -8.904 0.000 -4.450) 9.954 6.398 ( -3.352 0.000 -0.226) 3.360 6.683 ( -9.627 0.000 3.533) 10.255 6.718 ( 1.817 0.000 -10.804) 10.956 6.832 ( -7.522 0.000 11.911) 14.088 7.084 ( 0.312 0.000 -4.890) 4.900 7.410 ( 0.188 0.000 -0.149) 0.240 7.458 ( 9.107 0.000 5.093) 10.435 7.868 ( 2.598 0.000 3.934) 4.714 7.873 ( 5.787 0.000 5.486) 7.974 8.096 ( 1.982 0.000 1.219) 2.327 8.365 ( 4.638 0.000 -10.095) 11.109 8.509 ( -5.899 0.000 -1.454) 6.076 8.522 ( -5.767 0.000 1.475) 5.952 8.867 ( -0.511 0.000 1.429) 1.517 8.991 ( 7.240 0.000 -4.706) 8.635 9.078 ( 8.977 0.000 6.759) 11.237 9.152 ( -0.025 0.000 -3.696) 3.696 9.260 ( -1.220 0.000 1.055) 1.613 9.325 ( 5.508 0.000 -7.793) 9.543 9.667 ( 4.863 0.000 -0.107) 4.864 9.897 ( 2.809 0.000 3.636) 4.595 9.965 ( -0.832 0.000 4.141) 4.223 10.014 ( -0.115 0.000 -0.798) 0.806 10.190 ( 1.309 0.000 0.295) 1.342 10.294 ( -7.023 0.000 -3.821) 7.995 10.535 ( -6.509 0.000 7.167) 9.682 10.664 ( -6.153 0.000 6.949) 9.282 11.058 ( 1.306 0.000 2.157) 2.521 11.073 ( 4.798 0.000 1.336) 4.981 11.110 ( -6.427 0.000 -5.402) 8.396 11.240 ( 7.245 0.000 -1.390) 7.377 11.451 ( -1.530 0.000 3.987) 4.270 11.561 ( 2.157 0.000 1.204) 2.470 11.874 ( -4.165 0.000 -1.600) 4.461 11.963 ( -1.916 0.000 -2.756) 3.357 12.047 ( -3.343 0.000 -2.240) 4.024 12.169 ( -4.228 0.000 2.462) 4.893 12.669 ( -7.575 0.000 -6.406) 9.921 12.717 ( -0.720 0.000 3.874) 3.940 12.770 ( -1.456 0.000 -0.838) 1.680 13.013 ( 5.182 0.000 3.586) 6.302 13.164 ( -0.988 0.000 0.769) 1.252 13.214 ( -1.354 0.000 -3.162) 3.440 13.480 ( 3.325 0.000 0.384) 3.347 13.508 ( -5.568 0.000 -1.876) 5.875 13.679 ( 2.912 0.000 2.467) 3.816 13.724 ( 3.941 0.000 -6.792) 7.853 14.325 ( 1.053 0.000 -10.425) 10.478 14.430 ( -9.912 0.000 7.638) 12.513 14.485 ( -6.528 0.000 7.651) 10.057 14.740 ( -1.894 0.000 4.691) 5.059 14.820 ( 2.965 0.000 -5.669) 6.398 14.872 ( -1.785 0.000 -4.429) 4.775 15.126 ( 0.432 0.000 9.057) 9.068 15.370 ( 6.345 0.000 -4.112) 7.561 15.466 ( -4.294 0.000 0.419) 4.314 15.520 ( -7.918 0.000 0.710) 7.950 15.824 ( -0.764 0.000 -4.914) 4.973 15.927 ( -6.370 0.000 3.678) 7.356 16.073 ( 3.260 0.000 -1.935) 3.791 16.255 ( 4.932 0.000 0.062) 4.932 16.615 ( -5.193 0.000 4.162) 6.655 16.743 ( 7.042 0.000 -1.965) 7.311 16.751 ( 5.647 0.000 -0.715) 5.692 16.871 ( 1.390 0.000 -3.923) 4.162 16.961 ( 3.171 0.000 4.601) 5.588 17.126 ( -2.462 0.000 -1.375) 2.820 17.300 ( 5.548 0.000 1.502) 5.747 17.491 ( 0.450 0.000 8.348) 8.361 17.603 ( -1.516 0.000 1.024) 1.830 17.611 ( -2.399 0.000 -2.187) 3.246 18.230 ( -1.974 0.000 -1.070) 2.245 18.285 ( -1.444 0.000 4.591) 4.813 18.840 ( -6.635 0.000 -4.914) 8.257 19.143 ( 2.091 0.000 1.026) 2.329 19.846 ( 5.565 0.000 1.674) 5.811 19.880 ( 6.719 0.000 -4.299) 7.976 20.037 ( -3.289 0.000 -4.763) 5.788 20.106 ( 5.193 0.000 2.281) 5.672 ======================= Grid point 150 (68/104) ======================= q-point: ( 0.30 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.087 ( 24.771 0.000 -14.586) 28.746 2.209 ( 19.338 0.000 -12.149) 22.838 2.493 ( -2.276 0.000 3.665) 4.314 2.519 ( 6.631 0.000 5.197) 8.424 2.754 ( 8.371 0.000 1.470) 8.499 2.778 ( 6.040 0.000 -2.212) 6.433 2.867 ( -0.307 0.000 15.818) 15.821 2.943 ( 5.449 0.000 -1.053) 5.550 2.993 ( -2.387 0.000 2.483) 3.445 3.018 ( -4.042 0.000 4.415) 5.986 3.209 ( 1.230 0.000 0.593) 1.366 3.362 ( 3.858 0.000 -0.605) 3.905 3.422 ( 0.681 0.000 0.133) 0.694 3.636 ( 1.410 0.000 4.734) 4.940 3.636 ( 5.306 0.000 0.015) 5.306 3.680 ( 4.568 0.000 -5.285) 6.985 3.764 ( 4.808 0.000 -2.108) 5.250 3.868 ( 2.844 0.000 -3.491) 4.503 3.961 ( -1.154 0.000 8.585) 8.662 3.978 ( 11.863 0.000 -14.083) 18.414 4.081 ( -7.397 0.000 1.365) 7.522 4.234 ( -4.635 0.000 9.363) 10.448 4.282 ( 6.010 0.000 -4.386) 7.440 4.379 ( 10.211 0.000 -9.599) 14.014 4.396 ( -0.755 0.000 5.202) 5.256 4.435 ( 11.774 0.000 2.189) 11.976 4.586 ( -0.758 0.000 -0.216) 0.788 4.596 ( 3.594 0.000 -3.259) 4.851 4.648 ( -3.994 0.000 -4.250) 5.832 4.763 ( 2.326 0.000 -2.351) 3.307 4.983 ( -5.082 0.000 3.049) 5.926 5.112 ( -2.742 0.000 7.004) 7.522 5.113 ( -3.965 0.000 1.059) 4.104 5.254 ( 2.952 0.000 -0.989) 3.114 5.367 ( -0.087 0.000 1.732) 1.734 5.670 ( -2.717 0.000 -1.783) 3.250 5.713 ( 2.444 0.000 -5.061) 5.620 5.745 ( -1.841 0.000 3.938) 4.347 5.916 ( -1.916 0.000 6.073) 6.368 6.091 ( -7.794 0.000 -6.352) 10.055 6.223 ( 6.787 0.000 3.647) 7.705 6.347 ( 0.180 0.000 -1.623) 1.633 6.504 ( -10.763 0.000 2.014) 10.950 6.705 ( 3.742 0.000 -10.286) 10.946 6.796 ( -6.082 0.000 10.875) 12.461 7.061 ( 3.435 0.000 -9.236) 9.854 7.426 ( -0.108 0.000 4.548) 4.550 7.631 ( 5.496 0.000 1.231) 5.632 7.948 ( 5.146 0.000 -1.382) 5.328 7.995 ( 1.666 0.000 5.062) 5.329 8.150 ( 0.787 0.000 6.726) 6.772 8.320 ( 3.089 0.000 -13.703) 14.047 8.425 ( -2.121 0.000 2.622) 3.373 8.476 ( -1.090 0.000 0.970) 1.460 8.859 ( -1.633 0.000 1.377) 2.136 9.057 ( -0.293 0.000 -8.783) 8.788 9.103 ( 2.537 0.000 -3.588) 4.395 9.263 ( 0.162 0.000 11.789) 11.790 9.277 ( 5.497 0.000 -3.104) 6.313 9.389 ( 4.244 0.000 -0.881) 4.334 9.746 ( 3.823 0.000 -0.673) 3.882 9.873 ( -3.156 0.000 -1.412) 3.458 9.988 ( -0.008 0.000 6.288) 6.288 10.089 ( -2.566 0.000 5.879) 6.415 10.114 ( 1.171 0.000 -5.234) 5.363 10.247 ( 1.930 0.000 -2.115) 2.863 10.458 ( -7.282 0.000 6.811) 9.971 10.544 ( -11.308 0.000 4.290) 12.095 10.972 ( -5.113 0.000 2.084) 5.521 11.066 ( 1.164 0.000 0.455) 1.250 11.206 ( 7.249 0.000 0.347) 7.258 11.359 ( 4.811 0.000 -4.363) 6.495 11.439 ( -2.193 0.000 1.217) 2.508 11.537 ( -0.726 0.000 -7.409) 7.445 11.788 ( -3.831 0.000 -0.999) 3.960 11.936 ( 0.520 0.000 -1.016) 1.142 11.995 ( -1.468 0.000 -0.436) 1.531 12.086 ( -6.353 0.000 2.028) 6.669 12.528 ( -3.995 0.000 -2.987) 4.989 12.643 ( -8.356 0.000 7.645) 11.325 12.853 ( 8.237 0.000 -3.041) 8.780 13.092 ( 1.471 0.000 3.094) 3.426 13.174 ( -0.577 0.000 -4.269) 4.307 13.187 ( 0.156 0.000 1.975) 1.982 13.369 ( -5.532 0.000 -3.685) 6.647 13.581 ( 5.543 0.000 1.706) 5.800 13.708 ( 1.424 0.000 -9.168) 9.278 13.752 ( 2.636 0.000 2.802) 3.847 14.287 ( 0.109 0.000 -5.278) 5.280 14.332 ( -5.012 0.000 6.354) 8.093 14.378 ( -8.537 0.000 4.615) 9.705 14.710 ( -5.215 0.000 4.681) 7.008 14.829 ( 1.194 0.000 -4.379) 4.539 14.866 ( 4.537 0.000 -3.806) 5.922 15.141 ( -4.903 0.000 3.726) 6.158 15.289 ( -6.980 0.000 -1.345) 7.108 15.443 ( -1.583 0.000 5.602) 5.822 15.567 ( 10.796 0.000 -5.033) 11.912 15.786 ( 0.056 0.000 -2.034) 2.035 15.841 ( -7.208 0.000 6.521) 9.720 16.139 ( 3.557 0.000 -0.590) 3.606 16.340 ( 4.851 0.000 -1.643) 5.122 16.571 ( -1.420 0.000 2.845) 3.180 16.815 ( 2.834 0.000 -5.786) 6.443 16.833 ( 1.305 0.000 -0.198) 1.320 16.882 ( 3.120 0.000 0.316) 3.136 16.972 ( 0.474 0.000 1.762) 1.824 17.092 ( -0.962 0.000 -5.520) 5.603 17.381 ( -1.484 0.000 -1.293) 1.968 17.495 ( -5.086 0.000 1.885) 5.424 17.572 ( 1.409 0.000 7.468) 7.600 17.599 ( -1.410 0.000 8.185) 8.306 18.168 ( -4.157 0.000 -4.701) 6.276 18.279 ( -1.244 0.000 0.071) 1.246 18.749 ( -1.000 0.000 1.941) 2.184 19.171 ( 1.368 0.000 -2.703) 3.029 19.958 ( 5.454 0.000 -0.026) 5.454 19.966 ( -1.804 0.000 -0.253) 1.822 19.976 ( 6.593 0.000 -3.998) 7.710 20.213 ( 4.783 0.000 -0.155) 4.786 ======================= Grid point 151 (69/104) ======================= q-point: ( 0.40 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.426 ( 14.146 0.000 -2.817) 14.423 2.457 ( 16.031 0.000 -8.240) 18.024 2.490 ( 5.066 0.000 -1.809) 5.379 2.589 ( 1.522 0.000 -1.626) 2.228 2.766 ( -2.062 0.000 -0.352) 2.092 2.806 ( 0.580 0.000 -2.325) 2.396 2.929 ( -1.685 0.000 0.578) 1.782 2.938 ( -2.909 0.000 3.500) 4.551 3.120 ( 5.437 0.000 15.013) 15.967 3.138 ( 3.509 0.000 4.139) 5.426 3.264 ( 3.001 0.000 3.050) 4.279 3.386 ( 0.242 0.000 -3.800) 3.807 3.474 ( 4.529 0.000 8.624) 9.740 3.618 ( -5.039 0.000 0.538) 5.068 3.636 ( -1.295 0.000 -4.090) 4.290 3.746 ( 2.700 0.000 1.713) 3.197 3.790 ( 2.422 0.000 -2.529) 3.502 3.924 ( 5.440 0.000 -0.420) 5.456 3.942 ( -6.704 0.000 -2.224) 7.063 4.000 ( -5.814 0.000 12.172) 13.490 4.057 ( 7.293 0.000 -7.966) 10.800 4.179 ( -6.527 0.000 9.638) 11.640 4.387 ( -2.076 0.000 -1.195) 2.395 4.407 ( 5.711 0.000 -5.447) 7.892 4.466 ( -9.031 0.000 3.283) 9.609 4.484 ( 9.867 0.000 -9.017) 13.366 4.577 ( 2.558 0.000 -0.831) 2.689 4.585 ( 1.598 0.000 -7.036) 7.216 4.720 ( 8.748 0.000 -2.547) 9.111 4.842 ( 3.463 0.000 -3.697) 5.065 4.967 ( 4.152 0.000 4.251) 5.942 5.073 ( -0.435 0.000 1.978) 2.025 5.103 ( -3.482 0.000 6.201) 7.111 5.293 ( 2.461 0.000 -2.484) 3.497 5.322 ( -4.526 0.000 -0.694) 4.579 5.522 ( -11.551 0.000 -2.047) 11.731 5.703 ( -3.379 0.000 7.088) 7.852 5.762 ( 3.944 0.000 -0.920) 4.050 5.952 ( 3.922 0.000 -0.983) 4.043 6.092 ( 6.130 0.000 -0.350) 6.140 6.202 ( -3.912 0.000 -6.268) 7.389 6.335 ( -8.290 0.000 1.862) 8.496 6.509 ( 9.115 0.000 3.889) 9.910 6.687 ( 1.441 0.000 -6.997) 7.143 6.776 ( -3.633 0.000 9.892) 10.538 7.076 ( 5.644 0.000 -11.715) 13.004 7.472 ( 0.772 0.000 6.599) 6.644 7.667 ( 0.270 0.000 -2.904) 2.916 7.976 ( 0.146 0.000 -4.274) 4.276 7.978 ( -4.673 0.000 1.736) 4.985 8.251 ( 2.971 0.000 9.060) 9.534 8.361 ( 8.770 0.000 -6.642) 11.002 8.467 ( 0.189 0.000 -1.587) 1.598 8.477 ( 3.157 0.000 7.020) 7.697 8.816 ( -3.639 0.000 -0.613) 3.690 8.896 ( -5.134 0.000 -14.303) 15.197 9.153 ( 1.205 0.000 1.934) 2.278 9.294 ( 1.713 0.000 -3.584) 3.973 9.366 ( 0.949 0.000 9.539) 9.587 9.451 ( 1.690 0.000 3.468) 3.858 9.758 ( -1.802 0.000 -1.073) 2.097 9.794 ( -3.371 0.000 -3.811) 5.088 10.020 ( -0.688 0.000 2.509) 2.602 10.075 ( 3.054 0.000 8.005) 8.568 10.227 ( 6.916 0.000 -1.710) 7.125 10.264 ( 2.112 0.000 -2.385) 3.185 10.331 ( -14.035 0.000 4.903) 14.867 10.380 ( -5.966 0.000 2.124) 6.333 10.971 ( 0.588 0.000 8.448) 8.469 11.099 ( 1.287 0.000 0.350) 1.334 11.286 ( 1.204 0.000 -4.278) 4.444 11.359 ( 4.038 0.000 -9.325) 10.162 11.405 ( -2.107 0.000 3.027) 3.688 11.503 ( 1.548 0.000 -8.209) 8.353 11.745 ( 0.107 0.000 -0.007) 0.107 11.892 ( -6.422 0.000 0.634) 6.453 11.980 ( -0.424 0.000 0.504) 0.658 12.018 ( -0.863 0.000 0.112) 0.870 12.476 ( -0.140 0.000 -1.231) 1.239 12.548 ( -7.156 0.000 5.316) 8.915 12.981 ( 6.856 0.000 -0.842) 6.907 13.113 ( -1.456 0.000 2.381) 2.791 13.119 ( -1.478 0.000 -3.391) 3.699 13.169 ( -2.727 0.000 -0.068) 2.728 13.312 ( 2.032 0.000 -3.400) 3.961 13.553 ( -4.621 0.000 -7.082) 8.456 13.775 ( 7.871 0.000 -1.235) 7.968 13.810 ( 1.293 0.000 3.049) 3.312 14.236 ( -4.121 0.000 3.988) 5.735 14.271 ( -6.184 0.000 3.670) 7.191 14.362 ( 4.096 0.000 1.105) 4.242 14.623 ( -7.080 0.000 2.971) 7.678 14.873 ( 6.578 0.000 -2.861) 7.174 14.912 ( 3.564 0.000 -3.647) 5.099 15.041 ( -5.037 0.000 -2.124) 5.467 15.145 ( -8.341 0.000 -0.163) 8.343 15.513 ( 0.853 0.000 11.400) 11.432 15.714 ( 10.498 0.000 -9.533) 14.180 15.751 ( -8.511 0.000 8.235) 11.843 15.803 ( 2.829 0.000 -1.441) 3.175 16.185 ( 1.235 0.000 3.483) 3.695 16.403 ( 3.627 0.000 -2.945) 4.672 16.604 ( 2.958 0.000 0.935) 3.102 16.769 ( -2.266 0.000 -4.419) 4.966 16.798 ( -3.487 0.000 0.150) 3.490 16.951 ( -3.764 0.000 -8.689) 9.469 16.985 ( 5.209 0.000 3.778) 6.435 17.094 ( 6.634 0.000 0.014) 6.634 17.291 ( -4.218 0.000 -2.569) 4.939 17.375 ( -9.216 0.000 3.031) 9.702 17.641 ( -0.619 0.000 7.959) 7.983 17.731 ( 6.098 0.000 10.778) 12.384 18.028 ( -4.835 0.000 -8.113) 9.444 18.234 ( -2.147 0.000 -4.480) 4.968 18.808 ( 2.308 0.000 7.636) 7.977 19.151 ( 0.004 0.000 -6.284) 6.284 19.947 ( -0.497 0.000 1.953) 2.015 20.042 ( 3.678 0.000 -4.404) 5.738 20.062 ( 4.633 0.000 1.771) 4.960 20.257 ( 1.083 0.000 -2.659) 2.871 ======================= Grid point 152 (70/104) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.438 ( -6.489 0.000 7.452) 9.881 2.567 ( 0.131 0.000 -4.219) 4.221 2.612 ( -2.040 0.000 -0.733) 2.167 2.631 ( -0.300 0.000 -3.535) 3.547 2.765 ( 2.419 0.000 -0.443) 2.459 2.772 ( -0.881 0.000 -1.143) 1.443 2.870 ( -3.576 0.000 2.926) 4.621 2.966 ( 10.067 0.000 -6.100) 11.771 3.195 ( 0.935 0.000 5.623) 5.700 3.288 ( 2.523 0.000 3.174) 4.054 3.339 ( -0.679 0.000 -0.297) 0.741 3.343 ( 3.600 0.000 3.068) 4.730 3.503 ( -6.680 0.000 -0.241) 6.685 3.577 ( 0.541 0.000 -3.947) 3.984 3.688 ( 8.336 0.000 5.987) 10.263 3.756 ( -7.209 0.000 -0.352) 7.218 3.780 ( -1.107 0.000 3.819) 3.976 3.862 ( 1.299 0.000 -1.261) 1.811 3.891 ( -12.435 0.000 7.264) 14.401 4.034 ( 7.882 0.000 -3.793) 8.748 4.173 ( 7.436 0.000 2.504) 7.846 4.189 ( -1.424 0.000 8.846) 8.960 4.272 ( -8.426 0.000 -0.399) 8.435 4.407 ( 1.087 0.000 -0.162) 1.099 4.435 ( 0.331 0.000 -12.039) 12.044 4.452 ( 2.447 0.000 -2.615) 3.581 4.554 ( -6.393 0.000 2.352) 6.812 4.671 ( 6.919 0.000 -6.758) 9.672 4.799 ( 1.707 0.000 -1.158) 2.063 4.817 ( -2.049 0.000 -2.470) 3.209 5.071 ( -4.116 0.000 5.409) 6.797 5.135 ( 4.924 0.000 -0.024) 4.924 5.138 ( 8.259 0.000 3.125) 8.830 5.179 ( -7.675 0.000 -1.076) 7.750 5.337 ( -5.321 0.000 -2.440) 5.854 5.357 ( 6.165 0.000 -3.919) 7.305 5.737 ( -0.302 0.000 7.191) 7.198 5.808 ( 0.816 0.000 1.288) 1.525 6.004 ( 3.046 0.000 -1.288) 3.307 6.063 ( -5.004 0.000 -8.213) 9.617 6.209 ( 5.908 0.000 1.256) 6.040 6.226 ( -4.669 0.000 -0.242) 4.676 6.597 ( -1.848 0.000 3.101) 3.610 6.668 ( 0.399 0.000 -3.914) 3.935 6.827 ( -0.256 0.000 10.570) 10.573 7.065 ( 2.804 0.000 -13.629) 13.914 7.541 ( 1.205 0.000 6.262) 6.377 7.625 ( -2.232 0.000 -2.913) 3.670 7.911 ( -3.241 0.000 2.191) 3.913 7.947 ( 0.028 0.000 -1.828) 1.828 8.304 ( -4.556 0.000 8.365) 9.525 8.441 ( -2.848 0.000 3.231) 4.307 8.515 ( 11.368 0.000 -5.923) 12.818 8.581 ( 1.039 0.000 1.519) 1.840 8.720 ( -4.927 0.000 -3.445) 6.012 8.751 ( 3.068 0.000 -11.010) 11.430 9.175 ( -0.768 0.000 4.638) 4.701 9.281 ( 0.583 0.000 -5.538) 5.568 9.460 ( 2.430 0.000 7.216) 7.614 9.508 ( 2.055 0.000 2.351) 3.123 9.701 ( -2.952 0.000 0.397) 2.979 9.719 ( -1.782 0.000 -2.440) 3.022 10.102 ( -10.445 0.000 2.188) 10.672 10.106 ( 7.042 0.000 3.171) 7.723 10.183 ( 0.152 0.000 6.264) 6.266 10.252 ( -0.780 0.000 -0.203) 0.806 10.293 ( -5.379 0.000 1.637) 5.622 10.363 ( 9.422 0.000 -5.708) 11.016 11.076 ( 0.996 0.000 12.575) 12.615 11.124 ( 1.367 0.000 2.085) 2.493 11.212 ( -3.196 0.000 -6.078) 6.868 11.353 ( -0.934 0.000 -14.112) 14.142 11.387 ( -3.081 0.000 3.554) 4.704 11.475 ( 4.460 0.000 -4.999) 6.699 11.784 ( -4.859 0.000 1.027) 4.967 11.799 ( 5.552 0.000 -0.194) 5.556 11.981 ( -0.350 0.000 1.401) 1.444 12.011 ( -0.087 0.000 -1.152) 1.155 12.469 ( -4.546 0.000 3.207) 5.564 12.506 ( 4.284 0.000 -0.565) 4.321 13.066 ( 2.296 0.000 1.494) 2.739 13.081 ( -3.670 0.000 1.547) 3.982 13.100 ( -3.360 0.000 -1.637) 3.738 13.129 ( 5.079 0.000 -2.835) 5.816 13.364 ( 4.900 0.000 -1.398) 5.095 13.407 ( -5.600 0.000 -5.625) 7.937 13.823 ( -3.015 0.000 3.095) 4.321 13.873 ( 3.051 0.000 -1.532) 3.414 14.212 ( -3.738 0.000 4.342) 5.730 14.219 ( -0.052 0.000 3.307) 3.307 14.476 ( 6.372 0.000 3.172) 7.118 14.517 ( -4.595 0.000 -0.860) 4.675 14.944 ( -2.741 0.000 -1.147) 2.971 14.959 ( 5.002 0.000 -3.350) 6.020 14.985 ( -8.926 0.000 -0.376) 8.933 15.022 ( 10.514 0.000 -4.721) 11.526 15.570 ( -7.555 0.000 14.862) 16.672 15.687 ( -1.879 0.000 6.058) 6.343 15.780 ( 0.852 0.000 -3.299) 3.407 15.856 ( 9.240 0.000 -13.191) 16.106 16.254 ( 1.173 0.000 8.377) 8.459 16.405 ( -0.734 0.000 -5.680) 5.728 16.672 ( 3.719 0.000 0.286) 3.730 16.698 ( -2.355 0.000 -3.070) 3.870 16.738 ( -3.169 0.000 2.470) 4.018 16.835 ( -1.129 0.000 -6.802) 6.895 17.111 ( 5.417 0.000 4.031) 6.753 17.171 ( -3.572 0.000 -1.734) 3.970 17.223 ( -9.725 0.000 3.557) 10.355 17.260 ( 6.820 0.000 -0.658) 6.852 17.694 ( 0.210 0.000 8.610) 8.612 17.865 ( 1.260 0.000 -6.096) 6.225 17.957 ( 2.830 0.000 7.720) 8.223 18.135 ( -3.690 0.000 -8.041) 8.847 18.912 ( 2.426 0.000 8.554) 8.891 19.084 ( -1.393 0.000 -8.495) 8.608 19.961 ( -0.676 0.000 3.594) 3.657 20.045 ( 0.429 0.000 -4.626) 4.646 20.145 ( 2.447 0.000 3.171) 4.006 20.216 ( -2.819 0.000 -3.804) 4.735 ======================= Grid point 153 (71/104) ======================= q-point: (-0.40 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.273 ( -18.598 0.000 9.956) 21.095 2.320 ( -25.135 0.000 3.263) 25.346 2.550 ( 0.173 0.000 -3.755) 3.759 2.561 ( -1.712 0.000 0.769) 1.877 2.782 ( -0.391 0.000 0.258) 0.468 2.786 ( 0.756 0.000 -2.352) 2.471 2.930 ( 5.688 0.000 0.009) 5.688 3.050 ( 0.698 0.000 -7.340) 7.374 3.224 ( -3.985 0.000 -5.097) 6.470 3.255 ( 0.640 0.000 4.367) 4.413 3.337 ( -1.587 0.000 -3.487) 3.831 3.370 ( -0.382 0.000 -4.143) 4.161 3.487 ( -0.133 0.000 11.126) 11.127 3.612 ( 4.919 0.000 0.781) 4.980 3.619 ( -5.103 0.000 -3.493) 6.184 3.709 ( -12.545 0.000 5.578) 13.729 3.753 ( -3.100 0.000 1.103) 3.290 3.856 ( 5.421 0.000 5.183) 7.500 3.862 ( -1.708 0.000 0.184) 1.718 4.094 ( -6.850 0.000 -5.279) 8.649 4.178 ( 9.922 0.000 -2.036) 10.129 4.239 ( -2.764 0.000 8.483) 8.922 4.300 ( 1.572 0.000 4.054) 4.348 4.341 ( -12.966 0.000 1.910) 13.106 4.349 ( 1.141 0.000 -7.982) 8.063 4.495 ( 2.327 0.000 2.774) 3.621 4.534 ( 6.618 0.000 -2.553) 7.093 4.665 ( -0.903 0.000 -7.352) 7.407 4.723 ( -6.285 0.000 -3.225) 7.064 4.781 ( -3.944 0.000 2.487) 4.663 5.051 ( -2.505 0.000 -3.378) 4.205 5.071 ( 1.004 0.000 3.279) 3.429 5.209 ( 3.593 0.000 -4.038) 5.405 5.250 ( 1.071 0.000 1.286) 1.674 5.315 ( 4.166 0.000 -0.757) 4.234 5.496 ( 9.828 0.000 0.596) 9.846 5.726 ( -5.167 0.000 2.538) 5.756 5.829 ( 2.452 0.000 -0.011) 2.452 5.933 ( -3.360 0.000 -5.463) 6.414 6.087 ( 4.970 0.000 4.823) 6.926 6.133 ( -4.611 0.000 -3.543) 5.815 6.337 ( 7.717 0.000 1.385) 7.840 6.561 ( -4.270 0.000 5.230) 6.752 6.601 ( -5.772 0.000 -4.510) 7.325 6.861 ( -3.962 0.000 10.121) 10.869 7.008 ( 3.481 0.000 -14.125) 14.547 7.555 ( -3.469 0.000 -1.908) 3.959 7.588 ( -0.688 0.000 5.608) 5.650 7.904 ( -0.277 0.000 3.175) 3.187 7.964 ( 1.399 0.000 2.799) 3.129 8.240 ( -6.474 0.000 4.754) 8.033 8.375 ( -5.054 0.000 -1.582) 5.296 8.527 ( -1.418 0.000 -6.289) 6.447 8.575 ( -5.611 0.000 0.862) 5.677 8.725 ( 10.973 0.000 -3.400) 11.487 8.832 ( 6.696 0.000 -2.451) 7.130 9.200 ( -0.536 0.000 4.884) 4.913 9.224 ( -2.994 0.000 -5.183) 5.986 9.511 ( -1.008 0.000 -0.606) 1.176 9.527 ( 0.821 0.000 -5.407) 5.469 9.708 ( 2.371 0.000 4.921) 5.462 9.716 ( 1.021 0.000 2.525) 2.724 9.970 ( -5.036 0.000 4.118) 6.505 10.192 ( -2.333 0.000 -2.218) 3.219 10.199 ( -3.564 0.000 1.873) 4.027 10.234 ( -0.807 0.000 1.861) 2.028 10.311 ( 8.814 0.000 4.284) 9.800 10.499 ( 10.651 0.000 -6.798) 12.636 11.107 ( -2.852 0.000 0.059) 2.852 11.159 ( -2.886 0.000 9.051) 9.500 11.169 ( -4.242 0.000 -3.861) 5.736 11.188 ( 0.374 0.000 -2.996) 3.019 11.371 ( -1.224 0.000 4.266) 4.438 11.513 ( 1.474 0.000 -6.779) 6.937 11.751 ( 1.643 0.000 -0.532) 1.727 11.918 ( 6.502 0.000 -1.680) 6.715 11.992 ( 1.285 0.000 2.509) 2.819 11.999 ( -0.160 0.000 -1.095) 1.107 12.440 ( -0.781 0.000 2.549) 2.666 12.619 ( 8.534 0.000 -1.472) 8.660 12.980 ( -6.923 0.000 -0.784) 6.968 13.073 ( 0.153 0.000 1.103) 1.113 13.125 ( 2.595 0.000 2.580) 3.659 13.203 ( 5.025 0.000 -4.691) 6.874 13.298 ( -2.519 0.000 -2.261) 3.385 13.453 ( 4.481 0.000 1.963) 4.892 13.739 ( -8.015 0.000 2.346) 8.351 13.864 ( -1.761 0.000 -2.087) 2.730 14.171 ( -5.898 0.000 7.169) 9.283 14.285 ( 4.925 0.000 1.537) 5.160 14.477 ( 3.283 0.000 -6.095) 6.923 14.618 ( 5.508 0.000 4.824) 7.321 14.831 ( -7.460 0.000 0.212) 7.463 14.887 ( -2.090 0.000 -2.319) 3.122 15.061 ( 9.061 0.000 -3.494) 9.711 15.192 ( 10.901 0.000 -4.599) 11.832 15.488 ( -10.016 0.000 12.524) 16.037 15.716 ( -2.468 0.000 -8.408) 8.762 15.734 ( 0.401 0.000 5.445) 5.460 15.927 ( 6.629 0.000 -8.951) 11.138 16.303 ( -4.534 0.000 -6.958) 8.305 16.306 ( -2.044 0.000 6.904) 7.200 16.646 ( -0.504 0.000 -3.512) 3.548 16.711 ( 0.318 0.000 1.012) 1.061 16.777 ( 3.252 0.000 7.394) 8.077 16.818 ( 1.533 0.000 -1.970) 2.496 17.050 ( -6.876 0.000 -2.741) 7.402 17.079 ( -7.504 0.000 2.238) 7.831 17.247 ( 6.486 0.000 2.526) 6.960 17.395 ( 6.658 0.000 1.030) 6.738 17.774 ( 0.927 0.000 8.816) 8.864 17.809 ( 0.693 0.000 -8.726) 8.754 18.000 ( -3.683 0.000 -8.125) 8.921 18.113 ( 5.582 0.000 7.792) 9.585 18.983 ( -2.613 0.000 -9.392) 9.749 19.011 ( 2.132 0.000 7.426) 7.726 19.957 ( -3.112 0.000 3.729) 4.857 20.003 ( -1.526 0.000 -3.527) 3.843 20.114 ( -5.207 0.000 -3.406) 6.222 20.191 ( -0.297 0.000 3.782) 3.793 ======================= Grid point 154 (72/104) ======================= q-point: (-0.30 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.855 ( -29.344 0.000 7.869) 30.380 1.958 ( -24.239 0.000 12.959) 27.485 2.536 ( -2.972 0.000 1.583) 3.368 2.540 ( 0.925 0.000 -1.580) 1.830 2.729 ( -6.044 0.000 0.657) 6.079 2.759 ( -3.241 0.000 -1.098) 3.422 2.977 ( -2.567 0.000 -2.463) 3.558 3.012 ( 4.117 0.000 -2.200) 4.668 3.080 ( -8.450 0.000 -4.420) 9.536 3.225 ( -1.350 0.000 -8.657) 8.762 3.258 ( -4.113 0.000 -3.573) 5.448 3.339 ( -1.706 0.000 0.112) 1.710 3.380 ( -25.766 0.000 15.664) 30.154 3.500 ( -2.883 0.000 -5.542) 6.247 3.645 ( 1.167 0.000 3.172) 3.380 3.704 ( -0.895 0.000 -2.009) 2.200 3.711 ( 1.734 0.000 2.530) 3.067 3.778 ( -9.600 0.000 4.654) 10.668 3.950 ( 1.279 0.000 3.979) 4.180 3.958 ( -2.588 0.000 -9.188) 9.545 4.115 ( -7.607 0.000 7.879) 10.952 4.235 ( -1.284 0.000 -8.431) 8.528 4.278 ( -1.094 0.000 2.799) 3.005 4.325 ( 0.918 0.000 3.413) 3.535 4.407 ( 5.712 0.000 2.351) 6.177 4.540 ( -0.340 0.000 2.124) 2.151 4.565 ( -4.327 0.000 -4.593) 6.311 4.582 ( -3.664 0.000 -7.678) 8.507 4.634 ( 5.420 0.000 -1.299) 5.573 4.728 ( -2.327 0.000 1.725) 2.897 5.048 ( 3.916 0.000 -3.305) 5.125 5.118 ( 1.269 0.000 1.743) 2.156 5.229 ( 2.492 0.000 -4.619) 5.248 5.280 ( 3.595 0.000 -4.149) 5.490 5.371 ( 0.538 0.000 1.633) 1.720 5.623 ( 0.758 0.000 3.384) 3.468 5.635 ( -4.490 0.000 1.881) 4.868 5.858 ( 1.667 0.000 -7.655) 7.834 5.960 ( 2.208 0.000 5.623) 6.041 6.056 ( 7.826 0.000 -6.524) 10.188 6.223 ( 5.333 0.000 5.089) 7.371 6.368 ( -9.948 0.000 -4.555) 10.942 6.516 ( -5.905 0.000 7.537) 9.574 6.545 ( 10.450 0.000 -1.610) 10.574 6.872 ( -1.662 0.000 10.079) 10.215 7.015 ( 7.137 0.000 -12.061) 14.014 7.474 ( -4.777 0.000 -0.020) 4.777 7.602 ( -2.064 0.000 4.590) 5.032 7.903 ( -3.079 0.000 1.628) 3.483 8.028 ( 1.119 0.000 7.384) 7.468 8.154 ( -4.225 0.000 -2.254) 4.788 8.261 ( -4.249 0.000 -2.685) 5.026 8.489 ( 1.151 0.000 -1.872) 2.198 8.503 ( -0.998 0.000 -2.242) 2.454 8.888 ( 5.820 0.000 3.598) 6.842 8.908 ( 3.826 0.000 -3.105) 4.927 9.097 ( -7.329 0.000 -3.019) 7.927 9.207 ( -2.585 0.000 3.503) 4.353 9.429 ( -5.581 0.000 -3.332) 6.500 9.485 ( 0.615 0.000 -8.824) 8.845 9.730 ( -2.362 0.000 0.830) 2.503 9.814 ( 4.717 0.000 4.778) 6.714 9.970 ( -1.986 0.000 7.007) 7.283 10.107 ( -2.902 0.000 -4.954) 5.741 10.169 ( 1.761 0.000 -0.777) 1.925 10.230 ( -1.112 0.000 0.654) 1.290 10.486 ( 6.580 0.000 3.582) 7.492 10.649 ( 10.298 0.000 -5.522) 11.685 11.039 ( -2.695 0.000 -4.561) 5.298 11.066 ( -2.021 0.000 0.962) 2.239 11.203 ( 0.288 0.000 10.967) 10.970 11.208 ( -2.107 0.000 0.270) 2.125 11.400 ( 1.606 0.000 4.328) 4.617 11.462 ( -0.578 0.000 -2.248) 2.321 11.813 ( 5.507 0.000 -3.171) 6.354 11.935 ( -1.553 0.000 -0.626) 1.674 11.995 ( 0.458 0.000 -0.362) 0.584 12.110 ( 7.880 0.000 -0.234) 7.884 12.479 ( 3.016 0.000 2.513) 3.925 12.754 ( 4.504 0.000 -1.874) 4.879 12.846 ( -3.253 0.000 -3.544) 4.811 13.111 ( 2.082 0.000 2.150) 2.993 13.169 ( 0.561 0.000 -1.489) 1.592 13.224 ( 1.236 0.000 -5.010) 5.160 13.313 ( 4.839 0.000 1.724) 5.137 13.542 ( 2.221 0.000 4.996) 5.468 13.591 ( -9.387 0.000 2.132) 9.626 13.804 ( -2.786 0.000 -2.422) 3.692 14.113 ( -6.266 0.000 9.197) 11.129 14.405 ( 7.193 0.000 0.878) 7.247 14.531 ( 8.221 0.000 -9.644) 12.672 14.713 ( -1.157 0.000 7.460) 7.549 14.744 ( -2.964 0.000 3.286) 4.425 14.838 ( -0.095 0.000 -3.842) 3.843 15.226 ( 11.552 0.000 -5.002) 12.589 15.325 ( 6.123 0.000 -4.089) 7.363 15.426 ( -3.762 0.000 7.933) 8.780 15.594 ( -3.207 0.000 -9.058) 9.609 15.756 ( -1.053 0.000 2.572) 2.779 15.961 ( 2.650 0.000 -4.253) 5.011 16.168 ( -5.684 0.000 -3.945) 6.919 16.295 ( -2.596 0.000 3.001) 3.968 16.641 ( 3.318 0.000 -4.296) 5.428 16.708 ( -3.075 0.000 4.280) 5.269 16.826 ( -0.566 0.000 0.172) 0.592 16.897 ( -8.281 0.000 -0.890) 8.329 16.908 ( 3.382 0.000 9.549) 10.131 16.997 ( -2.176 0.000 0.321) 2.199 17.385 ( 7.369 0.000 -0.685) 7.401 17.501 ( 3.822 0.000 1.579) 4.135 17.746 ( -4.750 0.000 -6.851) 8.337 17.766 ( 0.878 0.000 -8.308) 8.354 18.007 ( 4.502 0.000 9.145) 10.193 18.253 ( 5.552 0.000 2.814) 6.224 18.865 ( -2.740 0.000 -8.705) 9.126 19.091 ( 1.658 0.000 4.981) 5.250 19.893 ( -6.779 0.000 3.717) 7.731 19.946 ( -3.305 0.000 -0.640) 3.367 20.003 ( -3.659 0.000 -2.465) 4.411 20.184 ( -2.962 0.000 2.475) 3.860 ======================= Grid point 155 (73/104) ======================= q-point: (-0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.415 ( -27.221 0.000 16.168) 31.661 1.598 ( -27.326 0.000 16.679) 32.014 2.458 ( -8.119 0.000 2.987) 8.651 2.532 ( -6.021 0.000 -1.775) 6.277 2.574 ( -16.410 0.000 8.103) 18.302 2.629 ( -5.079 0.000 -4.071) 6.509 2.777 ( -17.394 0.000 2.587) 17.585 2.913 ( -13.983 0.000 8.533) 16.381 3.043 ( 2.897 0.000 -7.078) 7.648 3.078 ( -0.868 0.000 2.423) 2.574 3.172 ( 3.268 0.000 -6.931) 7.663 3.233 ( 0.493 0.000 0.295) 0.574 3.280 ( -4.321 0.000 0.049) 4.321 3.464 ( -2.010 0.000 0.986) 2.239 3.587 ( -13.552 0.000 13.185) 18.908 3.643 ( -4.034 0.000 -2.950) 4.997 3.655 ( -2.802 0.000 -4.462) 5.269 3.686 ( -3.816 0.000 -3.795) 5.382 3.841 ( -4.418 0.000 -3.773) 5.810 3.983 ( 0.063 0.000 1.429) 1.431 4.099 ( -10.387 0.000 -1.223) 10.459 4.143 ( 2.100 0.000 5.706) 6.080 4.292 ( 2.820 0.000 -0.736) 2.914 4.328 ( 1.670 0.000 -4.747) 5.032 4.424 ( -2.275 0.000 -11.586) 11.807 4.519 ( -2.311 0.000 0.032) 2.311 4.528 ( 3.575 0.000 -3.978) 5.348 4.545 ( 1.786 0.000 3.809) 4.207 4.734 ( 6.127 0.000 0.679) 6.165 4.737 ( 1.240 0.000 3.146) 3.382 5.109 ( 4.416 0.000 -2.957) 5.314 5.128 ( -1.490 0.000 1.296) 1.975 5.198 ( -8.607 0.000 -4.936) 9.922 5.233 ( 1.526 0.000 -5.081) 5.305 5.424 ( 4.140 0.000 -0.861) 4.228 5.601 ( -4.003 0.000 2.261) 4.597 5.651 ( 4.960 0.000 2.428) 5.522 5.845 ( 1.168 0.000 -4.249) 4.407 5.987 ( 5.579 0.000 0.321) 5.588 6.181 ( -3.908 0.000 -5.144) 6.461 6.258 ( 3.123 0.000 3.410) 4.624 6.348 ( 4.209 0.000 4.437) 6.116 6.531 ( 6.569 0.000 6.179) 9.018 6.740 ( 10.703 0.000 -1.505) 10.808 6.948 ( 2.040 0.000 8.948) 9.178 7.066 ( 7.122 0.000 -11.473) 13.504 7.382 ( -6.374 0.000 2.788) 6.957 7.539 ( -6.948 0.000 -2.062) 7.248 7.837 ( -3.614 0.000 3.268) 4.872 8.019 ( -3.929 0.000 -8.349) 9.228 8.119 ( -1.368 0.000 11.626) 11.706 8.200 ( -1.199 0.000 -3.521) 3.719 8.517 ( 4.330 0.000 -3.024) 5.282 8.553 ( 6.572 0.000 -0.597) 6.599 8.906 ( -8.192 0.000 2.714) 8.630 8.928 ( 0.795 0.000 -4.218) 4.292 9.023 ( 1.501 0.000 6.081) 6.263 9.132 ( -7.412 0.000 0.100) 7.413 9.285 ( -7.432 0.000 -2.606) 7.876 9.424 ( 1.261 0.000 -11.717) 11.785 9.654 ( -4.791 0.000 0.645) 4.835 9.922 ( -6.600 0.000 3.390) 7.420 9.957 ( 7.930 0.000 2.721) 8.384 10.039 ( -1.619 0.000 -3.444) 3.805 10.181 ( -3.639 0.000 1.325) 3.872 10.278 ( 7.419 0.000 -0.520) 7.438 10.600 ( 4.009 0.000 1.127) 4.164 10.770 ( 6.495 0.000 -3.819) 7.534 10.970 ( -6.841 0.000 4.403) 8.135 11.059 ( 0.216 0.000 2.424) 2.434 11.161 ( 1.918 0.000 -4.283) 4.692 11.239 ( -3.049 0.000 0.693) 3.126 11.484 ( 2.189 0.000 0.585) 2.266 11.532 ( 7.233 0.000 4.420) 8.476 11.881 ( 4.093 0.000 -2.599) 4.849 11.899 ( -1.100 0.000 2.050) 2.327 12.015 ( 1.624 0.000 1.017) 1.916 12.220 ( 5.173 0.000 -2.557) 5.770 12.580 ( 5.892 0.000 2.560) 6.424 12.666 ( -7.568 0.000 2.520) 7.976 12.917 ( 9.882 0.000 -8.872) 13.281 13.103 ( -3.791 0.000 -6.138) 7.215 13.172 ( 3.780 0.000 0.968) 3.902 13.189 ( -2.188 0.000 -2.020) 2.978 13.455 ( -6.899 0.000 3.202) 7.606 13.462 ( 7.795 0.000 2.837) 8.296 13.591 ( -1.366 0.000 5.808) 5.966 13.731 ( -3.215 0.000 -2.630) 4.154 14.096 ( -3.519 0.000 11.441) 11.970 14.546 ( 6.428 0.000 0.642) 6.460 14.625 ( 10.285 0.000 -10.972) 15.038 14.682 ( -5.291 0.000 7.484) 9.165 14.775 ( 2.164 0.000 5.367) 5.787 14.828 ( 0.065 0.000 -3.096) 3.096 15.316 ( 0.969 0.000 -9.352) 9.402 15.324 ( -3.202 0.000 0.465) 3.235 15.494 ( 7.065 0.000 -1.529) 7.229 15.554 ( 6.679 0.000 -3.113) 7.369 15.752 ( -0.671 0.000 2.449) 2.539 15.987 ( 2.893 0.000 -1.362) 3.198 16.047 ( -5.580 0.000 -0.313) 5.589 16.260 ( -2.213 0.000 -0.403) 2.250 16.667 ( -4.447 0.000 4.722) 6.486 16.699 ( 3.538 0.000 -1.734) 3.940 16.731 ( -7.113 0.000 -1.252) 7.222 16.816 ( -1.322 0.000 1.679) 2.137 16.991 ( -0.353 0.000 2.831) 2.853 17.022 ( 2.548 0.000 6.612) 7.086 17.395 ( -6.283 0.000 -8.741) 10.765 17.554 ( 0.760 0.000 1.637) 1.805 17.669 ( 3.653 0.000 -5.154) 6.317 17.710 ( -0.488 0.000 -8.641) 8.655 18.168 ( 3.871 0.000 7.122) 8.106 18.351 ( 4.836 0.000 -1.946) 5.212 18.799 ( 1.737 0.000 -2.400) 2.962 19.137 ( 0.725 0.000 1.579) 1.737 19.780 ( -8.470 0.000 5.159) 9.917 19.867 ( -4.346 0.000 -0.455) 4.370 19.971 ( -0.128 0.000 1.560) 1.565 20.124 ( -4.212 0.000 0.405) 4.231 ======================= Grid point 156 (74/104) ======================= q-point: (-0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.171 ( -14.881 0.000 27.007) 30.835 1.238 ( -24.166 0.000 23.233) 33.523 2.182 ( -19.448 0.000 -14.037) 23.985 2.203 ( -12.103 0.000 -20.189) 23.539 2.356 ( -22.579 0.000 44.779) 50.150 2.591 ( -7.176 0.000 7.853) 10.638 2.633 ( 2.598 0.000 -1.752) 3.133 2.930 ( 5.605 0.000 10.420) 11.832 3.042 ( 3.859 0.000 -9.092) 9.876 3.121 ( 1.001 0.000 4.028) 4.150 3.214 ( -0.892 0.000 -0.550) 1.048 3.232 ( 4.899 0.000 -2.223) 5.380 3.303 ( 5.155 0.000 2.795) 5.864 3.385 ( -5.500 0.000 2.710) 6.132 3.461 ( -10.196 0.000 11.698) 15.517 3.499 ( -6.629 0.000 -6.054) 8.978 3.556 ( -4.171 0.000 -2.741) 4.992 3.611 ( -0.231 0.000 -5.613) 5.617 3.845 ( 4.222 0.000 8.472) 9.466 3.855 ( -9.886 0.000 -12.623) 16.033 3.944 ( -4.578 0.000 -3.034) 5.492 4.186 ( -0.243 0.000 0.745) 0.784 4.254 ( -3.725 0.000 -7.371) 8.259 4.381 ( 7.340 0.000 -2.925) 7.901 4.404 ( 4.049 0.000 -3.734) 5.508 4.480 ( -1.543 0.000 0.463) 1.611 4.512 ( -4.908 0.000 -3.550) 6.057 4.566 ( 0.661 0.000 -3.605) 3.665 4.802 ( 2.546 0.000 3.755) 4.537 4.855 ( 5.317 0.000 1.381) 5.493 5.006 ( -6.471 0.000 -1.714) 6.694 5.105 ( -1.774 0.000 2.020) 2.688 5.125 ( -0.517 0.000 -5.301) 5.326 5.221 ( 1.570 0.000 -3.718) 4.036 5.469 ( 1.852 0.000 -0.071) 1.853 5.543 ( -3.473 0.000 1.154) 3.660 5.804 ( 7.894 0.000 1.095) 7.969 5.864 ( 3.491 0.000 -2.174) 4.113 6.158 ( 9.639 0.000 2.804) 10.039 6.160 ( 4.133 0.000 -2.595) 4.880 6.236 ( -5.548 0.000 9.532) 11.029 6.447 ( 3.240 0.000 4.603) 5.629 6.722 ( 6.337 0.000 -0.746) 6.381 6.840 ( 0.879 0.000 -7.448) 7.500 7.062 ( 4.353 0.000 6.524) 7.843 7.119 ( 8.061 0.000 -7.792) 11.211 7.289 ( -6.813 0.000 5.332) 8.651 7.374 ( -6.039 0.000 -4.270) 7.396 7.828 ( -1.658 0.000 3.593) 3.957 7.874 ( -5.178 0.000 -6.347) 8.192 8.153 ( 1.099 0.000 -6.946) 7.033 8.175 ( -0.778 0.000 7.746) 7.785 8.552 ( -1.033 0.000 -0.759) 1.282 8.643 ( -1.098 0.000 -5.212) 5.327 8.803 ( -6.061 0.000 -0.654) 6.096 8.835 ( -0.834 0.000 4.766) 4.838 9.089 ( 6.173 0.000 -2.436) 6.636 9.118 ( 2.607 0.000 4.047) 4.814 9.147 ( -5.239 0.000 3.522) 6.313 9.394 ( 3.268 0.000 -8.357) 8.973 9.583 ( -3.855 0.000 -0.335) 3.870 9.775 ( -10.237 0.000 -1.311) 10.321 9.992 ( -1.401 0.000 -1.262) 1.885 10.092 ( -5.232 0.000 2.417) 5.763 10.166 ( 12.223 0.000 -0.858) 12.253 10.409 ( 6.286 0.000 1.613) 6.490 10.634 ( -0.657 0.000 -0.600) 0.889 10.819 ( 0.727 0.000 -6.235) 6.277 10.869 ( -8.153 0.000 8.428) 11.726 11.032 ( -9.932 0.000 -8.160) 12.854 11.134 ( -0.541 0.000 4.203) 4.237 11.219 ( 4.554 0.000 -0.328) 4.565 11.511 ( 0.774 0.000 -1.825) 1.982 11.588 ( 0.836 0.000 -4.718) 4.792 11.929 ( 2.289 0.000 0.616) 2.371 11.978 ( 3.977 0.000 3.163) 5.081 12.069 ( 2.662 0.000 2.763) 3.837 12.269 ( 2.750 0.000 -3.722) 4.628 12.588 ( -3.046 0.000 4.001) 5.028 12.729 ( 7.016 0.000 5.269) 8.774 12.945 ( -8.465 0.000 -5.939) 10.341 13.019 ( 8.136 0.000 -9.686) 12.650 13.208 ( 6.354 0.000 2.906) 6.987 13.267 ( 6.183 0.000 -0.080) 6.184 13.394 ( -3.414 0.000 4.378) 5.552 13.548 ( -1.351 0.000 -0.202) 1.366 13.582 ( -3.038 0.000 4.799) 5.679 13.677 ( 0.291 0.000 -2.241) 2.259 14.153 ( 0.024 0.000 13.419) 13.419 14.546 ( -4.362 0.000 0.863) 4.446 14.730 ( 8.139 0.000 -10.229) 13.072 14.749 ( 1.070 0.000 3.555) 3.712 14.781 ( 0.643 0.000 0.865) 1.078 14.865 ( 4.476 0.000 3.566) 5.722 15.200 ( -4.719 0.000 -7.582) 8.931 15.231 ( -5.643 0.000 -4.079) 6.963 15.641 ( 10.149 0.000 -0.667) 10.171 15.711 ( 9.892 0.000 -3.064) 10.355 15.766 ( -1.077 0.000 3.102) 3.284 16.005 ( 0.909 0.000 4.902) 4.986 16.020 ( -0.696 0.000 -1.588) 1.734 16.243 ( 3.692 0.000 -1.986) 4.193 16.554 ( -10.872 0.000 2.617) 11.183 16.617 ( -4.553 0.000 0.507) 4.582 16.738 ( -0.245 0.000 -0.391) 0.461 16.877 ( 7.742 0.000 -1.039) 7.811 16.918 ( -10.772 0.000 -6.954) 12.822 17.130 ( 2.988 0.000 4.760) 5.620 17.138 ( -10.810 0.000 4.010) 11.530 17.547 ( -3.874 0.000 2.826) 4.795 17.630 ( 0.264 0.000 -10.836) 10.839 17.673 ( -0.453 0.000 -7.788) 7.802 18.215 ( -0.853 0.000 4.032) 4.122 18.397 ( 2.899 0.000 -5.112) 5.877 18.903 ( 6.378 0.000 3.755) 7.402 19.138 ( -0.674 0.000 -1.613) 1.748 19.695 ( -5.212 0.000 6.660) 8.458 19.798 ( -2.060 0.000 -2.138) 2.969 19.999 ( -0.121 0.000 5.596) 5.597 20.092 ( 2.426 0.000 -0.889) 2.584 ======================= Grid point 157 (75/104) ======================= q-point: ( 0.00 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.303 ( 1.470 9.308 25.482) 27.168 1.510 ( 6.060 15.170 26.491) 31.122 1.783 ( -2.184 3.553 -22.094) 22.484 1.995 ( -5.662 9.200 -22.144) 24.638 2.489 ( -8.515 2.797 30.366) 31.661 2.552 ( -0.350 -0.021 10.814) 10.819 2.637 ( 2.607 -1.290 0.842) 3.028 2.885 ( 1.384 -10.844 -1.848) 11.087 3.050 ( -0.202 -11.826 6.325) 13.413 3.114 ( 3.266 -1.774 4.341) 5.715 3.127 ( 3.580 -4.182 5.642) 7.883 3.283 ( -0.107 -0.497 -0.409) 0.653 3.285 ( -3.049 -3.160 0.346) 4.405 3.376 ( -1.780 1.127 -1.063) 2.360 3.477 ( 6.074 1.632 -0.634) 6.321 3.535 ( -2.131 8.143 -1.400) 8.533 3.548 ( 3.854 -4.630 -0.602) 6.054 3.658 ( 0.788 2.692 -8.594) 9.040 3.670 ( 2.839 6.276 -5.678) 8.927 3.777 ( -4.652 0.482 -17.061) 17.690 3.994 ( 6.821 -3.945 4.823) 9.239 4.067 ( -5.295 -4.276 -3.012) 7.442 4.225 ( 1.784 1.729 5.741) 6.255 4.340 ( -4.050 2.056 -5.707) 7.294 4.435 ( -0.687 0.235 0.433) 0.846 4.467 ( -0.815 0.742 -2.484) 2.718 4.520 ( 0.418 3.217 -1.267) 3.483 4.556 ( 2.645 -0.184 -3.216) 4.169 4.848 ( 0.718 -0.784 2.880) 3.070 4.890 ( 0.723 -1.374 -1.345) 2.055 4.937 ( 0.103 -2.911 4.146) 5.066 5.024 ( -2.435 -3.266 -3.846) 5.602 5.193 ( 0.322 6.857 1.192) 6.967 5.240 ( -1.121 3.113 -2.706) 4.274 5.531 ( 4.462 3.041 1.568) 5.623 5.549 ( -4.056 3.583 -0.117) 5.413 5.860 ( -0.267 -1.146 0.392) 1.240 5.901 ( 2.098 -1.324 -2.985) 3.882 6.133 ( -4.892 -1.517 6.137) 7.993 6.247 ( 5.916 -1.271 -4.367) 7.462 6.403 ( 1.798 -0.120 7.060) 7.286 6.513 ( -1.111 1.439 0.979) 2.065 6.640 ( 1.285 -1.497 -1.243) 2.332 6.765 ( -1.727 -0.503 -7.308) 7.526 7.073 ( -5.124 -4.072 6.762) 9.411 7.185 ( 1.776 -1.145 -2.454) 3.239 7.284 ( 0.185 3.863 2.735) 4.736 7.369 ( 1.181 3.298 -4.933) 6.050 7.798 ( -1.734 2.639 0.862) 3.273 7.831 ( -4.148 2.707 -1.290) 5.118 8.081 ( -2.099 -5.398 0.921) 5.865 8.139 ( 6.187 -3.925 -4.862) 8.793 8.541 ( -3.949 2.619 2.108) 5.187 8.580 ( 1.846 3.846 -1.498) 4.522 8.756 ( 1.433 -4.862 2.506) 5.654 8.826 ( -0.380 -3.735 -4.704) 6.019 9.106 ( 1.485 3.455 5.113) 6.347 9.193 ( 6.064 -4.308 5.831) 9.451 9.245 ( 3.133 0.194 -5.339) 6.194 9.329 ( -6.137 -3.588 -5.521) 9.001 9.571 ( 2.133 2.241 0.372) 3.116 9.623 ( -2.743 3.393 -3.853) 5.821 10.051 ( 3.290 5.796 1.795) 6.902 10.067 ( -5.053 5.217 0.650) 7.292 10.410 ( 7.431 -2.011 3.262) 8.361 10.465 ( -2.145 -2.451 -1.273) 3.497 10.542 ( -4.653 -1.360 1.072) 4.964 10.573 ( -3.576 0.070 -1.710) 3.965 10.803 ( -5.726 -1.067 6.548) 8.764 10.911 ( 2.536 -3.813 -3.157) 5.562 11.214 ( 0.513 1.911 6.047) 6.362 11.294 ( 1.959 1.637 -1.854) 3.155 11.486 ( -1.311 -0.305 0.328) 1.385 11.539 ( -1.177 -1.325 -4.468) 4.806 11.899 ( 0.889 -4.751 3.003) 5.691 11.959 ( -0.381 -4.385 -3.127) 5.399 12.203 ( 0.281 4.966 5.194) 7.191 12.316 ( -0.519 5.780 -6.149) 8.455 12.625 ( 1.393 -0.568 3.732) 4.024 12.730 ( -2.601 -2.371 -6.940) 7.781 12.882 ( 0.482 2.718 8.815) 9.237 13.070 ( 1.099 2.055 -9.929) 10.198 13.296 ( 1.595 -3.687 1.409) 4.257 13.315 ( -1.058 -3.575 -0.609) 3.778 13.422 ( 3.985 0.824 4.792) 6.287 13.492 ( -2.768 1.342 -2.138) 3.746 13.641 ( 1.709 3.284 0.699) 3.768 13.685 ( 0.022 2.023 -3.189) 3.776 14.276 ( 1.355 -0.980 10.705) 10.835 14.410 ( -1.129 -4.806 -2.022) 5.335 14.657 ( -3.926 -0.446 3.516) 5.289 14.741 ( -2.024 -0.700 -4.391) 4.886 14.919 ( 4.447 0.715 6.097) 7.580 14.980 ( 1.564 -0.168 0.556) 1.669 15.096 ( -5.145 1.361 -6.010) 8.028 15.102 ( 2.099 1.296 -6.013) 6.499 15.728 ( 1.895 -1.634 3.809) 4.557 15.794 ( 0.274 -4.721 0.516) 4.757 15.831 ( 1.463 2.107 -2.363) 3.488 15.854 ( -2.580 0.795 -3.434) 4.368 16.208 ( 5.466 2.181 8.236) 10.122 16.332 ( -4.757 -2.836 -3.291) 6.442 16.393 ( 6.873 -0.299 0.977) 6.948 16.458 ( -10.275 4.825 -6.496) 13.078 16.710 ( -3.816 -1.069 1.489) 4.233 16.735 ( 3.391 -0.218 -0.733) 3.477 17.038 ( -3.263 2.356 1.077) 4.166 17.085 ( 4.051 3.908 -3.167) 6.459 17.257 ( -0.751 -0.327 10.189) 10.222 17.433 ( 1.044 -1.365 -6.043) 6.282 17.627 ( -3.527 6.990 1.020) 7.895 17.717 ( 1.703 7.122 -6.978) 10.115 18.259 ( -1.715 1.875 6.625) 7.096 18.379 ( 0.197 0.023 -5.415) 5.418 19.000 ( 3.481 -1.834 3.480) 5.253 19.066 ( -2.330 -2.568 -2.924) 4.535 19.541 ( -0.061 -11.873 4.055) 12.546 19.584 ( 2.420 -13.778 0.128) 13.990 20.101 ( -1.767 5.635 6.955) 9.123 20.229 ( 2.482 3.990 -5.661) 7.357 ======================= Grid point 158 (76/104) ======================= q-point: ( 0.10 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( 15.094 0.619 23.574) 27.999 1.762 ( 16.211 8.655 -21.574) 28.340 1.827 ( 8.132 9.213 -16.812) 20.824 1.952 ( 17.994 10.162 18.855) 27.974 2.529 ( -1.402 -4.433 6.175) 7.730 2.654 ( 4.439 -2.230 -2.141) 5.409 2.719 ( -0.406 4.596 17.541) 18.138 2.878 ( 2.074 -11.343 -4.512) 12.382 3.116 ( 2.204 -8.635 1.171) 8.989 3.141 ( 1.913 -4.506 0.095) 4.897 3.228 ( -1.916 2.696 -3.568) 4.865 3.239 ( -3.068 1.142 -3.041) 4.468 3.325 ( 4.612 0.036 9.883) 10.906 3.405 ( 5.575 -2.654 0.257) 6.180 3.467 ( 0.623 3.327 -7.108) 7.873 3.519 ( 0.998 2.523 -9.135) 9.530 3.598 ( 1.952 3.741 -3.288) 5.350 3.623 ( 10.288 0.767 -0.199) 10.319 3.745 ( 7.823 -0.836 -2.855) 8.369 3.824 ( 9.213 -3.165 -1.809) 9.909 3.977 ( -0.051 0.349 -4.289) 4.303 4.125 ( 4.634 -4.051 3.198) 6.936 4.220 ( -3.913 4.961 -0.655) 6.352 4.294 ( -0.206 -1.871 3.924) 4.352 4.411 ( -0.071 2.209 -2.140) 3.077 4.475 ( -1.933 0.818 2.608) 3.348 4.516 ( 1.490 2.727 -0.730) 3.192 4.568 ( 1.743 0.803 -4.354) 4.758 4.819 ( -4.142 -2.836 -0.085) 5.021 4.871 ( -1.437 -0.424 -1.499) 2.120 4.966 ( -0.623 -2.763 0.300) 2.848 5.004 ( 1.898 -3.554 3.739) 5.497 5.120 ( -4.706 1.256 0.450) 4.892 5.290 ( 2.770 7.229 0.467) 7.755 5.448 ( -6.067 1.079 -0.156) 6.164 5.622 ( 4.194 4.432 0.299) 6.109 5.820 ( -3.702 -1.238 -0.081) 3.904 5.876 ( -1.703 -0.308 -4.073) 4.425 6.086 ( -4.521 0.604 3.132) 5.533 6.218 ( -9.733 1.173 -0.474) 9.815 6.328 ( 0.516 -4.713 -2.782) 5.497 6.556 ( -5.355 4.270 -1.736) 7.065 6.645 ( 5.558 -3.559 -0.578) 6.625 6.743 ( -2.703 -2.540 0.521) 3.745 6.950 ( -10.867 -1.619 6.321) 12.675 7.126 ( -4.093 0.012 0.165) 4.097 7.336 ( 4.499 2.926 -1.894) 5.691 7.405 ( 3.192 1.094 1.019) 3.525 7.759 ( -2.719 -0.657 2.450) 3.719 7.835 ( 2.998 2.364 5.840) 6.978 8.088 ( 3.418 1.209 -3.210) 4.842 8.259 ( 8.473 -3.210 -4.922) 10.311 8.558 ( 2.041 0.660 2.015) 2.943 8.603 ( -2.059 1.464 1.316) 2.849 8.783 ( -0.977 -6.286 2.002) 6.669 8.827 ( 6.981 -1.898 -4.644) 8.597 9.096 ( -5.729 -2.665 -5.001) 8.058 9.134 ( 0.496 6.188 1.453) 6.376 9.283 ( 2.098 -1.497 -6.552) 7.041 9.402 ( 5.323 1.670 2.223) 6.006 9.507 ( 2.210 -0.363 -0.059) 2.241 9.757 ( 9.004 0.751 1.229) 9.118 9.974 ( -4.368 2.562 1.163) 5.195 10.103 ( -4.156 4.299 3.192) 6.778 10.249 ( -3.960 2.131 -2.533) 5.162 10.447 ( -5.484 0.010 -2.975) 6.239 10.556 ( -3.186 -2.512 5.485) 6.822 10.628 ( 2.468 -3.196 6.438) 7.599 10.836 ( 5.607 -2.762 2.833) 6.862 11.008 ( 8.797 -0.092 0.388) 8.806 11.228 ( -3.207 1.029 1.485) 3.681 11.277 ( -1.036 2.472 -4.948) 5.627 11.445 ( -3.646 -2.187 1.825) 4.627 11.497 ( -0.459 -0.595 1.814) 1.963 11.914 ( -1.496 -3.209 -0.731) 3.615 11.930 ( -0.210 -4.633 -0.332) 4.650 12.176 ( -4.860 3.182 0.287) 5.816 12.287 ( -0.519 7.049 0.426) 7.081 12.650 ( 0.826 -3.355 -1.198) 3.657 12.755 ( 4.419 0.238 1.206) 4.586 12.886 ( -5.880 3.382 4.295) 8.029 12.970 ( -2.438 0.908 -6.723) 7.209 13.236 ( -4.059 -1.692 -0.895) 4.488 13.274 ( -3.869 0.120 -1.363) 4.104 13.460 ( 0.842 0.132 -1.542) 1.762 13.528 ( 2.108 -0.224 2.195) 3.052 13.638 ( 0.121 0.032 -0.052) 0.136 13.686 ( 1.488 0.620 -2.850) 3.275 14.321 ( -1.032 -4.852 0.524) 4.988 14.410 ( -0.021 -3.539 1.656) 3.907 14.605 ( -5.455 2.885 6.126) 8.695 14.711 ( -0.612 -1.384 2.697) 3.092 14.887 ( -4.552 0.277 -4.497) 6.405 14.945 ( -3.547 -0.370 -3.455) 4.966 15.068 ( 3.494 3.131 4.404) 6.435 15.229 ( 10.007 0.448 -2.538) 10.334 15.608 ( -11.361 -1.441 -0.690) 11.473 15.718 ( -4.575 5.664 -0.319) 7.288 15.813 ( -0.159 -1.997 -3.879) 4.366 15.933 ( 4.072 -3.332 1.990) 5.625 16.191 ( -8.727 2.145 0.329) 8.992 16.212 ( -0.571 3.383 -3.772) 5.099 16.494 ( 6.940 -6.282 2.799) 9.770 16.572 ( 9.438 0.529 4.411) 10.431 16.703 ( 1.106 -0.091 0.944) 1.457 16.830 ( 7.315 0.299 -0.681) 7.352 16.945 ( -4.204 4.149 0.958) 5.984 17.149 ( 1.081 -1.615 -1.982) 2.776 17.276 ( -0.369 2.099 3.971) 4.506 17.482 ( 6.441 -0.524 -3.207) 7.215 17.571 ( -3.549 7.598 4.368) 9.455 17.726 ( 1.621 6.080 -3.205) 7.062 18.243 ( -4.631 -1.265 3.402) 5.884 18.350 ( 0.014 3.402 -0.602) 3.455 18.967 ( -5.378 -2.599 -4.524) 7.493 19.073 ( 2.083 -1.690 2.398) 3.598 19.578 ( 4.146 -11.732 -0.064) 12.443 19.684 ( 7.801 -11.241 -2.404) 13.893 20.104 ( -2.349 5.363 5.147) 7.795 20.192 ( -1.334 3.696 -5.384) 6.665 ======================= Grid point 159 (77/104) ======================= q-point: ( 0.20 0.17 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.878 ( 16.434 6.806 -17.401) 24.884 2.010 ( 21.115 8.368 -15.513) 27.506 2.135 ( 15.784 -4.228 18.349) 24.571 2.413 ( 12.398 4.375 17.387) 21.798 2.543 ( 2.808 -2.307 1.736) 4.027 2.676 ( 2.382 -2.287 -3.221) 4.613 2.801 ( 0.260 -1.988 1.899) 2.762 2.906 ( 1.866 -5.538 -0.273) 5.850 3.086 ( -3.840 1.915 -5.627) 7.076 3.123 ( -1.274 1.164 1.250) 2.131 3.186 ( -1.893 -0.046 0.942) 2.115 3.242 ( 5.378 -1.268 -2.278) 5.976 3.413 ( 1.233 -2.143 -0.504) 2.523 3.508 ( 8.455 -0.731 2.906) 8.970 3.525 ( 9.538 2.978 -5.314) 11.317 3.587 ( 6.951 -0.833 -0.109) 7.001 3.658 ( 5.702 4.364 -1.875) 7.421 3.816 ( 7.959 -2.524 -7.097) 10.958 3.865 ( 2.706 -1.375 -7.721) 8.296 3.930 ( 10.192 3.572 9.865) 14.627 4.085 ( 9.457 1.057 1.171) 9.587 4.167 ( 2.741 -1.341 -1.238) 3.293 4.260 ( -1.851 -2.336 -0.677) 3.056 4.276 ( 1.439 1.871 3.621) 4.322 4.376 ( 1.459 5.327 -0.953) 5.605 4.448 ( -4.389 1.829 3.937) 6.173 4.523 ( 2.054 0.598 -5.151) 5.577 4.588 ( 1.010 -1.017 0.737) 1.611 4.739 ( -3.650 -2.430 -1.395) 4.602 4.815 ( -2.622 -0.265 -2.568) 3.680 4.973 ( -1.151 -3.940 3.971) 5.711 5.060 ( -1.850 -2.115 1.921) 3.404 5.079 ( 3.033 -4.713 2.588) 6.173 5.285 ( -3.545 6.021 -1.409) 7.128 5.358 ( -4.250 -0.267 3.693) 5.636 5.682 ( 2.354 2.044 -1.859) 3.629 5.745 ( -2.193 -0.898 -2.657) 3.560 5.816 ( -2.049 2.707 -2.428) 4.174 5.983 ( -7.180 1.995 1.579) 7.618 6.130 ( 1.190 2.504 2.865) 3.987 6.285 ( -6.182 -3.519 -1.957) 7.378 6.432 ( -6.776 2.075 -2.300) 7.451 6.608 ( -3.117 -7.776 -4.070) 9.314 6.689 ( -3.318 -1.818 -3.827) 5.382 6.843 ( -7.132 1.130 11.840) 13.868 7.079 ( -0.547 -0.726 -3.438) 3.557 7.384 ( 1.863 0.123 -0.322) 1.894 7.532 ( 7.632 4.248 5.084) 10.107 7.781 ( 1.901 -3.676 5.096) 6.565 7.959 ( 5.223 2.694 4.194) 7.220 8.125 ( 2.854 3.132 -2.156) 4.754 8.319 ( 3.309 -3.063 -10.286) 11.231 8.541 ( -3.920 2.550 3.078) 5.599 8.559 ( -3.404 3.629 0.113) 4.977 8.773 ( 0.345 -5.570 -0.200) 5.584 8.984 ( 6.819 -3.539 1.399) 7.809 9.027 ( 3.095 -4.754 -2.800) 6.326 9.193 ( 3.251 5.093 1.003) 6.125 9.273 ( 3.786 2.573 -7.023) 8.383 9.441 ( 1.981 7.975 -0.521) 8.234 9.631 ( 6.453 -4.439 0.913) 7.885 9.899 ( 2.625 -0.078 2.831) 3.862 9.937 ( -0.427 0.277 2.608) 2.657 10.002 ( -3.170 -0.573 0.150) 3.225 10.207 ( -5.676 -1.741 1.021) 6.024 10.343 ( -1.276 5.536 -4.255) 7.098 10.508 ( -6.138 -3.166 6.413) 9.424 10.648 ( -4.732 -1.347 5.990) 7.752 10.962 ( 5.613 -4.252 1.474) 7.195 11.085 ( -4.218 -2.179 -4.020) 6.220 11.167 ( -2.386 4.304 1.081) 5.038 11.273 ( 7.394 2.736 -0.612) 7.908 11.430 ( -1.334 -1.949 3.917) 4.574 11.519 ( 1.561 -3.659 -1.487) 4.247 11.875 ( -3.118 -0.424 0.392) 3.171 11.913 ( -0.027 -2.789 -1.190) 3.033 12.089 ( -4.217 2.755 -0.625) 5.076 12.255 ( -4.191 7.882 1.132) 8.998 12.611 ( -6.134 -4.390 -3.685) 8.395 12.752 ( -6.458 1.708 3.045) 7.342 12.780 ( 2.151 1.522 -3.031) 4.016 13.020 ( 4.943 0.604 3.104) 5.868 13.193 ( -1.438 2.870 0.331) 3.227 13.210 ( 0.277 -0.091 -1.976) 1.998 13.462 ( -1.725 -2.842 -1.124) 3.509 13.500 ( -2.578 -0.038 -1.063) 2.789 13.663 ( 1.242 -1.370 2.387) 3.019 13.712 ( 3.739 -1.516 -4.741) 6.226 14.289 ( 0.119 -3.105 -5.467) 6.288 14.380 ( -5.513 -2.979 4.956) 7.989 14.535 ( -8.224 3.168 6.838) 11.155 14.723 ( -2.032 -1.730 4.646) 5.358 14.819 ( 1.498 0.082 -4.830) 5.058 14.870 ( -1.466 -0.170 -3.615) 3.905 15.159 ( 1.388 3.237 6.195) 7.126 15.363 ( 4.797 -0.989 -3.888) 6.254 15.431 ( -6.190 -1.562 0.290) 6.391 15.602 ( -4.873 6.020 -2.287) 8.076 15.784 ( -0.080 -1.298 -2.915) 3.192 16.016 ( -5.504 0.010 -1.016) 5.597 16.037 ( 2.461 2.317 3.378) 4.779 16.262 ( 5.069 0.258 -1.163) 5.207 16.551 ( -1.115 -4.800 2.868) 5.702 16.740 ( 5.034 -0.306 0.003) 5.044 16.751 ( 5.458 -0.018 -0.611) 5.493 16.859 ( -0.164 -0.515 -3.287) 3.331 17.004 ( 2.135 3.152 3.995) 5.519 17.113 ( -1.158 -1.111 1.028) 1.906 17.335 ( 3.990 3.008 1.009) 5.098 17.528 ( -0.942 -3.030 0.438) 3.204 17.604 ( 2.409 9.732 5.114) 11.255 17.687 ( -4.372 4.496 -0.987) 6.348 18.166 ( -4.722 -3.793 1.257) 6.186 18.375 ( 1.194 5.823 3.020) 6.667 18.808 ( -7.118 -3.085 -5.841) 9.711 19.117 ( 1.653 -2.829 0.221) 3.284 19.694 ( 8.736 -9.885 -1.489) 13.276 19.809 ( 7.645 -8.659 -3.155) 11.974 20.080 ( -2.108 4.365 -0.466) 4.870 20.168 ( 1.806 3.249 0.094) 3.719 ======================= Grid point 160 (78/104) ======================= q-point: ( 0.30 0.17 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.115 ( 20.050 2.290 -11.582) 23.268 2.268 ( 17.886 5.371 -11.913) 22.151 2.438 ( 5.882 -5.291 4.909) 9.311 2.512 ( 1.438 -0.838 5.379) 5.631 2.679 ( 2.308 -1.988 -2.450) 3.909 2.818 ( 8.245 2.017 7.072) 11.048 2.862 ( 7.418 -5.591 1.586) 9.424 2.900 ( -2.175 -2.321 6.530) 7.264 3.015 ( -1.584 5.804 -0.044) 6.017 3.124 ( 1.080 7.729 4.010) 8.774 3.185 ( 0.650 -2.340 1.558) 2.885 3.332 ( 3.581 -1.032 -0.077) 3.727 3.432 ( 1.529 -0.871 0.502) 1.829 3.628 ( 4.783 -0.492 -0.624) 4.848 3.640 ( 1.978 -0.004 2.702) 3.348 3.698 ( 2.988 1.833 -1.386) 3.769 3.749 ( 4.150 -1.946 -0.597) 4.622 3.860 ( 1.523 -0.559 -2.393) 2.891 3.961 ( 14.159 0.623 -12.177) 18.686 4.021 ( -1.802 5.409 3.675) 6.783 4.120 ( -7.111 3.118 0.188) 7.767 4.244 ( 1.692 0.131 6.088) 6.320 4.291 ( 7.823 -2.754 -3.635) 9.055 4.341 ( 0.247 1.454 -0.028) 1.475 4.427 ( 4.225 0.754 1.977) 4.726 4.473 ( 6.430 3.552 0.190) 7.348 4.561 ( 3.070 -1.914 -1.428) 3.889 4.588 ( 1.391 -0.112 -3.457) 3.728 4.676 ( -1.052 1.856 -3.236) 3.876 4.764 ( 0.977 -0.406 -2.908) 3.094 4.957 ( -3.805 -2.644 4.561) 6.502 5.056 ( -0.696 -3.961 2.568) 4.771 5.115 ( -2.707 -0.475 0.562) 2.805 5.241 ( 0.811 -6.900 1.288) 7.066 5.318 ( -3.118 2.480 3.249) 5.141 5.672 ( -0.237 -0.435 -3.314) 3.351 5.714 ( -1.158 1.501 -3.531) 4.008 5.775 ( -1.213 1.029 2.252) 2.757 5.929 ( -1.871 0.732 5.628) 5.976 6.068 ( -8.822 -1.916 -6.533) 11.144 6.262 ( 6.537 3.514 3.535) 8.221 6.353 ( 0.359 0.378 -1.512) 1.599 6.474 ( -9.379 -3.121 1.160) 9.952 6.643 ( 2.236 -5.759 -8.241) 10.300 6.824 ( -4.012 2.869 9.413) 10.627 7.056 ( 2.564 -0.590 -6.982) 7.461 7.415 ( 0.523 0.093 3.601) 3.640 7.673 ( 3.586 1.359 1.153) 4.005 7.890 ( 5.239 -2.864 5.429) 8.070 8.023 ( 0.863 2.411 -2.525) 3.597 8.176 ( 0.604 1.055 4.214) 4.386 8.287 ( 4.648 -1.760 -9.674) 10.876 8.486 ( -1.526 5.732 -0.170) 5.933 8.535 ( -0.653 5.134 1.511) 5.391 8.785 ( -0.001 -4.893 0.629) 4.933 9.002 ( -1.159 -6.100 -3.611) 7.182 9.116 ( 4.042 -1.076 -0.119) 4.185 9.245 ( 1.602 1.136 0.903) 2.161 9.335 ( 4.705 6.580 -1.223) 8.181 9.482 ( 2.034 5.774 1.023) 6.207 9.720 ( 3.193 -3.507 -1.169) 4.885 9.886 ( -2.305 0.428 -1.754) 2.928 9.942 ( 0.059 -0.596 6.054) 6.084 10.052 ( -5.929 -3.952 6.415) 9.587 10.091 ( 3.993 -2.058 -4.031) 6.036 10.318 ( -0.290 4.337 -2.113) 4.833 10.440 ( -6.147 -1.347 5.863) 8.601 10.542 ( -10.456 -0.240 4.170) 11.259 10.963 ( -4.042 -0.535 3.127) 5.138 11.072 ( 3.496 0.446 -0.509) 3.560 11.187 ( 4.134 -1.253 1.159) 4.473 11.380 ( 2.996 -0.283 -2.329) 3.805 11.423 ( -0.389 0.293 -1.467) 1.545 11.510 ( 1.328 -2.281 -6.045) 6.596 11.791 ( -4.417 0.127 -2.260) 4.964 11.938 ( 1.149 -1.512 1.772) 2.597 12.010 ( -3.720 3.500 -1.011) 5.207 12.161 ( -5.696 7.203 0.233) 9.186 12.484 ( -3.804 -4.161 -2.026) 5.991 12.646 ( -8.427 -0.297 6.045) 10.375 12.868 ( 7.540 1.610 -2.374) 8.067 13.098 ( 1.481 0.485 2.613) 3.043 13.154 ( -0.842 -0.308 -3.319) 3.438 13.235 ( -1.436 2.668 0.631) 3.095 13.347 ( -3.623 -1.827 -2.943) 5.012 13.544 ( 3.837 -3.556 1.153) 5.357 13.673 ( 1.154 -2.506 -5.238) 5.920 13.750 ( 2.474 -1.094 0.259) 2.717 14.263 ( 0.936 -2.847 -3.630) 4.707 14.312 ( -5.932 -0.560 6.208) 8.605 14.416 ( -8.120 3.090 4.140) 9.624 14.684 ( -5.220 -2.555 3.267) 6.667 14.834 ( 2.004 -0.729 -3.516) 4.112 14.868 ( 3.388 1.557 -0.759) 3.805 15.156 ( -5.136 1.252 0.407) 5.302 15.299 ( -4.611 1.235 0.798) 4.840 15.419 ( 0.111 -1.529 1.897) 2.439 15.607 ( 7.268 3.325 -4.673) 9.258 15.774 ( 0.807 -0.763 -1.620) 1.964 15.886 ( -7.868 2.813 4.044) 9.283 16.147 ( 4.718 0.753 1.724) 5.080 16.352 ( 5.580 1.106 -1.073) 5.789 16.540 ( -1.307 -2.143 1.932) 3.168 16.814 ( 3.911 -0.807 -1.141) 4.153 16.825 ( 2.244 -1.119 -1.615) 2.982 16.833 ( -1.158 -2.058 -1.007) 2.567 17.018 ( 1.489 3.143 1.691) 3.867 17.121 ( 0.118 2.168 -3.294) 3.945 17.388 ( -0.952 0.588 -0.248) 1.146 17.483 ( -5.668 -2.150 2.050) 6.399 17.567 ( -2.978 2.908 1.397) 4.391 17.715 ( 2.090 9.694 9.619) 13.816 18.081 ( -4.896 -6.031 -2.294) 8.100 18.399 ( -0.602 9.081 -1.380) 9.205 18.695 ( -1.595 -5.614 1.161) 5.951 19.130 ( 0.866 -4.274 -3.290) 5.463 19.843 ( 7.994 -6.836 -1.381) 10.609 19.896 ( 3.826 -5.625 -1.714) 7.015 20.069 ( 1.946 4.390 -0.970) 4.899 20.222 ( 3.158 0.415 -0.290) 3.198 ======================= Grid point 161 (79/104) ======================= q-point: ( 0.40 0.17 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.386 ( 13.930 -3.357 -4.017) 14.881 2.441 ( 3.670 -3.289 -1.278) 5.091 2.521 ( 10.073 3.550 -6.450) 12.477 2.601 ( 4.137 1.891 0.434) 4.570 2.706 ( 1.652 -1.794 1.430) 2.827 2.793 ( -5.150 -3.715 -0.589) 6.377 2.977 ( 3.354 1.355 2.337) 4.307 3.004 ( 0.765 6.685 0.708) 6.766 3.088 ( 6.408 -0.189 10.925) 12.667 3.194 ( 0.897 2.946 4.085) 5.116 3.262 ( 3.669 1.248 3.732) 5.380 3.359 ( 1.371 -1.659 0.389) 2.187 3.472 ( 1.199 -0.413 1.168) 1.725 3.603 ( -3.500 -2.063 -2.275) 4.656 3.669 ( -0.853 3.968 0.482) 4.087 3.752 ( 3.811 0.926 0.221) 3.929 3.799 ( 4.015 -0.923 -2.896) 5.036 3.880 ( 0.391 -2.919 2.545) 3.893 3.942 ( -5.173 -0.013 -2.621) 5.799 4.047 ( -0.426 2.573 7.971) 8.387 4.092 ( 0.571 5.772 -3.328) 6.687 4.233 ( -5.556 3.855 8.512) 10.872 4.320 ( -0.467 -4.201 -3.888) 5.743 4.395 ( 2.879 -1.262 -1.395) 3.439 4.505 ( -0.244 2.209 1.080) 2.471 4.519 ( 1.803 1.479 -4.041) 4.665 4.549 ( 2.493 -0.068 -5.646) 6.172 4.617 ( 3.192 1.630 -3.474) 4.991 4.723 ( 6.966 -0.015 -2.791) 7.505 4.831 ( 4.188 -1.869 -3.626) 5.846 4.949 ( 3.634 -1.779 2.091) 4.555 5.047 ( -2.206 -3.686 2.610) 5.027 5.070 ( -1.858 -1.101 2.113) 3.022 5.219 ( -5.681 -7.186 1.402) 9.268 5.321 ( 2.506 1.779 -0.449) 3.106 5.567 ( -8.187 2.896 -2.496) 9.036 5.698 ( -0.328 0.563 2.207) 2.301 5.795 ( 1.820 1.807 3.290) 4.172 5.928 ( 0.990 -1.821 -2.677) 3.385 6.035 ( 4.278 -4.457 0.640) 6.211 6.229 ( -3.309 1.522 -5.258) 6.396 6.320 ( -7.056 -1.877 0.080) 7.302 6.517 ( 8.665 0.501 2.988) 9.179 6.628 ( 1.013 -4.539 -3.350) 5.732 6.828 ( -1.939 4.280 7.284) 8.668 7.072 ( 4.998 -0.475 -9.354) 10.616 7.460 ( 0.854 -0.514 5.788) 5.874 7.680 ( -1.318 -0.531 -2.647) 3.004 7.973 ( -0.677 0.432 2.617) 2.738 7.992 ( -1.034 1.912 -2.957) 3.670 8.207 ( 2.245 -1.251 2.308) 3.454 8.364 ( 6.991 -2.572 -5.452) 9.231 8.516 ( 1.244 2.440 2.310) 3.583 8.542 ( 2.343 8.215 2.676) 8.952 8.758 ( -3.530 -3.560 -0.264) 5.020 8.908 ( -2.395 -0.118 -9.720) 10.011 9.189 ( 2.659 0.310 1.331) 2.989 9.252 ( -1.472 -0.313 2.899) 3.266 9.396 ( 2.091 4.454 2.303) 5.433 9.522 ( 0.697 3.937 3.030) 5.016 9.721 ( -1.242 -2.973 -2.175) 3.887 9.802 ( -4.215 -0.304 -3.106) 5.244 9.998 ( 0.683 -1.801 2.421) 3.094 10.041 ( 3.233 -2.059 7.880) 8.763 10.182 ( 3.541 -3.683 -1.419) 5.303 10.288 ( -1.953 0.992 -0.862) 2.354 10.343 ( -10.013 0.519 7.368) 12.442 10.402 ( -3.476 2.358 -1.082) 4.338 10.981 ( 1.321 0.991 8.071) 8.238 11.121 ( 1.582 1.931 0.027) 2.496 11.252 ( 1.289 -2.949 -2.092) 3.839 11.377 ( 0.815 0.041 -2.297) 2.438 11.390 ( -0.045 0.162 -4.193) 4.196 11.507 ( 2.516 0.013 -8.126) 8.506 11.725 ( -0.692 -0.913 -0.970) 1.502 11.889 ( -5.802 -1.528 -0.867) 6.062 11.995 ( 0.609 3.695 1.579) 4.064 12.083 ( -2.517 5.130 -0.400) 5.728 12.441 ( -0.309 -3.419 -0.241) 3.441 12.539 ( -7.055 -1.387 3.724) 8.097 12.985 ( 5.645 0.372 -0.138) 5.659 13.100 ( -1.931 -1.106 -0.179) 2.233 13.122 ( -0.186 0.216 -1.653) 1.677 13.173 ( -3.244 0.463 -0.373) 3.298 13.325 ( 1.770 1.200 -2.781) 3.509 13.523 ( -4.036 -3.001 -5.363) 7.352 13.733 ( 7.013 -3.557 -0.794) 7.904 13.794 ( 1.147 -1.711 1.930) 2.823 14.247 ( -3.072 0.307 1.865) 3.607 14.266 ( -4.245 -0.700 6.086) 7.453 14.354 ( 1.284 0.098 0.666) 1.450 14.591 ( -6.900 -3.068 2.166) 7.856 14.867 ( 3.718 -0.849 -2.531) 4.577 14.938 ( 4.119 3.275 1.470) 5.464 15.043 ( -4.491 0.728 -3.922) 6.007 15.201 ( -5.483 4.497 -1.742) 7.302 15.484 ( 1.304 -1.938 9.344) 9.631 15.713 ( 8.398 -0.433 -7.914) 11.547 15.756 ( -4.474 -0.738 1.495) 4.775 15.814 ( -1.161 1.140 1.868) 2.477 16.226 ( 2.087 3.843 4.542) 6.305 16.437 ( 4.327 3.663 -2.579) 6.228 16.549 ( 1.761 -4.330 1.182) 4.822 16.761 ( -3.465 -0.718 -3.172) 4.752 16.809 ( -1.761 0.789 0.603) 2.022 16.927 ( 5.223 -2.683 2.784) 6.498 17.027 ( -2.225 4.537 -6.395) 8.150 17.127 ( 5.446 2.305 -0.301) 5.922 17.303 ( -4.712 1.203 -2.958) 5.692 17.363 ( -8.405 -1.133 3.023) 9.003 17.600 ( 0.788 -1.941 6.623) 6.946 17.837 ( 3.237 8.502 8.751) 12.624 17.963 ( -4.076 -4.870 -4.252) 7.643 18.334 ( -2.497 8.777 -6.719) 11.332 18.750 ( 2.273 -6.040 8.025) 10.297 19.100 ( -0.178 -5.224 -6.539) 8.371 19.923 ( 1.309 -2.318 1.116) 2.887 19.964 ( 4.624 -4.790 -1.452) 6.814 20.117 ( 3.341 2.744 -0.790) 4.395 20.252 ( 0.720 -0.657 -2.194) 2.401 ======================= Grid point 162 (80/104) ======================= q-point: (-0.50 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.425 ( -4.450 -2.327 4.821) 6.961 2.512 ( 2.168 -5.786 -3.738) 7.222 2.590 ( -11.274 0.711 3.453) 11.812 2.675 ( 8.509 0.397 -3.182) 9.093 2.700 ( -3.735 -0.620 1.292) 4.001 2.750 ( 5.537 0.821 -4.339) 7.083 2.996 ( -4.977 8.296 2.555) 10.006 3.066 ( 7.093 6.854 -3.861) 10.592 3.207 ( 2.603 1.668 5.375) 6.201 3.271 ( 2.904 -1.598 5.897) 6.765 3.331 ( 1.660 -0.957 1.987) 2.760 3.360 ( -0.067 1.885 -0.959) 2.116 3.450 ( -3.948 -3.955 -0.620) 5.622 3.534 ( -1.001 -3.721 -4.943) 6.267 3.721 ( 2.590 2.767 4.059) 5.553 3.761 ( -1.824 0.415 -0.139) 1.876 3.799 ( -4.446 0.708 2.185) 5.004 3.853 ( 2.873 -1.113 -2.150) 3.757 3.941 ( -10.836 4.821 6.826) 13.684 4.032 ( 6.538 -0.096 -0.354) 6.548 4.124 ( 1.520 -1.118 5.728) 6.030 4.224 ( -1.378 -0.789 -2.885) 3.293 4.291 ( 1.749 2.708 3.466) 4.734 4.398 ( -2.131 0.549 1.712) 2.788 4.464 ( 1.153 2.138 -7.517) 7.900 4.499 ( -0.483 3.341 -4.255) 5.432 4.548 ( -3.108 -0.119 2.693) 4.114 4.672 ( 4.913 -0.020 -6.650) 8.269 4.803 ( 2.658 -0.752 -1.515) 3.151 4.806 ( -2.487 -1.530 -1.527) 3.295 5.014 ( -4.510 -6.147 4.899) 9.063 5.084 ( -0.467 -2.124 1.608) 2.704 5.086 ( 4.236 -5.203 -1.964) 6.991 5.120 ( 1.960 -3.724 -1.607) 4.505 5.361 ( -0.930 2.877 1.993) 3.621 5.446 ( 1.863 5.312 -5.577) 7.924 5.742 ( 0.728 0.514 5.624) 5.694 5.812 ( -2.501 0.164 0.586) 2.574 5.960 ( 3.937 -3.321 0.971) 5.242 6.046 ( -2.635 -1.718 -6.010) 6.784 6.194 ( 2.629 -1.393 0.285) 2.989 6.221 ( -2.801 -1.136 -2.002) 3.626 6.592 ( -2.065 -0.477 2.212) 3.063 6.640 ( 1.433 -2.156 -2.190) 3.391 6.866 ( -0.879 3.558 8.713) 9.453 7.071 ( 2.674 0.424 -11.338) 11.657 7.528 ( 1.511 -1.220 6.387) 6.675 7.613 ( -3.552 -1.510 -2.475) 4.584 7.936 ( -3.418 2.785 2.567) 5.102 7.979 ( 1.384 2.957 -1.966) 3.811 8.252 ( -2.193 -2.912 5.558) 6.647 8.402 ( 2.918 -6.195 -9.512) 11.721 8.522 ( -3.414 3.844 6.895) 8.601 8.656 ( 6.389 3.889 -1.798) 7.692 8.697 ( -0.741 0.013 0.012) 0.741 8.816 ( 0.714 4.188 -9.628) 10.523 9.192 ( -2.964 1.917 4.295) 5.560 9.279 ( 3.465 -0.420 -3.222) 4.750 9.472 ( 3.007 2.451 5.956) 7.108 9.542 ( -0.633 2.019 0.888) 2.294 9.675 ( -1.765 -1.457 0.795) 2.423 9.722 ( -2.195 -0.907 -2.976) 3.808 10.076 ( -4.944 -2.048 2.536) 5.922 10.090 ( 3.635 -2.054 2.198) 4.719 10.169 ( 1.729 -0.974 5.126) 5.496 10.242 ( -2.899 -1.242 -0.946) 3.293 10.303 ( -2.081 1.579 3.819) 4.627 10.391 ( 5.211 2.039 -4.686) 7.299 11.090 ( 0.907 1.277 12.034) 12.136 11.140 ( 1.327 1.507 1.151) 2.315 11.198 ( -2.909 -1.271 -3.746) 4.911 11.332 ( -3.044 -2.543 -4.902) 6.306 11.407 ( -0.581 2.664 -5.110) 5.792 11.468 ( 3.202 -0.354 -5.506) 6.380 11.752 ( 0.171 -2.144 1.727) 2.758 11.799 ( 0.644 -0.760 -2.734) 2.910 12.011 ( -0.516 3.412 2.578) 4.308 12.056 ( 0.180 3.927 -1.696) 4.281 12.443 ( -3.474 -2.806 3.044) 5.405 12.483 ( 3.191 -2.487 -0.873) 4.139 13.041 ( 0.023 -1.457 2.486) 2.882 13.093 ( 0.083 -0.329 -0.764) 0.836 13.098 ( -3.787 0.632 -0.388) 3.859 13.137 ( 4.173 0.721 -2.823) 5.089 13.356 ( 1.550 -0.706 -0.577) 1.798 13.404 ( -2.690 -0.441 -5.117) 5.798 13.794 ( -2.982 -2.627 2.491) 4.690 13.830 ( 2.679 -3.723 -0.701) 4.640 14.218 ( -2.571 0.776 4.427) 5.178 14.241 ( -0.846 1.444 2.829) 3.287 14.452 ( 7.078 -2.410 1.891) 7.712 14.486 ( -4.062 -3.026 -1.261) 5.220 14.891 ( -2.657 -1.884 1.889) 3.766 14.971 ( 2.085 1.315 -5.951) 6.441 15.024 ( -0.012 3.544 3.265) 4.819 15.118 ( 3.282 6.700 -6.498) 9.894 15.547 ( -4.979 -1.844 12.525) 13.604 15.684 ( -2.367 -0.427 3.165) 3.975 15.784 ( -0.549 -0.484 -3.039) 3.126 15.824 ( 7.903 -3.041 -9.550) 12.764 16.297 ( 0.011 4.231 7.922) 8.981 16.446 ( 0.965 3.782 -6.380) 7.479 16.623 ( 2.892 -2.805 2.294) 4.636 16.673 ( -2.753 -1.719 -2.701) 4.222 16.792 ( -0.984 3.829 3.280) 5.137 16.900 ( -1.827 5.329 -7.141) 9.096 17.084 ( 5.831 -2.481 4.404) 7.717 17.149 ( -5.793 -1.916 -1.894) 6.389 17.236 ( -6.271 1.159 3.284) 7.174 17.282 ( 5.339 1.985 -1.566) 5.908 17.667 ( 1.312 -2.449 7.512) 8.009 17.824 ( -1.536 -4.228 -7.897) 9.089 18.020 ( 4.075 6.942 11.221) 13.810 18.223 ( -3.394 8.104 -9.163) 12.694 18.856 ( 2.361 -5.809 8.781) 10.790 19.033 ( -1.161 -5.367 -8.727) 10.311 19.942 ( -0.936 -1.729 2.733) 3.367 20.000 ( 0.972 -3.586 -2.733) 4.612 20.167 ( 1.623 1.392 1.433) 2.574 20.215 ( -2.362 -0.205 -3.047) 3.861 ======================= Grid point 163 (81/104) ======================= q-point: (-0.40 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.286 ( -18.091 -2.871 3.670) 18.682 2.326 ( -18.069 5.273 9.122) 20.917 2.506 ( 0.151 -3.982 -2.642) 4.781 2.612 ( -4.086 3.351 -0.355) 5.297 2.757 ( -2.020 1.195 -4.383) 4.972 2.782 ( 3.468 -2.322 0.485) 4.201 2.973 ( 2.068 3.788 0.710) 4.374 3.095 ( -1.877 3.221 -5.498) 6.643 3.222 ( -4.232 0.713 -4.655) 6.331 3.266 ( -1.727 0.678 1.789) 2.577 3.325 ( -1.821 -0.366 -2.372) 3.013 3.369 ( -0.736 -0.868 -0.635) 1.304 3.482 ( 2.398 -3.657 4.331) 6.155 3.514 ( 2.548 -2.114 1.353) 3.576 3.670 ( -3.207 1.667 1.559) 3.936 3.727 ( -5.335 -2.434 2.353) 6.318 3.752 ( -9.760 4.355 2.886) 11.071 3.844 ( 1.285 -0.194 2.394) 2.724 3.904 ( 2.695 2.102 1.735) 3.833 4.072 ( -3.591 0.005 -4.245) 5.560 4.187 ( 0.271 -3.249 5.289) 6.213 4.249 ( 7.274 3.835 -1.645) 8.386 4.326 ( -5.030 -0.554 -0.067) 5.061 4.361 ( -6.136 1.776 -3.036) 7.072 4.399 ( 1.072 5.842 6.322) 8.675 4.478 ( 3.274 1.575 -2.235) 4.266 4.579 ( 4.025 2.180 -0.091) 4.578 4.656 ( -1.555 -1.301 -5.852) 6.193 4.718 ( -5.360 -0.195 -3.712) 6.523 4.768 ( -5.911 -2.079 1.983) 6.573 4.979 ( 0.258 -5.313 -0.643) 5.358 5.052 ( 0.149 -1.821 2.268) 2.912 5.133 ( 1.980 -5.440 -2.691) 6.384 5.220 ( 4.777 -6.614 0.173) 8.160 5.346 ( 1.919 5.924 -2.119) 6.577 5.547 ( 8.387 2.531 -1.187) 8.841 5.705 ( -5.729 -0.814 1.140) 5.898 5.816 ( 0.421 -2.602 5.879) 6.443 5.929 ( -1.656 0.691 -9.111) 9.286 6.083 ( 4.877 -0.495 2.137) 5.348 6.139 ( -2.618 0.236 -0.907) 2.781 6.305 ( 7.265 -3.285 1.598) 8.131 6.534 ( -5.839 -1.615 2.534) 6.566 6.602 ( -3.840 -0.672 -2.483) 4.622 6.883 ( -4.191 2.251 9.031) 10.208 7.027 ( 2.944 1.583 -11.958) 12.417 7.525 ( -4.398 -2.187 -0.736) 4.966 7.595 ( 0.538 -0.024 6.160) 6.184 7.914 ( -1.078 1.703 2.596) 3.287 8.015 ( 2.691 3.917 1.119) 4.882 8.194 ( -6.262 -2.817 2.123) 7.187 8.360 ( -1.683 -3.357 -5.064) 6.305 8.500 ( -2.746 0.945 5.697) 6.394 8.627 ( -3.956 2.687 -5.301) 7.139 8.779 ( 6.654 3.523 0.323) 7.536 8.835 ( 5.915 1.651 -6.980) 9.297 9.176 ( -2.035 -1.593 3.055) 4.001 9.294 ( 0.317 5.669 -3.427) 6.632 9.494 ( -2.266 -0.289 -5.088) 5.578 9.553 ( 1.142 1.100 2.678) 3.112 9.671 ( -1.838 -1.959 0.234) 2.696 9.725 ( 4.390 -0.629 5.012) 6.692 9.978 ( -3.657 0.730 2.342) 4.404 10.167 ( -3.424 -1.640 -2.809) 4.723 10.179 ( -0.492 -2.550 0.375) 2.624 10.235 ( 1.022 -0.104 3.709) 3.849 10.344 ( 5.703 3.029 4.428) 7.829 10.488 ( 9.219 -0.928 -6.228) 11.164 11.101 ( -3.396 -0.603 0.528) 3.490 11.149 ( -3.459 -0.751 2.305) 4.224 11.195 ( 1.447 1.841 3.542) 4.246 11.221 ( -3.668 3.443 -3.927) 6.382 11.351 ( -1.819 -1.639 5.204) 5.751 11.494 ( 0.791 -1.782 -6.643) 6.923 11.730 ( 1.167 -1.486 -1.068) 2.171 11.889 ( 6.657 -2.512 -0.913) 7.174 12.007 ( -1.345 2.880 1.115) 3.368 12.077 ( 3.213 5.695 -0.305) 6.547 12.417 ( -0.757 -2.412 2.137) 3.310 12.592 ( 8.603 -2.957 -1.215) 9.178 12.995 ( -6.456 1.465 -0.996) 6.695 13.049 ( -0.278 -1.514 2.531) 2.963 13.129 ( 3.380 -0.268 0.329) 3.406 13.202 ( 4.186 -0.161 -3.802) 5.657 13.300 ( -2.224 0.294 -0.400) 2.278 13.447 ( 4.337 -0.882 1.289) 4.609 13.708 ( -7.824 -2.654 1.685) 8.432 13.827 ( -1.808 -3.352 -0.672) 3.868 14.186 ( -4.878 1.258 5.429) 7.406 14.296 ( 4.598 0.878 1.321) 4.864 14.459 ( 3.840 -1.781 -5.297) 6.780 14.603 ( 6.959 -1.904 2.462) 7.623 14.812 ( -5.658 0.001 0.958) 5.739 14.938 ( -4.353 2.893 0.112) 5.228 15.064 ( 8.000 1.393 -4.056) 9.077 15.224 ( 8.841 3.083 -4.410) 10.350 15.489 ( -8.114 0.464 9.993) 12.881 15.696 ( -1.837 -2.862 -6.191) 7.063 15.719 ( -0.619 -1.134 2.664) 2.961 15.909 ( 6.499 -1.783 -5.726) 8.843 16.296 ( -4.200 0.888 2.390) 4.913 16.402 ( -2.824 7.644 -3.125) 8.728 16.590 ( -0.543 -4.155 -2.296) 4.778 16.708 ( 1.905 -0.081 1.387) 2.358 16.840 ( 0.936 4.511 2.764) 5.373 16.855 ( 1.512 3.374 1.169) 3.877 17.005 ( -7.412 -2.576 -1.609) 8.011 17.114 ( -5.489 1.444 1.345) 5.833 17.252 ( 6.909 0.840 2.731) 7.477 17.391 ( 5.748 -0.092 0.155) 5.751 17.724 ( -0.983 -3.716 -1.383) 4.085 17.798 ( 4.462 -2.165 2.163) 5.410 18.085 ( -3.912 8.134 -10.228) 13.641 18.175 ( 4.619 6.296 9.217) 12.080 18.928 ( -1.896 -5.601 -6.728) 8.957 18.963 ( 1.831 -5.178 4.413) 7.045 19.912 ( -4.490 -3.518 2.065) 6.066 19.969 ( -2.449 -3.540 -2.115) 4.796 20.125 ( -4.292 1.347 -1.425) 4.719 20.202 ( -0.185 0.545 2.262) 2.334 ======================= Grid point 164 (82/104) ======================= q-point: (-0.30 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.915 ( -24.626 5.473 7.443) 26.302 2.032 ( -22.677 7.396 11.843) 26.631 2.494 ( -0.681 -5.027 -1.375) 5.256 2.551 ( -2.866 1.371 -0.117) 3.179 2.663 ( -4.718 -1.399 -1.803) 5.241 2.821 ( -0.444 -1.236 0.547) 1.423 2.946 ( -6.426 -3.908 -5.550) 9.347 3.026 ( -1.628 4.938 -0.822) 5.264 3.090 ( -5.269 0.106 -3.510) 6.332 3.205 ( -2.458 -0.283 -2.376) 3.430 3.250 ( -4.600 -0.704 -2.816) 5.440 3.329 ( -3.197 -0.183 -2.762) 4.228 3.421 ( -18.505 1.785 9.484) 20.870 3.488 ( -3.593 1.115 1.354) 3.998 3.639 ( -5.289 -2.276 3.499) 6.737 3.698 ( 1.030 3.263 -1.405) 3.699 3.709 ( 2.015 -1.979 2.809) 3.983 3.819 ( -6.064 2.033 2.493) 6.865 3.874 ( -3.650 -3.238 -2.475) 5.471 4.025 ( 0.728 3.584 -2.981) 4.718 4.127 ( -4.880 -0.245 5.186) 7.125 4.250 ( -2.755 -0.338 1.259) 3.048 4.278 ( -0.951 3.718 -2.937) 4.832 4.351 ( -1.659 -0.131 1.757) 2.420 4.453 ( 3.157 3.523 1.910) 5.102 4.537 ( 1.433 -0.245 -0.166) 1.463 4.553 ( -4.267 -0.074 -4.719) 6.363 4.593 ( -2.799 1.731 -4.375) 5.474 4.651 ( 4.052 0.939 -2.012) 4.621 4.713 ( -0.465 -1.450 2.117) 2.608 5.018 ( 4.168 -2.729 -1.765) 5.286 5.063 ( -1.060 -5.276 1.373) 5.554 5.151 ( 2.606 -3.397 -2.583) 5.001 5.264 ( -0.095 -7.560 -0.220) 7.564 5.398 ( 5.440 6.000 -4.623) 9.326 5.600 ( -2.604 -2.172 1.902) 3.888 5.671 ( 0.318 3.041 2.502) 3.951 5.861 ( 3.025 -1.056 -4.531) 5.550 5.920 ( 1.258 -2.385 3.125) 4.128 6.074 ( 7.565 1.377 -6.070) 9.797 6.242 ( 5.148 1.430 5.775) 7.868 6.377 ( -8.641 0.707 -3.510) 9.354 6.469 ( 2.565 -3.869 2.996) 5.525 6.531 ( 1.564 -1.970 0.578) 2.581 6.883 ( -2.013 1.412 9.402) 9.718 7.031 ( 6.153 1.304 -10.794) 12.493 7.442 ( -5.043 -1.661 1.215) 5.447 7.637 ( -0.652 1.624 5.189) 5.476 7.906 ( -2.691 0.689 1.339) 3.084 8.067 ( 1.531 -0.050 -4.042) 4.323 8.097 ( -4.580 0.981 5.835) 7.482 8.279 ( -3.563 -1.171 -2.815) 4.689 8.523 ( 1.680 1.600 3.371) 4.092 8.530 ( -1.494 4.645 -4.167) 6.416 8.832 ( -0.423 -3.051 -1.656) 3.497 8.913 ( 5.426 0.585 -2.042) 5.827 9.135 ( -3.968 -1.834 -0.996) 4.484 9.244 ( -4.163 6.516 0.701) 7.764 9.401 ( -3.889 -0.352 -5.665) 6.880 9.545 ( -0.451 3.533 -4.097) 5.428 9.663 ( -1.632 -4.950 3.970) 6.552 9.848 ( 3.972 1.580 2.510) 4.957 9.972 ( -0.889 0.339 4.628) 4.725 10.085 ( -1.696 -1.302 -4.839) 5.291 10.141 ( -0.231 -2.609 -1.714) 3.130 10.273 ( 0.394 3.176 2.488) 4.054 10.477 ( 4.808 -0.898 2.532) 5.507 10.630 ( 9.780 -1.885 -4.565) 10.956 11.041 ( -0.565 -0.462 -3.254) 3.335 11.071 ( -4.627 1.455 -1.232) 5.004 11.181 ( -2.603 -0.377 4.581) 5.282 11.270 ( 2.025 3.464 5.691) 6.964 11.351 ( -2.330 -3.771 4.634) 6.413 11.455 ( 1.012 -1.472 -1.487) 2.324 11.782 ( 4.799 -1.646 -1.621) 5.326 11.971 ( 0.550 -1.871 -1.140) 2.258 11.997 ( 2.341 4.163 0.201) 4.781 12.167 ( 6.338 6.081 -0.214) 8.786 12.448 ( 2.536 -3.029 1.913) 4.389 12.740 ( 7.381 -1.825 -2.471) 7.995 12.860 ( -5.645 1.706 -2.209) 6.298 13.083 ( 1.491 -1.711 3.154) 3.885 13.172 ( 0.271 -0.252 -3.678) 3.697 13.246 ( 4.840 0.692 -0.696) 4.938 13.307 ( 2.146 0.356 0.678) 2.278 13.530 ( 0.739 -2.639 2.590) 3.770 13.565 ( -6.615 -0.584 3.063) 7.313 13.779 ( -2.544 -2.558 -0.962) 3.734 14.140 ( -4.306 2.560 6.201) 7.972 14.402 ( 6.188 -0.911 -0.491) 6.274 14.530 ( 8.052 0.019 -6.388) 10.278 14.701 ( 0.479 -1.323 3.311) 3.597 14.737 ( -3.653 0.417 3.551) 5.111 14.873 ( -1.267 2.333 -1.880) 3.253 15.211 ( 10.325 -1.091 -3.686) 11.017 15.326 ( 4.710 0.234 -3.334) 5.776 15.439 ( -2.306 2.055 3.582) 4.730 15.586 ( -3.207 -0.877 -5.656) 6.560 15.737 ( -0.839 -1.909 2.695) 3.408 15.972 ( 4.227 0.407 -3.506) 5.507 16.206 ( -4.702 1.276 -3.709) 6.123 16.312 ( -5.613 3.919 2.249) 7.205 16.593 ( 1.774 -3.372 -2.395) 4.501 16.731 ( -0.769 1.625 2.688) 3.233 16.826 ( -1.051 -0.440 -0.330) 1.186 16.852 ( -6.883 -2.502 -1.206) 7.422 16.970 ( 2.103 5.089 8.600) 10.212 17.044 ( -1.991 3.273 0.281) 3.841 17.401 ( 7.267 1.515 -0.703) 7.457 17.479 ( 3.282 -1.976 1.620) 4.159 17.670 ( -0.658 -2.604 -5.870) 6.456 17.902 ( 0.173 8.340 -5.803) 10.162 17.993 ( 3.591 -1.065 3.285) 4.982 18.314 ( 4.766 6.297 5.915) 9.867 18.815 ( -2.643 -5.361 -9.469) 11.198 19.042 ( 1.857 -5.125 5.195) 7.530 19.807 ( -8.557 -6.473 1.697) 10.863 19.879 ( -6.266 -5.796 -0.059) 8.536 20.056 ( -2.459 3.750 0.070) 4.485 20.198 ( -1.810 0.636 1.872) 2.681 ======================= Grid point 165 (83/104) ======================= q-point: (-0.20 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.551 ( -22.641 12.574 13.928) 29.406 1.703 ( -24.401 10.358 15.267) 30.591 2.404 ( -6.671 -5.813 -6.187) 10.797 2.516 ( -7.444 1.753 3.505) 8.412 2.575 ( -2.074 -2.658 -0.624) 3.429 2.709 ( -11.578 2.138 -5.995) 13.212 2.756 ( -8.227 -0.946 3.030) 8.818 2.851 ( -22.177 -1.243 14.299) 26.416 3.052 ( -0.100 -1.512 -2.639) 3.043 3.081 ( -6.975 1.586 4.918) 8.680 3.189 ( 0.520 -0.215 -6.346) 6.371 3.230 ( 2.266 2.489 -1.026) 3.519 3.252 ( -6.767 -1.150 3.673) 7.785 3.450 ( -2.574 -2.159 0.615) 3.415 3.544 ( -7.359 -0.876 3.875) 8.362 3.634 ( -4.221 0.235 -2.467) 4.895 3.712 ( -2.952 -1.768 -4.746) 5.862 3.735 ( -5.466 5.108 1.203) 7.578 3.793 ( -2.452 -1.751 -1.510) 3.370 4.048 ( 1.590 5.168 0.751) 5.459 4.104 ( -3.810 -3.693 1.780) 5.597 4.127 ( -7.572 2.335 -1.208) 8.015 4.284 ( 0.456 -2.313 0.160) 2.363 4.326 ( 0.664 0.966 -1.515) 1.916 4.448 ( -2.638 1.055 -7.396) 7.923 4.460 ( -0.923 -2.224 0.070) 2.409 4.544 ( 3.696 1.331 -3.674) 5.379 4.605 ( 1.422 3.404 -0.319) 3.703 4.706 ( 3.442 -2.047 0.487) 4.034 4.763 ( 2.538 0.902 2.629) 3.764 5.042 ( -1.381 -5.329 -1.466) 5.696 5.072 ( 1.437 -3.755 -0.885) 4.117 5.136 ( -1.285 -2.452 -2.975) 4.063 5.282 ( 3.807 -0.509 -0.326) 3.854 5.430 ( 0.686 2.397 -3.760) 4.511 5.637 ( 3.664 1.272 1.609) 4.198 5.673 ( 0.148 2.884 2.770) 4.002 5.858 ( 0.341 1.258 -4.106) 4.308 5.985 ( 6.839 -0.646 1.408) 7.013 6.197 ( -3.533 2.061 -3.620) 5.462 6.272 ( 4.663 0.386 -0.361) 4.693 6.366 ( 4.248 1.895 4.299) 6.333 6.467 ( 4.072 -5.706 4.560) 8.362 6.696 ( 10.262 -4.338 -0.689) 11.162 6.946 ( 0.936 0.113 9.003) 9.053 7.073 ( 6.427 0.560 -10.639) 12.442 7.359 ( -5.732 -0.467 2.897) 6.439 7.611 ( -5.054 4.055 -1.332) 6.615 7.834 ( -3.592 -0.093 0.116) 3.595 8.020 ( -0.543 0.157 -5.820) 5.848 8.101 ( -4.151 -0.433 8.835) 9.771 8.204 ( -2.089 -0.450 -3.546) 4.141 8.549 ( 5.074 3.821 -0.149) 6.353 8.598 ( 5.039 3.531 -0.881) 6.215 8.778 ( -3.321 -4.942 -1.984) 6.276 8.970 ( 0.693 -4.776 3.679) 6.069 9.011 ( -8.550 0.611 -2.811) 9.021 9.166 ( -5.306 0.364 1.890) 5.644 9.276 ( -4.275 4.041 -6.010) 8.410 9.506 ( 0.211 5.665 -5.856) 8.150 9.622 ( -4.861 -3.537 1.386) 6.169 9.892 ( -1.349 -1.867 2.378) 3.310 9.965 ( -1.445 1.859 0.600) 2.430 10.058 ( 3.574 1.814 -4.059) 5.704 10.187 ( 1.482 -3.554 3.608) 5.276 10.297 ( 2.603 4.471 0.275) 5.181 10.564 ( 3.587 -3.702 1.129) 5.277 10.736 ( 4.435 -3.602 -2.901) 6.408 10.951 ( -8.504 -0.731 1.031) 8.598 11.065 ( 3.607 -0.090 0.097) 3.610 11.139 ( -3.012 0.099 2.605) 3.983 11.298 ( -1.135 3.309 -1.352) 3.751 11.423 ( 4.432 -5.712 4.919) 8.745 11.495 ( 2.727 -2.782 -0.326) 3.909 11.867 ( 3.919 -1.305 1.563) 4.416 11.936 ( -0.556 1.671 -3.541) 3.954 12.066 ( 3.526 3.753 1.474) 5.356 12.279 ( 6.190 7.894 -1.298) 10.116 12.535 ( 5.326 -4.359 2.521) 7.329 12.696 ( -6.564 3.151 2.690) 7.762 12.900 ( 8.986 -2.138 -7.493) 11.894 13.091 ( -3.698 -1.505 -3.811) 5.520 13.157 ( 3.124 0.280 1.257) 3.379 13.249 ( -2.175 3.942 -3.724) 5.842 13.413 ( 2.226 -3.385 3.618) 5.432 13.467 ( 1.296 -0.206 2.627) 2.937 13.600 ( -0.074 0.990 4.543) 4.650 13.723 ( -2.145 -1.101 -2.332) 3.355 14.130 ( -2.283 3.375 8.137) 9.101 14.488 ( 3.643 -4.976 -3.338) 7.012 14.644 ( 8.123 1.256 -3.535) 8.948 14.685 ( -3.782 -0.286 6.428) 7.464 14.748 ( 2.321 -0.411 3.235) 4.002 14.861 ( 0.678 1.499 -3.340) 3.724 15.310 ( 1.075 -0.844 -4.795) 4.986 15.331 ( -1.893 0.803 -3.168) 3.777 15.454 ( 5.190 -2.133 -2.857) 6.297 15.580 ( 5.745 2.163 0.203) 6.142 15.737 ( -0.563 -1.478 2.252) 2.752 16.011 ( 0.336 1.330 -0.521) 1.467 16.111 ( -0.076 4.169 -4.351) 6.027 16.235 ( -4.621 -0.675 1.596) 4.935 16.596 ( -0.869 -5.232 -0.023) 5.303 16.703 ( -7.547 -1.354 1.990) 7.921 16.749 ( 0.009 2.885 -0.902) 3.023 16.805 ( -1.109 -0.731 2.027) 2.423 17.044 ( 0.412 4.241 1.279) 4.448 17.058 ( 2.183 2.851 5.404) 6.489 17.398 ( -5.202 0.274 -7.062) 8.775 17.532 ( 0.148 -2.660 1.702) 3.162 17.676 ( 4.842 3.083 -4.239) 7.136 17.802 ( -1.258 7.887 -8.948) 11.993 18.152 ( 6.236 -1.931 4.254) 7.792 18.417 ( 2.765 6.692 0.148) 7.242 18.744 ( 1.779 -6.137 -2.035) 6.706 19.095 ( 0.954 -4.389 2.263) 5.029 19.639 ( -11.180 -10.736 3.502) 15.891 19.755 ( -8.055 -8.243 2.130) 11.720 20.039 ( -0.432 4.829 2.479) 5.445 20.177 ( -0.616 2.785 -0.059) 2.853 ======================= Grid point 166 (84/104) ======================= q-point: (-0.10 0.17 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.331 ( -17.381 15.322 20.570) 30.984 1.404 ( -16.674 15.521 21.136) 31.075 2.104 ( -14.010 -2.383 -18.067) 22.987 2.306 ( -13.361 5.104 -9.132) 16.970 2.476 ( -17.227 9.590 28.464) 34.625 2.569 ( -8.823 -2.210 11.296) 14.503 2.602 ( 0.435 -3.569 -1.325) 3.831 2.800 ( 3.635 -7.763 5.569) 10.222 3.038 ( -0.325 -6.778 0.538) 6.807 3.086 ( -0.141 -2.543 5.622) 6.173 3.091 ( -4.368 -3.927 -1.087) 5.974 3.257 ( 2.730 0.204 2.360) 3.614 3.313 ( 4.915 1.948 -1.623) 5.530 3.382 ( -5.031 -3.820 0.655) 6.351 3.453 ( -2.317 3.541 -0.128) 4.234 3.528 ( -4.998 -3.080 0.092) 5.872 3.616 ( -5.022 5.886 -1.031) 7.805 3.642 ( -1.779 4.185 -2.154) 5.032 3.815 ( 3.343 -3.619 1.904) 5.282 3.900 ( -7.768 5.048 -11.454) 14.731 3.979 ( -4.864 1.618 -7.159) 8.805 4.148 ( 1.650 -0.946 2.045) 2.793 4.212 ( -5.924 -5.406 -1.707) 8.199 4.365 ( 3.341 -1.786 -1.901) 4.238 4.417 ( 2.888 1.999 -3.976) 5.305 4.484 ( 1.866 2.646 0.858) 3.349 4.547 ( 0.112 0.108 -4.081) 4.084 4.581 ( -3.341 0.883 -2.789) 4.441 4.787 ( 3.408 -1.441 2.912) 4.709 4.827 ( 2.841 -3.133 3.135) 5.265 4.972 ( -3.197 -0.811 -2.047) 3.882 5.071 ( -0.347 -1.880 -0.790) 2.069 5.141 ( 3.187 0.197 -2.892) 4.308 5.320 ( -1.772 8.129 -2.320) 8.638 5.431 ( 3.612 -2.288 1.146) 4.427 5.616 ( -3.421 4.574 1.120) 5.821 5.801 ( 6.715 -0.021 0.984) 6.787 5.863 ( 2.866 -0.028 -2.445) 3.768 6.132 ( 6.190 0.732 -1.149) 6.338 6.168 ( 1.142 -1.281 3.817) 4.185 6.279 ( 0.853 2.527 1.898) 3.273 6.462 ( 3.439 1.678 5.304) 6.541 6.636 ( 5.692 -6.912 -1.329) 9.052 6.819 ( 3.211 -2.762 -3.599) 5.558 7.026 ( 1.251 -2.685 7.847) 8.387 7.118 ( 7.107 -0.144 -7.903) 10.629 7.290 ( -3.693 1.744 3.251) 5.219 7.466 ( -6.285 5.957 -4.970) 9.984 7.809 ( 0.462 -0.590 -1.105) 1.336 7.937 ( -5.211 4.575 -2.456) 7.356 8.081 ( -0.510 -5.671 -0.833) 5.754 8.159 ( -2.341 -1.929 1.109) 3.230 8.601 ( -0.889 3.954 -2.857) 4.958 8.664 ( 0.157 2.112 -4.571) 5.037 8.731 ( -4.147 -5.022 4.460) 7.893 8.826 ( -1.383 0.438 -1.742) 2.267 9.013 ( 1.914 -6.663 1.893) 7.186 9.116 ( -1.896 -2.263 7.046) 7.640 9.213 ( 1.713 7.060 -4.386) 8.486 9.473 ( -1.093 4.447 -4.931) 6.729 9.532 ( -3.173 -3.644 -1.579) 5.083 9.790 ( -8.538 1.388 -1.267) 8.742 9.981 ( 2.218 1.203 0.633) 2.601 10.160 ( -1.964 3.059 -0.729) 3.708 10.188 ( 8.042 2.890 2.185) 8.820 10.394 ( 5.530 -0.809 2.162) 5.993 10.608 ( -0.026 -3.102 0.390) 3.127 10.727 ( -5.306 -6.848 -2.007) 8.893 10.837 ( -2.463 -2.140 1.138) 3.455 11.040 ( -9.522 -2.857 -2.388) 10.224 11.153 ( 0.922 3.347 6.604) 7.461 11.260 ( 1.501 3.634 -2.156) 4.484 11.493 ( 1.360 -1.803 -1.647) 2.795 11.542 ( 3.564 -4.417 -2.303) 6.125 11.880 ( -1.045 -2.027 1.283) 2.617 11.961 ( 2.797 -2.635 -2.402) 4.531 12.139 ( 2.745 4.762 2.999) 6.261 12.343 ( 2.399 7.138 -4.273) 8.658 12.604 ( -0.846 -0.450 1.486) 1.768 12.729 ( 6.789 2.395 7.437) 10.350 12.897 ( -6.391 -4.476 -6.127) 9.921 13.052 ( 6.517 1.791 -6.806) 9.591 13.220 ( 2.330 1.526 0.629) 2.855 13.251 ( 5.331 -0.478 0.992) 5.444 13.402 ( -2.897 -0.212 3.892) 4.856 13.550 ( 0.415 -0.533 -0.138) 0.689 13.604 ( -0.878 2.268 2.569) 3.537 13.694 ( 1.206 1.386 -2.560) 3.151 14.178 ( 0.205 2.402 10.508) 10.781 14.465 ( -3.081 -6.354 -0.913) 7.121 14.688 ( -0.390 -2.086 0.260) 2.137 14.770 ( 5.438 0.237 3.020) 6.225 14.815 ( 1.729 2.281 -5.653) 6.337 14.863 ( 4.358 -0.267 3.672) 5.705 15.210 ( -4.632 1.007 -7.174) 8.598 15.240 ( -5.375 0.787 -4.287) 6.920 15.584 ( 8.595 -3.937 1.490) 9.571 15.731 ( 8.950 1.532 -0.332) 9.086 15.758 ( 0.982 -0.588 1.746) 2.088 15.960 ( -3.551 -1.036 -1.001) 3.832 16.138 ( -1.217 6.952 2.067) 7.354 16.216 ( 6.631 -2.765 -1.650) 7.371 16.517 ( -8.493 -4.412 0.041) 9.571 16.615 ( -3.174 0.015 1.167) 3.382 16.724 ( -1.320 -0.154 -0.872) 1.589 16.825 ( -1.784 -1.397 -0.600) 2.344 17.025 ( -1.069 6.037 -5.031) 7.931 17.131 ( 0.856 0.078 0.636) 1.069 17.209 ( -7.296 5.737 4.150) 10.166 17.501 ( -3.479 -3.731 -1.566) 5.337 17.666 ( -0.088 5.903 -5.733) 8.229 17.768 ( 0.613 6.417 -6.816) 9.382 18.234 ( 1.009 1.473 2.120) 2.772 18.408 ( 0.112 1.396 -4.442) 4.657 18.870 ( 7.485 -3.657 5.005) 9.718 19.105 ( -0.528 -3.430 -0.701) 3.540 19.515 ( -4.860 -14.462 6.953) 16.766 19.632 ( -6.738 -10.269 2.579) 12.550 20.068 ( -0.032 5.200 5.720) 7.730 20.194 ( 3.476 4.911 -2.712) 6.599 ======================= Grid point 167 (85/104) ======================= q-point: ( 0.00 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.588 ( -4.248 18.902 15.340) 24.711 1.816 ( 3.440 16.716 19.364) 25.811 1.923 ( 3.258 9.944 -17.060) 20.013 2.134 ( -4.561 3.585 -11.117) 12.540 2.394 ( -3.389 -10.021 3.179) 11.046 2.437 ( 5.837 -11.811 -0.132) 13.175 2.618 ( -1.412 -5.167 10.070) 11.406 2.757 ( -1.395 -6.464 -2.747) 7.160 2.891 ( -2.733 0.213 11.030) 11.366 3.036 ( -0.560 -4.381 -2.614) 5.133 3.162 ( 2.414 6.129 14.282) 15.727 3.233 ( -0.371 -1.612 3.318) 3.707 3.258 ( -0.862 -2.783 -0.733) 3.004 3.390 ( 3.212 -2.296 4.451) 5.950 3.458 ( 0.012 1.380 3.117) 3.409 3.528 ( 2.988 3.597 -2.432) 5.271 3.627 ( -1.996 -1.519 -4.378) 5.046 3.682 ( -1.880 2.322 2.707) 4.031 3.765 ( 3.855 4.432 -6.404) 8.690 3.857 ( -3.634 4.426 -17.650) 18.555 3.957 ( 3.284 1.112 1.231) 3.679 4.034 ( -0.686 1.425 -4.372) 4.650 4.228 ( 1.187 -3.383 6.455) 7.384 4.353 ( 0.502 0.054 -2.689) 2.736 4.380 ( -0.560 -3.631 -0.361) 3.692 4.435 ( -1.335 -5.279 -5.050) 7.426 4.570 ( 0.480 2.414 1.120) 2.704 4.592 ( 0.385 1.991 -0.626) 2.123 4.829 ( 0.435 -1.729 3.363) 3.806 4.847 ( 2.435 0.123 1.730) 2.990 4.913 ( -3.010 -1.090 -1.677) 3.614 4.947 ( -1.941 -3.439 -4.698) 6.137 5.308 ( 5.140 4.813 2.573) 7.497 5.338 ( -5.960 5.724 -0.489) 8.277 5.551 ( 4.503 -1.317 1.620) 4.963 5.585 ( -3.915 -0.801 -1.365) 4.223 5.864 ( -0.387 1.633 0.433) 1.733 5.890 ( 0.772 1.156 -1.443) 2.004 6.097 ( -1.913 -1.752 3.184) 4.107 6.197 ( 2.445 -4.330 -5.546) 7.449 6.444 ( 1.215 4.506 4.963) 6.812 6.546 ( 1.126 3.335 -5.876) 6.849 6.638 ( 7.257 -1.249 4.601) 8.683 6.719 ( -6.074 -3.650 -2.070) 7.382 7.020 ( -3.916 -0.767 7.129) 8.170 7.134 ( -0.236 -3.963 -0.974) 4.088 7.370 ( 2.569 4.869 -0.143) 5.507 7.435 ( -1.388 2.757 -4.534) 5.485 7.841 ( -1.910 1.285 -0.858) 2.457 7.858 ( -6.674 0.039 -2.108) 6.999 7.998 ( 3.652 -2.562 0.368) 4.476 8.056 ( 5.934 -4.339 -5.595) 9.239 8.608 ( -3.701 3.989 2.205) 5.871 8.639 ( 1.225 2.006 -1.444) 2.758 8.695 ( -0.508 -1.588 0.106) 1.671 8.759 ( -0.405 -2.827 -5.918) 6.571 9.116 ( 9.347 -2.214 6.628) 11.671 9.138 ( 2.443 -1.281 6.363) 6.935 9.253 ( -6.017 0.118 -5.650) 8.255 9.282 ( -0.230 -0.388 -5.758) 5.775 9.615 ( 1.796 2.310 1.188) 3.158 9.668 ( -2.816 0.968 -3.179) 4.356 10.163 ( -1.558 4.830 1.973) 5.446 10.165 ( 1.243 4.417 2.271) 5.120 10.381 ( -0.806 -0.238 3.062) 3.175 10.437 ( 3.304 -0.481 -1.779) 3.783 10.495 ( -4.016 -3.090 3.009) 5.893 10.553 ( -0.546 -2.453 -2.102) 3.276 10.767 ( -3.774 -2.066 4.200) 6.013 10.816 ( 1.869 -5.037 -0.004) 5.373 11.274 ( -0.985 3.728 4.424) 5.868 11.327 ( 0.887 1.314 -0.639) 1.710 11.479 ( 0.321 -0.292 0.035) 0.436 11.509 ( -0.178 -1.692 -2.514) 3.036 11.837 ( -0.123 -1.595 1.080) 1.930 11.880 ( -0.569 -3.449 -2.936) 4.565 12.309 ( -1.471 6.192 5.253) 8.252 12.425 ( 0.539 5.081 -6.180) 8.019 12.577 ( -0.619 -4.108 2.963) 5.102 12.663 ( 0.782 -4.602 -6.110) 7.689 12.977 ( 1.213 6.657 6.241) 9.205 13.111 ( 0.453 1.398 -6.771) 6.928 13.241 ( 0.966 -1.814 1.061) 2.313 13.255 ( -2.528 -2.401 -0.389) 3.508 13.431 ( 1.797 0.289 4.963) 5.286 13.495 ( -1.512 -1.310 -1.282) 2.376 13.694 ( 1.263 2.210 -1.397) 2.904 13.720 ( 0.083 1.250 -3.313) 3.542 14.270 ( -1.485 0.541 6.467) 6.657 14.334 ( -0.072 -2.895 0.114) 2.898 14.651 ( -1.352 -0.080 2.832) 3.140 14.707 ( -2.941 -2.537 -2.188) 4.458 14.938 ( 3.553 1.135 4.694) 5.995 14.973 ( 1.839 -0.587 1.719) 2.585 15.126 ( -3.265 1.562 -6.444) 7.391 15.129 ( 0.834 1.322 -6.109) 6.305 15.676 ( 4.361 -2.583 2.506) 5.654 15.704 ( -1.107 -4.089 0.312) 4.248 15.888 ( -0.753 4.227 0.426) 4.315 15.924 ( -0.137 4.524 -3.086) 5.478 16.188 ( 5.563 -3.549 3.485) 7.463 16.240 ( -4.522 -5.731 -1.856) 7.532 16.431 ( 3.876 3.364 3.370) 6.140 16.510 ( -4.834 0.285 -3.358) 5.893 16.717 ( -3.116 1.385 -0.223) 3.417 16.741 ( 1.769 0.523 -1.849) 2.612 17.074 ( -2.608 1.404 0.241) 2.972 17.117 ( 0.357 -0.412 -3.468) 3.511 17.299 ( -0.632 4.108 6.033) 7.326 17.409 ( 2.187 -1.221 -4.550) 5.194 17.778 ( -1.615 7.149 0.162) 7.331 17.833 ( 0.251 4.329 -4.824) 6.486 18.317 ( -1.871 4.084 3.490) 5.688 18.387 ( 1.114 0.768 -3.391) 3.651 18.941 ( 3.787 -3.855 3.505) 6.441 18.992 ( -1.294 -5.128 -1.583) 5.521 19.335 ( 2.113 -7.257 4.382) 8.737 19.374 ( -0.500 -8.030 0.073) 8.046 20.194 ( -1.043 3.926 5.053) 6.483 20.268 ( 0.790 0.264 -2.080) 2.241 ======================= Grid point 168 (86/104) ======================= q-point: ( 0.10 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.751 ( 7.788 8.032 15.991) 19.516 1.971 ( 8.390 7.572 -12.548) 16.887 2.019 ( 11.514 13.172 -9.085) 19.713 2.169 ( 14.238 12.043 10.855) 21.577 2.393 ( 1.860 -8.563 0.391) 8.772 2.580 ( 8.079 -6.514 -5.395) 11.696 2.650 ( 0.891 -8.189 6.370) 10.413 2.764 ( 3.380 -5.285 -0.960) 6.346 2.971 ( 2.213 -4.377 11.008) 12.051 3.036 ( 3.165 -5.647 -1.914) 6.750 3.236 ( 0.743 -0.742 2.349) 2.573 3.282 ( 4.318 -1.226 -1.783) 4.830 3.311 ( -2.401 0.031 1.586) 2.877 3.358 ( -1.236 0.592 -0.389) 1.424 3.511 ( 2.653 0.651 -1.900) 3.327 3.576 ( 3.689 -1.478 7.354) 8.359 3.634 ( -1.244 6.498 -9.306) 11.418 3.725 ( 8.398 5.227 2.070) 10.106 3.753 ( 7.540 6.293 -2.561) 10.149 3.847 ( 8.294 3.219 -4.299) 9.881 3.997 ( 1.246 1.101 -5.248) 5.505 4.050 ( 4.927 -1.465 0.630) 5.179 4.263 ( -1.805 -2.549 -2.902) 4.264 4.299 ( -0.800 3.027 2.968) 4.314 4.415 ( 1.679 -2.790 -2.439) 4.069 4.422 ( 1.546 -6.553 2.904) 7.332 4.563 ( -1.239 1.764 -0.087) 2.157 4.605 ( 1.413 2.297 -1.423) 3.049 4.756 ( -6.322 -2.207 -1.446) 6.851 4.847 ( -3.279 -1.670 -2.505) 4.451 4.915 ( 0.756 -2.170 4.322) 4.895 4.929 ( 1.249 -2.833 2.230) 3.815 5.208 ( -7.449 6.635 -0.303) 9.980 5.384 ( -0.421 0.992 2.226) 2.473 5.476 ( -4.535 2.347 -0.697) 5.154 5.637 ( 2.529 -3.304 0.796) 4.236 5.824 ( -3.783 2.404 0.103) 4.483 5.887 ( 0.132 1.592 -1.462) 2.165 6.107 ( 0.175 0.535 2.851) 2.906 6.195 ( -0.258 -4.614 -4.470) 6.429 6.297 ( -8.509 3.480 -1.393) 9.298 6.558 ( -6.719 -6.072 -3.956) 9.883 6.618 ( -1.159 3.019 -4.263) 5.351 6.726 ( -0.060 0.100 1.211) 1.217 6.933 ( -9.345 0.588 9.234) 13.151 7.078 ( -4.046 -4.537 1.908) 6.372 7.402 ( 2.077 4.102 -3.445) 5.745 7.460 ( 5.006 3.267 1.408) 6.142 7.744 ( -4.509 -0.488 2.676) 5.266 7.835 ( 2.094 -2.411 3.076) 4.434 8.121 ( 8.664 1.703 -3.921) 9.661 8.191 ( 10.613 -3.299 -6.535) 12.893 8.603 ( 0.731 3.379 1.531) 3.781 8.637 ( -2.716 2.501 2.971) 4.739 8.693 ( -1.046 -3.285 1.761) 3.872 8.784 ( 7.475 -2.624 -1.744) 8.112 9.058 ( -5.489 0.155 -8.344) 9.989 9.212 ( 0.137 -2.323 -1.334) 2.682 9.269 ( 4.760 2.251 -3.346) 6.239 9.350 ( 9.857 -2.449 4.186) 10.985 9.589 ( -0.532 5.559 -1.212) 5.715 9.750 ( 7.096 -1.797 2.112) 7.619 10.054 ( -7.047 5.164 0.847) 8.778 10.165 ( -7.861 2.174 2.019) 8.403 10.270 ( -4.848 -0.123 -1.281) 5.015 10.442 ( -5.914 -5.488 5.427) 9.723 10.480 ( 0.536 0.667 -1.659) 1.866 10.579 ( 3.374 -2.535 1.479) 4.471 10.809 ( 5.339 0.816 1.763) 5.681 10.961 ( 9.478 -4.348 0.936) 10.469 11.277 ( -1.903 3.314 3.499) 5.182 11.331 ( 0.090 2.562 -2.411) 3.519 11.407 ( -5.918 -1.396 0.528) 6.103 11.468 ( -2.214 -2.208 -0.891) 3.251 11.859 ( 0.324 -2.271 1.574) 2.782 11.861 ( 0.589 -2.274 -1.052) 2.574 12.255 ( -5.686 5.023 1.466) 7.728 12.394 ( -2.302 2.716 1.716) 3.952 12.591 ( 2.367 -1.416 -2.119) 3.478 12.726 ( 5.237 -3.588 -0.474) 6.366 12.962 ( -6.232 4.398 -0.878) 7.678 13.007 ( -3.750 2.159 -1.520) 4.586 13.223 ( -0.729 0.758 0.630) 1.226 13.275 ( 0.376 -0.083 0.533) 0.657 13.445 ( -2.415 -1.562 -1.693) 3.337 13.492 ( 1.060 -3.256 2.802) 4.424 13.661 ( -2.391 1.830 -0.967) 3.163 13.694 ( -0.962 0.215 -1.829) 2.078 14.267 ( -1.798 -0.627 2.741) 3.337 14.342 ( -0.425 -3.318 0.842) 3.450 14.638 ( -3.284 0.860 3.806) 5.100 14.682 ( -0.550 -1.580 3.920) 4.262 14.898 ( -4.668 0.897 -2.854) 5.544 14.934 ( -4.049 -0.713 -2.255) 4.689 15.139 ( 5.506 3.813 0.377) 6.708 15.226 ( 8.742 -0.878 -2.403) 9.108 15.588 ( -7.938 0.069 -2.151) 8.225 15.734 ( -1.247 -5.876 -2.168) 6.386 15.840 ( -0.632 6.769 -0.683) 6.833 15.950 ( 0.815 4.466 0.912) 4.630 16.137 ( -2.607 -4.791 -2.441) 5.976 16.237 ( -3.626 -4.965 0.815) 6.202 16.452 ( 3.110 3.400 -0.701) 4.661 16.574 ( 6.915 -0.882 3.214) 7.676 16.726 ( 2.519 2.335 1.321) 3.680 16.816 ( 5.864 -1.494 -0.955) 6.126 17.017 ( -2.947 3.004 3.144) 5.253 17.106 ( -1.595 -2.382 1.035) 3.048 17.346 ( 2.379 4.054 1.836) 5.046 17.444 ( 4.146 -1.775 -3.849) 5.929 17.761 ( -0.393 8.945 2.655) 9.339 17.823 ( 0.145 3.844 -1.709) 4.210 18.247 ( -6.595 2.367 1.144) 7.100 18.399 ( 0.740 0.519 -0.133) 0.914 18.909 ( -4.142 -2.365 -3.980) 6.212 19.018 ( 1.911 -4.182 0.352) 4.611 19.397 ( 5.824 -6.112 -1.281) 8.539 19.474 ( 8.661 -9.456 -0.232) 12.825 20.187 ( -2.832 3.265 3.591) 5.619 20.235 ( -1.986 0.849 -2.231) 3.105 ======================= Grid point 169 (87/104) ======================= q-point: ( 0.20 0.33 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.989 ( 9.825 3.866 -1.703) 10.694 2.088 ( 11.176 0.040 5.152) 12.306 2.205 ( 14.475 9.865 -12.301) 21.405 2.417 ( 3.542 -4.646 2.796) 6.477 2.552 ( 13.267 2.437 1.734) 13.600 2.639 ( 6.730 0.591 2.033) 7.055 2.775 ( 2.531 -0.533 -6.109) 6.634 2.796 ( 2.964 -3.559 6.160) 7.707 3.047 ( 1.917 -6.231 1.253) 6.638 3.125 ( 1.049 -1.150 5.343) 5.565 3.229 ( 0.605 2.874 -0.150) 2.940 3.287 ( 1.741 3.973 -0.674) 4.390 3.319 ( 0.114 -3.622 4.843) 6.048 3.463 ( 10.061 -5.267 3.441) 11.866 3.564 ( 2.485 -0.546 -0.271) 2.558 3.588 ( 5.517 -0.303 -5.938) 8.111 3.712 ( 6.435 5.019 -1.576) 8.312 3.850 ( 12.412 6.831 -10.297) 17.514 3.887 ( 1.881 2.594 -7.854) 8.482 4.041 ( 11.743 4.064 9.556) 15.675 4.078 ( 8.072 -0.029 -0.197) 8.074 4.128 ( 2.324 -3.736 -2.571) 5.096 4.211 ( 1.589 -0.347 -1.022) 1.921 4.317 ( 0.337 2.342 1.715) 2.922 4.430 ( 2.210 -0.825 -1.422) 2.754 4.465 ( -0.532 -1.608 4.809) 5.099 4.550 ( -0.872 -1.040 1.978) 2.399 4.591 ( -1.338 5.536 -5.441) 7.877 4.670 ( -0.023 -5.222 -0.634) 5.260 4.768 ( -3.273 -3.189 -1.603) 4.843 4.931 ( -1.585 -1.108 3.389) 3.902 4.982 ( 0.945 -4.452 4.567) 6.448 5.083 ( -5.619 4.333 -0.141) 7.097 5.286 ( -7.776 -4.005 -1.266) 8.838 5.448 ( -2.338 6.925 3.429) 8.074 5.668 ( 0.758 -3.809 1.227) 4.072 5.746 ( -3.315 2.769 -1.864) 4.704 5.875 ( 0.059 2.209 -2.385) 3.251 6.029 ( -9.726 1.930 -3.472) 10.506 6.172 ( 3.771 0.940 2.989) 4.903 6.224 ( -4.702 -1.522 -1.377) 5.130 6.423 ( -3.834 -6.785 -3.582) 8.577 6.494 ( -4.863 0.859 -3.143) 5.854 6.634 ( -6.927 -3.864 -4.374) 9.058 6.891 ( -4.528 3.935 11.212) 12.716 7.047 ( -1.286 -2.770 0.646) 3.121 7.421 ( 1.335 3.420 -0.214) 3.677 7.566 ( 3.986 -1.504 2.114) 4.756 7.759 ( 3.603 2.141 4.610) 6.230 7.937 ( 5.844 -4.197 1.990) 7.465 8.205 ( 3.496 4.161 -4.133) 6.828 8.279 ( 4.393 -1.142 -7.259) 8.561 8.607 ( -0.868 2.894 1.644) 3.439 8.635 ( -0.897 4.458 2.971) 5.432 8.701 ( 0.601 -1.491 2.070) 2.621 8.881 ( -0.556 -5.128 -0.785) 5.218 8.999 ( 7.980 0.889 -4.361) 9.137 9.190 ( 2.087 -4.116 -5.625) 7.276 9.378 ( 7.116 5.718 -0.694) 9.155 9.531 ( 7.265 -4.224 2.201) 8.687 9.591 ( 0.584 7.835 -0.300) 7.862 9.883 ( 4.496 -4.261 1.387) 6.348 9.946 ( -4.291 2.195 1.551) 5.063 10.042 ( -6.046 3.068 3.750) 7.748 10.147 ( -7.313 -2.108 -2.098) 7.895 10.370 ( -5.645 -5.940 4.377) 9.290 10.486 ( 0.737 3.769 -1.358) 4.074 10.614 ( -1.952 -2.396 2.453) 3.945 10.926 ( 5.066 0.677 2.504) 5.692 11.036 ( -1.983 -2.981 -0.458) 3.610 11.235 ( -4.981 3.075 -0.060) 5.854 11.310 ( 3.367 0.490 -1.639) 3.777 11.393 ( 0.711 -1.253 3.017) 3.344 11.451 ( 2.972 -3.087 -3.525) 5.549 11.854 ( -2.016 -1.090 0.429) 2.332 11.875 ( 0.700 -1.597 1.171) 2.101 12.167 ( -4.131 5.625 0.202) 6.982 12.370 ( -2.848 0.897 4.054) 5.034 12.554 ( -5.946 0.887 -4.618) 7.581 12.730 ( -6.247 -3.388 2.752) 7.621 12.860 ( 1.249 5.878 -3.793) 7.106 13.023 ( 4.009 -0.867 1.432) 4.344 13.211 ( -1.099 1.025 -1.961) 2.471 13.274 ( 0.176 4.718 2.218) 5.216 13.380 ( -4.289 -4.895 -1.592) 6.700 13.484 ( -1.749 -2.591 -0.563) 3.177 13.642 ( -0.483 -0.407 2.297) 2.382 13.676 ( 1.054 -1.773 -2.438) 3.193 14.250 ( -1.141 -0.363 -0.133) 1.205 14.325 ( -2.360 -2.927 1.891) 4.209 14.589 ( -6.694 2.491 5.742) 9.164 14.682 ( -3.265 -2.443 4.388) 5.991 14.826 ( -0.518 0.905 -3.154) 3.322 14.869 ( -0.361 -0.217 -1.873) 1.920 15.227 ( 2.098 3.242 0.800) 3.944 15.328 ( 3.313 -2.512 -3.153) 5.218 15.440 ( -5.165 3.235 -0.647) 6.129 15.659 ( -2.663 -2.693 -2.384) 4.475 15.810 ( -0.255 5.236 -5.671) 7.723 15.995 ( -0.465 0.629 2.607) 2.722 16.066 ( -1.306 -1.189 0.465) 1.826 16.237 ( 2.919 -4.210 2.813) 5.844 16.519 ( 3.510 2.819 -0.415) 4.521 16.705 ( 6.084 -3.637 -0.611) 7.115 16.776 ( 1.458 2.652 0.876) 3.151 16.853 ( 0.053 -0.555 -2.433) 2.496 17.051 ( 0.057 1.629 4.263) 4.564 17.092 ( 0.676 -1.001 4.056) 4.232 17.394 ( 2.017 2.850 -0.593) 3.541 17.474 ( 0.371 -2.283 -0.723) 2.424 17.779 ( -4.610 5.259 -0.426) 7.007 17.819 ( 3.302 9.870 4.769) 11.449 18.117 ( -7.774 0.076 0.155) 7.776 18.419 ( 0.920 -3.868 2.928) 4.938 18.778 ( -5.401 2.502 -6.979) 9.172 19.034 ( 0.484 -5.950 -1.850) 6.250 19.546 ( 11.207 -4.734 -2.049) 12.337 19.638 ( 9.708 -8.226 -1.482) 12.811 20.152 ( -2.015 2.993 0.189) 3.613 20.202 ( -0.229 0.486 0.018) 0.537 ======================= Grid point 170 (88/104) ======================= q-point: ( 0.30 0.33 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.154 ( 11.989 1.932 -5.513) 13.336 2.302 ( 5.849 -5.330 2.738) 8.373 2.387 ( 14.704 3.691 -4.129) 15.712 2.495 ( 4.050 -0.995 1.195) 4.338 2.701 ( 0.399 1.487 -3.283) 3.626 2.745 ( 6.563 -5.137 0.841) 8.377 2.798 ( 4.323 -0.106 -2.234) 4.867 2.934 ( 5.663 3.844 10.505) 12.538 3.089 ( 1.725 -1.672 2.505) 3.471 3.158 ( 0.454 2.371 3.189) 3.999 3.272 ( 3.161 6.094 1.684) 7.068 3.348 ( 3.621 3.166 0.297) 4.819 3.386 ( 3.372 -2.700 4.158) 5.996 3.601 ( 1.616 -4.613 2.547) 5.512 3.627 ( 4.667 0.128 -0.971) 4.769 3.692 ( 5.430 -2.113 -0.015) 5.826 3.766 ( 1.245 4.452 -2.177) 5.110 3.856 ( -0.582 0.450 -1.510) 1.680 4.024 ( 5.799 2.620 -8.102) 10.302 4.085 ( 3.951 2.176 -5.578) 7.173 4.142 ( 4.272 -3.791 -4.097) 7.029 4.255 ( 0.457 4.947 8.087) 9.492 4.273 ( 4.499 1.033 -0.087) 4.617 4.367 ( 1.332 1.034 0.562) 1.777 4.439 ( -1.259 0.218 6.090) 6.223 4.514 ( 3.056 -2.437 -0.780) 3.986 4.548 ( 2.166 2.988 -5.423) 6.559 4.604 ( 6.416 1.453 -1.661) 6.785 4.686 ( 1.766 -2.090 -1.858) 3.307 4.721 ( -0.850 -2.934 -1.248) 3.299 4.917 ( -2.153 -0.983 3.045) 3.857 4.996 ( -1.382 -2.755 0.158) 3.086 5.057 ( 2.262 -3.441 2.969) 5.077 5.138 ( -6.876 -3.696 -0.575) 7.828 5.415 ( -3.576 7.226 3.065) 8.626 5.673 ( -0.940 -1.237 -2.781) 3.186 5.719 ( 2.476 0.152 -1.086) 2.707 5.821 ( -6.422 4.762 0.088) 7.995 5.900 ( -0.270 -3.849 0.231) 3.865 6.027 ( -8.961 -2.959 -3.815) 10.179 6.334 ( 7.032 3.545 3.269) 8.526 6.354 ( -3.304 -0.013 -2.059) 3.893 6.406 ( -5.043 -3.144 -0.705) 5.984 6.522 ( 0.763 -6.241 -4.784) 7.900 6.897 ( -2.247 4.529 7.652) 9.171 7.034 ( 0.696 -1.867 -1.812) 2.694 7.445 ( 0.757 2.900 1.501) 3.352 7.621 ( 0.886 -5.358 1.657) 5.677 7.899 ( 6.581 2.758 3.720) 8.048 8.035 ( 3.592 -2.244 -0.397) 4.254 8.204 ( -0.145 3.249 -1.486) 3.576 8.290 ( 3.325 1.025 -6.721) 7.568 8.584 ( -1.851 4.086 -0.766) 4.551 8.631 ( 0.771 2.415 -2.285) 3.413 8.739 ( 0.584 1.625 3.833) 4.204 8.878 ( 0.727 -5.699 0.623) 5.779 9.103 ( 4.063 0.712 -1.127) 4.276 9.242 ( 5.140 -2.598 -0.420) 5.774 9.475 ( 3.601 6.484 -1.140) 7.504 9.579 ( -2.253 5.163 1.289) 5.779 9.635 ( 4.040 -3.558 -1.546) 5.601 9.871 ( -2.901 -3.486 -1.463) 4.765 9.946 ( -2.842 -2.461 5.155) 6.380 9.988 ( -2.586 -0.662 3.092) 4.085 10.077 ( 2.534 2.831 0.345) 3.815 10.306 ( -4.069 -5.009 2.476) 6.912 10.465 ( -3.093 3.199 0.502) 4.478 10.534 ( -8.156 -0.648 2.955) 8.699 10.965 ( -1.612 0.988 3.685) 4.142 11.059 ( 4.718 -2.322 1.035) 5.359 11.192 ( 0.406 2.245 0.594) 2.357 11.329 ( 0.426 -3.628 -0.189) 3.658 11.451 ( 3.771 1.010 -3.611) 5.318 11.476 ( 2.401 -0.996 -5.669) 6.236 11.798 ( -3.025 0.912 -2.100) 3.794 11.889 ( -0.692 -3.104 0.790) 3.277 12.112 ( -2.082 6.605 0.121) 6.926 12.327 ( -6.625 8.627 1.399) 10.967 12.385 ( -4.540 -5.349 -2.524) 7.456 12.611 ( -8.631 -3.683 3.377) 9.974 12.918 ( 5.334 3.746 -1.236) 6.635 13.088 ( 0.972 -2.525 0.378) 2.731 13.165 ( -1.054 1.648 -3.095) 3.662 13.252 ( -4.637 -1.132 -1.195) 4.921 13.341 ( 1.909 1.788 0.446) 2.653 13.467 ( 0.106 -4.155 -0.131) 4.158 13.638 ( 0.508 -0.817 -2.170) 2.374 13.704 ( 2.278 -3.368 0.466) 4.093 14.226 ( -1.450 -0.436 0.914) 1.768 14.289 ( -3.099 -1.988 2.351) 4.368 14.482 ( -8.088 3.650 3.963) 9.718 14.624 ( -6.004 -3.570 3.215) 7.689 14.831 ( 2.358 1.228 -1.135) 2.891 14.898 ( 3.360 0.473 1.095) 3.566 15.182 ( -4.817 1.977 -2.180) 5.645 15.313 ( -1.168 -1.773 -3.134) 3.785 15.427 ( 0.983 4.046 3.219) 5.263 15.647 ( 2.989 -1.498 -3.462) 4.813 15.767 ( -0.190 1.846 -4.833) 5.177 15.908 ( -6.187 -1.106 0.845) 6.342 16.169 ( 6.337 2.329 4.182) 7.941 16.341 ( 5.394 -3.406 3.488) 7.271 16.558 ( 0.992 4.800 -0.907) 4.985 16.761 ( 0.336 -3.613 -0.106) 3.630 16.813 ( 2.906 0.008 0.645) 2.977 16.828 ( -0.944 -0.244 -1.828) 2.072 17.074 ( 1.987 2.873 2.264) 4.162 17.147 ( 1.302 0.166 0.014) 1.312 17.399 ( -1.539 0.562 -0.144) 1.645 17.438 ( -4.592 -2.097 1.108) 5.168 17.663 ( -5.633 6.722 -1.759) 8.945 17.923 ( 1.571 3.725 6.313) 7.496 17.983 ( -5.282 3.451 -0.027) 6.309 18.485 ( 2.511 -8.404 6.667) 11.017 18.637 ( -4.072 7.707 -7.627) 11.583 19.011 ( -0.329 -8.084 -4.640) 9.327 19.737 ( 10.386 -3.655 -1.583) 11.124 19.787 ( 7.342 -5.237 -0.979) 9.072 20.139 ( 0.793 3.063 -0.618) 3.223 20.217 ( 1.466 -1.006 -0.399) 1.822 ======================= Grid point 171 (89/104) ======================= q-point: ( 0.40 0.33 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.319 ( 8.869 -2.442 -3.979) 10.023 2.378 ( 1.198 -3.706 1.360) 4.126 2.569 ( 6.196 1.960 -2.751) 7.057 2.636 ( 11.032 0.894 1.682) 11.195 2.707 ( -0.036 -1.241 0.841) 1.500 2.737 ( -2.320 0.309 2.350) 3.316 2.959 ( 7.164 -0.823 4.858) 8.695 3.065 ( 3.128 -0.746 3.735) 4.929 3.165 ( 4.584 3.872 3.461) 6.927 3.206 ( 2.442 2.523 3.985) 5.311 3.355 ( 0.589 1.660 -0.149) 1.767 3.372 ( 2.789 7.694 -0.647) 8.209 3.453 ( 0.819 -1.074 -1.156) 1.778 3.569 ( -4.450 -1.327 -1.446) 4.864 3.714 ( 3.904 -2.467 -1.465) 4.845 3.763 ( 2.214 1.366 -1.617) 3.063 3.786 ( 6.644 -0.283 1.971) 6.936 3.823 ( -3.272 -1.969 1.225) 4.010 3.944 ( -6.181 1.270 -1.927) 6.598 4.093 ( -1.486 -0.510 4.370) 4.644 4.222 ( 1.816 5.431 -7.791) 9.669 4.265 ( -2.954 3.238 4.522) 6.297 4.295 ( -1.915 0.825 6.574) 6.897 4.391 ( 1.723 1.176 0.311) 2.109 4.498 ( -1.256 -1.127 2.067) 2.668 4.542 ( 3.524 1.473 -6.296) 7.364 4.578 ( 4.430 0.138 0.198) 4.437 4.642 ( 3.284 1.378 -3.841) 5.238 4.694 ( 0.772 -4.230 -3.732) 5.693 4.742 ( 1.501 -6.013 -1.312) 6.334 4.909 ( 0.291 -1.715 0.435) 1.794 4.975 ( -0.812 -3.263 -1.212) 3.575 5.064 ( -0.527 -0.096 0.467) 0.711 5.124 ( 0.963 -2.657 2.088) 3.514 5.380 ( -1.036 5.480 1.094) 5.683 5.591 ( -4.561 -0.954 -4.033) 6.163 5.744 ( 0.004 3.997 -0.114) 3.998 5.806 ( 4.415 0.045 2.389) 5.020 5.897 ( -2.744 -1.872 -4.882) 5.906 5.950 ( 2.242 -4.283 5.207) 7.105 6.237 ( -4.733 -0.659 -3.816) 6.115 6.270 ( -5.893 -2.766 -2.658) 7.032 6.519 ( 7.683 -0.185 1.076) 7.760 6.555 ( 3.036 -2.651 -0.387) 4.049 6.917 ( -0.958 4.826 5.913) 7.692 7.051 ( 2.915 -1.854 -3.388) 4.838 7.471 ( 0.474 1.786 2.763) 3.324 7.620 ( -1.435 -4.893 -0.726) 5.150 8.005 ( 2.359 2.586 1.854) 3.961 8.051 ( -0.105 2.984 -2.604) 3.962 8.208 ( 0.653 0.951 1.058) 1.566 8.312 ( 3.652 -2.641 -6.672) 8.052 8.566 ( 0.478 2.814 -0.203) 2.862 8.637 ( 2.385 0.365 -3.494) 4.246 8.758 ( -1.940 3.861 4.979) 6.592 8.877 ( -0.275 -2.852 -2.615) 3.879 9.179 ( 4.624 1.817 2.125) 5.403 9.295 ( -0.552 1.304 1.141) 1.819 9.493 ( -0.534 4.771 1.411) 5.003 9.557 ( -1.196 0.015 2.792) 3.037 9.671 ( 1.659 -1.351 -2.489) 3.282 9.766 ( -4.681 -3.683 -2.656) 6.522 9.976 ( 1.903 -0.259 2.162) 2.892 10.013 ( 0.992 -1.480 5.655) 5.929 10.132 ( 1.353 -0.375 0.861) 1.647 10.257 ( -2.824 -3.595 0.689) 4.623 10.378 ( -6.832 2.678 4.977) 8.867 10.437 ( -2.867 0.706 -0.224) 2.961 11.010 ( 2.459 2.153 6.018) 6.849 11.128 ( 2.394 -2.496 -0.550) 3.502 11.226 ( 0.511 1.722 1.389) 2.271 11.337 ( -1.851 -2.698 2.821) 4.320 11.430 ( 1.978 2.277 -8.593) 9.107 11.496 ( 3.852 -1.094 -5.874) 7.109 11.733 ( -1.617 1.750 -3.406) 4.157 11.846 ( -3.144 -2.852 -2.557) 4.956 12.095 ( -0.402 6.271 1.085) 6.377 12.199 ( -4.971 6.719 -1.052) 8.424 12.356 ( -0.441 -5.174 1.212) 5.333 12.481 ( -7.065 -4.888 1.357) 8.697 12.998 ( 2.856 1.088 0.877) 3.179 13.070 ( -1.065 -2.032 0.403) 2.329 13.139 ( -0.135 1.683 -2.887) 3.345 13.185 ( -2.495 0.436 -1.074) 2.751 13.348 ( 0.419 1.197 -2.258) 2.589 13.449 ( -1.943 -4.354 -2.676) 5.467 13.679 ( 4.852 -1.410 -0.176) 5.056 13.746 ( 1.401 -3.176 1.125) 3.649 14.228 ( -0.062 -1.050 3.144) 3.316 14.254 ( -2.707 -1.065 3.599) 4.627 14.382 ( -3.876 2.604 0.824) 4.741 14.519 ( -6.980 -4.170 1.428) 8.255 14.877 ( 1.910 2.244 1.777) 3.441 14.981 ( 3.159 -0.347 2.426) 3.998 15.093 ( -1.751 5.135 -2.908) 6.156 15.260 ( -1.370 0.260 -4.206) 4.431 15.484 ( 1.185 2.808 5.903) 6.644 15.679 ( 2.961 -3.821 -5.162) 7.072 15.737 ( 0.497 0.024 -3.300) 3.338 15.813 ( -4.856 -1.663 0.891) 5.209 16.311 ( 5.314 4.714 4.452) 8.383 16.464 ( 4.708 -3.290 3.273) 6.611 16.545 ( -0.046 5.722 -2.187) 6.126 16.728 ( -3.630 -3.124 -0.510) 4.816 16.824 ( 0.638 1.301 2.296) 2.715 16.894 ( 4.961 -1.049 3.019) 5.901 17.106 ( -1.497 3.402 -5.015) 6.242 17.156 ( 3.093 0.603 -1.400) 3.449 17.322 ( -6.149 0.374 -0.446) 6.176 17.347 ( -5.136 -0.360 2.079) 5.552 17.601 ( -1.240 2.540 1.487) 3.194 17.829 ( -4.795 -6.827 -5.342) 9.906 18.065 ( 3.028 12.849 10.614) 16.939 18.516 ( -3.031 6.306 -7.124) 9.985 18.595 ( 2.949 -6.333 7.759) 10.440 18.960 ( -0.665 -9.348 -7.108) 11.763 19.874 ( 4.986 -2.273 -0.478) 5.500 19.887 ( 4.573 -2.937 -0.310) 5.444 20.162 ( 1.907 2.089 -0.811) 2.942 20.231 ( 0.450 -1.494 -1.477) 2.149 ======================= Grid point 172 (90/104) ======================= q-point: (-0.50 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.362 ( -3.889 -3.062 1.272) 5.111 2.396 ( 2.363 -5.179 -2.026) 6.043 2.630 ( -6.734 2.415 4.103) 8.248 2.673 ( 2.837 -0.272 -0.017) 2.850 2.729 ( -3.006 3.404 2.656) 5.261 2.798 ( 6.933 2.072 -3.300) 7.953 3.100 ( 1.711 1.722 4.768) 5.351 3.139 ( 3.393 0.617 1.756) 3.870 3.248 ( -2.350 0.522 5.371) 5.886 3.281 ( 4.211 2.387 0.675) 4.887 3.315 ( 0.326 0.899 -0.119) 0.964 3.386 ( -3.501 -2.205 -5.161) 6.615 3.416 ( -0.371 4.252 0.632) 4.315 3.488 ( -1.324 0.077 -4.206) 4.410 3.746 ( -3.593 -0.781 2.127) 4.248 3.776 ( -1.987 -2.911 -0.471) 3.556 3.808 ( 5.807 0.948 0.872) 5.949 3.825 ( -2.180 3.524 -1.696) 4.477 3.979 ( 8.238 -4.045 3.827) 9.943 4.030 ( -9.663 -0.156 0.765) 9.695 4.182 ( 0.057 6.457 5.747) 8.644 4.217 ( -3.228 2.606 -1.021) 4.272 4.347 ( 1.946 3.307 1.837) 4.254 4.414 ( -1.009 -0.020 2.482) 2.680 4.474 ( 1.528 -1.428 2.176) 3.019 4.534 ( -1.837 0.923 -7.094) 7.386 4.601 ( 0.737 3.939 -1.809) 4.397 4.652 ( 0.760 -2.375 -3.212) 4.067 4.734 ( -1.247 -5.690 -0.520) 5.849 4.748 ( 5.192 -4.188 -3.622) 7.590 4.897 ( -4.268 -3.945 3.010) 6.545 4.970 ( 3.239 -5.811 -3.732) 7.627 5.092 ( 0.600 0.916 1.611) 1.948 5.108 ( -1.577 2.802 -0.043) 3.215 5.408 ( 1.782 2.137 2.163) 3.524 5.505 ( 0.619 0.220 -6.376) 6.410 5.761 ( -0.929 1.587 3.149) 3.646 5.808 ( -4.888 -0.480 -0.305) 4.921 5.921 ( 5.925 -0.239 3.013) 6.651 6.004 ( 1.530 -2.673 -3.230) 4.463 6.159 ( -0.372 -1.954 -1.346) 2.402 6.179 ( -2.079 -2.766 -2.703) 4.390 6.584 ( -1.160 -0.212 1.024) 1.562 6.606 ( 1.702 -1.343 -0.933) 2.360 6.943 ( -1.446 4.223 6.210) 7.648 7.066 ( 1.511 -1.317 -4.995) 5.382 7.507 ( 0.661 -0.477 4.166) 4.245 7.571 ( -2.436 -2.676 -1.437) 3.894 8.004 ( -3.019 3.752 1.695) 5.106 8.041 ( 1.404 2.855 -1.757) 3.635 8.223 ( -1.743 -0.276 2.832) 3.337 8.299 ( 0.856 -4.279 -6.177) 7.563 8.581 ( -0.731 2.669 1.324) 3.068 8.658 ( 3.413 -1.115 -5.560) 6.619 8.770 ( 0.467 4.314 4.002) 5.903 8.857 ( 1.385 -0.199 -4.337) 4.558 9.251 ( -3.750 4.020 1.785) 5.780 9.292 ( 6.089 2.086 -0.730) 6.478 9.522 ( 1.357 1.638 4.678) 5.139 9.559 ( -1.771 -0.466 2.459) 3.066 9.657 ( -1.294 -0.424 -0.760) 1.560 9.689 ( -1.631 -2.083 -3.189) 4.143 10.034 ( -2.804 -1.908 2.628) 4.291 10.050 ( 4.709 -1.699 0.911) 5.088 10.154 ( 1.493 -0.458 2.826) 3.229 10.207 ( -2.618 -2.265 -1.017) 3.608 10.352 ( -0.760 3.111 4.583) 5.591 10.417 ( 1.840 0.439 -1.964) 2.727 11.112 ( 0.697 0.912 9.599) 9.668 11.156 ( 0.796 -1.222 1.130) 1.845 11.187 ( -2.630 1.486 -0.824) 3.131 11.277 ( -2.858 -2.896 -2.849) 4.967 11.469 ( 3.858 2.904 -4.823) 6.825 11.479 ( -1.901 1.853 -4.955) 5.622 11.717 ( 0.888 -1.246 -0.036) 1.531 11.770 ( -0.168 -2.267 -4.796) 5.308 12.099 ( -1.344 5.516 2.798) 6.329 12.147 ( 0.694 5.346 -1.896) 5.715 12.365 ( -1.725 -5.101 2.940) 6.135 12.411 ( 1.700 -4.984 -1.639) 5.515 13.028 ( -0.411 0.299 3.014) 3.057 13.080 ( 0.990 -1.100 -0.471) 1.553 13.111 ( -2.802 0.758 -0.881) 3.033 13.145 ( 2.091 -0.194 -2.950) 3.621 13.347 ( -0.521 0.163 0.143) 0.564 13.388 ( -0.621 -1.198 -3.608) 3.852 13.742 ( -1.413 -2.330 1.798) 3.265 13.761 ( 0.926 -3.121 0.050) 3.256 14.234 ( -2.047 0.816 4.218) 4.759 14.257 ( -0.051 0.118 2.753) 2.756 14.401 ( 5.902 -2.260 -0.522) 6.341 14.421 ( -2.351 -3.179 -1.885) 4.380 14.901 ( -2.854 2.513 5.220) 6.459 14.989 ( -1.121 -0.063 -0.673) 1.309 15.115 ( 2.110 5.671 0.482) 6.070 15.222 ( 3.232 3.099 -7.730) 8.933 15.533 ( -1.975 1.118 7.756) 8.081 15.659 ( -0.627 -2.622 -2.979) 4.018 15.739 ( -2.547 -2.818 -1.318) 4.020 15.772 ( 4.688 -2.685 -3.653) 6.522 16.390 ( -1.901 4.941 5.939) 7.956 16.499 ( 2.662 0.315 -4.237) 5.014 16.607 ( 3.020 1.446 2.295) 4.059 16.649 ( -2.567 -0.737 -1.573) 3.100 16.868 ( 1.115 4.186 5.883) 7.306 16.999 ( -2.972 4.597 -6.788) 8.720 17.028 ( 4.278 -3.375 5.021) 7.410 17.110 ( -6.144 -2.017 -3.134) 7.186 17.266 ( -2.744 2.145 3.013) 4.606 17.321 ( 4.301 1.523 -2.438) 5.173 17.621 ( 0.974 -1.686 4.346) 4.762 17.727 ( -1.744 -5.493 -5.999) 8.318 18.200 ( 3.141 11.383 11.112) 16.215 18.405 ( -2.972 9.871 -9.040) 13.711 18.706 ( 2.546 -9.055 8.500) 12.678 18.887 ( -0.929 -9.699 -9.148) 13.365 19.911 ( -0.923 -1.177 1.234) 1.939 19.937 ( 0.906 -2.693 -1.255) 3.106 20.186 ( 0.631 0.656 0.302) 0.959 20.207 ( -1.433 -0.570 -1.733) 2.319 ======================= Grid point 173 (91/104) ======================= q-point: (-0.40 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.247 ( -10.621 -0.335 2.646) 10.951 2.395 ( -2.199 -5.881 1.491) 6.453 2.462 ( -13.290 7.149 4.238) 15.675 2.660 ( -4.699 1.637 0.120) 4.978 2.718 ( 0.185 -2.604 -0.364) 2.636 2.817 ( -1.485 0.747 -4.946) 5.218 3.031 ( -6.790 2.947 -1.346) 7.523 3.144 ( -1.910 0.939 -4.639) 5.104 3.216 ( -3.705 0.564 -0.849) 3.843 3.305 ( -2.506 -0.452 -1.255) 2.839 3.342 ( 1.894 0.250 0.946) 2.132 3.364 ( -5.098 4.645 0.509) 6.915 3.383 ( 3.415 -3.114 3.446) 5.765 3.524 ( 5.466 0.325 2.061) 5.851 3.678 ( -6.069 -2.317 2.186) 6.854 3.714 ( -2.919 3.376 2.400) 5.068 3.817 ( -6.249 -2.719 1.847) 7.060 3.834 ( -2.361 1.258 -1.469) 3.052 3.942 ( 4.713 3.816 -0.085) 6.065 4.109 ( -2.832 0.833 -1.360) 3.250 4.121 ( 0.647 -1.243 1.090) 1.775 4.265 ( -2.069 -0.952 5.743) 6.179 4.337 ( -0.582 1.004 1.856) 2.189 4.405 ( -1.512 3.553 -0.334) 3.876 4.510 ( 4.799 5.203 -1.156) 7.172 4.554 ( 1.253 3.936 -2.725) 4.949 4.590 ( 0.752 -1.661 1.147) 2.154 4.598 ( -4.192 -4.844 -0.563) 6.431 4.693 ( -2.383 -3.402 -1.528) 4.425 4.728 ( -2.409 0.816 -5.624) 6.172 4.890 ( 2.430 -4.002 1.179) 4.828 4.982 ( -0.645 -6.152 -1.251) 6.311 5.071 ( 0.403 0.657 0.888) 1.176 5.135 ( 0.626 -1.759 0.746) 2.010 5.440 ( 3.246 3.484 -3.138) 5.702 5.541 ( 4.005 -2.428 -0.868) 4.764 5.720 ( -3.295 1.431 1.586) 3.927 5.754 ( -3.029 -2.608 4.741) 6.201 5.961 ( 1.297 2.364 -8.129) 8.564 6.064 ( 4.625 -1.715 -3.427) 6.006 6.137 ( 0.995 -0.084 3.178) 3.331 6.226 ( 5.873 -4.452 2.286) 7.716 6.520 ( -5.769 0.302 0.458) 5.795 6.576 ( -3.495 -1.791 -1.854) 4.343 6.939 ( -3.831 3.464 6.596) 8.378 7.043 ( 0.870 -0.493 -5.497) 5.587 7.499 ( -2.817 -0.076 0.056) 2.818 7.574 ( 1.350 -2.179 3.673) 4.479 7.967 ( -2.320 3.491 2.209) 4.738 8.060 ( 0.993 0.074 -0.678) 1.205 8.179 ( -3.764 1.334 3.121) 5.068 8.283 ( -0.019 -3.866 -2.573) 4.644 8.553 ( -2.061 4.150 1.116) 4.766 8.656 ( -0.079 0.355 -4.730) 4.743 8.822 ( 1.958 1.533 1.285) 2.799 8.870 ( 3.828 -0.001 -5.679) 6.849 9.195 ( -2.969 4.640 -0.057) 5.509 9.370 ( 3.054 0.891 -4.874) 5.820 9.511 ( -3.275 1.978 -0.531) 3.863 9.557 ( -1.658 -0.476 4.253) 4.589 9.642 ( -1.809 -1.032 -1.438) 2.530 9.692 ( 4.405 -2.601 4.817) 7.026 10.000 ( -1.043 1.819 -0.394) 2.134 10.115 ( 0.825 -3.680 -2.074) 4.305 10.150 ( -2.040 0.038 -1.088) 2.312 10.217 ( 2.574 -1.903 3.416) 4.682 10.407 ( 3.795 3.096 3.230) 5.867 10.471 ( 6.192 -0.815 -3.841) 7.332 11.088 ( -4.284 -0.550 0.890) 4.410 11.120 ( -3.637 -2.105 2.141) 4.716 11.233 ( 3.373 2.112 2.543) 4.723 11.292 ( 0.996 1.675 2.627) 3.271 11.336 ( -6.316 1.885 0.148) 6.593 11.459 ( -3.443 -1.815 -4.947) 6.295 11.717 ( 2.348 0.453 -1.399) 2.770 11.826 ( 5.377 -3.920 -1.011) 6.730 12.091 ( -0.712 5.562 1.626) 5.838 12.190 ( 4.268 5.377 -0.023) 6.865 12.357 ( 0.419 -3.151 0.942) 3.315 12.506 ( 8.424 -5.931 -0.989) 10.350 13.017 ( -3.020 0.502 -0.712) 3.143 13.045 ( -3.007 0.782 2.608) 4.056 13.117 ( 3.618 -0.092 -0.804) 3.707 13.192 ( 3.315 -1.123 -1.895) 3.980 13.314 ( -1.520 1.315 1.040) 2.263 13.410 ( 2.637 -3.011 0.586) 4.045 13.671 ( -5.955 -0.524 0.582) 6.006 13.755 ( -2.026 -3.869 0.633) 4.413 14.214 ( -2.439 1.766 2.589) 3.971 14.296 ( 2.812 -1.394 0.496) 3.177 14.436 ( 5.862 0.254 -3.297) 6.731 14.543 ( 8.518 -3.979 -0.295) 9.407 14.846 ( -5.815 3.265 3.724) 7.638 14.956 ( -4.500 -0.860 3.357) 5.679 15.136 ( 4.282 5.531 -5.059) 8.632 15.272 ( 5.683 0.786 -5.428) 7.898 15.523 ( -3.333 3.111 5.451) 7.106 15.625 ( -1.492 -3.705 -3.737) 5.470 15.699 ( -0.843 -0.267 1.244) 1.527 15.848 ( 5.598 -4.797 -2.755) 7.870 16.341 ( -5.616 3.683 2.327) 7.108 16.504 ( -4.878 -3.825 -0.394) 6.211 16.559 ( 2.064 7.040 -4.125) 8.417 16.709 ( 3.213 -0.346 1.132) 3.425 16.887 ( -3.828 1.241 -3.669) 5.446 16.931 ( -3.947 1.746 1.306) 4.509 16.982 ( -0.719 1.724 4.222) 4.617 17.111 ( -1.241 -1.834 3.401) 4.059 17.298 ( 5.794 4.137 1.363) 7.249 17.399 ( 5.036 0.597 -2.421) 5.620 17.657 ( -0.206 -2.778 -1.753) 3.291 17.728 ( 5.509 -4.754 2.735) 7.774 18.277 ( -3.443 11.427 -10.140) 15.661 18.334 ( 3.214 9.811 10.208) 14.519 18.782 ( -1.160 -9.314 -5.652) 10.956 18.819 ( 1.941 -9.530 2.396) 10.016 19.856 ( -6.046 -1.904 0.894) 6.401 19.897 ( -4.519 -3.464 -0.851) 5.757 20.154 ( -2.504 1.522 -0.148) 2.934 20.200 ( -0.453 -0.712 1.240) 1.500 ======================= Grid point 174 (92/104) ======================= q-point: (-0.30 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.035 ( -14.835 7.039 5.366) 17.275 2.211 ( -18.360 10.700 8.881) 23.031 2.358 ( -3.167 -8.765 -0.737) 9.349 2.550 ( -6.433 -2.821 -2.170) 7.352 2.669 ( -3.467 -0.299 -0.530) 3.520 2.760 ( -1.883 -2.382 -1.366) 3.329 2.865 ( -9.381 -1.870 -6.125) 11.359 3.043 ( -6.085 -4.653 -2.037) 7.926 3.158 ( -1.461 5.961 -2.346) 6.571 3.233 ( -4.320 1.185 -0.956) 4.580 3.266 ( -4.105 3.923 0.740) 5.726 3.363 ( -0.883 3.989 -2.224) 4.652 3.425 ( -1.469 -0.771 1.311) 2.114 3.527 ( -14.632 1.957 7.349) 16.490 3.605 ( -2.258 -3.805 3.039) 5.367 3.680 ( -0.841 3.441 3.755) 5.162 3.759 ( 1.442 -1.512 -2.461) 3.228 3.819 ( -6.949 -0.088 2.360) 7.339 3.878 ( -7.061 4.772 1.295) 8.620 4.059 ( -1.003 -0.390 -3.158) 3.337 4.092 ( -1.899 -2.734 -1.060) 3.494 4.225 ( -5.185 -3.586 4.039) 7.487 4.335 ( -3.425 0.892 1.652) 3.906 4.392 ( -0.121 6.768 0.222) 6.773 4.454 ( -5.329 -5.862 0.007) 7.922 4.538 ( 1.036 3.625 -0.147) 3.773 4.586 ( -2.970 2.366 -3.168) 4.945 4.642 ( 2.530 0.219 -7.389) 7.813 4.646 ( -0.803 -0.797 0.452) 1.219 4.691 ( 4.553 0.140 1.109) 4.688 4.955 ( 3.070 -3.434 0.129) 4.608 4.974 ( 0.685 -3.295 1.196) 3.572 5.103 ( 1.167 -1.797 -0.939) 2.340 5.136 ( 2.173 -4.787 -0.714) 5.306 5.490 ( 3.768 3.583 -3.879) 6.487 5.586 ( 1.221 0.780 4.022) 4.275 5.703 ( -0.423 0.050 1.027) 1.112 5.791 ( 3.694 -4.484 4.133) 7.130 5.934 ( 1.168 3.080 -6.759) 7.519 6.076 ( 6.487 -1.813 -5.677) 8.809 6.262 ( 5.170 0.989 5.879) 7.892 6.384 ( 7.524 -4.319 1.577) 8.818 6.399 ( -5.777 1.211 -1.812) 6.174 6.485 ( -3.743 -2.401 -1.224) 4.612 6.929 ( -2.011 3.272 7.240) 8.195 7.040 ( 3.092 -0.856 -5.045) 5.979 7.447 ( -3.094 2.472 0.420) 3.983 7.617 ( 0.552 -3.708 2.248) 4.372 7.937 ( -3.032 2.604 0.674) 4.053 8.037 ( -1.723 -1.224 -2.356) 3.165 8.173 ( -1.144 3.309 5.689) 6.680 8.237 ( -2.622 -2.069 -3.230) 4.646 8.561 ( 1.863 3.199 2.917) 4.713 8.619 ( -0.011 3.072 -2.609) 4.030 8.815 ( -1.762 0.581 -2.512) 3.123 8.892 ( 1.141 -3.003 -3.756) 4.942 9.126 ( -4.022 2.697 -2.489) 5.445 9.297 ( -5.788 -1.667 -5.621) 8.238 9.456 ( -3.187 4.732 0.644) 5.741 9.575 ( -0.784 -3.117 4.328) 5.390 9.608 ( 0.138 3.225 -1.613) 3.609 9.827 ( 4.934 -4.384 3.976) 7.705 9.981 ( -0.402 0.977 0.310) 1.101 10.068 ( -1.477 -2.404 -4.552) 5.356 10.121 ( -0.370 3.056 -1.855) 3.593 10.296 ( 3.711 -1.874 2.558) 4.881 10.476 ( 1.533 1.612 0.577) 2.299 10.585 ( 7.400 -2.690 -2.497) 8.261 11.036 ( -0.113 0.231 -2.034) 2.050 11.090 ( -1.730 -0.887 -1.774) 2.632 11.188 ( -4.352 1.934 1.630) 5.033 11.286 ( -7.274 -1.745 4.768) 8.871 11.330 ( 0.945 1.762 5.822) 6.156 11.408 ( 2.027 -2.963 -0.134) 3.592 11.777 ( 4.464 1.176 -0.447) 4.638 11.902 ( 3.075 -4.389 -0.672) 5.401 12.106 ( 1.498 6.450 0.870) 6.678 12.296 ( 6.422 3.510 2.691) 7.798 12.395 ( 3.886 0.873 -1.572) 4.282 12.671 ( 10.041 -5.623 -2.281) 11.732 12.912 ( -6.371 3.653 -0.944) 7.405 13.052 ( -0.103 -2.237 3.232) 3.932 13.165 ( 1.337 0.221 -2.415) 2.770 13.230 ( 4.026 -1.439 0.561) 4.312 13.335 ( 1.416 1.697 1.277) 2.553 13.444 ( -1.259 -5.062 1.847) 5.533 13.593 ( -1.074 2.568 1.078) 2.984 13.716 ( -2.192 -3.708 0.218) 4.313 14.201 ( -0.682 3.717 1.793) 4.182 14.354 ( 3.904 -3.785 -1.987) 5.789 14.546 ( 7.408 1.874 -1.936) 7.882 14.659 ( 2.946 -3.049 0.740) 4.304 14.775 ( -3.802 3.333 2.825) 5.792 14.891 ( -3.447 -0.896 1.598) 3.904 15.215 ( 7.466 1.957 -4.317) 8.843 15.322 ( 3.843 -1.207 -4.611) 6.122 15.494 ( -1.957 2.716 -2.138) 3.972 15.580 ( -1.312 0.176 1.757) 2.200 15.706 ( -0.001 0.374 1.838) 1.876 15.928 ( 4.846 -5.457 -1.374) 7.427 16.237 ( -5.931 3.441 -1.722) 7.070 16.386 ( -6.041 0.168 -1.030) 6.131 16.570 ( -0.145 2.875 -1.888) 3.442 16.758 ( 1.126 -1.166 1.383) 2.130 16.782 ( -5.633 -0.700 -0.402) 5.690 16.841 ( -2.817 -0.478 -0.954) 3.012 17.060 ( 1.359 3.910 6.284) 7.525 17.095 ( -0.916 1.868 1.418) 2.518 17.425 ( 5.178 0.479 0.019) 5.201 17.448 ( 1.721 -0.855 -1.842) 2.662 17.668 ( 4.275 2.813 -1.672) 5.384 17.895 ( 8.815 -5.699 4.668) 11.488 18.136 ( -3.820 12.594 -10.381) 16.762 18.466 ( 3.692 7.840 9.303) 12.714 18.669 ( -2.669 -8.594 -11.393) 14.518 18.904 ( 2.357 -9.124 5.667) 10.996 19.707 ( -11.033 -3.153 1.067) 11.524 19.771 ( -8.729 -5.127 0.480) 10.134 20.120 ( -1.437 2.916 0.988) 3.398 20.195 ( -1.009 -0.951 1.560) 2.087 ======================= Grid point 175 (93/104) ======================= q-point: (-0.20 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.822 ( -13.693 14.798 8.764) 21.984 1.950 ( -17.989 14.514 11.911) 26.002 2.274 ( -3.831 -7.895 -5.105) 10.152 2.430 ( -5.449 -9.787 -0.113) 11.202 2.597 ( -11.035 2.064 -2.870) 11.588 2.628 ( -6.230 -5.392 -3.142) 8.818 2.691 ( -5.017 -2.505 1.735) 5.870 2.907 ( -9.265 -3.589 2.906) 10.352 3.079 ( -10.166 8.693 6.169) 14.730 3.140 ( -9.159 3.435 4.222) 10.654 3.196 ( -3.935 1.702 -0.555) 4.323 3.262 ( -10.989 2.675 2.057) 11.495 3.329 ( -2.641 2.887 3.299) 5.118 3.393 ( -1.165 2.068 -1.003) 2.577 3.544 ( -5.226 -3.853 1.166) 6.597 3.605 ( -6.246 0.459 -6.330) 8.905 3.705 ( -1.557 2.254 -0.158) 2.744 3.755 ( -1.541 -2.171 -2.775) 3.846 3.829 ( -2.716 3.671 1.201) 4.722 4.025 ( -2.512 -3.450 0.999) 4.383 4.075 ( -1.311 -3.814 2.565) 4.780 4.136 ( -4.203 -6.495 0.042) 7.736 4.255 ( -5.603 2.550 -0.642) 6.189 4.322 ( -5.071 -2.752 1.519) 5.966 4.445 ( 1.699 3.051 0.938) 3.616 4.492 ( -2.415 3.265 -4.153) 5.809 4.566 ( 1.419 1.249 -0.344) 1.921 4.652 ( -0.082 0.514 -4.796) 4.824 4.660 ( 4.330 -1.847 -1.810) 5.044 4.755 ( 2.854 -1.463 -0.319) 3.223 4.992 ( 1.022 -1.838 -2.361) 3.162 5.018 ( 2.335 -0.740 2.151) 3.260 5.100 ( 2.498 -0.082 -3.416) 4.233 5.239 ( 6.497 -3.720 2.928) 8.039 5.501 ( -0.067 5.175 -1.537) 5.399 5.663 ( 2.910 0.810 1.073) 3.205 5.714 ( 2.467 1.742 0.798) 3.124 5.867 ( 0.457 -2.468 0.506) 2.561 5.974 ( 8.570 1.977 -0.176) 8.797 6.214 ( 4.463 -6.249 -0.992) 7.743 6.265 ( 0.316 3.937 -4.186) 5.755 6.380 ( -2.208 -2.426 -0.143) 3.283 6.416 ( 6.763 3.094 3.295) 8.134 6.594 ( 9.751 -5.888 0.922) 11.428 6.968 ( -0.184 2.334 7.347) 7.711 7.070 ( 3.754 -1.263 -5.122) 6.475 7.394 ( -3.216 4.187 0.928) 5.361 7.611 ( -1.829 -3.977 -1.740) 4.711 7.857 ( -3.208 2.676 -3.990) 5.777 7.995 ( -1.232 -3.001 -2.472) 4.079 8.141 ( -5.456 3.575 2.457) 6.970 8.191 ( -2.369 -0.314 0.860) 2.540 8.636 ( 3.825 4.355 -0.125) 5.797 8.655 ( 4.487 2.043 1.864) 5.271 8.747 ( -2.584 1.384 -3.678) 4.703 8.861 ( -1.596 -5.847 -0.218) 6.065 9.005 ( -7.635 0.041 -3.200) 8.278 9.131 ( -7.604 -3.346 -2.519) 8.682 9.392 ( -3.623 5.770 -1.400) 6.956 9.539 ( -4.546 -3.703 0.809) 5.919 9.619 ( 0.163 6.294 -1.941) 6.589 9.869 ( -0.820 -2.092 1.549) 2.729 9.987 ( -2.074 0.270 -0.964) 2.303 10.072 ( 4.987 -6.375 3.695) 8.897 10.139 ( 4.916 6.501 -3.521) 8.879 10.381 ( 3.599 0.947 1.624) 4.061 10.485 ( 0.034 -1.934 0.407) 1.977 10.647 ( 0.637 -5.338 -1.420) 5.560 10.965 ( -8.256 2.071 -1.531) 8.649 11.053 ( 0.092 -1.190 -1.450) 1.878 11.163 ( -2.414 1.923 6.474) 7.172 11.291 ( 6.317 -4.979 2.372) 8.386 11.360 ( -1.904 1.075 2.925) 3.652 11.439 ( 1.554 -2.912 -1.199) 3.512 11.852 ( 3.050 -0.012 0.372) 3.072 11.919 ( 0.241 -2.584 -2.374) 3.517 12.160 ( 3.651 6.327 0.999) 7.372 12.428 ( 4.386 -6.641 2.002) 8.206 12.485 ( 7.312 11.638 -1.959) 13.883 12.776 ( -0.901 3.257 2.488) 4.197 12.836 ( 3.337 -2.670 -5.314) 6.819 13.039 ( -2.504 -4.268 0.060) 4.948 13.185 ( 3.045 2.529 0.377) 3.976 13.320 ( -2.066 3.552 -1.554) 4.394 13.336 ( 4.174 -4.510 2.287) 6.557 13.450 ( 1.655 -1.948 2.700) 3.718 13.628 ( 1.704 1.807 1.452) 2.877 13.692 ( 0.676 -1.773 -1.910) 2.692 14.209 ( -0.287 4.632 2.621) 5.330 14.389 ( 1.304 -5.053 -3.011) 6.025 14.653 ( 4.030 -0.106 0.748) 4.100 14.673 ( -1.311 -0.724 5.556) 5.754 14.775 ( 2.513 2.642 0.725) 3.718 14.864 ( -0.137 -1.095 -2.453) 2.690 15.298 ( 2.827 0.150 -4.121) 5.000 15.343 ( 1.263 -0.308 -5.520) 5.671 15.447 ( 0.999 1.851 -1.836) 2.792 15.602 ( 1.486 -2.154 3.242) 4.166 15.735 ( 2.129 3.801 2.226) 4.892 16.005 ( 3.823 -5.104 0.080) 6.377 16.119 ( -4.145 2.650 -3.438) 6.002 16.284 ( -3.978 0.742 -1.618) 4.358 16.524 ( -3.346 -0.063 -0.822) 3.446 16.672 ( -6.228 -2.807 2.191) 7.174 16.795 ( -0.538 1.803 -0.985) 2.124 16.803 ( -0.162 0.524 2.486) 2.546 17.101 ( 2.106 2.006 -0.374) 2.933 17.117 ( 0.230 2.389 2.455) 3.434 17.405 ( -3.467 0.580 -3.379) 4.876 17.473 ( -0.237 -2.982 0.443) 3.024 17.778 ( 6.678 6.992 -1.288) 9.754 17.968 ( -3.337 6.038 -8.071) 10.617 18.114 ( 8.672 0.994 0.971) 8.783 18.535 ( -3.460 -6.440 -9.593) 12.061 18.612 ( 5.409 4.259 9.428) 11.674 18.975 ( 1.589 -8.130 3.769) 9.101 19.491 ( -13.198 -3.613 2.967) 14.002 19.604 ( -10.154 -7.247 1.733) 12.594 20.120 ( 0.173 3.611 2.509) 4.401 20.199 ( 0.874 -0.290 0.749) 1.187 ======================= Grid point 176 (94/104) ======================= q-point: (-0.10 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.676 ( -12.431 19.164 12.535) 26.056 1.750 ( -11.410 19.867 14.687) 27.214 2.103 ( -6.828 1.530 -15.960) 17.427 2.337 ( -11.464 -4.931 -1.163) 12.533 2.377 ( -1.694 -10.511 1.831) 10.803 2.492 ( -8.045 -8.918 2.443) 12.257 2.630 ( -6.641 0.240 6.196) 9.085 2.791 ( -3.981 1.883 4.287) 6.146 2.921 ( -10.862 2.992 13.849) 17.853 3.067 ( -3.870 1.536 5.442) 6.852 3.106 ( -2.868 3.259 -1.111) 4.482 3.230 ( 1.445 -1.781 6.235) 6.643 3.288 ( -3.117 -5.298 1.600) 6.351 3.350 ( -4.442 -3.697 -6.102) 8.404 3.465 ( 0.231 3.266 0.590) 3.327 3.522 ( -0.552 3.591 -3.539) 5.072 3.678 ( -0.145 -2.356 -3.683) 4.374 3.708 ( -1.948 -0.292 1.529) 2.494 3.778 ( -2.121 5.295 -1.179) 5.825 3.944 ( -4.252 -0.699 -0.605) 4.351 4.048 ( -3.180 0.337 -9.035) 9.584 4.082 ( -2.016 -3.350 -0.765) 3.984 4.174 ( -0.211 0.177 1.485) 1.511 4.316 ( 0.528 -1.760 3.647) 4.083 4.419 ( 0.111 -1.377 -4.177) 4.400 4.495 ( 0.038 -1.535 -2.356) 2.812 4.573 ( -0.676 0.351 -1.029) 1.280 4.591 ( -1.193 2.127 -1.230) 2.731 4.746 ( 5.385 -0.974 -0.343) 5.483 4.803 ( 1.894 -0.126 1.534) 2.441 4.970 ( -1.251 -0.046 -2.539) 2.830 5.016 ( -1.331 -3.260 -3.777) 5.164 5.185 ( 6.366 4.182 1.176) 7.707 5.373 ( 4.322 -4.039 2.229) 6.321 5.477 ( -0.500 7.717 -0.265) 7.738 5.654 ( -2.443 -0.827 -0.292) 2.596 5.818 ( 5.185 1.877 0.523) 5.539 5.877 ( 1.311 1.279 -0.863) 2.024 6.123 ( 0.668 -2.394 2.360) 3.427 6.168 ( 2.677 1.112 -2.830) 4.051 6.308 ( 4.196 1.441 -1.404) 4.653 6.460 ( 7.647 -4.151 3.475) 9.369 6.566 ( 5.074 2.132 0.699) 5.548 6.742 ( 5.016 -4.923 -0.675) 7.061 7.003 ( -1.918 0.784 7.652) 7.927 7.102 ( 3.904 -1.923 -3.930) 5.864 7.356 ( -1.181 4.946 0.587) 5.119 7.526 ( -3.899 -0.414 -5.184) 6.500 7.820 ( 2.940 1.876 -4.503) 5.696 7.954 ( 0.679 -4.318 -6.990) 8.244 8.038 ( -8.467 2.587 3.847) 9.653 8.115 ( -6.105 -2.261 0.392) 6.522 8.654 ( -1.299 0.573 -2.801) 3.140 8.692 ( -3.248 0.953 1.326) 3.635 8.719 ( 1.251 3.510 -4.512) 5.852 8.828 ( -5.031 -0.070 -4.734) 6.908 8.917 ( 6.482 -2.838 4.553) 8.415 9.055 ( -1.550 -4.465 7.174) 8.591 9.322 ( -1.655 4.207 -3.698) 5.841 9.423 ( -7.335 -3.583 -2.608) 8.569 9.595 ( -0.033 5.568 -1.964) 5.904 9.793 ( -6.783 -2.010 -1.474) 7.226 10.035 ( 5.896 3.762 2.430) 7.404 10.174 ( 2.242 -2.411 3.714) 4.963 10.247 ( 8.260 4.806 -1.134) 9.623 10.422 ( -0.034 3.778 2.142) 4.343 10.516 ( 2.156 -6.364 0.817) 6.769 10.604 ( -3.308 -6.058 -2.243) 7.258 10.817 ( -6.527 0.502 0.914) 6.610 10.952 ( -10.582 -5.356 2.447) 12.110 11.231 ( 2.304 4.448 5.630) 7.535 11.327 ( -1.013 2.714 -0.833) 3.015 11.442 ( 6.132 -4.040 1.328) 7.462 11.458 ( 3.293 -2.900 -3.191) 5.425 11.861 ( -1.730 -0.223 -0.687) 1.875 11.904 ( 0.472 -2.689 -2.809) 3.917 12.244 ( 4.073 6.483 2.248) 7.979 12.470 ( 0.907 3.225 -5.737) 6.643 12.543 ( 0.681 -2.216 2.329) 3.286 12.781 ( -5.504 -6.811 -5.018) 10.093 12.856 ( 5.950 8.365 5.462) 11.628 13.059 ( 5.765 -1.148 -2.614) 6.433 13.239 ( 1.072 0.881 -0.414) 1.448 13.291 ( -0.044 3.564 -1.153) 3.746 13.378 ( -0.459 -1.781 4.563) 4.920 13.506 ( 1.184 -3.967 0.736) 4.205 13.660 ( 2.431 3.083 -0.948) 4.039 13.714 ( 2.825 0.489 -3.063) 4.195 14.232 ( 0.077 3.159 4.958) 5.879 14.361 ( -2.135 -4.273 -0.585) 4.813 14.665 ( -1.268 -0.120 1.601) 2.045 14.748 ( 1.708 -2.685 1.668) 3.593 14.844 ( 1.641 1.014 -1.334) 2.345 14.862 ( 5.482 0.152 2.607) 6.072 15.235 ( -3.929 1.566 -6.917) 8.108 15.258 ( -4.774 0.952 -5.762) 7.543 15.540 ( 6.921 -0.379 2.206) 7.274 15.673 ( 2.394 -5.483 4.260) 7.344 15.818 ( 5.278 5.485 0.620) 7.637 15.999 ( -2.772 3.524 -2.828) 5.300 16.102 ( 2.089 -5.004 0.840) 5.488 16.246 ( 1.485 -0.747 -0.472) 1.728 16.447 ( -4.608 0.084 -0.163) 4.611 16.591 ( -4.169 -2.924 1.308) 5.257 16.751 ( -2.071 2.458 -0.829) 3.319 16.814 ( -2.311 -0.464 -0.290) 2.375 17.107 ( -0.309 2.440 -4.514) 5.141 17.134 ( 1.477 0.238 -1.837) 2.368 17.308 ( -5.094 4.530 3.128) 7.500 17.440 ( -2.245 -2.772 -1.823) 4.006 17.811 ( -0.678 7.792 -3.556) 8.592 17.881 ( -0.260 4.928 -6.252) 7.965 18.257 ( 6.012 1.509 0.003) 6.198 18.429 ( -2.707 -1.304 -3.421) 4.553 18.794 ( 7.168 -1.628 7.659) 10.616 19.009 ( -0.026 -6.684 1.320) 6.813 19.329 ( -6.756 -4.226 5.602) 9.741 19.449 ( -7.716 -8.496 1.846) 11.624 20.157 ( 0.817 3.974 4.397) 5.983 20.238 ( 2.894 0.199 -0.617) 2.965 ======================= Grid point 177 (95/104) ======================= q-point: ( 0.00 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.933 ( -4.876 -13.932 4.205) 15.348 1.933 ( -4.876 13.932 4.205) 15.348 2.144 ( 2.185 -15.895 6.341) 17.252 2.144 ( 2.185 15.895 6.341) 17.252 2.206 ( 5.220 -10.538 -3.767) 12.349 2.206 ( 5.220 10.538 -3.767) 12.349 2.611 ( -4.410 -5.793 1.411) 7.416 2.611 ( -4.410 5.793 1.411) 7.416 2.958 ( -1.401 -4.195 -3.055) 5.375 2.958 ( -1.401 4.195 -3.055) 5.375 3.197 ( -0.116 -1.323 0.289) 1.359 3.197 ( -0.116 1.323 0.289) 1.359 3.316 ( 3.302 -5.002 11.781) 13.218 3.316 ( 3.302 5.002 11.781) 13.218 3.528 ( -1.135 -3.937 -4.020) 5.740 3.528 ( -1.135 3.937 -4.020) 5.740 3.676 ( 1.511 -4.584 6.092) 7.772 3.676 ( 1.511 4.584 6.092) 7.772 3.850 ( -1.678 -3.502 -7.207) 8.186 3.850 ( -1.678 3.502 -7.207) 8.186 4.010 ( 1.740 -6.203 4.597) 7.915 4.010 ( 1.740 6.203 4.597) 7.915 4.258 ( 0.585 -10.099 -9.164) 13.649 4.258 ( 0.585 10.099 -9.164) 13.649 4.366 ( -0.272 -1.093 -0.576) 1.265 4.366 ( -0.272 1.093 -0.576) 1.265 4.599 ( -0.347 -0.779 0.890) 1.233 4.599 ( -0.347 0.779 0.890) 1.233 4.837 ( 1.393 -1.824 2.448) 3.356 4.837 ( 1.393 1.824 2.448) 3.356 4.908 ( -2.594 -1.455 -4.108) 5.072 4.908 ( -2.594 1.455 -4.108) 5.072 5.382 ( 1.618 -2.018 2.872) 3.865 5.382 ( 1.618 2.018 2.872) 3.865 5.541 ( -2.135 -1.972 -1.506) 3.273 5.541 ( -2.135 1.972 -1.506) 3.273 5.902 ( 0.137 -1.274 1.102) 1.690 5.902 ( 0.137 1.274 1.102) 1.690 6.109 ( 0.203 -3.602 -3.012) 4.700 6.109 ( 0.203 3.602 -3.012) 4.700 6.551 ( 3.322 -5.753 4.468) 8.006 6.551 ( 3.322 5.753 4.468) 8.006 6.640 ( 0.057 -4.636 -4.190) 6.249 6.640 ( 0.057 4.636 -4.190) 6.249 7.054 ( -3.716 -3.776 5.053) 7.322 7.054 ( -3.716 3.776 5.053) 7.322 7.444 ( 1.839 -2.132 -3.479) 4.475 7.444 ( 1.839 2.132 -3.479) 4.475 7.851 ( -6.046 -0.354 -1.436) 6.224 7.851 ( -6.046 0.354 -1.436) 6.224 7.993 ( 6.237 -1.827 -3.303) 7.290 7.993 ( 6.237 1.827 -3.303) 7.290 8.653 ( -0.132 -0.804 1.371) 1.595 8.653 ( -0.132 0.804 1.371) 1.595 8.710 ( -2.123 -2.792 -4.226) 5.492 8.710 ( -2.123 2.792 -4.226) 5.492 9.104 ( 5.993 -1.103 5.893) 8.477 9.104 ( 5.993 1.103 5.893) 8.477 9.271 ( -2.630 -1.138 -5.255) 5.986 9.271 ( -2.630 1.138 -5.255) 5.986 9.657 ( -0.656 -1.793 -0.311) 1.935 9.657 ( -0.656 1.793 -0.311) 1.935 10.209 ( 0.649 -0.207 2.457) 2.550 10.209 ( 0.649 0.207 2.457) 2.550 10.410 ( -4.327 -2.878 3.015) 6.008 10.410 ( -4.327 2.878 3.015) 6.008 10.490 ( 2.534 -3.260 -2.349) 4.751 10.490 ( 2.534 3.260 -2.349) 4.751 10.754 ( -0.485 -1.160 2.601) 2.889 10.754 ( -0.485 1.160 2.601) 2.889 11.328 ( -0.822 -1.470 1.716) 2.404 11.328 ( -0.822 1.470 1.716) 2.404 11.483 ( 1.120 -0.850 -0.537) 1.505 11.483 ( 1.120 0.850 -0.537) 1.505 11.835 ( -0.677 -1.243 -1.484) 2.051 11.835 ( -0.677 1.243 -1.484) 2.051 12.428 ( -2.803 -5.547 3.007) 6.904 12.428 ( -2.803 5.547 3.007) 6.904 12.569 ( 2.848 -4.540 -4.725) 7.145 12.569 ( 2.848 4.540 -4.725) 7.145 13.090 ( 1.072 -4.043 0.279) 4.192 13.090 ( 1.072 4.043 0.279) 4.192 13.227 ( -1.709 -0.424 0.177) 1.770 13.227 ( -1.709 0.424 0.177) 1.770 13.453 ( -0.007 -2.277 1.550) 2.754 13.453 ( -0.007 2.277 1.550) 2.754 13.724 ( 0.662 -0.802 -2.963) 3.141 13.724 ( 0.662 0.802 -2.963) 3.141 14.293 ( -1.011 -1.704 2.770) 3.406 14.293 ( -1.011 1.704 2.770) 3.406 14.663 ( -1.782 -1.613 0.598) 2.477 14.663 ( -1.782 1.613 0.598) 2.477 14.958 ( 2.532 -0.970 3.279) 4.255 14.958 ( 2.532 0.970 3.279) 4.255 15.143 ( -1.183 -0.045 -6.488) 6.595 15.143 ( -1.183 0.045 -6.488) 6.595 15.655 ( 1.630 -0.725 1.179) 2.139 15.655 ( 1.630 0.725 1.179) 2.139 15.963 ( -0.209 -1.970 0.284) 2.001 15.963 ( -0.209 1.970 0.284) 2.001 16.153 ( 0.556 -1.987 -0.808) 2.216 16.153 ( 0.556 1.987 -0.808) 2.216 16.488 ( -0.089 -2.264 1.439) 2.684 16.488 ( -0.089 2.264 1.439) 2.684 16.741 ( -0.840 -0.762 -1.528) 1.903 16.741 ( -0.840 0.762 -1.528) 1.903 17.098 ( -1.761 -1.224 -1.538) 2.639 17.098 ( -1.761 1.224 -1.538) 2.639 17.372 ( 0.938 -3.008 0.421) 3.179 17.372 ( 0.938 3.008 0.421) 3.179 17.862 ( -0.686 -1.442 -2.366) 2.855 17.862 ( -0.686 1.442 -2.366) 2.855 18.384 ( 0.308 -1.955 -0.230) 1.993 18.384 ( 0.308 1.955 -0.230) 1.993 18.909 ( 1.349 -1.851 1.338) 2.652 18.909 ( 1.349 1.851 1.338) 2.652 19.285 ( 0.390 -1.359 1.664) 2.184 19.285 ( 0.390 1.359 1.664) 2.184 20.249 ( -0.246 -2.009 1.765) 2.685 20.249 ( -0.246 2.009 1.765) 2.685 ======================= Grid point 179 (96/104) ======================= q-point: ( 0.10 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.937 ( 1.783 -9.321 5.656) 11.047 1.937 ( 1.783 9.321 5.656) 11.047 2.261 ( 8.311 -7.497 -5.864) 12.637 2.261 ( 8.311 7.497 -5.864) 12.637 2.388 ( 15.079 -10.611 -4.507) 18.981 2.388 ( 15.079 10.611 -4.507) 18.981 2.617 ( 2.597 -5.622 10.023) 11.782 2.617 ( 2.597 5.622 10.023) 11.782 2.959 ( 1.550 -2.159 1.349) 2.981 2.959 ( 1.550 2.159 1.349) 2.981 3.233 ( 3.915 -1.585 -0.256) 4.232 3.233 ( 3.915 1.585 -0.256) 4.232 3.353 ( -3.149 -2.503 -1.661) 4.352 3.353 ( -3.149 2.503 -1.661) 4.352 3.525 ( 1.559 -1.385 0.589) 2.168 3.525 ( 1.559 1.385 0.589) 2.168 3.764 ( 4.922 -4.420 -0.164) 6.617 3.764 ( 4.922 4.420 -0.164) 6.617 3.852 ( 6.709 -4.188 -0.133) 7.910 3.852 ( 6.709 4.188 -0.133) 7.910 4.065 ( 1.752 -6.259 -0.732) 6.541 4.065 ( 1.752 6.259 -0.732) 6.541 4.235 ( 3.560 -7.481 -3.745) 9.092 4.235 ( 3.560 7.481 -3.745) 9.092 4.365 ( -0.098 -2.125 0.211) 2.138 4.365 ( -0.098 2.125 0.211) 2.138 4.594 ( -0.937 -1.870 1.021) 2.328 4.594 ( -0.937 1.870 1.021) 2.328 4.792 ( -4.844 -3.927 -2.108) 6.582 4.792 ( -4.844 3.927 -2.108) 6.582 4.902 ( 0.949 -0.467 2.994) 3.176 4.902 ( 0.949 0.467 2.994) 3.176 5.329 ( -6.678 -5.456 -0.858) 8.666 5.329 ( -6.678 5.456 -0.858) 8.666 5.548 ( 0.901 -4.796 2.773) 5.613 5.548 ( 0.901 4.796 2.773) 5.613 5.887 ( -2.087 -2.533 -0.327) 3.298 5.887 ( -2.087 2.533 -0.327) 3.298 6.119 ( 2.389 -2.076 -1.061) 3.337 6.119 ( 2.389 2.076 -1.061) 3.337 6.416 ( -9.871 -7.878 -3.134) 13.013 6.416 ( -9.871 7.878 -3.134) 13.013 6.691 ( -0.924 -3.697 -3.880) 5.438 6.691 ( -0.924 3.697 -3.880) 5.438 6.986 ( -6.027 -4.527 8.208) 11.144 6.986 ( -6.027 4.527 8.208) 11.144 7.472 ( 2.919 -2.328 -2.394) 4.435 7.472 ( 2.919 2.328 -2.394) 4.435 7.770 ( -1.089 -3.322 2.465) 4.278 7.770 ( -1.089 3.322 2.465) 4.278 8.147 ( 10.846 -1.448 -4.898) 11.989 8.147 ( 10.846 1.448 -4.898) 11.989 8.648 ( -1.363 -1.772 0.783) 2.369 8.648 ( -1.363 1.772 0.783) 2.369 8.714 ( 2.874 -4.709 2.151) 5.921 8.714 ( 2.874 4.709 2.151) 5.921 9.115 ( -1.527 -5.321 -7.397) 9.239 9.115 ( -1.527 5.321 -7.397) 9.239 9.318 ( 7.158 -1.871 1.865) 7.630 9.318 ( 7.158 1.871 1.865) 7.630 9.687 ( 3.225 -4.582 0.999) 5.691 9.687 ( 3.225 4.582 0.999) 5.691 10.147 ( -7.399 -4.025 0.460) 8.435 10.147 ( -7.399 4.025 0.460) 8.435 10.315 ( -6.991 -5.634 3.205) 9.534 10.315 ( -6.991 5.634 3.205) 9.534 10.528 ( 2.745 -2.752 -0.619) 3.936 10.528 ( 2.745 2.752 -0.619) 3.936 10.868 ( 8.078 -4.760 1.177) 9.450 10.868 ( 8.078 4.760 1.177) 9.450 11.332 ( -0.434 -2.188 3.061) 3.787 11.332 ( -0.434 2.188 3.061) 3.787 11.421 ( -5.048 -2.459 -3.017) 6.374 11.421 ( -5.048 2.459 -3.017) 6.374 11.839 ( 0.904 -0.136 0.620) 1.104 11.839 ( 0.904 0.136 0.620) 1.104 12.356 ( -5.413 -5.095 2.601) 7.875 12.356 ( -5.413 5.095 2.601) 7.875 12.637 ( 5.073 -4.957 -2.927) 7.673 12.637 ( 5.073 4.957 -2.927) 7.673 13.021 ( -5.279 -1.137 -0.832) 5.463 13.021 ( -5.279 1.137 -0.832) 5.463 13.258 ( 1.817 -2.074 1.676) 3.227 13.258 ( 1.817 2.074 1.676) 3.227 13.436 ( -2.477 -1.613 0.544) 3.006 13.436 ( -2.477 1.613 0.544) 3.006 13.689 ( -2.091 -0.917 -1.615) 2.797 13.689 ( -2.091 0.917 -1.615) 2.797 14.287 ( -1.439 -2.315 1.961) 3.358 14.287 ( -1.439 2.315 1.961) 3.358 14.654 ( -1.334 -1.149 3.581) 3.990 14.654 ( -1.334 1.149 3.581) 3.990 14.918 ( -4.411 -1.034 -2.097) 4.992 14.918 ( -4.411 1.034 -2.097) 4.992 15.197 ( 6.966 -2.205 -1.497) 7.458 15.197 ( 6.966 2.205 -1.497) 7.458 15.630 ( -3.624 -4.300 -2.042) 5.983 15.630 ( -3.624 4.300 -2.042) 5.983 15.968 ( 0.718 -5.508 -0.326) 5.565 15.968 ( 0.718 5.508 -0.326) 5.565 16.116 ( -3.224 -5.433 -0.233) 6.322 16.116 ( -3.224 5.433 -0.233) 6.322 16.531 ( 3.975 -3.607 0.284) 5.375 16.531 ( 3.975 3.607 0.284) 5.375 16.777 ( 4.021 -2.592 0.527) 4.812 16.777 ( 4.021 2.592 0.527) 4.812 17.063 ( -2.141 -2.185 2.723) 4.096 17.063 ( -2.141 2.185 2.723) 4.096 17.408 ( 2.887 -2.415 -1.242) 3.963 17.408 ( 2.887 2.415 -1.242) 3.963 17.856 ( 0.392 -1.017 0.862) 1.390 17.856 ( 0.392 1.017 0.862) 1.390 18.338 ( -4.425 -5.997 -0.936) 7.512 18.338 ( -4.425 5.997 -0.936) 7.512 18.928 ( 0.507 -4.217 -1.827) 4.624 18.928 ( 0.507 4.217 -1.827) 4.624 19.361 ( 7.235 -2.144 -0.231) 7.550 19.361 ( 7.235 2.144 -0.231) 7.550 20.230 ( -2.555 -1.269 0.911) 2.995 20.230 ( -2.555 1.269 0.911) 2.995 ======================= Grid point 181 (97/104) ======================= q-point: ( 0.20 -0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.057 ( 6.785 -3.713 3.764) 8.602 2.057 ( 6.785 3.713 3.764) 8.602 2.337 ( 6.457 -4.291 -5.535) 9.526 2.337 ( 6.457 4.291 -5.535) 9.526 2.603 ( 11.870 -4.549 -6.791) 14.412 2.603 ( 11.870 4.549 -6.791) 14.412 2.794 ( 7.084 -3.183 3.313) 8.443 2.794 ( 7.084 3.183 3.313) 8.443 3.018 ( 0.047 -5.824 11.654) 13.028 3.018 ( 0.047 5.824 11.654) 13.028 3.274 ( 1.193 -1.356 -1.269) 2.207 3.274 ( 1.193 1.356 -1.269) 2.207 3.370 ( 7.790 -3.255 -0.563) 8.461 3.370 ( 7.790 3.255 -0.563) 8.461 3.561 ( 2.140 -0.485 2.252) 3.144 3.561 ( 2.140 0.485 2.252) 3.144 3.869 ( 4.940 -7.410 -4.891) 10.161 3.869 ( 4.940 7.410 -4.891) 10.161 3.976 ( 8.301 -6.442 -3.811) 11.177 3.976 ( 8.301 6.442 -3.811) 11.177 4.080 ( 5.132 -5.323 -6.096) 9.583 4.080 ( 5.132 5.323 -6.096) 9.583 4.327 ( 3.085 -7.551 2.506) 8.533 4.327 ( 3.085 7.551 2.506) 8.533 4.388 ( 3.387 -0.567 3.581) 4.962 4.388 ( 3.387 0.567 3.581) 4.962 4.577 ( -1.499 -3.338 1.265) 3.872 4.577 ( -1.499 3.338 1.265) 3.872 4.697 ( -3.051 -4.809 -2.496) 6.218 4.697 ( -3.051 4.809 -2.496) 6.218 4.931 ( -0.647 -1.110 3.681) 3.899 4.931 ( -0.647 1.110 3.681) 3.899 5.185 ( -7.579 -5.891 -1.164) 9.669 5.185 ( -7.579 5.891 -1.164) 9.669 5.571 ( -1.230 -5.914 4.231) 7.375 5.571 ( -1.230 5.914 4.231) 7.375 5.837 ( -1.811 -5.336 -2.525) 6.175 5.837 ( -1.811 5.336 -2.525) 6.175 6.102 ( -6.297 -5.526 -3.731) 9.171 6.102 ( -6.297 5.526 -3.731) 9.171 6.289 ( 1.200 -5.973 -0.074) 6.092 6.289 ( 1.200 5.973 -0.074) 6.092 6.554 ( -7.978 -4.190 -3.588) 9.700 6.554 ( -7.978 4.190 -3.588) 9.700 6.976 ( -2.475 -4.494 6.678) 8.422 6.976 ( -2.475 4.494 6.678) 8.422 7.499 ( 1.076 -4.425 0.173) 4.557 7.499 ( 1.076 4.425 0.173) 4.557 7.840 ( 5.807 -5.366 1.912) 8.134 7.840 ( 5.807 5.366 1.912) 8.134 8.259 ( 4.819 -1.622 -4.288) 6.651 8.259 ( 4.819 1.622 -4.288) 6.651 8.642 ( -0.493 -1.379 1.389) 2.018 8.642 ( -0.493 1.379 1.389) 2.018 8.777 ( 1.258 -6.170 2.191) 6.667 8.777 ( 1.258 6.170 2.191) 6.667 9.076 ( 4.141 -6.480 -6.580) 10.121 9.076 ( 4.141 6.480 -6.580) 10.121 9.463 ( 7.117 -3.529 0.853) 7.990 9.463 ( 7.117 3.529 0.853) 7.990 9.753 ( 1.815 -8.574 1.357) 8.868 9.753 ( 1.815 8.574 1.357) 8.868 10.008 ( -6.710 -3.917 0.132) 7.771 10.008 ( -6.710 3.917 0.132) 7.771 10.228 ( -5.065 -7.708 3.470) 9.854 10.228 ( -5.065 7.708 3.470) 9.854 10.559 ( 0.390 -3.374 -0.512) 3.435 10.559 ( 0.390 3.374 -0.512) 3.435 10.972 ( 1.566 -3.489 2.065) 4.347 10.972 ( 1.566 3.489 2.065) 4.347 11.286 ( -4.028 -2.362 -0.788) 4.735 11.286 ( -4.028 2.362 -0.788) 4.735 11.403 ( 4.506 -1.954 -1.453) 5.122 11.403 ( 4.506 1.954 -1.453) 5.122 11.851 ( -0.529 -0.774 0.898) 1.298 11.851 ( -0.529 0.774 0.898) 1.298 12.289 ( -3.628 -6.646 1.710) 7.762 12.289 ( -3.628 6.646 1.710) 7.762 12.640 ( -4.590 -5.676 -0.189) 7.302 12.640 ( -4.590 5.676 -0.189) 7.302 12.969 ( 1.379 -4.797 -1.692) 5.270 12.969 ( 1.379 4.797 -1.692) 5.270 13.263 ( -2.159 -4.250 -0.398) 4.784 13.263 ( -2.159 4.250 -0.398) 4.784 13.399 ( -1.159 -5.508 0.721) 5.675 13.399 ( -1.159 5.508 0.721) 5.675 13.650 ( -1.145 -1.001 -0.164) 1.530 13.650 ( -1.145 1.001 -0.164) 1.530 14.273 ( -1.609 -2.317 1.349) 3.127 14.273 ( -1.609 2.317 1.349) 3.127 14.635 ( -4.745 -2.482 4.665) 7.102 14.635 ( -4.745 2.482 4.665) 7.102 14.852 ( -0.487 -1.470 -1.787) 2.365 14.852 ( -0.487 1.470 -1.787) 2.365 15.278 ( 2.013 -2.548 -2.103) 3.869 15.278 ( 2.013 2.548 -2.103) 3.869 15.548 ( -2.191 -7.108 -1.575) 7.603 15.548 ( -2.191 7.108 -1.575) 7.603 15.934 ( -2.664 -6.388 -4.586) 8.303 15.934 ( -2.664 6.388 -4.586) 8.303 16.123 ( 2.715 -6.366 5.063) 8.575 16.123 ( 2.715 6.366 5.063) 8.575 16.614 ( 4.906 -5.665 -1.061) 7.569 16.614 ( 4.906 5.665 -1.061) 7.569 16.827 ( 0.711 -2.237 -0.636) 2.432 16.827 ( 0.711 2.237 -0.636) 2.432 17.074 ( 0.330 -0.996 4.928) 5.038 17.074 ( 0.330 0.996 4.928) 5.038 17.437 ( 0.878 -1.867 -1.427) 2.508 17.437 ( 0.878 1.867 -1.427) 2.508 17.870 ( -1.560 -3.309 2.954) 4.702 17.870 ( -1.560 3.309 2.954) 4.702 18.245 ( -3.829 -11.486 -0.421) 12.115 18.245 ( -3.829 11.486 -0.421) 12.115 18.897 ( -1.305 -7.996 -4.194) 9.123 18.897 ( -1.305 7.996 -4.194) 9.123 19.529 ( 11.131 -2.809 -1.110) 11.534 19.529 ( 11.131 2.809 -1.110) 11.534 20.193 ( -1.425 -1.364 0.193) 1.982 20.193 ( -1.425 1.364 0.193) 1.982 ======================= Grid point 183 (98/104) ======================= q-point: ( 0.30 -0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.206 ( 7.498 -3.937 0.330) 8.476 2.206 ( 7.498 3.937 0.330) 8.476 2.459 ( 8.780 -3.132 0.502) 9.336 2.459 ( 8.780 3.132 0.502) 9.336 2.687 ( 2.909 -0.874 -5.017) 5.865 2.687 ( 2.909 0.874 -5.017) 5.865 2.902 ( 5.202 -6.796 0.625) 8.581 2.902 ( 5.202 6.796 0.625) 8.581 3.123 ( 2.529 -5.163 8.426) 10.200 3.123 ( 2.529 5.163 8.426) 10.200 3.342 ( 5.181 -2.279 2.222) 6.081 3.342 ( 5.181 2.279 2.222) 6.081 3.476 ( 2.909 -7.840 1.101) 8.434 3.476 ( 2.909 7.840 1.101) 8.434 3.648 ( 4.038 -2.181 1.192) 4.742 3.648 ( 4.038 2.181 1.192) 4.742 3.854 ( -0.576 -2.503 -4.564) 5.237 3.854 ( -0.576 2.503 -4.564) 5.237 4.028 ( 1.138 -2.939 -2.654) 4.121 4.028 ( 1.138 2.939 -2.654) 4.121 4.219 ( 9.045 -6.004 -3.081) 11.285 4.219 ( 9.045 6.004 -3.081) 11.285 4.372 ( 4.080 -3.286 -0.551) 5.267 4.372 ( 4.080 3.286 -0.551) 5.267 4.444 ( -2.385 -1.952 3.039) 4.328 4.444 ( -2.385 1.952 3.039) 4.328 4.602 ( 2.377 -2.571 -0.547) 3.544 4.602 ( 2.377 2.571 -0.547) 3.544 4.672 ( 1.973 -2.787 -1.303) 3.655 4.672 ( 1.973 2.787 -1.303) 3.655 4.930 ( -1.330 -2.732 1.910) 3.590 4.930 ( -1.330 2.732 1.910) 3.590 5.069 ( -3.500 -3.181 -0.049) 4.730 5.069 ( -3.500 3.181 -0.049) 4.730 5.568 ( -1.899 -7.904 2.168) 8.413 5.568 ( -1.899 7.904 2.168) 8.413 5.793 ( -0.359 -5.689 -3.369) 6.621 5.793 ( -0.359 5.689 -3.369) 6.621 5.939 ( -6.234 -5.959 -1.415) 8.739 5.939 ( -6.234 5.959 -1.415) 8.739 6.357 ( -1.774 -1.257 -0.665) 2.274 6.357 ( -1.774 1.257 -0.665) 2.274 6.421 ( 1.008 -4.372 -1.290) 4.668 6.421 ( 1.008 4.372 -1.290) 4.668 6.980 ( -1.018 -3.818 3.924) 5.569 6.980 ( -1.018 3.818 3.924) 5.569 7.519 ( 0.686 -4.856 0.779) 4.966 7.519 ( 0.686 4.856 0.779) 4.966 7.966 ( 5.902 -4.079 1.822) 7.402 7.966 ( 5.902 4.079 1.822) 7.402 8.275 ( 1.009 -2.934 -4.329) 5.327 8.275 ( 1.009 2.934 -4.329) 5.327 8.631 ( -0.700 -1.022 -1.305) 1.800 8.631 ( -0.700 1.022 -1.305) 1.800 8.801 ( 0.870 -3.136 1.161) 3.455 8.801 ( 0.870 3.136 1.161) 3.455 9.158 ( 5.895 -4.847 0.258) 7.636 9.158 ( 5.895 4.847 0.258) 7.636 9.563 ( 3.079 -3.342 -0.939) 4.640 9.563 ( 3.079 3.342 -0.939) 4.640 9.731 ( -3.858 -8.809 -0.068) 9.617 9.731 ( -3.858 8.809 -0.068) 9.617 9.954 ( -0.452 -2.020 2.507) 3.251 9.954 ( -0.452 2.020 2.507) 3.251 10.186 ( -2.088 -6.926 2.735) 7.734 10.186 ( -2.088 6.926 2.735) 7.734 10.513 ( -5.336 -1.742 0.987) 5.699 10.513 ( -5.336 1.742 0.987) 5.699 11.003 ( 1.350 -2.865 2.799) 4.227 11.003 ( 1.350 2.865 2.799) 4.227 11.256 ( 0.744 -3.943 0.142) 4.015 11.256 ( 0.744 3.943 0.142) 4.015 11.463 ( 3.409 -0.622 -4.678) 5.822 11.463 ( 3.409 0.622 -4.678) 5.822 11.832 ( -1.464 -2.620 -0.897) 3.132 11.832 ( -1.464 2.620 -0.897) 3.132 12.247 ( -2.126 -7.295 0.505) 7.616 12.247 ( -2.126 7.295 0.505) 7.616 12.502 ( -9.143 -7.655 0.602) 11.939 12.502 ( -9.143 7.655 0.602) 11.939 13.006 ( 2.267 -5.168 -0.842) 5.706 13.006 ( 2.267 5.168 -0.842) 5.706 13.212 ( -1.500 -2.768 -1.932) 3.694 13.212 ( -1.500 2.768 -1.932) 3.694 13.395 ( -0.371 -3.459 0.065) 3.479 13.395 ( -0.371 3.459 0.065) 3.479 13.648 ( 1.075 -1.926 0.040) 2.207 13.648 ( 1.075 1.926 0.040) 2.207 14.246 ( -2.354 -2.151 1.772) 3.648 14.246 ( -2.354 2.151 1.772) 3.648 14.553 ( -7.063 -3.807 3.405) 8.716 14.553 ( -7.063 3.807 3.405) 8.716 14.874 ( 2.729 -2.537 0.859) 3.824 14.874 ( 2.729 2.537 0.859) 3.824 15.244 ( -2.111 -4.234 -2.972) 5.587 15.244 ( -2.111 4.234 -2.972) 5.587 15.547 ( 1.816 -7.176 -0.292) 7.408 15.547 ( 1.816 7.176 -0.292) 7.408 15.846 ( -3.345 -4.759 -3.734) 6.912 15.846 ( -3.345 4.759 -3.734) 6.912 16.248 ( 6.219 -5.391 5.137) 9.702 16.248 ( 6.219 5.391 5.137) 9.702 16.671 ( 1.424 -5.879 -1.069) 6.143 16.671 ( 1.424 5.879 -1.069) 6.143 16.819 ( 0.156 -0.544 0.216) 0.606 16.819 ( 0.156 0.544 0.216) 0.606 17.125 ( 1.897 -2.227 2.081) 3.590 17.125 ( 1.897 2.227 2.081) 3.590 17.411 ( -3.166 -0.843 -0.205) 3.282 17.411 ( -3.166 0.843 -0.205) 3.282 17.806 ( -5.745 -7.851 -1.108) 9.791 17.806 ( -5.745 7.851 -1.108) 9.791 18.239 ( 1.115 -14.908 5.347) 15.878 18.239 ( 1.115 14.908 5.347) 15.878 18.832 ( -1.649 -10.552 -5.858) 12.181 18.832 ( -1.649 10.552 -5.858) 12.181 19.718 ( 9.896 -1.624 -0.994) 10.077 19.718 ( 9.896 1.624 -0.994) 10.077 20.187 ( 0.686 -2.072 -0.458) 2.230 20.187 ( 0.686 2.072 -0.458) 2.230 ======================= Grid point 185 (99/104) ======================= q-point: ( 0.40 -0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.316 ( 4.372 -2.030 -1.251) 4.980 2.316 ( 4.372 2.030 -1.251) 4.980 2.613 ( 5.128 -2.755 2.156) 6.208 2.613 ( 5.128 2.755 2.156) 6.208 2.717 ( 3.891 -2.721 1.056) 4.864 2.717 ( 3.891 2.721 1.056) 4.864 3.004 ( 4.235 -4.410 3.987) 7.299 3.004 ( 4.235 4.410 3.987) 7.299 3.217 ( 3.096 -2.212 3.640) 5.265 3.217 ( 3.096 2.212 3.640) 5.265 3.412 ( 0.339 -2.575 -1.828) 3.176 3.412 ( 0.339 2.575 -1.828) 3.176 3.526 ( 1.948 -5.740 -1.819) 6.329 3.526 ( 1.948 5.740 -1.819) 6.329 3.690 ( 2.386 -3.224 0.403) 4.032 3.690 ( 2.386 3.224 0.403) 4.032 3.816 ( -1.340 -0.926 0.224) 1.644 3.816 ( -1.340 0.926 0.224) 1.644 4.015 ( -1.671 -5.515 -0.869) 5.828 4.015 ( -1.671 5.515 -0.869) 5.828 4.276 ( -0.200 -1.950 2.793) 3.413 4.276 ( -0.200 1.950 2.793) 3.413 4.400 ( -2.531 -3.843 2.423) 5.201 4.400 ( -2.531 3.843 2.423) 5.201 4.505 ( 6.675 -4.218 -2.233) 8.206 4.505 ( 6.675 4.218 -2.233) 8.206 4.588 ( -1.054 -3.830 -2.711) 4.809 4.588 ( -1.054 3.830 -2.711) 4.809 4.680 ( 0.334 -2.303 -1.549) 2.795 4.680 ( 0.334 2.303 -1.549) 2.795 4.916 ( -0.534 -2.513 -1.849) 3.165 4.916 ( -0.534 2.513 -1.849) 3.165 5.081 ( 2.304 -1.898 2.536) 3.917 5.081 ( 2.304 1.898 2.536) 3.917 5.514 ( -3.169 -6.907 -2.589) 8.029 5.514 ( -3.169 6.907 -2.589) 8.029 5.809 ( 4.243 -1.484 -4.163) 6.127 5.809 ( 4.243 1.484 -4.163) 6.127 5.879 ( -2.214 -2.189 5.056) 5.937 5.879 ( -2.214 2.189 5.056) 5.937 6.233 ( -5.509 -0.892 -3.389) 6.529 6.233 ( -5.509 0.892 -3.389) 6.529 6.524 ( 5.638 -0.871 0.604) 5.736 6.524 ( 5.638 0.871 0.604) 5.736 6.999 ( 0.405 -3.628 2.595) 4.479 6.999 ( 0.405 3.628 2.595) 4.479 7.529 ( -0.156 -4.208 0.181) 4.215 7.529 ( -0.156 4.208 0.181) 4.215 8.056 ( 2.305 -2.160 0.706) 3.236 8.056 ( 2.305 2.160 0.706) 3.236 8.254 ( 0.526 -3.451 -4.087) 5.375 8.254 ( 0.526 3.451 -4.087) 5.375 8.616 ( 0.847 -2.120 -2.296) 3.238 8.616 ( 0.847 2.120 -2.296) 3.238 8.822 ( -0.027 -2.725 1.728) 3.227 8.822 ( -0.027 2.725 1.728) 3.227 9.256 ( 3.639 -4.724 1.995) 6.288 9.256 ( 3.639 4.724 1.995) 6.288 9.551 ( -3.068 -1.069 2.018) 3.824 9.551 ( -3.068 1.069 2.018) 3.824 9.688 ( -0.073 -3.272 -2.558) 4.154 9.688 ( -0.073 3.272 -2.558) 4.154 9.983 ( 0.811 -1.060 3.274) 3.535 9.983 ( 0.811 1.060 3.274) 3.535 10.177 ( -0.935 -4.178 1.251) 4.461 10.177 ( -0.935 4.178 1.251) 4.461 10.425 ( -4.526 -1.822 2.394) 5.434 10.425 ( -4.526 1.822 2.394) 5.434 11.063 ( 2.815 -3.414 2.407) 5.037 11.063 ( 2.815 3.414 2.407) 5.037 11.281 ( -0.889 -3.152 2.097) 3.889 11.281 ( -0.889 3.152 2.097) 3.889 11.468 ( 3.144 -1.797 -6.012) 7.019 11.468 ( 3.144 1.797 -6.012) 7.019 11.784 ( -1.928 -3.359 -3.947) 5.530 11.784 ( -1.928 3.359 -3.947) 5.530 12.218 ( -1.327 -6.011 0.148) 6.158 12.218 ( -1.327 6.011 0.148) 6.158 12.362 ( -5.984 -6.853 0.604) 9.118 12.362 ( -5.984 6.853 0.604) 9.118 13.029 ( 0.691 -2.102 0.843) 2.368 13.029 ( 0.691 2.102 0.843) 2.368 13.175 ( -1.554 -1.574 -2.233) 3.144 13.175 ( -1.554 1.574 -2.233) 3.144 13.380 ( -0.222 -2.569 -2.018) 3.275 13.380 ( -0.222 2.569 -2.018) 3.275 13.689 ( 2.629 -2.281 0.771) 3.565 13.689 ( 2.629 2.281 0.771) 3.565 14.230 ( -0.942 -1.087 3.023) 3.348 14.230 ( -0.942 1.087 3.023) 3.348 14.443 ( -6.160 -3.716 0.993) 7.263 14.443 ( -6.160 3.716 0.993) 7.263 14.937 ( 1.735 -3.444 3.282) 5.064 14.937 ( 1.735 3.444 3.282) 5.064 15.203 ( 0.484 -5.374 -3.212) 6.280 15.203 ( 0.484 5.374 -3.212) 6.280 15.579 ( 1.423 -6.034 -0.096) 6.200 15.579 ( 1.423 6.034 -0.096) 6.200 15.766 ( -2.633 -2.623 -2.673) 4.577 15.766 ( -2.633 2.623 -2.673) 4.577 16.395 ( 5.764 -4.043 3.543) 7.882 16.395 ( 5.764 4.043 3.543) 7.882 16.650 ( -2.097 -4.918 -0.126) 5.348 16.650 ( -2.097 4.918 -0.126) 5.348 16.863 ( 2.963 -2.296 2.949) 4.770 16.863 ( 2.963 2.296 2.949) 4.770 17.150 ( 0.377 -1.264 -3.044) 3.317 17.150 ( 0.377 1.264 -3.044) 3.317 17.333 ( -4.936 -1.004 1.957) 5.404 17.333 ( -4.936 1.004 1.957) 5.404 17.695 ( -3.717 -6.746 -3.369) 8.407 17.695 ( -3.717 6.746 -3.369) 8.407 18.326 ( 2.070 -13.996 8.724) 16.622 18.326 ( 2.070 13.996 8.724) 16.622 18.759 ( -1.154 -11.415 -7.224) 13.559 18.759 ( -1.154 11.415 -7.224) 13.559 19.855 ( 5.546 -0.399 -0.429) 5.577 19.855 ( 5.546 0.399 -0.429) 5.577 20.199 ( 0.821 -1.858 -0.997) 2.263 20.199 ( 0.821 1.858 -0.997) 2.263 ======================= Grid point 187 (100/104) ======================= q-point: (-0.50 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.338 ( -0.891 -0.803 -0.558) 1.323 2.338 ( -0.891 0.803 -0.558) 1.323 2.663 ( -0.830 -0.986 2.223) 2.570 2.663 ( -0.830 0.986 2.223) 2.570 2.794 ( 0.782 -2.505 1.454) 3.000 2.794 ( 0.782 2.505 1.454) 3.000 3.120 ( 4.828 -1.462 4.061) 6.475 3.120 ( 4.828 1.462 4.061) 6.475 3.266 ( -1.504 -1.429 2.615) 3.338 3.266 ( -1.504 1.429 2.615) 3.338 3.351 ( -1.781 -1.535 -4.381) 4.972 3.351 ( -1.781 1.535 -4.381) 4.972 3.505 ( -1.116 -2.092 -2.029) 3.120 3.505 ( -1.116 2.092 -2.029) 3.120 3.715 ( -1.353 -0.522 0.561) 1.555 3.715 ( -1.353 0.522 0.561) 1.555 3.875 ( 5.256 -5.636 3.302) 8.384 3.875 ( 5.256 5.636 3.302) 8.384 3.945 ( -3.154 -6.928 -3.085) 8.213 3.945 ( -3.154 6.928 -3.085) 8.213 4.281 ( -4.175 -1.418 6.846) 8.143 4.281 ( -4.175 1.418 6.846) 8.143 4.406 ( 0.954 -3.680 -0.114) 3.803 4.406 ( 0.954 3.680 -0.114) 3.803 4.463 ( -1.185 -5.706 0.131) 5.829 4.463 ( -1.185 5.706 0.131) 5.829 4.654 ( 0.386 -1.646 -5.233) 5.500 4.654 ( 0.386 1.646 -5.233) 5.500 4.669 ( 4.239 -2.275 -1.613) 5.074 4.669 ( 4.239 2.275 -1.613) 5.074 4.888 ( -0.710 -2.502 -1.983) 3.271 4.888 ( -0.710 2.502 -1.983) 3.271 5.125 ( -0.511 -1.381 3.538) 3.832 5.125 ( -0.511 1.381 3.538) 3.832 5.463 ( 0.777 -3.589 -3.791) 5.278 5.463 ( 0.777 3.589 -3.791) 5.278 5.792 ( -3.882 -1.342 1.213) 4.283 5.792 ( -3.882 1.342 1.213) 4.283 5.949 ( 5.739 -2.729 0.095) 6.355 5.949 ( 5.739 2.729 0.095) 6.355 6.143 ( -1.979 -0.611 -2.272) 3.074 6.143 ( -1.979 0.611 -2.272) 3.074 6.588 ( 0.480 -0.606 0.006) 0.773 6.588 ( 0.480 0.606 0.006) 0.773 7.018 ( -0.567 -3.512 2.071) 4.117 7.018 ( -0.567 3.512 2.071) 4.117 7.522 ( -0.383 -2.042 0.350) 2.107 7.522 ( -0.383 2.042 0.350) 2.107 8.057 ( -1.336 -1.369 -0.477) 1.971 8.057 ( -1.336 1.369 -0.477) 1.971 8.240 ( -0.601 -2.090 -0.656) 2.271 8.240 ( -0.601 2.090 -0.656) 2.271 8.628 ( 2.319 -2.151 -3.525) 4.736 8.628 ( 2.319 2.151 -3.525) 4.736 8.829 ( 0.232 -2.201 0.887) 2.384 8.829 ( 0.232 2.201 0.887) 2.384 9.313 ( 1.985 -1.301 -0.469) 2.420 9.313 ( 1.985 1.301 -0.469) 2.420 9.538 ( -1.148 -0.988 5.212) 5.428 9.538 ( -1.148 0.988 5.212) 5.428 9.659 ( -1.117 -0.792 -2.707) 3.034 9.659 ( -1.117 0.792 -2.707) 3.034 10.025 ( 1.766 -0.835 1.442) 2.428 10.025 ( 1.766 0.835 1.442) 2.428 10.165 ( -0.762 -1.753 0.426) 1.958 10.165 ( -0.762 1.753 0.426) 1.958 10.403 ( 0.302 -1.908 1.777) 2.625 10.403 ( 0.302 1.908 1.777) 2.625 11.129 ( 0.162 -1.092 5.538) 5.647 11.129 ( 0.162 1.092 5.538) 5.647 11.227 ( -2.277 -2.381 -2.266) 3.999 11.227 ( -2.277 2.381 -2.266) 3.999 11.503 ( 1.227 -0.604 -2.864) 3.173 11.503 ( 1.227 0.604 -2.864) 3.173 11.723 ( -0.074 -2.034 -4.157) 4.629 11.723 ( -0.074 2.034 -4.157) 4.629 12.199 ( -1.332 -3.223 1.347) 3.739 12.199 ( -1.332 3.223 1.347) 3.739 12.315 ( 1.005 -3.262 -0.530) 3.454 12.315 ( 1.005 3.262 -0.530) 3.454 13.050 ( -0.015 -1.744 2.052) 2.693 13.050 ( -0.015 1.744 2.052) 2.693 13.130 ( -0.400 -1.148 -2.570) 2.843 13.130 ( -0.400 1.148 -2.570) 2.843 13.363 ( -0.366 -1.259 -1.260) 1.818 13.363 ( -0.366 1.259 -1.260) 1.818 13.723 ( -0.233 -0.568 0.862) 1.059 13.723 ( -0.233 0.568 0.862) 1.059 14.249 ( -0.481 -0.732 3.507) 3.615 14.249 ( -0.481 0.732 3.507) 3.615 14.384 ( 1.475 -0.571 -1.859) 2.441 14.384 ( 1.475 0.571 -1.859) 2.441 14.959 ( -2.691 -2.902 4.843) 6.254 14.959 ( -2.691 2.902 4.843) 6.254 15.212 ( 3.108 -3.703 -4.639) 6.700 15.212 ( 3.108 3.703 -4.639) 6.700 15.589 ( -0.411 -4.057 0.370) 4.094 15.589 ( -0.411 4.057 0.370) 4.094 15.726 ( 0.237 -1.409 -1.857) 2.343 15.726 ( 0.237 1.409 -1.857) 2.343 16.467 ( -0.651 -3.019 1.899) 3.625 16.467 ( -0.651 3.019 1.899) 3.625 16.637 ( 1.372 -0.986 -0.301) 1.716 16.637 ( 1.372 0.986 -0.301) 1.716 16.952 ( 2.607 -4.512 6.349) 8.214 16.952 ( 2.607 4.512 6.349) 8.214 17.069 ( -5.062 -2.693 -5.302) 7.809 17.069 ( -5.062 2.693 -5.302) 7.809 17.314 ( 1.726 -2.229 0.805) 2.932 17.314 ( 1.726 2.229 0.805) 2.932 17.636 ( -0.688 -3.429 -1.953) 4.006 17.636 ( -0.688 3.429 -1.953) 4.006 18.421 ( 1.302 -10.340 8.021) 13.151 18.421 ( 1.302 10.340 8.021) 13.151 18.690 ( -0.458 -9.616 -7.524) 12.218 18.690 ( -0.458 9.616 -7.524) 12.218 19.905 ( -0.022 -0.669 -0.058) 0.672 19.905 ( -0.022 0.669 -0.058) 0.672 20.196 ( -0.402 -0.556 -0.613) 0.920 20.196 ( -0.402 0.556 -0.613) 0.920 ======================= Grid point 189 (101/104) ======================= q-point: (-0.40 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.287 ( -5.017 -4.388 1.433) 6.818 2.287 ( -5.017 4.388 1.433) 6.818 2.600 ( -8.385 -6.339 2.432) 10.789 2.600 ( -8.385 6.339 2.432) 10.789 2.760 ( -2.844 -4.876 -1.993) 5.986 2.760 ( -2.844 4.876 -1.993) 5.986 3.101 ( -5.802 -3.812 -5.458) 8.831 3.101 ( -5.802 3.812 -5.458) 8.831 3.270 ( -1.414 -3.007 1.743) 3.753 3.270 ( -1.414 3.007 1.743) 3.753 3.342 ( 1.906 -0.560 2.807) 3.438 3.342 ( 1.906 0.560 2.807) 3.438 3.494 ( 0.001 -4.793 0.753) 4.852 3.494 ( 0.001 4.793 0.753) 4.852 3.679 ( -2.941 -3.886 1.741) 5.175 3.679 ( -2.941 3.886 1.741) 5.175 3.827 ( -4.848 -2.756 -0.433) 5.593 3.827 ( -4.848 2.756 -0.433) 5.593 4.023 ( 5.896 -4.621 -2.012) 7.757 4.023 ( 5.896 4.621 -2.012) 7.757 4.213 ( -6.464 -4.981 3.924) 9.055 4.213 ( -6.464 4.981 3.924) 9.055 4.397 ( -2.329 -5.448 4.484) 7.430 4.397 ( -2.330 5.448 4.484) 7.430 4.540 ( 1.739 -2.808 1.595) 3.668 4.540 ( 1.739 2.808 1.595) 3.668 4.581 ( 1.042 -1.606 -5.314) 5.648 4.581 ( 1.042 1.606 -5.314) 5.648 4.706 ( 1.233 -2.989 -5.236) 6.153 4.706 ( 1.233 2.989 -5.236) 6.153 4.879 ( 0.557 -3.568 0.946) 3.733 4.879 ( 0.557 3.568 0.946) 3.733 5.109 ( -2.476 -2.044 0.811) 3.312 5.109 ( -2.476 2.044 0.811) 3.312 5.490 ( 3.548 -2.574 -0.695) 4.439 5.490 ( 3.548 2.574 -0.695) 4.439 5.733 ( -3.356 -0.226 2.535) 4.212 5.733 ( -3.356 0.226 2.535) 4.212 6.015 ( 3.108 -3.143 -7.269) 8.508 6.015 ( 3.108 3.143 -7.269) 8.508 6.157 ( 4.076 -2.489 3.755) 6.075 6.157 ( 4.076 2.489 3.755) 6.075 6.541 ( -4.508 -1.673 -0.959) 4.903 6.541 ( -4.508 1.673 -0.959) 4.903 7.005 ( -2.093 -3.155 2.063) 4.311 7.005 ( -2.093 3.155 2.063) 4.311 7.525 ( 0.227 -2.465 0.347) 2.499 7.525 ( 0.227 2.465 0.347) 2.499 8.030 ( -1.980 -2.750 1.723) 3.802 8.030 ( -1.980 2.750 1.723) 3.802 8.221 ( -1.253 -2.760 0.652) 3.100 8.221 ( -1.253 2.760 0.652) 3.100 8.631 ( 0.888 -3.188 -3.716) 4.976 8.631 ( 0.888 3.188 -3.716) 4.976 8.846 ( 1.076 -1.456 -0.722) 1.949 8.846 ( 1.076 1.456 -0.722) 1.949 9.315 ( -0.563 -6.079 -3.859) 7.222 9.315 ( -0.563 6.079 -3.859) 7.222 9.544 ( -2.374 -1.044 2.801) 3.817 9.544 ( -2.374 1.044 2.801) 3.817 9.645 ( 1.296 -1.656 1.688) 2.696 9.645 ( 1.296 1.656 1.688) 2.696 10.049 ( 0.567 -3.175 -2.277) 3.948 10.049 ( 0.567 3.175 -2.277) 3.948 10.173 ( 1.129 -2.198 1.286) 2.785 10.173 ( 1.129 2.198 1.286) 2.785 10.451 ( 4.159 -1.556 -0.098) 4.441 10.451 ( 4.159 1.556 -0.098) 4.441 11.089 ( -4.406 -0.850 1.663) 4.786 11.089 ( -4.406 0.850 1.663) 4.786 11.272 ( 3.898 -1.975 3.997) 5.922 11.272 ( 3.898 1.975 3.997) 5.922 11.410 ( -7.364 -3.720 -3.475) 8.952 11.410 ( -7.364 3.720 -3.475) 8.952 11.753 ( 4.187 -3.291 -1.144) 5.447 11.753 ( 4.187 3.291 -1.144) 5.447 12.197 ( 0.017 -4.696 1.956) 5.088 12.197 ( 0.017 4.696 1.956) 5.088 12.384 ( 6.860 -6.070 -1.205) 9.239 12.384 ( 6.860 6.070 -1.205) 9.239 13.034 ( -2.176 -1.343 0.518) 2.608 13.034 ( -2.176 1.343 0.518) 2.608 13.153 ( 2.912 -2.830 -0.295) 4.072 13.153 ( 2.912 2.830 -0.295) 4.072 13.351 ( -0.375 -2.665 0.554) 2.747 13.351 ( -0.375 2.665 0.554) 2.747 13.692 ( -3.115 -2.499 0.527) 4.028 13.692 ( -3.115 2.499 0.527) 4.028 14.254 ( 0.252 -2.425 0.655) 2.525 14.254 ( 0.252 2.425 0.655) 2.525 14.472 ( 7.930 -3.166 -1.544) 8.677 14.472 ( 7.930 3.166 -1.544) 8.677 14.914 ( -5.758 -3.326 4.835) 8.222 14.914 ( -5.758 3.326 4.835) 8.222 15.237 ( 3.824 -4.248 -5.845) 8.175 15.237 ( 3.824 4.248 -5.845) 8.175 15.574 ( -1.518 -1.990 0.605) 2.574 15.574 ( -1.518 1.990 0.605) 2.574 15.745 ( 2.546 -5.080 -0.716) 5.727 15.745 ( 2.546 5.080 -0.716) 5.727 16.421 ( -4.811 -4.501 1.064) 6.674 16.421 ( -4.811 4.501 1.064) 6.674 16.671 ( 2.392 -4.023 -1.806) 5.017 16.671 ( 2.392 4.023 -1.806) 5.017 16.913 ( -6.510 -1.707 -2.215) 7.085 16.913 ( -6.510 1.707 -2.215) 7.085 17.054 ( 1.587 -3.924 5.893) 7.255 17.054 ( 1.587 3.924 5.893) 7.255 17.380 ( 5.098 -3.286 -1.949) 6.371 17.380 ( 5.098 3.286 -1.949) 6.371 17.649 ( 3.083 -2.441 0.840) 4.021 17.649 ( 3.083 2.441 0.840) 4.021 18.459 ( -1.157 -3.006 -0.135) 3.224 18.459 ( -1.157 3.006 -0.135) 3.224 18.659 ( 1.466 -2.580 -1.435) 3.296 18.659 ( 1.466 2.580 -1.435) 3.296 19.850 ( -5.967 -1.258 0.036) 6.098 19.850 ( -5.967 1.258 0.036) 6.098 20.180 ( -1.204 -1.279 0.598) 1.855 20.180 ( -1.204 1.279 0.598) 1.855 ======================= Grid point 191 (102/104) ======================= q-point: (-0.30 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.185 ( -7.134 -8.779 2.272) 11.538 2.185 ( -7.134 8.779 2.272) 11.538 2.416 ( -13.081 -10.088 3.348) 16.855 2.416 ( -13.081 10.088 3.348) 16.855 2.692 ( -2.754 -3.592 -3.395) 5.658 2.692 ( -2.754 3.592 -3.395) 5.658 2.933 ( -8.872 -6.284 -2.469) 11.149 2.933 ( -8.872 6.284 -2.469) 11.149 3.228 ( -1.736 -1.906 -2.417) 3.534 3.228 ( -1.736 1.906 -2.417) 3.534 3.355 ( -3.732 -4.271 1.300) 5.819 3.355 ( -3.732 4.271 1.300) 5.819 3.487 ( -2.469 -5.854 1.222) 6.470 3.487 ( -2.469 5.854 1.222) 6.470 3.643 ( -2.805 -7.594 2.830) 8.576 3.643 ( -2.805 7.594 2.830) 8.576 3.776 ( -2.151 -4.335 2.210) 5.320 3.776 ( -2.151 4.335 2.210) 5.320 4.033 ( -2.693 -4.655 -1.763) 5.659 4.033 ( -2.693 4.655 -1.763) 5.659 4.088 ( -10.570 -7.363 2.335) 13.091 4.088 ( -10.570 7.363 2.335) 13.091 4.366 ( -2.903 -2.513 0.920) 3.948 4.366 ( -2.903 2.513 0.920) 3.948 4.523 ( -0.481 -5.385 1.775) 5.691 4.523 ( -0.481 5.385 1.775) 5.691 4.616 ( 0.940 -1.338 -3.299) 3.682 4.616 ( 0.940 1.338 -3.299) 3.682 4.676 ( 0.619 -3.289 -3.539) 4.871 4.676 ( 0.619 3.289 -3.539) 4.871 4.931 ( 3.790 -1.285 1.673) 4.338 4.931 ( 3.790 1.285 1.673) 4.338 5.087 ( 1.390 -0.576 -1.502) 2.126 5.087 ( 1.390 0.576 -1.502) 2.126 5.563 ( 2.856 -3.808 3.387) 5.842 5.563 ( 2.856 3.808 3.387) 5.842 5.721 ( 0.938 -2.802 0.603) 3.016 5.721 ( 0.938 2.802 0.603) 3.016 6.011 ( 3.594 -4.383 -6.407) 8.555 6.011 ( 3.594 4.383 -6.407) 8.555 6.301 ( 7.448 -3.398 3.675) 8.974 6.301 ( 7.448 3.398 3.675) 8.974 6.441 ( -4.680 -2.392 -1.939) 5.602 6.441 ( -4.680 2.392 -1.939) 5.602 6.996 ( -0.310 -3.411 2.573) 4.284 6.996 ( -0.310 3.411 2.573) 4.284 7.525 ( -0.241 -5.150 -0.841) 5.224 7.525 ( -0.241 5.150 -0.841) 5.224 7.996 ( -3.067 -3.149 0.150) 4.399 7.996 ( -3.067 3.149 0.150) 4.399 8.210 ( -1.067 -1.236 1.875) 2.486 8.210 ( -1.067 1.236 1.875) 2.486 8.628 ( 1.467 -2.365 -1.074) 2.983 8.628 ( 1.467 2.365 -1.074) 2.983 8.834 ( -1.372 -1.991 -2.541) 3.508 8.834 ( -1.372 1.991 -2.541) 3.508 9.221 ( -5.835 -5.697 -5.691) 9.944 9.221 ( -5.835 5.697 -5.691) 9.944 9.522 ( -2.375 -2.612 3.072) 4.680 9.522 ( -2.375 2.612 3.072) 4.680 9.710 ( 3.537 -6.738 2.137) 7.904 9.710 ( 3.537 6.738 2.137) 7.904 10.016 ( -1.477 -2.531 -2.965) 4.169 10.016 ( -1.477 2.531 -2.965) 4.169 10.215 ( 2.863 -5.566 0.074) 6.260 10.215 ( 2.863 5.566 0.074) 6.260 10.528 ( 3.541 -3.243 -0.618) 4.841 10.528 ( 3.541 3.243 -0.618) 4.841 11.054 ( 0.551 -1.779 -1.145) 2.187 11.054 ( 0.551 1.779 -1.145) 2.187 11.245 ( -8.582 -2.999 1.830) 9.274 11.245 ( -8.582 2.999 1.830) 9.274 11.361 ( 1.928 -1.803 3.475) 4.364 11.361 ( 1.928 1.803 3.475) 4.364 11.823 ( 3.742 -3.522 -0.326) 5.149 11.823 ( 3.742 3.522 -0.326) 5.149 12.229 ( 1.924 -6.235 1.974) 6.817 12.229 ( 1.924 6.235 1.974) 6.817 12.531 ( 10.104 -8.735 -1.792) 13.476 12.531 ( 10.104 8.735 -1.792) 13.476 12.988 ( -3.619 -4.066 0.657) 5.483 12.988 ( -3.619 4.066 0.657) 5.483 13.195 ( 2.154 -2.344 -0.262) 3.194 13.195 ( 2.154 2.344 -0.262) 3.194 13.370 ( 1.030 -2.507 2.128) 3.446 13.370 ( 1.030 2.507 2.128) 3.446 13.649 ( -1.117 -3.283 0.043) 3.468 13.649 ( -1.117 3.283 0.043) 3.468 14.276 ( 1.988 -4.185 -0.845) 4.710 14.276 ( 1.988 4.185 -0.845) 4.710 14.596 ( 5.542 -3.214 -0.554) 6.430 14.596 ( 5.542 3.214 -0.554) 6.430 14.844 ( -4.174 -3.517 3.309) 6.383 14.844 ( -4.174 3.517 3.309) 6.383 15.274 ( 4.872 -3.507 -5.692) 8.272 15.274 ( 4.872 3.507 -5.692) 8.272 15.546 ( -1.851 -3.038 0.188) 3.563 15.546 ( -1.851 3.038 0.188) 3.563 15.796 ( 2.847 -7.374 0.943) 7.961 15.796 ( 2.847 7.374 0.943) 7.961 16.323 ( -5.408 -4.946 -1.756) 7.536 16.323 ( -5.408 4.946 -1.756) 7.536 16.672 ( -2.062 -5.878 -1.189) 6.342 16.672 ( -2.062 5.878 -1.189) 6.342 16.816 ( -2.380 -2.032 0.291) 3.143 16.816 ( -2.380 2.032 0.291) 3.143 17.106 ( 0.439 -0.852 3.733) 3.854 17.106 ( 0.439 0.852 3.733) 3.854 17.433 ( 2.006 -0.793 -2.087) 3.001 17.433 ( 2.006 0.793 -2.087) 3.001 17.768 ( 8.215 -6.906 2.183) 10.952 17.768 ( 8.215 6.906 2.183) 10.952 18.385 ( -2.896 -12.808 -7.395) 15.071 18.385 ( -2.896 12.808 -7.395) 15.071 18.714 ( 2.628 -10.106 4.397) 11.330 18.714 ( 2.628 10.106 4.397) 11.330 19.699 ( -10.597 -2.110 0.697) 10.827 19.699 ( -10.597 2.110 0.697) 10.827 20.166 ( -0.933 -2.002 1.367) 2.597 20.166 ( -0.933 2.002 1.367) 2.597 ======================= Grid point 193 (103/104) ======================= q-point: (-0.20 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.084 ( -5.242 -12.235 1.429) 13.387 2.084 ( -5.242 12.235 1.429) 13.387 2.216 ( -11.748 -12.691 6.474) 18.466 2.216 ( -11.748 12.691 6.474) 18.466 2.567 ( -9.681 -0.310 -4.082) 10.511 2.567 ( -9.681 0.310 -4.082) 10.511 2.782 ( -6.799 -7.625 2.665) 10.558 2.782 ( -6.799 7.625 2.665) 10.558 3.179 ( -2.688 -0.311 -0.189) 2.713 3.179 ( -2.688 0.311 -0.189) 2.713 3.251 ( -8.339 -4.556 3.141) 10.008 3.251 ( -8.339 4.556 3.141) 10.008 3.374 ( -9.473 -8.303 -2.862) 12.918 3.374 ( -9.473 8.303 -2.862) 12.918 3.623 ( 0.600 -6.342 -2.856) 6.981 3.623 ( 0.600 6.342 -2.856) 6.981 3.722 ( -6.189 -6.730 4.159) 10.045 3.722 ( -6.189 6.730 4.159) 10.045 3.907 ( -6.944 -8.620 4.192) 11.836 3.907 ( -6.944 8.620 4.192) 11.836 4.010 ( -0.814 -2.661 -1.100) 2.992 4.010 ( -0.814 2.661 -1.100) 2.992 4.299 ( -3.914 -1.215 2.010) 4.565 4.299 ( -3.914 1.215 2.010) 4.565 4.517 ( -1.114 -2.211 -1.992) 3.177 4.517 ( -1.114 2.211 -1.992) 3.177 4.599 ( -1.194 -2.702 -1.881) 3.502 4.599 ( -1.194 2.702 -1.881) 3.502 4.699 ( 5.154 -3.932 -3.023) 7.152 4.699 ( 5.154 3.932 -3.023) 7.152 4.992 ( 1.808 -1.621 -1.417) 2.812 4.992 ( 1.808 1.621 -1.417) 2.812 5.153 ( 5.731 -4.589 0.921) 7.400 5.153 ( 5.731 4.589 0.921) 7.400 5.614 ( 0.471 -5.515 1.215) 5.667 5.614 ( 0.471 5.515 1.215) 5.667 5.780 ( 4.456 -4.882 1.399) 6.756 5.780 ( 4.456 4.882 1.399) 6.756 6.073 ( 5.728 -7.218 -1.384) 9.318 6.073 ( 5.728 7.218 -1.384) 9.318 6.336 ( -1.649 -2.960 -3.743) 5.049 6.336 ( -1.649 2.960 -3.743) 5.049 6.490 ( 8.604 -4.805 2.643) 10.203 6.490 ( 8.604 4.805 2.643) 10.203 7.025 ( 0.851 -3.196 2.532) 4.165 7.025 ( 0.851 3.196 2.532) 4.165 7.502 ( -1.204 -6.529 -1.968) 6.925 7.502 ( -1.204 6.529 -1.968) 6.925 7.923 ( -2.598 -4.022 -4.310) 6.443 7.923 ( -2.598 4.022 -4.310) 6.443 8.186 ( -4.221 -0.894 2.753) 5.118 8.186 ( -4.221 0.894 2.753) 5.118 8.682 ( 3.977 -0.322 -0.310) 4.002 8.682 ( 3.977 0.322 -0.310) 4.002 8.780 ( -1.778 -2.118 -0.383) 2.792 8.780 ( -1.778 2.118 -0.383) 2.792 9.048 ( -8.330 -4.448 -4.408) 10.421 9.048 ( -8.330 4.448 -4.408) 10.421 9.476 ( -4.193 -3.402 -0.100) 5.400 9.476 ( -4.193 3.402 -0.100) 5.400 9.764 ( -0.423 -8.182 0.779) 8.230 9.764 ( -0.423 8.182 0.779) 8.230 9.998 ( 2.276 -1.558 0.629) 2.829 9.998 ( 2.276 1.558 0.629) 2.829 10.282 ( 5.090 -7.863 -1.253) 9.450 10.282 ( 5.090 7.863 -1.253) 9.450 10.545 ( -1.366 -5.176 0.295) 5.361 10.545 ( -1.366 5.176 0.295) 5.361 11.015 ( -6.065 -2.737 -1.641) 6.853 11.015 ( -6.065 2.737 -1.641) 6.853 11.210 ( 2.814 -3.233 6.047) 7.412 11.210 ( 2.814 3.233 6.047) 7.412 11.391 ( 0.461 -2.092 -0.155) 2.148 11.391 ( 0.461 2.092 -0.155) 2.148 11.871 ( 1.733 -1.982 -0.934) 2.793 11.871 ( 1.733 1.982 -0.934) 2.793 12.293 ( 3.726 -7.361 1.417) 8.371 12.293 ( 3.726 7.361 1.417) 8.371 12.679 ( 5.906 -8.648 -3.794) 11.138 12.679 ( 5.906 8.648 -3.794) 11.138 12.928 ( -1.916 -6.975 1.987) 7.502 12.928 ( -1.916 6.975 1.987) 7.502 13.249 ( 3.473 -4.185 0.863) 5.506 13.249 ( 3.473 4.185 0.863) 5.506 13.392 ( -0.109 -3.796 1.435) 4.059 13.392 ( -0.109 3.796 1.435) 4.059 13.662 ( 2.567 -1.623 -1.130) 3.241 13.662 ( 2.567 1.623 -1.130) 3.241 14.298 ( 0.709 -4.696 -0.928) 4.839 14.298 ( 0.709 4.696 -0.928) 4.839 14.658 ( 1.170 -0.697 3.282) 3.553 14.658 ( 1.170 0.697 3.282) 3.553 14.827 ( 0.574 -2.555 -0.456) 2.658 14.827 ( 0.574 2.555 -0.456) 2.658 15.318 ( 3.225 -1.671 -5.676) 6.739 15.318 ( 3.225 1.671 -5.676) 6.739 15.519 ( -0.626 -5.016 1.160) 5.186 15.519 ( -0.626 5.016 1.160) 5.186 15.863 ( 3.362 -8.154 2.290) 9.112 15.863 ( 3.362 8.154 2.290) 9.112 16.215 ( -3.837 -5.852 -3.720) 7.925 16.215 ( -3.837 5.852 -3.720) 7.925 16.593 ( -5.284 -5.109 0.788) 7.392 16.593 ( -5.284 5.109 0.788) 7.392 16.812 ( -0.094 -0.043 1.019) 1.024 16.812 ( -0.094 0.043 1.019) 1.024 17.130 ( 0.851 -0.802 -0.143) 1.178 17.130 ( 0.851 0.802 -0.143) 1.178 17.427 ( -1.427 -1.837 -0.684) 2.425 17.427 ( -1.427 1.837 -0.684) 2.425 17.917 ( 5.421 -6.929 -0.982) 8.853 17.917 ( 5.421 6.929 -0.982) 8.853 18.294 ( -0.157 -13.544 -5.651) 14.676 18.294 ( -0.157 13.544 -5.651) 14.676 18.797 ( 2.382 -10.374 5.155) 11.827 18.797 ( 2.382 10.374 5.155) 11.827 19.497 ( -11.888 -3.561 1.795) 12.539 19.497 ( -11.888 3.561 1.795) 12.539 20.175 ( 0.786 -2.135 1.777) 2.887 20.175 ( 0.786 2.135 1.777) 2.887 ======================= Grid point 195 (104/104) ======================= q-point: (-0.10 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.64e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.005 ( -4.547 -13.557 0.974) 14.333 2.005 ( -4.547 13.557 0.974) 14.333 2.116 ( -4.996 -15.269 8.178) 18.028 2.116 ( -4.996 15.269 8.178) 18.028 2.315 ( -13.215 -5.812 -1.007) 14.472 2.315 ( -13.215 5.812 -1.007) 14.472 2.697 ( -5.535 -6.307 1.880) 8.599 2.697 ( -5.535 6.307 1.880) 8.599 3.068 ( -8.659 -4.627 -1.234) 9.894 3.068 ( -8.659 4.627 -1.234) 9.894 3.191 ( -0.252 -3.719 8.724) 9.487 3.191 ( -0.252 3.719 8.724) 9.487 3.231 ( -2.898 -3.468 -2.612) 5.220 3.231 ( -2.898 3.468 -2.612) 5.220 3.587 ( -1.620 -4.127 -4.240) 6.135 3.587 ( -1.620 4.127 -4.240) 6.135 3.662 ( -3.575 -9.580 4.351) 11.112 3.662 ( -3.575 9.580 4.351) 11.112 3.880 ( 0.387 -6.946 1.740) 7.171 3.880 ( 0.387 6.946 1.740) 7.171 3.988 ( -1.335 -4.525 0.315) 4.728 3.988 ( -1.335 4.525 0.315) 4.728 4.285 ( -0.370 -4.718 1.837) 5.076 4.285 ( -0.370 4.718 1.837) 5.076 4.427 ( -2.655 -3.340 -8.927) 9.895 4.427 ( -2.655 3.340 -8.927) 9.895 4.594 ( 0.000 -1.517 1.292) 1.993 4.594 ( 0.000 1.517 1.292) 1.993 4.776 ( 4.250 -2.794 -0.670) 5.130 4.776 ( 4.250 2.794 -0.670) 5.130 4.976 ( -1.179 -0.921 -3.728) 4.017 4.976 ( -1.179 0.921 -3.728) 4.017 5.279 ( 5.945 -5.406 2.941) 8.557 5.279 ( 5.945 5.406 2.941) 8.557 5.599 ( -1.903 -4.819 -1.259) 5.332 5.599 ( -1.903 4.819 -1.259) 5.332 5.866 ( 3.185 -2.584 1.006) 4.222 5.866 ( 3.185 2.584 1.006) 4.222 6.132 ( 0.303 -3.201 -1.220) 3.439 6.132 ( 0.303 3.201 -1.220) 3.439 6.370 ( 8.205 -4.558 0.281) 9.390 6.370 ( 8.205 4.558 0.281) 9.390 6.645 ( 5.161 -5.051 0.710) 7.256 6.645 ( 5.161 5.051 0.710) 7.256 7.048 ( -0.370 -3.309 3.133) 4.572 7.048 ( -0.370 3.309 3.133) 4.572 7.461 ( -0.932 -5.461 -2.826) 6.219 7.461 ( -0.932 5.461 -2.826) 6.219 7.875 ( 2.331 -3.667 -6.694) 7.981 7.875 ( 2.331 3.667 -6.694) 7.981 8.080 ( -9.149 -1.679 1.745) 9.464 8.080 ( -9.149 1.679 1.745) 9.464 8.675 ( -1.712 -1.891 -1.967) 3.221 8.675 ( -1.712 1.891 -1.967) 3.221 8.799 ( -1.521 -3.924 -4.435) 6.114 8.799 ( -1.521 3.924 -4.435) 6.114 8.947 ( 2.121 -5.764 6.246) 8.760 8.947 ( 2.121 5.764 6.246) 8.760 9.378 ( -4.922 -2.022 -3.014) 6.115 9.378 ( -4.922 2.022 -3.014) 6.115 9.709 ( -3.833 -6.094 -1.004) 7.269 9.709 ( -3.833 6.094 -1.004) 7.269 10.107 ( 6.205 -3.802 3.937) 8.274 10.107 ( 6.205 3.802 3.937) 8.274 10.375 ( 5.815 -7.895 -1.623) 9.939 10.375 ( 5.815 7.895 -1.623) 9.939 10.504 ( -2.942 -4.586 0.710) 5.494 10.504 ( -2.942 4.586 0.710) 5.494 10.860 ( -10.150 -3.889 2.381) 11.128 10.860 ( -10.150 3.889 2.381) 11.128 11.315 ( 1.399 -3.986 4.427) 6.119 11.315 ( 1.399 3.986 4.427) 6.119 11.415 ( 4.844 -1.619 -2.433) 5.657 11.415 ( 4.844 1.619 -2.433) 5.657 11.868 ( -0.784 -1.044 -1.912) 2.315 11.868 ( -0.784 1.044 -1.912) 2.315 12.379 ( 4.484 -7.345 0.977) 8.661 12.379 ( 4.484 7.345 0.977) 8.661 12.640 ( -4.593 -7.466 -3.681) 9.507 12.640 ( -4.593 7.466 -3.681) 9.507 12.998 ( 6.079 -5.531 1.347) 8.328 12.998 ( 6.079 5.531 1.347) 8.328 13.281 ( -1.614 -3.283 -0.013) 3.658 13.281 ( -1.614 3.283 -0.013) 3.658 13.416 ( 2.045 -4.919 1.742) 5.605 13.416 ( 2.045 4.919 1.742) 5.605 13.705 ( 3.297 -1.511 -2.779) 4.569 13.705 ( 3.297 1.511 -2.779) 4.569 14.293 ( -0.823 -3.251 1.223) 3.569 14.293 ( -0.823 3.251 1.223) 3.569 14.690 ( -0.679 -2.685 1.537) 3.167 14.690 ( -0.679 2.685 1.537) 3.167 14.860 ( 3.665 -0.538 1.415) 3.965 14.860 ( 3.665 0.538 1.415) 3.965 15.261 ( -3.802 -0.828 -6.999) 8.008 15.261 ( -3.802 0.828 -6.999) 8.008 15.576 ( 4.072 -4.050 3.404) 6.676 15.576 ( 4.072 4.050 3.404) 6.676 15.939 ( 2.654 -6.791 1.658) 7.477 15.939 ( 2.654 6.791 1.658) 7.477 16.150 ( -0.406 -6.722 -2.665) 7.242 16.150 ( -0.406 6.722 -2.665) 7.242 16.514 ( -3.878 -4.790 1.480) 6.338 16.514 ( -3.878 4.790 1.480) 6.338 16.794 ( -2.371 -1.751 -0.673) 3.024 16.794 ( -2.371 1.751 -0.673) 3.024 17.132 ( 0.482 -0.609 -3.437) 3.524 17.132 ( 0.482 0.609 -3.437) 3.524 17.384 ( -2.705 -3.431 0.920) 4.465 17.384 ( -2.705 3.431 0.920) 4.465 17.914 ( -1.565 -2.224 -4.722) 5.449 17.914 ( -1.565 2.224 -4.722) 5.449 18.332 ( 4.805 -6.500 -0.495) 8.099 18.332 ( 4.805 6.500 -0.495) 8.099 18.866 ( 1.433 -7.463 4.108) 8.638 18.866 ( 1.433 7.463 4.108) 8.638 19.331 ( -7.288 -3.646 2.586) 8.550 19.331 ( -7.288 3.646 2.586) 8.550 20.216 ( 1.854 -2.219 2.076) 3.559 20.216 ( 1.854 2.219 2.076) 3.559 =================== End of collection of collisions =================== ----------- Thermal conductivity (W/m-k) with tetrahedron method ----------- # T(K) xx yy zz yz xz xy #ipm 0.0 0.000 0.000 0.000 0.000 0.000 0.000 3/36000 10.0 1574.277 1928.856 2081.706 0.000 705.982 0.000 3/36000 20.0 287.575 252.671 302.761 0.000 48.167 0.000 3/36000 30.0 85.790 67.251 86.697 0.000 9.899 0.000 3/36000 40.0 40.938 30.373 40.285 0.000 4.107 0.000 3/36000 50.0 24.903 17.947 24.168 0.000 2.336 0.000 3/36000 60.0 17.332 12.289 16.692 0.000 1.565 0.000 3/36000 70.0 13.087 9.189 12.543 0.000 1.151 0.000 3/36000 80.0 10.420 7.273 9.952 0.000 0.896 0.000 3/36000 90.0 8.609 5.985 8.198 0.000 0.725 0.000 3/36000 100.0 7.307 5.066 6.941 0.000 0.602 0.000 3/36000 110.0 6.330 4.380 6.000 0.000 0.510 0.000 3/36000 120.0 5.574 3.851 5.271 0.000 0.440 0.000 3/36000 130.0 4.973 3.432 4.693 0.000 0.384 0.000 3/36000 140.0 4.484 3.092 4.225 0.000 0.339 0.000 3/36000 150.0 4.081 2.812 3.839 0.000 0.302 0.000 3/36000 160.0 3.744 2.578 3.516 0.000 0.272 0.000 3/36000 170.0 3.457 2.380 3.242 0.000 0.247 0.000 3/36000 180.0 3.211 2.210 3.007 0.000 0.226 0.000 3/36000 190.0 2.997 2.063 2.804 0.000 0.207 0.000 3/36000 200.0 2.811 1.935 2.626 0.000 0.192 0.000 3/36000 210.0 2.646 1.822 2.470 0.000 0.178 0.000 3/36000 220.0 2.500 1.721 2.332 0.000 0.166 0.000 3/36000 230.0 2.370 1.632 2.208 0.000 0.156 0.000 3/36000 240.0 2.252 1.552 2.098 0.000 0.147 0.000 3/36000 250.0 2.147 1.479 1.998 0.000 0.138 0.000 3/36000 260.0 2.050 1.413 1.907 0.000 0.131 0.000 3/36000 270.0 1.963 1.353 1.825 0.000 0.125 0.000 3/36000 280.0 1.883 1.298 1.749 0.000 0.119 0.000 3/36000 290.0 1.809 1.248 1.680 0.000 0.113 0.000 3/36000 300.0 1.741 1.201 1.616 0.000 0.108 0.000 3/36000 310.0 1.678 1.158 1.557 0.000 0.104 0.000 3/36000 320.0 1.620 1.118 1.502 0.000 0.100 0.000 3/36000 330.0 1.565 1.081 1.451 0.000 0.096 0.000 3/36000 340.0 1.514 1.046 1.404 0.000 0.092 0.000 3/36000 350.0 1.467 1.014 1.359 0.000 0.089 0.000 3/36000 360.0 1.423 0.983 1.318 0.000 0.086 0.000 3/36000 370.0 1.381 0.955 1.279 0.000 0.083 0.000 3/36000 380.0 1.342 0.928 1.242 0.000 0.081 0.000 3/36000 390.0 1.304 0.902 1.208 0.000 0.078 0.000 3/36000 400.0 1.269 0.878 1.175 0.000 0.076 0.000 3/36000 410.0 1.236 0.856 1.144 0.000 0.074 0.000 3/36000 420.0 1.205 0.834 1.115 0.000 0.072 0.000 3/36000 430.0 1.175 0.814 1.087 0.000 0.070 0.000 3/36000 440.0 1.147 0.794 1.061 0.000 0.068 0.000 3/36000 450.0 1.120 0.776 1.035 0.000 0.066 0.000 3/36000 460.0 1.094 0.758 1.012 0.000 0.064 0.000 3/36000 470.0 1.070 0.741 0.989 0.000 0.063 0.000 3/36000 480.0 1.046 0.725 0.967 0.000 0.061 0.000 3/36000 490.0 1.024 0.710 0.946 0.000 0.060 0.000 3/36000 500.0 1.002 0.695 0.926 0.000 0.059 0.000 3/36000 510.0 0.982 0.681 0.907 0.000 0.057 0.000 3/36000 520.0 0.962 0.667 0.889 0.000 0.056 0.000 3/36000 530.0 0.943 0.654 0.871 0.000 0.055 0.000 3/36000 540.0 0.925 0.642 0.854 0.000 0.054 0.000 3/36000 550.0 0.908 0.630 0.838 0.000 0.053 0.000 3/36000 560.0 0.891 0.618 0.823 0.000 0.052 0.000 3/36000 570.0 0.875 0.607 0.808 0.000 0.051 0.000 3/36000 580.0 0.859 0.596 0.793 0.000 0.050 0.000 3/36000 590.0 0.844 0.586 0.779 0.000 0.049 0.000 3/36000 600.0 0.829 0.576 0.766 0.000 0.048 0.000 3/36000 610.0 0.815 0.566 0.753 0.000 0.047 0.000 3/36000 620.0 0.802 0.557 0.740 0.000 0.046 0.000 3/36000 630.0 0.789 0.548 0.728 0.000 0.045 0.000 3/36000 640.0 0.776 0.539 0.716 0.000 0.045 0.000 3/36000 650.0 0.764 0.530 0.705 0.000 0.044 0.000 3/36000 660.0 0.752 0.522 0.694 0.000 0.043 0.000 3/36000 670.0 0.740 0.514 0.683 0.000 0.043 0.000 3/36000 680.0 0.729 0.507 0.673 0.000 0.042 0.000 3/36000 690.0 0.718 0.499 0.663 0.000 0.041 0.000 3/36000 700.0 0.708 0.492 0.653 0.000 0.041 0.000 3/36000 710.0 0.698 0.485 0.644 0.000 0.040 0.000 3/36000 720.0 0.688 0.478 0.635 0.000 0.039 0.000 3/36000 730.0 0.678 0.471 0.626 0.000 0.039 0.000 3/36000 740.0 0.669 0.465 0.617 0.000 0.038 0.000 3/36000 750.0 0.660 0.458 0.609 0.000 0.038 0.000 3/36000 760.0 0.651 0.452 0.601 0.000 0.037 0.000 3/36000 770.0 0.642 0.446 0.593 0.000 0.037 0.000 3/36000 780.0 0.634 0.441 0.585 0.000 0.036 0.000 3/36000 790.0 0.626 0.435 0.577 0.000 0.036 0.000 3/36000 800.0 0.618 0.429 0.570 0.000 0.035 0.000 3/36000 810.0 0.610 0.424 0.563 0.000 0.035 0.000 3/36000 820.0 0.603 0.419 0.556 0.000 0.034 0.000 3/36000 830.0 0.595 0.414 0.549 0.000 0.034 0.000 3/36000 840.0 0.588 0.409 0.542 0.000 0.034 0.000 3/36000 850.0 0.581 0.404 0.536 0.000 0.033 0.000 3/36000 860.0 0.574 0.399 0.530 0.000 0.033 0.000 3/36000 870.0 0.567 0.395 0.523 0.000 0.032 0.000 3/36000 880.0 0.561 0.390 0.517 0.000 0.032 0.000 3/36000 890.0 0.554 0.386 0.511 0.000 0.032 0.000 3/36000 900.0 0.548 0.381 0.506 0.000 0.031 0.000 3/36000 910.0 0.542 0.377 0.500 0.000 0.031 0.000 3/36000 920.0 0.536 0.373 0.494 0.000 0.030 0.000 3/36000 930.0 0.530 0.369 0.489 0.000 0.030 0.000 3/36000 940.0 0.525 0.365 0.484 0.000 0.030 0.000 3/36000 950.0 0.519 0.361 0.479 0.000 0.029 0.000 3/36000 960.0 0.514 0.357 0.474 0.000 0.029 0.000 3/36000 970.0 0.508 0.353 0.469 0.000 0.029 0.000 3/36000 980.0 0.503 0.350 0.464 0.000 0.029 0.000 3/36000 990.0 0.498 0.346 0.459 0.000 0.028 0.000 3/36000 1000.0 0.493 0.343 0.454 0.000 0.028 0.000 3/36000 Thermal conductivity related properties were written into "kappa-m1065.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 04:10:28]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|