----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 19:18:04]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.516992525005413 -4.368106500000000 0.000000000000000 b 2.516992525005413 4.368106500000000 0.000000000000000 c -1.710838581990054 0.000000000000000 9.512502458134843 Atomic positions (fractional): *1 Li 0.68060777732294 0.84011588172089 0.00038423785170 6.941 2 Li 0.15988411827911 0.31939222267706 0.49961576214830 6.941 3 Li 0.31939222267706 0.15988411827911 0.99961576214830 6.941 4 Li 0.84011588172089 0.68060777732294 0.50038423785170 6.941 *5 Li 0.50000000000000 0.00000000000000 0.50000000000000 6.941 6 Li 0.00000000000000 0.50000000000000 0.00000000000000 6.941 *7 Li 0.91593720236554 0.08406279763446 0.75000000000000 6.941 8 Li 0.08406279763446 0.91593720236554 0.25000000000000 6.941 *9 O 0.76839798026561 0.95527758186898 0.36631584704351 15.999 *10 O 0.59851716087321 0.12278478896086 0.86422091630135 15.999 11 O 0.04472241813102 0.23160201973439 0.13368415295649 15.999 12 O 0.23160201973439 0.04472241813102 0.63368415295649 15.999 *13 O 0.30915113235516 0.47726725987877 0.86415924461306 15.999 14 O 0.87721521103914 0.40148283912679 0.63577908369865 15.999 15 O 0.40148283912679 0.87721521103914 0.13577908369865 15.999 16 O 0.12278478896086 0.59851716087321 0.36422091630135 15.999 17 O 0.47726725987877 0.30915113235516 0.36415924461306 15.999 18 O 0.52273274012123 0.69084886764484 0.63584075538694 15.999 19 O 0.69084886764484 0.52273274012123 0.13584075538694 15.999 20 O 0.95527758186898 0.76839798026561 0.86631584704351 15.999 *21 Ti 0.58290602306559 0.41709397693441 0.75000000000000 47.867 *22 Ti 0.74937771315621 0.25062228684379 0.25000000000000 47.867 23 Ti 0.25062228684379 0.74937771315621 0.75000000000000 47.867 24 Ti 0.41709397693441 0.58290602306559 0.25000000000000 47.867 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.033985050010825 0.000000000000000 0.000000000000000 b 0.000000000000000 8.736212999999999 0.000000000000000 c -1.710838581990054 0.000000000000000 9.512502458134843 Atomic positions (fractional): *1 Li 0.76036182952192 0.07975405219897 0.00038423785170 6.941 > 1 2 Li 0.23963817047808 0.07975405219897 0.49961576214830 6.941 > 2 3 Li 0.73963817047808 0.42024594780102 0.99961576214830 6.941 > 3 4 Li 0.26036182952192 0.42024594780102 0.50038423785170 6.941 > 4 *5 Li 0.75000000000000 0.25000000000000 0.50000000000000 6.941 > 5 6 Li 0.25000000000000 0.25000000000000 0.00000000000000 6.941 > 6 *7 Li 0.00000000000000 0.08406279763446 0.75000000000000 6.941 > 7 8 Li 0.50000000000000 0.41593720236554 0.25000000000000 6.941 > 8 9 Li 0.26036182952192 0.57975405219898 0.00038423785170 6.941 > 1 10 Li 0.73963817047808 0.57975405219898 0.49961576214830 6.941 > 2 11 Li 0.23963817047808 0.92024594780102 0.99961576214830 6.941 > 3 12 Li 0.76036182952192 0.92024594780102 0.50038423785170 6.941 > 4 13 Li 0.25000000000000 0.75000000000000 0.50000000000000 6.941 > 5 14 Li 0.75000000000000 0.75000000000000 0.00000000000000 6.941 > 6 15 Li 0.50000000000000 0.58406279763446 0.75000000000000 6.941 > 7 16 Li 0.00000000000000 0.91593720236554 0.25000000000000 6.941 > 8 *17 O 0.86183778106730 0.09343980080169 0.36631584704351 15.999 > 9 *18 O 0.86065097491704 0.26213381404382 0.86422091630135 15.999 > 10 19 O 0.13816221893270 0.09343980080169 0.13368415295649 15.999 > 11 20 O 0.63816221893270 0.40656019919831 0.63368415295649 15.999 > 12 *21 O 0.39320919611696 0.08405806376181 0.86415924461306 15.999 > 13 22 O 0.13934902508296 0.26213381404382 0.63577908369865 15.999 > 14 23 O 0.63934902508296 0.23786618595618 0.13577908369865 15.999 > 15 24 O 0.36065097491704 0.23786618595618 0.36422091630135 15.999 > 16 25 O 0.89320919611696 0.41594193623819 0.36415924461306 15.999 > 17 26 O 0.60679080388304 0.08405806376181 0.63584075538694 15.999 > 18 27 O 0.10679080388304 0.41594193623819 0.13584075538694 15.999 > 19 28 O 0.36183778106729 0.40656019919831 0.86631584704351 15.999 > 20 29 O 0.36183778106729 0.59343980080169 0.36631584704351 15.999 > 9 30 O 0.36065097491704 0.76213381404382 0.86422091630135 15.999 > 10 31 O 0.63816221893270 0.59343980080169 0.13368415295649 15.999 > 11 32 O 0.13816221893270 0.90656019919831 0.63368415295649 15.999 > 12 33 O 0.89320919611696 0.58405806376181 0.86415924461306 15.999 > 13 34 O 0.63934902508296 0.76213381404382 0.63577908369865 15.999 > 14 35 O 0.13934902508296 0.73786618595618 0.13577908369865 15.999 > 15 36 O 0.86065097491704 0.73786618595618 0.36422091630135 15.999 > 16 37 O 0.39320919611696 0.91594193623819 0.36415924461306 15.999 > 17 38 O 0.10679080388304 0.58405806376181 0.63584075538694 15.999 > 18 39 O 0.60679080388304 0.91594193623819 0.13584075538694 15.999 > 19 40 O 0.86183778106730 0.90656019919831 0.86631584704351 15.999 > 20 *41 Ti 0.00000000000000 0.41709397693441 0.75000000000000 47.867 > 21 *42 Ti 0.00000000000000 0.25062228684379 0.25000000000000 47.867 > 22 43 Ti 0.50000000000000 0.24937771315621 0.75000000000000 47.867 > 23 44 Ti 0.50000000000000 0.08290602306559 0.25000000000000 47.867 > 24 45 Ti 0.50000000000000 0.91709397693441 0.75000000000000 47.867 > 21 46 Ti 0.50000000000000 0.75062228684379 0.25000000000000 47.867 > 22 47 Ti 0.00000000000000 0.74937771315621 0.75000000000000 47.867 > 23 48 Ti 0.00000000000000 0.58290602306559 0.25000000000000 47.867 > 24 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.067970100021650 0.000000000000000 0.000000000000000 b 0.000000000000000 8.736212999999999 0.000000000000000 c -1.710838581990054 0.000000000000000 9.512502458134843 Atomic positions (fractional): *1 Li 0.38018091476096 0.07975405219897 0.00038423785170 6.941 > 1 2 Li 0.88018091476096 0.07975405219897 0.00038423785170 6.941 > 1 3 Li 0.11981908523904 0.07975405219897 0.49961576214830 6.941 > 2 4 Li 0.61981908523904 0.07975405219897 0.49961576214830 6.941 > 2 5 Li 0.36981908523904 0.42024594780102 0.99961576214830 6.941 > 3 6 Li 0.86981908523904 0.42024594780102 0.99961576214830 6.941 > 3 7 Li 0.13018091476096 0.42024594780102 0.50038423785170 6.941 > 4 8 Li 0.63018091476096 0.42024594780102 0.50038423785170 6.941 > 4 *9 Li 0.37500000000000 0.25000000000000 0.50000000000000 6.941 > 5 10 Li 0.87500000000000 0.25000000000000 0.50000000000000 6.941 > 5 11 Li 0.12500000000000 0.25000000000000 0.00000000000000 6.941 > 6 12 Li 0.62500000000000 0.25000000000000 0.00000000000000 6.941 > 6 *13 Li 0.00000000000000 0.08406279763446 0.75000000000000 6.941 > 7 14 Li 0.50000000000000 0.08406279763446 0.75000000000000 6.941 > 7 15 Li 0.25000000000000 0.41593720236554 0.25000000000000 6.941 > 8 16 Li 0.75000000000000 0.41593720236554 0.25000000000000 6.941 > 8 17 Li 0.13018091476096 0.57975405219898 0.00038423785170 6.941 > 1 18 Li 0.63018091476096 0.57975405219898 0.00038423785170 6.941 > 1 19 Li 0.36981908523904 0.57975405219898 0.49961576214830 6.941 > 2 20 Li 0.86981908523904 0.57975405219898 0.49961576214830 6.941 > 2 21 Li 0.11981908523904 0.92024594780102 0.99961576214830 6.941 > 3 22 Li 0.61981908523904 0.92024594780102 0.99961576214830 6.941 > 3 23 Li 0.38018091476096 0.92024594780102 0.50038423785170 6.941 > 4 24 Li 0.88018091476096 0.92024594780102 0.50038423785170 6.941 > 4 25 Li 0.12500000000000 0.75000000000000 0.50000000000000 6.941 > 5 26 Li 0.62500000000000 0.75000000000000 0.50000000000000 6.941 > 5 27 Li 0.37500000000000 0.75000000000000 0.00000000000000 6.941 > 6 28 Li 0.87500000000000 0.75000000000000 0.00000000000000 6.941 > 6 29 Li 0.25000000000000 0.58406279763446 0.75000000000000 6.941 > 7 30 Li 0.75000000000000 0.58406279763446 0.75000000000000 6.941 > 7 31 Li 0.00000000000000 0.91593720236554 0.25000000000000 6.941 > 8 32 Li 0.50000000000000 0.91593720236554 0.25000000000000 6.941 > 8 *33 O 0.43091889053365 0.09343980080169 0.36631584704351 15.999 > 9 34 O 0.93091889053365 0.09343980080169 0.36631584704351 15.999 > 9 *35 O 0.43032548745852 0.26213381404382 0.86422091630135 15.999 > 10 36 O 0.93032548745852 0.26213381404382 0.86422091630135 15.999 > 10 37 O 0.06908110946635 0.09343980080169 0.13368415295649 15.999 > 11 38 O 0.56908110946635 0.09343980080169 0.13368415295649 15.999 > 11 39 O 0.31908110946635 0.40656019919831 0.63368415295649 15.999 > 12 40 O 0.81908110946635 0.40656019919831 0.63368415295649 15.999 > 12 *41 O 0.19660459805848 0.08405806376181 0.86415924461306 15.999 > 13 42 O 0.69660459805848 0.08405806376181 0.86415924461306 15.999 > 13 43 O 0.06967451254148 0.26213381404382 0.63577908369865 15.999 > 14 44 O 0.56967451254148 0.26213381404382 0.63577908369865 15.999 > 14 45 O 0.31967451254148 0.23786618595618 0.13577908369865 15.999 > 15 46 O 0.81967451254148 0.23786618595618 0.13577908369865 15.999 > 15 47 O 0.18032548745852 0.23786618595618 0.36422091630135 15.999 > 16 48 O 0.68032548745852 0.23786618595618 0.36422091630135 15.999 > 16 49 O 0.44660459805848 0.41594193623819 0.36415924461306 15.999 > 17 50 O 0.94660459805848 0.41594193623819 0.36415924461306 15.999 > 17 51 O 0.30339540194152 0.08405806376181 0.63584075538694 15.999 > 18 52 O 0.80339540194152 0.08405806376181 0.63584075538694 15.999 > 18 53 O 0.05339540194152 0.41594193623819 0.13584075538694 15.999 > 19 54 O 0.55339540194152 0.41594193623819 0.13584075538694 15.999 > 19 55 O 0.18091889053365 0.40656019919831 0.86631584704351 15.999 > 20 56 O 0.68091889053365 0.40656019919831 0.86631584704351 15.999 > 20 57 O 0.18091889053365 0.59343980080169 0.36631584704351 15.999 > 9 58 O 0.68091889053365 0.59343980080169 0.36631584704351 15.999 > 9 59 O 0.18032548745852 0.76213381404382 0.86422091630135 15.999 > 10 60 O 0.68032548745852 0.76213381404382 0.86422091630135 15.999 > 10 61 O 0.31908110946635 0.59343980080169 0.13368415295649 15.999 > 11 62 O 0.81908110946635 0.59343980080169 0.13368415295649 15.999 > 11 63 O 0.06908110946635 0.90656019919831 0.63368415295649 15.999 > 12 64 O 0.56908110946635 0.90656019919831 0.63368415295649 15.999 > 12 65 O 0.44660459805848 0.58405806376181 0.86415924461306 15.999 > 13 66 O 0.94660459805848 0.58405806376181 0.86415924461306 15.999 > 13 67 O 0.31967451254148 0.76213381404382 0.63577908369865 15.999 > 14 68 O 0.81967451254148 0.76213381404382 0.63577908369865 15.999 > 14 69 O 0.06967451254148 0.73786618595618 0.13577908369865 15.999 > 15 70 O 0.56967451254148 0.73786618595618 0.13577908369865 15.999 > 15 71 O 0.43032548745852 0.73786618595618 0.36422091630135 15.999 > 16 72 O 0.93032548745852 0.73786618595618 0.36422091630135 15.999 > 16 73 O 0.19660459805848 0.91594193623819 0.36415924461306 15.999 > 17 74 O 0.69660459805848 0.91594193623819 0.36415924461306 15.999 > 17 75 O 0.05339540194152 0.58405806376181 0.63584075538694 15.999 > 18 76 O 0.55339540194152 0.58405806376181 0.63584075538694 15.999 > 18 77 O 0.30339540194152 0.91594193623819 0.13584075538694 15.999 > 19 78 O 0.80339540194152 0.91594193623819 0.13584075538694 15.999 > 19 79 O 0.43091889053365 0.90656019919831 0.86631584704351 15.999 > 20 80 O 0.93091889053365 0.90656019919831 0.86631584704351 15.999 > 20 *81 Ti 0.00000000000000 0.41709397693441 0.75000000000000 47.867 > 21 82 Ti 0.50000000000000 0.41709397693441 0.75000000000000 47.867 > 21 *83 Ti 0.00000000000000 0.25062228684379 0.25000000000000 47.867 > 22 84 Ti 0.50000000000000 0.25062228684379 0.25000000000000 47.867 > 22 85 Ti 0.25000000000000 0.24937771315621 0.75000000000000 47.867 > 23 86 Ti 0.75000000000000 0.24937771315621 0.75000000000000 47.867 > 23 87 Ti 0.25000000000000 0.08290602306559 0.25000000000000 47.867 > 24 88 Ti 0.75000000000000 0.08290602306559 0.25000000000000 47.867 > 24 89 Ti 0.25000000000000 0.91709397693441 0.75000000000000 47.867 > 21 90 Ti 0.75000000000000 0.91709397693441 0.75000000000000 47.867 > 21 91 Ti 0.25000000000000 0.75062228684379 0.25000000000000 47.867 > 22 92 Ti 0.75000000000000 0.75062228684379 0.25000000000000 47.867 > 22 93 Ti 0.00000000000000 0.74937771315621 0.75000000000000 47.867 > 23 94 Ti 0.50000000000000 0.74937771315621 0.75000000000000 47.867 > 23 95 Ti 0.00000000000000 0.58290602306559 0.25000000000000 47.867 > 24 96 Ti 0.50000000000000 0.58290602306559 0.25000000000000 47.867 > 24 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.3308836 0.0000000 0.0088037 0.0000000 5.3699063 0.0000000 0.0088054 0.0000000 3.8003126 -------------------------- Born effective charges -------------------------- 1 Li 0.9648578 0.0998828 -0.0032249 0.0950657 1.0765624 -0.0108620 0.0114177 0.0194058 1.5948857 2 Li 0.9648578 -0.0998828 -0.0032249 -0.0950657 1.0765624 0.0108620 0.0114177 -0.0194058 1.5948857 3 Li 0.9648578 0.0998828 -0.0032249 0.0950657 1.0765624 -0.0108620 0.0114177 0.0194058 1.5948857 4 Li 0.9648578 -0.0998828 -0.0032249 -0.0950657 1.0765624 0.0108620 0.0114177 -0.0194058 1.5948857 5 Li 1.1266338 0.2064500 0.0180239 0.1976291 0.8948054 -0.0236814 -0.0180968 0.0332458 1.5916121 6 Li 1.1266338 -0.2064500 0.0180239 -0.1976291 0.8948054 0.0236814 -0.0180968 -0.0332458 1.5916121 7 Li 1.2100302 -0.0000000 0.0064876 0.0000000 1.1982358 0.0000000 -0.0043546 0.0000000 0.4660038 8 Li 1.2100302 -0.0000000 0.0064876 0.0000000 1.1982358 0.0000000 -0.0043546 0.0000000 0.4660038 9 O -3.1466745 -0.7681557 -0.2284552 -0.7798387 -2.2620948 0.3629069 -0.2031778 0.3184076 -1.8627852 10 O -3.2099345 -0.8202106 -0.2072076 -0.8719630 -2.2541466 0.3610174 -0.1920054 0.3238941 -1.8177914 11 O -3.1466745 0.7681557 -0.2284552 0.7798387 -2.2620948 -0.3629069 -0.2031778 -0.3184076 -1.8627852 12 O -3.1466745 -0.7681557 -0.2284552 -0.7798387 -2.2620948 0.3629069 -0.2031778 0.3184076 -1.8627852 13 O -1.7674755 -0.0235221 0.4183193 0.0158946 -3.6658715 0.0163771 0.3782405 0.0123892 -1.8160282 14 O -3.2099345 0.8202106 -0.2072076 0.8719630 -2.2541466 -0.3610174 -0.1920054 -0.3238941 -1.8177914 15 O -3.2099345 -0.8202106 -0.2072076 -0.8719630 -2.2541466 0.3610174 -0.1920054 0.3238941 -1.8177914 16 O -3.2099345 0.8202106 -0.2072076 0.8719630 -2.2541466 -0.3610174 -0.1920054 -0.3238941 -1.8177914 17 O -1.7674755 0.0235221 0.4183193 -0.0158946 -3.6658715 -0.0163771 0.3782405 -0.0123892 -1.8160282 18 O -1.7674755 0.0235221 0.4183193 -0.0158946 -3.6658715 -0.0163771 0.3782405 -0.0123892 -1.8160282 19 O -1.7674755 -0.0235221 0.4183193 0.0158946 -3.6658715 0.0163771 0.3782405 0.0123892 -1.8160282 20 O -3.1466745 0.7681557 -0.2284552 0.7798387 -2.2620948 -0.3629069 -0.2031778 -0.3184076 -1.8627852 21 Ti 5.9723385 -0.0000000 -0.0877067 0.0000000 6.0821859 0.0000000 0.0354117 0.0000000 2.8747190 22 Ti 6.0094511 -0.0000000 0.1043319 0.0000000 6.0358739 0.0000000 -0.0019103 0.0000000 2.8711032 23 Ti 6.0094511 -0.0000000 0.1043319 0.0000000 6.0358739 0.0000000 -0.0019103 0.0000000 2.8711032 24 Ti 5.9723385 -0.0000000 -0.0877067 0.0000000 6.0821859 0.0000000 0.0354117 0.0000000 2.8747190 ---------------------------------------------------------------------------- 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: 288/288 Permutation basis: 12456/12456 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2718 Number of blocks in projector: 2718 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: 596 Use submatrix version of eigh solver. (1) Block: 596 / 596 (2) Block: 250 / 596 (2) 235 eigenvectors found. (2) Block: 500 / 596 (2) 239 eigenvectors found. (2) Block: 596 / 596 (2) 88 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 19 eigenvectors found. (1) 581 eigenvectors found. (1) Complementary block size: 14 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 240 eigenvectors found. (2) Block: 500 / 560 (2) 240 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 550 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 240 eigenvectors found. (2) Block: 500 / 560 (2) 240 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 550 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 334 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 334 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 334 Use standard eigh solver. Tree of FC basis block matrices: - (2718, 2659), data: False |-- (334, 326), data: True |-- (334, 326), data: True |-- (334, 326), data: True |-- (560, 550), data: False |-- (560, 550), data: False |-- (560, 16), data: (560, 26) @ (26, 16) |-- (60, 54), data: True |-- (250, 240), data: True |-- (250, 240), data: True |-- (560, 550), data: False |-- (560, 550), data: False |-- (560, 16), data: (560, 26) @ (26, 16) |-- (60, 54), data: True |-- (250, 240), data: True |-- (250, 240), data: True |-- (596, 581), data: False |-- (596, 581), data: False |-- (596, 19), data: (596, 34) @ (34, 19) |-- (96, 88), data: True |-- (250, 239), data: True |-- (250, 235), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 720 - Time: 0.651 Solver_block: 200 / 720 - Time: 0.566 Solver_block: 300 / 720 - Time: 0.566 Solver_block: 400 / 720 - Time: 0.563 Solver_block: 500 / 720 - Time: 0.562 Solver_block: 600 / 720 - Time: 0.561 Solver_block: 700 / 720 - Time: 0.564 Solver_block: 720 / 720 - Time: 0.220 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 4.356 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 288/288 Permutation basis: 12456/12456 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2718 Number of blocks in projector: 2718 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: 596 Use submatrix version of eigh solver. (1) Block: 596 / 596 (2) Block: 250 / 596 (2) 235 eigenvectors found. (2) Block: 500 / 596 (2) 239 eigenvectors found. (2) Block: 596 / 596 (2) 88 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 19 eigenvectors found. (1) 581 eigenvectors found. (1) Complementary block size: 14 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 240 eigenvectors found. (2) Block: 500 / 560 (2) 240 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 550 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 240 eigenvectors found. (2) Block: 500 / 560 (2) 240 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 550 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 334 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 334 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 334 Use standard eigh solver. Tree of FC basis block matrices: - (2718, 2659), data: False |-- (334, 326), data: True |-- (334, 326), data: True |-- (334, 326), data: True |-- (560, 550), data: False |-- (560, 550), data: False |-- (560, 16), data: (560, 26) @ (26, 16) |-- (60, 54), data: True |-- (250, 240), data: True |-- (250, 240), data: True |-- (560, 550), data: False |-- (560, 550), data: False |-- (560, 16), data: (560, 26) @ (26, 16) |-- (60, 54), data: True |-- (250, 240), data: True |-- (250, 240), data: True |-- (596, 581), data: False |-- (596, 581), data: False |-- (596, 19), data: (596, 34) @ (34, 19) |-- (96, 88), data: True |-- (250, 239), data: True |-- (250, 235), 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 2026-01-07 19:18:34]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 19:18:35]------------------------- 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: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.516992525005413 -4.368106500000000 0.000000000000000 b 2.516992525005413 4.368106500000000 0.000000000000000 c -1.710838581990054 0.000000000000000 9.512502458134843 Atomic positions (fractional): 1 Li 0.68060777732294 0.84011588172089 0.00038423785170 6.941 2 Li 0.15988411827911 0.31939222267706 0.49961576214830 6.941 3 Li 0.31939222267706 0.15988411827911 0.99961576214830 6.941 4 Li 0.84011588172089 0.68060777732294 0.50038423785170 6.941 5 Li 0.50000000000000 0.00000000000000 0.50000000000000 6.941 6 Li 0.00000000000000 0.50000000000000 0.00000000000000 6.941 7 Li 0.91593720236554 0.08406279763446 0.75000000000000 6.941 8 Li 0.08406279763446 0.91593720236554 0.25000000000000 6.941 9 O 0.76839798026561 0.95527758186898 0.36631584704351 15.999 10 O 0.59851716087321 0.12278478896086 0.86422091630135 15.999 11 O 0.04472241813102 0.23160201973439 0.13368415295649 15.999 12 O 0.23160201973439 0.04472241813102 0.63368415295649 15.999 13 O 0.30915113235516 0.47726725987877 0.86415924461306 15.999 14 O 0.87721521103914 0.40148283912679 0.63577908369865 15.999 15 O 0.40148283912679 0.87721521103914 0.13577908369865 15.999 16 O 0.12278478896086 0.59851716087321 0.36422091630135 15.999 17 O 0.47726725987877 0.30915113235516 0.36415924461306 15.999 18 O 0.52273274012123 0.69084886764484 0.63584075538694 15.999 19 O 0.69084886764484 0.52273274012123 0.13584075538694 15.999 20 O 0.95527758186898 0.76839798026561 0.86631584704351 15.999 21 Ti 0.58290602306559 0.41709397693441 0.75000000000000 47.867 22 Ti 0.74937771315621 0.25062228684379 0.25000000000000 47.867 23 Ti 0.25062228684379 0.74937771315621 0.75000000000000 47.867 24 Ti 0.41709397693441 0.58290602306559 0.25000000000000 47.867 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.067970100021650 0.000000000000000 0.000000000000000 b 0.000000000000000 8.736212999999999 0.000000000000000 c -1.710838581990054 0.000000000000000 9.512502458134843 Atomic positions (fractional): 1 Li 0.38018091476096 0.07975405219897 0.00038423785170 6.941 > 1 2 Li 0.88018091476096 0.07975405219897 0.00038423785170 6.941 > 1 3 Li 0.11981908523904 0.07975405219897 0.49961576214830 6.941 > 3 4 Li 0.61981908523904 0.07975405219897 0.49961576214830 6.941 > 3 5 Li 0.36981908523904 0.42024594780102 0.99961576214830 6.941 > 5 6 Li 0.86981908523904 0.42024594780102 0.99961576214830 6.941 > 5 7 Li 0.13018091476096 0.42024594780102 0.50038423785170 6.941 > 7 8 Li 0.63018091476096 0.42024594780102 0.50038423785170 6.941 > 7 9 Li 0.37500000000000 0.25000000000000 0.50000000000000 6.941 > 9 10 Li 0.87500000000000 0.25000000000000 0.50000000000000 6.941 > 9 11 Li 0.12500000000000 0.25000000000000 0.00000000000000 6.941 > 11 12 Li 0.62500000000000 0.25000000000000 0.00000000000000 6.941 > 11 13 Li 0.00000000000000 0.08406279763446 0.75000000000000 6.941 > 13 14 Li 0.50000000000000 0.08406279763446 0.75000000000000 6.941 > 13 15 Li 0.25000000000000 0.41593720236554 0.25000000000000 6.941 > 15 16 Li 0.75000000000000 0.41593720236554 0.25000000000000 6.941 > 15 17 Li 0.13018091476096 0.57975405219898 0.00038423785170 6.941 > 1 18 Li 0.63018091476096 0.57975405219898 0.00038423785170 6.941 > 1 19 Li 0.36981908523904 0.57975405219898 0.49961576214830 6.941 > 3 20 Li 0.86981908523904 0.57975405219898 0.49961576214830 6.941 > 3 21 Li 0.11981908523904 0.92024594780102 0.99961576214830 6.941 > 5 22 Li 0.61981908523904 0.92024594780102 0.99961576214830 6.941 > 5 23 Li 0.38018091476096 0.92024594780102 0.50038423785170 6.941 > 7 24 Li 0.88018091476096 0.92024594780102 0.50038423785170 6.941 > 7 25 Li 0.12500000000000 0.75000000000000 0.50000000000000 6.941 > 9 26 Li 0.62500000000000 0.75000000000000 0.50000000000000 6.941 > 9 27 Li 0.37500000000000 0.75000000000000 0.00000000000000 6.941 > 11 28 Li 0.87500000000000 0.75000000000000 0.00000000000000 6.941 > 11 29 Li 0.25000000000000 0.58406279763446 0.75000000000000 6.941 > 13 30 Li 0.75000000000000 0.58406279763446 0.75000000000000 6.941 > 13 31 Li 0.00000000000000 0.91593720236554 0.25000000000000 6.941 > 15 32 Li 0.50000000000000 0.91593720236554 0.25000000000000 6.941 > 15 33 O 0.43091889053365 0.09343980080169 0.36631584704351 15.999 > 33 34 O 0.93091889053365 0.09343980080169 0.36631584704351 15.999 > 33 35 O 0.43032548745852 0.26213381404382 0.86422091630135 15.999 > 35 36 O 0.93032548745852 0.26213381404382 0.86422091630135 15.999 > 35 37 O 0.06908110946635 0.09343980080169 0.13368415295649 15.999 > 37 38 O 0.56908110946635 0.09343980080169 0.13368415295649 15.999 > 37 39 O 0.31908110946635 0.40656019919831 0.63368415295649 15.999 > 39 40 O 0.81908110946635 0.40656019919831 0.63368415295649 15.999 > 39 41 O 0.19660459805848 0.08405806376181 0.86415924461306 15.999 > 41 42 O 0.69660459805848 0.08405806376181 0.86415924461306 15.999 > 41 43 O 0.06967451254148 0.26213381404382 0.63577908369865 15.999 > 43 44 O 0.56967451254148 0.26213381404382 0.63577908369865 15.999 > 43 45 O 0.31967451254148 0.23786618595618 0.13577908369865 15.999 > 45 46 O 0.81967451254148 0.23786618595618 0.13577908369865 15.999 > 45 47 O 0.18032548745852 0.23786618595618 0.36422091630135 15.999 > 47 48 O 0.68032548745852 0.23786618595618 0.36422091630135 15.999 > 47 49 O 0.44660459805848 0.41594193623819 0.36415924461306 15.999 > 49 50 O 0.94660459805848 0.41594193623819 0.36415924461306 15.999 > 49 51 O 0.30339540194152 0.08405806376181 0.63584075538694 15.999 > 51 52 O 0.80339540194152 0.08405806376181 0.63584075538694 15.999 > 51 53 O 0.05339540194152 0.41594193623819 0.13584075538694 15.999 > 53 54 O 0.55339540194152 0.41594193623819 0.13584075538694 15.999 > 53 55 O 0.18091889053365 0.40656019919831 0.86631584704351 15.999 > 55 56 O 0.68091889053365 0.40656019919831 0.86631584704351 15.999 > 55 57 O 0.18091889053365 0.59343980080169 0.36631584704351 15.999 > 33 58 O 0.68091889053365 0.59343980080169 0.36631584704351 15.999 > 33 59 O 0.18032548745852 0.76213381404382 0.86422091630135 15.999 > 35 60 O 0.68032548745852 0.76213381404382 0.86422091630135 15.999 > 35 61 O 0.31908110946635 0.59343980080169 0.13368415295649 15.999 > 37 62 O 0.81908110946635 0.59343980080169 0.13368415295649 15.999 > 37 63 O 0.06908110946635 0.90656019919831 0.63368415295649 15.999 > 39 64 O 0.56908110946635 0.90656019919831 0.63368415295649 15.999 > 39 65 O 0.44660459805848 0.58405806376181 0.86415924461306 15.999 > 41 66 O 0.94660459805848 0.58405806376181 0.86415924461306 15.999 > 41 67 O 0.31967451254148 0.76213381404382 0.63577908369865 15.999 > 43 68 O 0.81967451254148 0.76213381404382 0.63577908369865 15.999 > 43 69 O 0.06967451254148 0.73786618595618 0.13577908369865 15.999 > 45 70 O 0.56967451254148 0.73786618595618 0.13577908369865 15.999 > 45 71 O 0.43032548745852 0.73786618595618 0.36422091630135 15.999 > 47 72 O 0.93032548745852 0.73786618595618 0.36422091630135 15.999 > 47 73 O 0.19660459805848 0.91594193623819 0.36415924461306 15.999 > 49 74 O 0.69660459805848 0.91594193623819 0.36415924461306 15.999 > 49 75 O 0.05339540194152 0.58405806376181 0.63584075538694 15.999 > 51 76 O 0.55339540194152 0.58405806376181 0.63584075538694 15.999 > 51 77 O 0.30339540194152 0.91594193623819 0.13584075538694 15.999 > 53 78 O 0.80339540194152 0.91594193623819 0.13584075538694 15.999 > 53 79 O 0.43091889053365 0.90656019919831 0.86631584704351 15.999 > 55 80 O 0.93091889053365 0.90656019919831 0.86631584704351 15.999 > 55 81 Ti 0.00000000000000 0.41709397693441 0.75000000000000 47.867 > 81 82 Ti 0.50000000000000 0.41709397693441 0.75000000000000 47.867 > 81 83 Ti 0.00000000000000 0.25062228684379 0.25000000000000 47.867 > 83 84 Ti 0.50000000000000 0.25062228684379 0.25000000000000 47.867 > 83 85 Ti 0.25000000000000 0.24937771315621 0.75000000000000 47.867 > 85 86 Ti 0.75000000000000 0.24937771315621 0.75000000000000 47.867 > 85 87 Ti 0.25000000000000 0.08290602306559 0.25000000000000 47.867 > 87 88 Ti 0.75000000000000 0.08290602306559 0.25000000000000 47.867 > 87 89 Ti 0.25000000000000 0.91709397693441 0.75000000000000 47.867 > 81 90 Ti 0.75000000000000 0.91709397693441 0.75000000000000 47.867 > 81 91 Ti 0.25000000000000 0.75062228684379 0.25000000000000 47.867 > 83 92 Ti 0.75000000000000 0.75062228684379 0.25000000000000 47.867 > 83 93 Ti 0.00000000000000 0.74937771315621 0.75000000000000 47.867 > 85 94 Ti 0.50000000000000 0.74937771315621 0.75000000000000 47.867 > 85 95 Ti 0.00000000000000 0.58290602306559 0.25000000000000 47.867 > 87 96 Ti 0.50000000000000 0.58290602306559 0.25000000000000 47.867 > 87 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.3308836 0.0000000 0.0088037 0.0000000 5.3699063 0.0000000 0.0088054 0.0000000 3.8003126 -------------------------- Born effective charges -------------------------- 1 Li 0.9648578 0.0998828 -0.0032249 0.0950657 1.0765624 -0.0108620 0.0114177 0.0194058 1.5948857 2 Li 0.9648578 -0.0998828 -0.0032249 -0.0950657 1.0765624 0.0108620 0.0114177 -0.0194058 1.5948857 3 Li 0.9648578 0.0998828 -0.0032249 0.0950657 1.0765624 -0.0108620 0.0114177 0.0194058 1.5948857 4 Li 0.9648578 -0.0998828 -0.0032249 -0.0950657 1.0765624 0.0108620 0.0114177 -0.0194058 1.5948857 5 Li 1.1266338 0.2064500 0.0180239 0.1976291 0.8948054 -0.0236814 -0.0180968 0.0332458 1.5916121 6 Li 1.1266338 -0.2064500 0.0180239 -0.1976291 0.8948054 0.0236814 -0.0180968 -0.0332458 1.5916121 7 Li 1.2100302 -0.0000000 0.0064876 0.0000000 1.1982358 0.0000000 -0.0043546 0.0000000 0.4660038 8 Li 1.2100302 -0.0000000 0.0064876 0.0000000 1.1982358 0.0000000 -0.0043546 0.0000000 0.4660038 9 O -3.1466745 -0.7681557 -0.2284552 -0.7798387 -2.2620948 0.3629069 -0.2031778 0.3184076 -1.8627852 10 O -3.2099345 -0.8202106 -0.2072076 -0.8719630 -2.2541466 0.3610174 -0.1920054 0.3238941 -1.8177914 11 O -3.1466745 0.7681557 -0.2284552 0.7798387 -2.2620948 -0.3629069 -0.2031778 -0.3184076 -1.8627852 12 O -3.1466745 -0.7681557 -0.2284552 -0.7798387 -2.2620948 0.3629069 -0.2031778 0.3184076 -1.8627852 13 O -1.7674755 -0.0235221 0.4183193 0.0158946 -3.6658715 0.0163771 0.3782405 0.0123892 -1.8160282 14 O -3.2099345 0.8202106 -0.2072076 0.8719630 -2.2541466 -0.3610174 -0.1920054 -0.3238941 -1.8177914 15 O -3.2099345 -0.8202106 -0.2072076 -0.8719630 -2.2541466 0.3610174 -0.1920054 0.3238941 -1.8177914 16 O -3.2099345 0.8202106 -0.2072076 0.8719630 -2.2541466 -0.3610174 -0.1920054 -0.3238941 -1.8177914 17 O -1.7674755 0.0235221 0.4183193 -0.0158946 -3.6658715 -0.0163771 0.3782405 -0.0123892 -1.8160282 18 O -1.7674755 0.0235221 0.4183193 -0.0158946 -3.6658715 -0.0163771 0.3782405 -0.0123892 -1.8160282 19 O -1.7674755 -0.0235221 0.4183193 0.0158946 -3.6658715 0.0163771 0.3782405 0.0123892 -1.8160282 20 O -3.1466745 0.7681557 -0.2284552 0.7798387 -2.2620948 -0.3629069 -0.2031778 -0.3184076 -1.8627852 21 Ti 5.9723385 -0.0000000 -0.0877067 0.0000000 6.0821859 0.0000000 0.0354117 0.0000000 2.8747190 22 Ti 6.0094511 -0.0000000 0.1043319 0.0000000 6.0358739 0.0000000 -0.0019103 0.0000000 2.8711032 23 Ti 6.0094511 -0.0000000 0.1043319 0.0000000 6.0358739 0.0000000 -0.0019103 0.0000000 2.8711032 24 Ti 5.9723385 -0.0000000 -0.0877067 0.0000000 6.0821859 0.0000000 0.0354117 0.0000000 2.8747190 ---------------------------------------------------------------------------- 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] [-0.0018 0.0000 0.0098] [ 0.0018 0.0000 -0.0098] 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] [-0.0018 0.0000 0.0098] [ 0.0018 0.0000 -0.0098] Computing fc3[ 13, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0018 0.0000 0.0098] [ 0.0018 0.0000 -0.0098] 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] [-0.0018 0.0000 0.0098] [ 0.0018 0.0000 -0.0098] Computing fc3[ 35, 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] [-0.0018 0.0000 0.0098] [ 0.0018 0.0000 -0.0098] 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] [-0.0018 0.0000 0.0098] [ 0.0018 0.0000 -0.0098] Computing fc3[ 81, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0018 0.0000 0.0098] [ 0.0018 0.0000 -0.0098] Computing fc3[ 83, 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] [-0.0018 0.0000 0.0098] [ 0.0018 0.0000 -0.0098] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000001 (yyy) -0.00000001 (yyy) -0.00000001 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (xz) 0.00000000 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 19:19:00]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 19:19:01]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.516992525005413 -4.368106500000000 0.000000000000000 b 2.516992525005413 4.368106500000000 0.000000000000000 c -1.710838581990054 0.000000000000000 9.512502458134843 Atomic positions (fractional): 1 Li 0.68060777732294 0.84011588172089 0.00038423785170 6.941 2 Li 0.15988411827911 0.31939222267706 0.49961576214830 6.941 3 Li 0.31939222267706 0.15988411827911 0.99961576214830 6.941 4 Li 0.84011588172089 0.68060777732294 0.50038423785170 6.941 5 Li 0.50000000000000 0.00000000000000 0.50000000000000 6.941 6 Li 0.00000000000000 0.50000000000000 0.00000000000000 6.941 7 Li 0.91593720236554 0.08406279763446 0.75000000000000 6.941 8 Li 0.08406279763446 0.91593720236554 0.25000000000000 6.941 9 O 0.76839798026561 0.95527758186898 0.36631584704351 15.999 10 O 0.59851716087321 0.12278478896086 0.86422091630135 15.999 11 O 0.04472241813102 0.23160201973439 0.13368415295649 15.999 12 O 0.23160201973439 0.04472241813102 0.63368415295649 15.999 13 O 0.30915113235516 0.47726725987877 0.86415924461306 15.999 14 O 0.87721521103914 0.40148283912679 0.63577908369865 15.999 15 O 0.40148283912679 0.87721521103914 0.13577908369865 15.999 16 O 0.12278478896086 0.59851716087321 0.36422091630135 15.999 17 O 0.47726725987877 0.30915113235516 0.36415924461306 15.999 18 O 0.52273274012123 0.69084886764484 0.63584075538694 15.999 19 O 0.69084886764484 0.52273274012123 0.13584075538694 15.999 20 O 0.95527758186898 0.76839798026561 0.86631584704351 15.999 21 Ti 0.58290602306559 0.41709397693441 0.75000000000000 47.867 22 Ti 0.74937771315621 0.25062228684379 0.25000000000000 47.867 23 Ti 0.25062228684379 0.74937771315621 0.75000000000000 47.867 24 Ti 0.41709397693441 0.58290602306559 0.25000000000000 47.867 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.067970100021650 0.000000000000000 0.000000000000000 b 0.000000000000000 8.736212999999999 0.000000000000000 c -1.710838581990054 0.000000000000000 9.512502458134843 Atomic positions (fractional): 1 Li 0.38018091476096 0.07975405219897 0.00038423785170 6.941 > 1 2 Li 0.88018091476096 0.07975405219897 0.00038423785170 6.941 > 1 3 Li 0.11981908523904 0.07975405219897 0.49961576214830 6.941 > 3 4 Li 0.61981908523904 0.07975405219897 0.49961576214830 6.941 > 3 5 Li 0.36981908523904 0.42024594780102 0.99961576214830 6.941 > 5 6 Li 0.86981908523904 0.42024594780102 0.99961576214830 6.941 > 5 7 Li 0.13018091476096 0.42024594780102 0.50038423785170 6.941 > 7 8 Li 0.63018091476096 0.42024594780102 0.50038423785170 6.941 > 7 9 Li 0.37500000000000 0.25000000000000 0.50000000000000 6.941 > 9 10 Li 0.87500000000000 0.25000000000000 0.50000000000000 6.941 > 9 11 Li 0.12500000000000 0.25000000000000 0.00000000000000 6.941 > 11 12 Li 0.62500000000000 0.25000000000000 0.00000000000000 6.941 > 11 13 Li 0.00000000000000 0.08406279763446 0.75000000000000 6.941 > 13 14 Li 0.50000000000000 0.08406279763446 0.75000000000000 6.941 > 13 15 Li 0.25000000000000 0.41593720236554 0.25000000000000 6.941 > 15 16 Li 0.75000000000000 0.41593720236554 0.25000000000000 6.941 > 15 17 Li 0.13018091476096 0.57975405219898 0.00038423785170 6.941 > 1 18 Li 0.63018091476096 0.57975405219898 0.00038423785170 6.941 > 1 19 Li 0.36981908523904 0.57975405219898 0.49961576214830 6.941 > 3 20 Li 0.86981908523904 0.57975405219898 0.49961576214830 6.941 > 3 21 Li 0.11981908523904 0.92024594780102 0.99961576214830 6.941 > 5 22 Li 0.61981908523904 0.92024594780102 0.99961576214830 6.941 > 5 23 Li 0.38018091476096 0.92024594780102 0.50038423785170 6.941 > 7 24 Li 0.88018091476096 0.92024594780102 0.50038423785170 6.941 > 7 25 Li 0.12500000000000 0.75000000000000 0.50000000000000 6.941 > 9 26 Li 0.62500000000000 0.75000000000000 0.50000000000000 6.941 > 9 27 Li 0.37500000000000 0.75000000000000 0.00000000000000 6.941 > 11 28 Li 0.87500000000000 0.75000000000000 0.00000000000000 6.941 > 11 29 Li 0.25000000000000 0.58406279763446 0.75000000000000 6.941 > 13 30 Li 0.75000000000000 0.58406279763446 0.75000000000000 6.941 > 13 31 Li 0.00000000000000 0.91593720236554 0.25000000000000 6.941 > 15 32 Li 0.50000000000000 0.91593720236554 0.25000000000000 6.941 > 15 33 O 0.43091889053365 0.09343980080169 0.36631584704351 15.999 > 33 34 O 0.93091889053365 0.09343980080169 0.36631584704351 15.999 > 33 35 O 0.43032548745852 0.26213381404382 0.86422091630135 15.999 > 35 36 O 0.93032548745852 0.26213381404382 0.86422091630135 15.999 > 35 37 O 0.06908110946635 0.09343980080169 0.13368415295649 15.999 > 37 38 O 0.56908110946635 0.09343980080169 0.13368415295649 15.999 > 37 39 O 0.31908110946635 0.40656019919831 0.63368415295649 15.999 > 39 40 O 0.81908110946635 0.40656019919831 0.63368415295649 15.999 > 39 41 O 0.19660459805848 0.08405806376181 0.86415924461306 15.999 > 41 42 O 0.69660459805848 0.08405806376181 0.86415924461306 15.999 > 41 43 O 0.06967451254148 0.26213381404382 0.63577908369865 15.999 > 43 44 O 0.56967451254148 0.26213381404382 0.63577908369865 15.999 > 43 45 O 0.31967451254148 0.23786618595618 0.13577908369865 15.999 > 45 46 O 0.81967451254148 0.23786618595618 0.13577908369865 15.999 > 45 47 O 0.18032548745852 0.23786618595618 0.36422091630135 15.999 > 47 48 O 0.68032548745852 0.23786618595618 0.36422091630135 15.999 > 47 49 O 0.44660459805848 0.41594193623819 0.36415924461306 15.999 > 49 50 O 0.94660459805848 0.41594193623819 0.36415924461306 15.999 > 49 51 O 0.30339540194152 0.08405806376181 0.63584075538694 15.999 > 51 52 O 0.80339540194152 0.08405806376181 0.63584075538694 15.999 > 51 53 O 0.05339540194152 0.41594193623819 0.13584075538694 15.999 > 53 54 O 0.55339540194152 0.41594193623819 0.13584075538694 15.999 > 53 55 O 0.18091889053365 0.40656019919831 0.86631584704351 15.999 > 55 56 O 0.68091889053365 0.40656019919831 0.86631584704351 15.999 > 55 57 O 0.18091889053365 0.59343980080169 0.36631584704351 15.999 > 33 58 O 0.68091889053365 0.59343980080169 0.36631584704351 15.999 > 33 59 O 0.18032548745852 0.76213381404382 0.86422091630135 15.999 > 35 60 O 0.68032548745852 0.76213381404382 0.86422091630135 15.999 > 35 61 O 0.31908110946635 0.59343980080169 0.13368415295649 15.999 > 37 62 O 0.81908110946635 0.59343980080169 0.13368415295649 15.999 > 37 63 O 0.06908110946635 0.90656019919831 0.63368415295649 15.999 > 39 64 O 0.56908110946635 0.90656019919831 0.63368415295649 15.999 > 39 65 O 0.44660459805848 0.58405806376181 0.86415924461306 15.999 > 41 66 O 0.94660459805848 0.58405806376181 0.86415924461306 15.999 > 41 67 O 0.31967451254148 0.76213381404382 0.63577908369865 15.999 > 43 68 O 0.81967451254148 0.76213381404382 0.63577908369865 15.999 > 43 69 O 0.06967451254148 0.73786618595618 0.13577908369865 15.999 > 45 70 O 0.56967451254148 0.73786618595618 0.13577908369865 15.999 > 45 71 O 0.43032548745852 0.73786618595618 0.36422091630135 15.999 > 47 72 O 0.93032548745852 0.73786618595618 0.36422091630135 15.999 > 47 73 O 0.19660459805848 0.91594193623819 0.36415924461306 15.999 > 49 74 O 0.69660459805848 0.91594193623819 0.36415924461306 15.999 > 49 75 O 0.05339540194152 0.58405806376181 0.63584075538694 15.999 > 51 76 O 0.55339540194152 0.58405806376181 0.63584075538694 15.999 > 51 77 O 0.30339540194152 0.91594193623819 0.13584075538694 15.999 > 53 78 O 0.80339540194152 0.91594193623819 0.13584075538694 15.999 > 53 79 O 0.43091889053365 0.90656019919831 0.86631584704351 15.999 > 55 80 O 0.93091889053365 0.90656019919831 0.86631584704351 15.999 > 55 81 Ti 0.00000000000000 0.41709397693441 0.75000000000000 47.867 > 81 82 Ti 0.50000000000000 0.41709397693441 0.75000000000000 47.867 > 81 83 Ti 0.00000000000000 0.25062228684379 0.25000000000000 47.867 > 83 84 Ti 0.50000000000000 0.25062228684379 0.25000000000000 47.867 > 83 85 Ti 0.25000000000000 0.24937771315621 0.75000000000000 47.867 > 85 86 Ti 0.75000000000000 0.24937771315621 0.75000000000000 47.867 > 85 87 Ti 0.25000000000000 0.08290602306559 0.25000000000000 47.867 > 87 88 Ti 0.75000000000000 0.08290602306559 0.25000000000000 47.867 > 87 89 Ti 0.25000000000000 0.91709397693441 0.75000000000000 47.867 > 81 90 Ti 0.75000000000000 0.91709397693441 0.75000000000000 47.867 > 81 91 Ti 0.25000000000000 0.75062228684379 0.25000000000000 47.867 > 83 92 Ti 0.75000000000000 0.75062228684379 0.25000000000000 47.867 > 83 93 Ti 0.00000000000000 0.74937771315621 0.75000000000000 47.867 > 85 94 Ti 0.50000000000000 0.74937771315621 0.75000000000000 47.867 > 85 95 Ti 0.00000000000000 0.58290602306559 0.25000000000000 47.867 > 87 96 Ti 0.50000000000000 0.58290602306559 0.25000000000000 47.867 > 87 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 5.3308836 0.0000000 0.0088037 0.0000000 5.3699063 0.0000000 0.0088054 0.0000000 3.8003126 -------------------------- Born effective charges -------------------------- 1 Li 0.9648578 0.0998828 -0.0032249 0.0950657 1.0765624 -0.0108620 0.0114177 0.0194058 1.5948857 2 Li 0.9648578 -0.0998828 -0.0032249 -0.0950657 1.0765624 0.0108620 0.0114177 -0.0194058 1.5948857 3 Li 0.9648578 0.0998828 -0.0032249 0.0950657 1.0765624 -0.0108620 0.0114177 0.0194058 1.5948857 4 Li 0.9648578 -0.0998828 -0.0032249 -0.0950657 1.0765624 0.0108620 0.0114177 -0.0194058 1.5948857 5 Li 1.1266338 0.2064500 0.0180239 0.1976291 0.8948054 -0.0236814 -0.0180968 0.0332458 1.5916121 6 Li 1.1266338 -0.2064500 0.0180239 -0.1976291 0.8948054 0.0236814 -0.0180968 -0.0332458 1.5916121 7 Li 1.2100302 -0.0000000 0.0064876 0.0000000 1.1982358 0.0000000 -0.0043546 0.0000000 0.4660038 8 Li 1.2100302 -0.0000000 0.0064876 0.0000000 1.1982358 0.0000000 -0.0043546 0.0000000 0.4660038 9 O -3.1466745 -0.7681557 -0.2284552 -0.7798387 -2.2620948 0.3629069 -0.2031778 0.3184076 -1.8627852 10 O -3.2099345 -0.8202106 -0.2072076 -0.8719630 -2.2541466 0.3610174 -0.1920054 0.3238941 -1.8177914 11 O -3.1466745 0.7681557 -0.2284552 0.7798387 -2.2620948 -0.3629069 -0.2031778 -0.3184076 -1.8627852 12 O -3.1466745 -0.7681557 -0.2284552 -0.7798387 -2.2620948 0.3629069 -0.2031778 0.3184076 -1.8627852 13 O -1.7674755 -0.0235221 0.4183193 0.0158946 -3.6658715 0.0163771 0.3782405 0.0123892 -1.8160282 14 O -3.2099345 0.8202106 -0.2072076 0.8719630 -2.2541466 -0.3610174 -0.1920054 -0.3238941 -1.8177914 15 O -3.2099345 -0.8202106 -0.2072076 -0.8719630 -2.2541466 0.3610174 -0.1920054 0.3238941 -1.8177914 16 O -3.2099345 0.8202106 -0.2072076 0.8719630 -2.2541466 -0.3610174 -0.1920054 -0.3238941 -1.8177914 17 O -1.7674755 0.0235221 0.4183193 -0.0158946 -3.6658715 -0.0163771 0.3782405 -0.0123892 -1.8160282 18 O -1.7674755 0.0235221 0.4183193 -0.0158946 -3.6658715 -0.0163771 0.3782405 -0.0123892 -1.8160282 19 O -1.7674755 -0.0235221 0.4183193 0.0158946 -3.6658715 0.0163771 0.3782405 0.0123892 -1.8160282 20 O -3.1466745 0.7681557 -0.2284552 0.7798387 -2.2620948 -0.3629069 -0.2031778 -0.3184076 -1.8627852 21 Ti 5.9723385 -0.0000000 -0.0877067 0.0000000 6.0821859 0.0000000 0.0354117 0.0000000 2.8747190 22 Ti 6.0094511 -0.0000000 0.1043319 0.0000000 6.0358739 0.0000000 -0.0019103 0.0000000 2.8711032 23 Ti 6.0094511 -0.0000000 0.1043319 0.0000000 6.0358739 0.0000000 -0.0019103 0.0000000 2.8711032 24 Ti 5.9723385 -0.0000000 -0.0877067 0.0000000 6.0821859 0.0000000 0.0354117 0.0000000 2.8747190 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000001 (yyy) -0.00000001 (yyy) -0.00000001 (yyy) Max drift of fc2: 0.00000000 (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 ... [ 12 12 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: 0.70, Number of G-points: 313, Lambda: 0.16 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/199) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 199 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 2.200 ( 0.000 0.000 0.000) 0.000 2.259 ( 0.000 0.000 0.000) 0.000 2.876 ( 0.000 0.000 0.000) 0.000 2.893 ( 0.000 0.000 0.000) 0.000 5.557 ( 0.000 0.000 0.000) 0.000 5.741 ( 0.000 0.000 0.000) 0.000 5.800 ( 0.000 0.000 0.000) 0.000 6.564 ( 0.000 0.000 0.000) 0.000 6.784 ( 0.000 0.000 0.000) 0.000 7.380 ( 0.000 0.000 0.000) 0.000 7.778 ( 0.000 0.000 0.000) 0.000 7.866 ( 0.000 0.000 0.000) 0.000 7.887 ( 0.000 0.000 0.000) 0.000 8.082 ( 0.000 0.000 0.000) 0.000 8.406 ( 0.000 0.000 0.000) 0.000 8.543 ( 0.000 0.000 0.000) 0.000 8.712 ( 0.000 0.000 0.000) 0.000 8.842 ( 0.000 0.000 0.000) 0.000 8.874 ( 0.000 0.000 0.000) 0.000 8.928 ( 0.000 0.000 0.000) 0.000 9.125 ( 0.000 0.000 0.000) 0.000 9.439 ( 0.000 0.000 0.000) 0.000 9.747 ( 0.000 0.000 0.000) 0.000 9.753 ( 0.000 0.000 0.000) 0.000 9.881 ( 0.000 0.000 0.000) 0.000 9.930 ( 0.000 0.000 0.000) 0.000 10.106 ( 0.000 0.000 0.000) 0.000 10.242 ( 0.000 0.000 0.000) 0.000 10.459 ( 0.000 0.000 0.000) 0.000 11.241 ( 0.000 0.000 0.000) 0.000 11.251 ( 0.000 0.000 0.000) 0.000 11.324 ( 0.000 0.000 0.000) 0.000 11.544 ( 0.000 0.000 0.000) 0.000 11.632 ( 0.000 0.000 0.000) 0.000 11.804 ( 0.000 0.000 0.000) 0.000 11.808 ( 0.000 0.000 0.000) 0.000 12.004 ( 0.000 0.000 0.000) 0.000 12.051 ( 0.000 0.000 0.000) 0.000 12.109 ( 0.000 0.000 0.000) 0.000 12.147 ( 0.000 0.000 0.000) 0.000 12.795 ( 0.000 0.000 0.000) 0.000 12.810 ( 0.000 0.000 0.000) 0.000 12.871 ( 0.000 0.000 0.000) 0.000 13.063 ( 0.000 0.000 0.000) 0.000 13.077 ( 0.000 0.000 0.000) 0.000 13.375 ( 0.000 0.000 0.000) 0.000 13.520 ( 0.000 0.000 0.000) 0.000 13.524 ( 0.000 0.000 0.000) 0.000 14.149 ( 0.000 0.000 0.000) 0.000 14.178 ( 0.000 0.000 0.000) 0.000 14.287 ( 0.000 0.000 0.000) 0.000 14.323 ( 0.000 0.000 0.000) 0.000 14.378 ( 0.000 0.000 0.000) 0.000 14.543 ( 0.000 0.000 0.000) 0.000 15.221 ( 0.000 0.000 0.000) 0.000 15.319 ( 0.000 0.000 0.000) 0.000 15.394 ( 0.000 0.000 0.000) 0.000 15.434 ( 0.000 0.000 0.000) 0.000 15.931 ( 0.000 0.000 0.000) 0.000 16.700 ( 0.000 0.000 0.000) 0.000 16.739 ( 0.000 0.000 0.000) 0.000 16.773 ( 0.000 0.000 0.000) 0.000 16.775 ( 0.000 0.000 0.000) 0.000 18.703 ( 0.000 0.000 0.000) 0.000 19.066 ( 0.000 0.000 0.000) 0.000 19.765 ( 0.000 0.000 0.000) 0.000 19.803 ( 0.000 0.000 0.000) 0.000 20.370 ( 0.000 0.000 0.000) 0.000 21.434 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/199) ======================= q-point: ( 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.774 ( 39.477 -11.421 5.211) 41.425 1.031 ( 48.604 -21.556 -2.897) 53.248 1.727 ( 73.792 -48.208 3.976) 88.233 2.216 ( 7.805 4.617 -0.779) 9.102 2.427 ( 6.358 -10.302 1.070) 12.153 3.013 ( 7.518 -14.215 -4.654) 16.740 3.240 ( 30.601 -15.575 3.044) 34.471 5.597 ( 0.969 4.287 1.516) 4.650 5.701 ( -0.392 -6.804 0.037) 6.816 5.911 ( 8.989 -4.886 -1.367) 10.322 6.640 ( 6.610 -1.680 -3.149) 7.511 6.991 ( 10.598 2.466 1.194) 10.947 7.389 ( -0.315 3.496 -5.529) 6.549 7.841 ( 1.347 0.580 -0.789) 1.665 7.869 ( -8.903 -4.591 -0.481) 10.028 7.995 ( 6.820 -10.955 0.656) 12.921 8.375 ( -3.402 1.614 -3.774) 5.331 8.454 ( -11.309 -5.070 1.745) 12.515 8.688 ( -0.865 2.361 1.854) 3.124 8.827 ( 2.324 4.897 -2.082) 5.806 8.860 ( 2.634 -0.670 -1.842) 3.283 8.981 ( 2.768 -5.300 -2.020) 6.312 9.149 ( 1.796 -0.983 1.256) 2.402 9.489 ( 4.885 -1.682 -5.082) 7.248 9.555 ( -5.275 -3.367 1.760) 6.501 9.728 ( -4.958 2.644 -0.714) 5.664 9.783 ( -2.383 0.215 -0.436) 2.432 9.876 ( -2.723 3.013 0.914) 4.162 9.933 ( -4.403 -2.860 -11.695) 12.820 10.289 ( 3.000 4.968 7.007) 9.098 10.368 ( -4.852 4.734 5.434) 8.688 11.105 ( -7.640 9.707 -0.443) 12.361 11.220 ( -0.692 -1.758 -8.200) 8.415 11.236 ( -11.119 4.535 6.740) 13.770 11.327 ( -4.967 -3.021 -18.034) 18.948 11.598 ( -14.270 11.340 -7.623) 19.757 11.622 ( -3.299 -0.989 -3.704) 5.058 11.735 ( -12.400 0.967 -1.280) 12.503 11.800 ( -6.239 9.550 3.483) 11.927 12.039 ( -0.991 2.776 -2.017) 3.572 12.090 ( -2.405 -8.993 2.706) 9.694 12.286 ( 6.792 2.711 6.056) 9.495 12.725 ( -6.126 -0.292 5.919) 8.524 12.744 ( -1.464 -2.670 -0.102) 3.046 12.823 ( 1.138 3.648 -3.308) 5.054 12.871 ( -1.422 -1.698 3.699) 4.312 13.094 ( 6.588 7.409 -1.222) 9.990 13.284 ( -1.696 8.904 11.856) 14.924 13.396 ( -4.862 0.657 -0.267) 4.913 13.424 ( -6.534 -0.420 -6.067) 8.926 14.018 ( -1.382 8.374 2.983) 8.996 14.191 ( -3.202 3.940 -1.820) 5.393 14.222 ( -10.906 -3.910 2.808) 11.921 14.269 ( 4.768 5.173 1.081) 7.117 14.398 ( 3.850 5.083 0.860) 6.434 14.464 ( -5.129 -4.704 0.659) 6.990 15.201 ( 2.755 -2.639 0.982) 3.939 15.255 ( -4.500 -4.393 -0.843) 6.345 15.534 ( 8.295 1.093 -3.527) 9.080 15.635 ( 11.780 -6.243 6.750) 14.944 16.006 ( 7.712 1.977 0.989) 8.023 16.622 ( -3.077 -3.005 0.406) 4.320 16.670 ( 4.249 -5.786 -1.092) 7.261 17.006 ( 17.155 -4.763 -0.168) 17.805 17.098 ( 17.008 -13.704 -2.433) 21.977 18.555 ( -8.804 4.690 -19.246) 21.678 19.058 ( -1.897 1.585 8.253) 8.615 19.815 ( 5.148 -1.610 0.281) 5.401 19.855 ( 4.130 -3.012 0.418) 5.129 20.332 ( -3.888 0.038 0.224) 3.894 21.337 ( -8.752 4.996 -0.550) 10.093 22.521 ( -1.796 0.135 -10.920) 11.067 ======================= Grid point 2 (3/199) ======================= q-point: ( 0.17 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.519 ( 31.123 -12.990 6.562) 34.357 1.921 ( 34.466 -16.001 -5.820) 38.443 2.403 ( 20.785 -2.957 2.405) 21.132 2.684 ( 12.215 -16.128 1.684) 20.301 3.373 ( 16.313 -22.327 -7.672) 28.696 3.405 ( 69.398 -46.743 4.485) 83.792 4.048 ( 41.317 -18.685 4.868) 45.606 5.489 ( -5.102 3.689 -2.574) 6.801 5.918 ( 12.317 -10.995 2.391) 16.683 6.149 ( 10.005 -9.598 -0.782) 13.887 6.782 ( 12.392 2.381 -3.726) 13.158 7.214 ( 11.841 -6.224 2.202) 13.558 7.322 ( -3.965 0.466 -2.545) 4.735 7.702 ( -10.925 -1.034 -1.833) 11.126 7.868 ( -0.238 -1.751 2.817) 3.325 8.083 ( -7.360 2.388 -1.192) 7.829 8.238 ( -5.969 -5.451 -10.432) 13.197 8.376 ( -8.236 -6.971 3.008) 11.201 8.658 ( -3.071 0.472 5.973) 6.733 8.788 ( -0.572 4.269 -5.464) 6.957 8.892 ( 0.016 -0.019 1.351) 1.352 9.064 ( -0.518 -7.435 1.244) 7.556 9.196 ( 3.366 3.533 1.568) 5.126 9.438 ( -7.924 -1.374 -3.567) 8.798 9.535 ( -3.886 4.308 -2.969) 6.517 9.607 ( -2.116 1.104 -3.967) 4.630 9.665 ( -6.358 6.839 -1.377) 9.439 9.840 ( -3.307 0.934 -4.531) 5.687 9.912 ( 4.389 6.018 3.574) 8.261 10.159 ( 0.776 13.485 6.655) 15.058 10.439 ( 6.285 1.330 8.729) 10.838 10.820 ( -12.834 10.712 0.747) 16.734 10.941 ( -15.066 2.532 4.282) 15.866 11.112 ( -17.735 12.285 -10.202) 23.865 11.191 ( -7.238 2.749 -1.398) 7.868 11.292 ( -3.571 1.663 -9.167) 9.977 11.417 ( -11.680 4.213 -5.935) 13.762 11.588 ( -4.122 -1.700 -2.814) 5.273 11.660 ( -5.371 5.078 2.982) 7.970 11.929 ( -4.883 6.830 1.882) 8.605 12.114 ( -6.392 -8.336 -2.369) 10.768 12.334 ( 1.788 4.325 5.122) 6.938 12.599 ( -9.592 1.269 4.938) 10.863 12.705 ( -4.931 2.410 -2.658) 6.098 12.799 ( -0.468 0.044 -1.070) 1.168 12.848 ( -4.779 0.357 2.191) 5.270 13.088 ( 0.015 7.695 -3.336) 8.387 13.151 ( -5.238 9.213 2.177) 10.819 13.225 ( -4.630 0.035 5.525) 7.209 13.451 ( 0.594 -2.615 -3.058) 4.067 13.858 ( -5.140 11.859 1.629) 13.027 13.982 ( -11.552 6.168 2.909) 13.414 14.104 ( -5.283 4.637 1.871) 7.274 14.214 ( -7.369 0.741 0.908) 7.461 14.465 ( 10.569 2.231 2.003) 10.987 14.570 ( 8.069 -0.753 -5.121) 9.587 15.262 ( 1.724 -1.673 -1.294) 2.729 15.321 ( 0.269 -12.208 4.141) 12.894 15.611 ( 5.695 3.814 -10.610) 12.631 15.870 ( 12.389 2.075 15.772) 20.164 16.080 ( 4.896 5.799 2.645) 8.037 16.714 ( 5.997 -12.834 -6.175) 15.453 16.988 ( 15.151 -20.175 3.415) 25.460 17.367 ( 20.552 -2.855 0.785) 20.764 17.532 ( 19.492 -14.752 -6.218) 25.223 18.217 ( -17.480 9.007 -13.218) 23.694 19.017 ( -3.366 2.740 8.413) 9.466 19.962 ( 8.972 -2.865 0.262) 9.422 19.977 ( 5.540 -3.922 1.201) 6.894 20.281 ( -2.495 -3.642 -0.954) 4.516 21.053 ( -16.523 10.075 1.183) 19.389 22.426 ( -6.299 -0.088 -7.454) 9.760 ======================= Grid point 3 (4/199) ======================= q-point: ( 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( 6.118 -10.875 0.691) 12.497 2.539 ( 29.630 -8.349 1.963) 30.846 2.819 ( 15.918 -17.238 4.217) 23.839 3.312 ( 38.899 -18.467 0.791) 43.067 3.884 ( 20.642 -22.897 -7.694) 31.774 4.865 ( 36.908 -16.109 3.822) 40.452 4.930 ( 57.159 -37.919 5.488) 68.813 5.382 ( -2.986 0.052 -4.830) 5.679 6.274 ( 13.484 -8.614 0.742) 16.018 6.377 ( 5.542 -16.360 -0.187) 17.274 6.987 ( 16.769 5.740 -1.308) 17.772 7.233 ( -5.006 1.174 0.311) 5.151 7.370 ( -7.449 -8.534 -0.244) 11.331 7.622 ( 5.919 2.124 -1.064) 6.378 7.860 ( -9.491 2.590 -4.769) 10.933 7.888 ( -2.411 -4.660 4.002) 6.599 8.185 ( -4.122 -5.818 -11.814) 13.799 8.287 ( -14.665 -13.229 -1.839) 19.835 8.593 ( -2.823 6.865 8.184) 11.049 8.699 ( -3.958 2.108 -6.733) 8.090 8.861 ( -3.456 1.863 5.344) 6.632 9.075 ( -5.978 3.116 4.427) 8.065 9.149 ( -0.956 4.199 2.090) 4.787 9.312 ( -4.791 2.373 -3.972) 6.660 9.437 ( -7.484 10.076 5.607) 13.747 9.473 ( -0.002 -2.943 -1.351) 3.238 9.575 ( -1.475 1.716 -4.779) 5.287 9.798 ( -6.266 1.979 0.997) 6.646 9.833 ( 0.699 1.884 1.980) 2.821 10.038 ( -4.999 17.039 1.397) 17.812 10.360 ( -10.424 11.179 1.862) 15.398 10.575 ( -7.017 11.534 1.585) 13.593 10.674 ( -15.790 4.838 -3.852) 16.958 10.905 ( -11.450 9.941 -3.078) 15.472 10.970 ( 9.273 -2.423 1.111) 9.649 11.127 ( -6.419 3.476 -2.521) 7.723 11.347 ( 0.203 -3.390 -6.987) 7.769 11.507 ( -6.656 5.294 2.818) 8.959 11.579 ( -0.672 -3.862 -4.490) 5.961 11.806 ( -1.712 7.065 2.919) 7.834 12.033 ( -10.318 -6.646 -1.791) 12.403 12.304 ( -2.474 4.844 3.195) 6.308 12.413 ( -12.879 1.137 2.765) 13.221 12.536 ( -8.363 4.748 -1.886) 9.800 12.693 ( -6.259 10.733 -2.407) 12.655 12.760 ( -7.657 -3.895 -0.779) 8.626 12.967 ( -3.633 3.070 0.148) 4.758 13.075 ( -1.124 2.173 4.307) 4.953 13.200 ( 0.835 5.173 2.178) 5.674 13.418 ( -4.502 1.230 -2.065) 5.103 13.663 ( -6.712 8.924 2.496) 11.442 13.738 ( -7.145 13.297 -0.159) 15.096 14.004 ( -2.089 3.380 2.699) 4.803 14.102 ( -7.462 -3.215 0.734) 8.158 14.616 ( 9.299 3.914 0.079) 10.089 14.657 ( 5.550 2.666 -4.421) 7.580 15.313 ( 1.535 -3.350 0.222) 3.692 15.448 ( -0.940 -12.444 4.713) 13.340 15.602 ( 4.936 6.493 -14.286) 16.450 16.043 ( 4.671 9.128 11.828) 15.654 16.202 ( 15.420 -1.450 12.478) 19.889 16.978 ( 10.406 -15.566 -9.492) 20.993 17.438 ( 11.940 -12.696 -2.323) 17.582 17.679 ( 3.418 -4.166 -2.115) 5.789 17.791 ( -3.457 6.092 3.290) 7.739 17.978 ( 16.255 -13.507 -8.776) 22.884 18.956 ( -3.048 2.712 5.742) 7.044 20.024 ( -2.105 -1.522 -1.423) 2.962 20.183 ( 10.580 -4.029 0.189) 11.322 20.338 ( -0.154 -7.636 -7.897) 10.987 20.668 ( -12.613 12.582 12.047) 21.506 22.272 ( -9.555 0.385 -6.383) 11.497 ======================= Grid point 4 (5/199) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.087 ( 1.503 -10.806 -0.898) 10.947 2.953 ( 13.666 -7.111 6.238) 16.621 3.421 ( 28.689 -20.191 3.985) 35.307 4.112 ( 35.424 -14.372 -0.500) 38.232 4.397 ( 18.179 -18.874 -5.262) 26.728 5.254 ( -3.481 1.773 -8.737) 9.570 5.464 ( 20.978 -7.702 8.362) 23.860 6.085 ( 27.031 -22.657 -5.604) 35.713 6.459 ( 9.331 -6.034 5.875) 12.570 6.688 ( 6.496 -21.801 0.254) 22.750 7.123 ( 1.070 6.282 0.915) 6.438 7.192 ( 2.296 -5.111 -1.643) 5.839 7.261 ( -4.013 5.597 1.163) 6.985 7.670 ( 2.761 -2.040 -1.753) 3.855 7.801 ( 1.629 -2.594 -0.763) 3.156 7.943 ( 2.757 -7.590 0.630) 8.099 8.073 ( -13.215 -1.233 -7.264) 15.130 8.223 ( -2.671 -13.260 -7.382) 15.410 8.486 ( -5.925 5.522 4.041) 9.051 8.636 ( 1.109 -1.497 -6.401) 6.667 8.769 ( -4.241 8.515 6.517) 11.531 8.942 ( -6.266 0.731 6.542) 9.088 9.012 ( -7.839 16.971 7.942) 20.311 9.255 ( 2.377 1.874 0.905) 3.159 9.311 ( -1.192 3.184 1.524) 3.726 9.509 ( -2.593 -4.771 -0.111) 5.431 9.546 ( -0.176 -1.738 -2.993) 3.466 9.649 ( -3.400 7.233 1.737) 8.179 9.813 ( -1.589 5.671 -1.552) 6.090 9.901 ( 1.079 -2.103 1.336) 2.715 10.019 ( -14.309 12.299 -2.204) 18.997 10.349 ( -10.416 7.344 -2.162) 12.927 10.419 ( -9.584 6.335 2.269) 11.710 10.663 ( -3.748 4.736 -0.064) 6.039 10.880 ( -9.140 6.248 -9.657) 14.692 11.253 ( 5.822 -2.054 2.119) 6.527 11.364 ( -4.787 2.860 0.285) 5.583 11.402 ( 5.631 -1.917 -1.504) 6.135 11.601 ( -0.278 -3.034 -2.756) 4.108 11.780 ( 4.041 4.214 2.609) 6.395 11.907 ( -11.116 -5.458 -2.056) 12.553 12.106 ( -12.709 1.666 -0.876) 12.848 12.277 ( -2.253 7.294 3.347) 8.335 12.348 ( -9.031 4.641 0.510) 10.166 12.459 ( -8.036 10.875 0.505) 13.531 12.649 ( -8.515 -4.607 -3.402) 10.262 12.865 ( -4.185 5.462 0.964) 6.948 13.092 ( 0.985 1.227 3.903) 4.208 13.118 ( -4.495 4.801 1.783) 6.815 13.289 ( -6.288 3.906 0.540) 7.422 13.492 ( -3.514 14.889 -2.839) 15.559 13.525 ( -4.290 3.009 0.490) 5.263 13.988 ( 1.464 1.438 1.487) 2.534 14.030 ( -5.655 -3.646 1.175) 6.831 14.654 ( 3.321 5.620 -4.497) 7.927 14.713 ( 3.083 2.122 1.852) 4.176 15.389 ( 2.094 -6.854 1.068) 7.246 15.554 ( -0.035 -9.088 3.446) 9.719 15.593 ( 7.409 7.704 -14.009) 17.621 16.046 ( 1.440 4.664 6.694) 8.284 16.540 ( 16.283 0.121 16.089) 22.891 17.063 ( -18.218 11.704 -10.752) 24.176 17.345 ( 8.448 -10.789 -4.110) 14.306 17.909 ( 9.298 -10.902 2.625) 14.567 18.021 ( 12.658 -7.123 6.493) 15.910 18.329 ( 12.601 -12.304 -8.842) 19.707 18.909 ( -1.190 2.039 3.051) 3.857 19.813 ( -24.422 2.827 -14.562) 28.574 20.156 ( -2.927 6.332 7.925) 10.558 20.440 ( 10.760 -1.884 2.105) 11.125 20.730 ( 10.668 -5.808 7.243) 14.142 22.071 ( -11.341 1.354 -5.311) 12.596 ======================= Grid point 5 (6/199) ======================= q-point: ( 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.201 ( 1.527 -7.201 -0.329) 7.368 3.228 ( 9.220 -6.077 4.403) 11.888 4.043 ( 22.867 -13.913 4.464) 27.137 4.666 ( 17.398 -6.925 -0.817) 18.743 4.758 ( 7.965 -9.875 -2.587) 12.948 5.151 ( -3.082 0.309 -7.644) 8.248 5.770 ( 9.179 -1.210 4.279) 10.199 6.349 ( 3.683 -10.804 -4.839) 12.398 6.541 ( 0.670 4.564 1.296) 4.792 6.968 ( -3.169 -0.090 3.097) 4.431 7.079 ( -2.449 -9.959 -6.763) 12.285 7.110 ( -3.221 4.959 6.453) 8.753 7.309 ( 0.025 -2.747 0.554) 2.802 7.752 ( -10.761 -6.981 -5.073) 13.794 7.864 ( 13.091 4.124 0.209) 13.727 8.001 ( -2.677 -10.500 -0.077) 10.836 8.127 ( 15.433 -4.980 -2.993) 16.491 8.325 ( 10.813 -4.538 -2.120) 11.917 8.412 ( -1.385 -0.739 -1.543) 2.201 8.609 ( -4.663 2.306 5.849) 7.828 8.647 ( -8.185 -1.838 3.794) 9.207 8.770 ( -3.130 8.899 6.141) 11.256 8.886 ( -0.300 3.137 0.200) 3.158 9.291 ( 1.069 0.759 2.557) 2.874 9.339 ( 7.883 6.281 2.167) 10.310 9.463 ( -6.131 -4.591 -1.850) 7.879 9.554 ( 1.243 4.424 -1.506) 4.836 9.613 ( -2.087 -5.179 0.757) 5.634 9.683 ( -10.272 10.627 -3.920) 15.291 9.790 ( -1.153 0.334 -0.656) 1.368 9.896 ( 0.513 5.202 -2.085) 5.628 10.146 ( -6.379 -3.437 2.226) 7.580 10.317 ( 0.819 7.211 1.742) 7.464 10.583 ( -4.514 3.261 3.926) 6.813 10.671 ( -4.778 1.033 -10.288) 11.391 11.259 ( -1.949 -0.993 -1.222) 2.505 11.322 ( -0.152 1.506 1.336) 2.019 11.426 ( -5.416 0.991 -1.879) 5.818 11.619 ( 0.407 -1.341 -1.216) 1.855 11.760 ( -4.728 -1.945 -1.604) 5.358 11.868 ( 1.569 -3.317 -2.546) 4.466 11.983 ( -1.987 -0.201 4.821) 5.218 12.145 ( -3.925 7.612 -1.024) 8.625 12.196 ( 1.553 14.421 -0.266) 14.507 12.260 ( -9.770 -1.839 5.226) 11.231 12.543 ( -8.346 -2.875 -1.106) 8.897 12.768 ( -2.036 3.948 -0.996) 4.553 12.930 ( -4.546 7.696 -0.528) 8.954 13.158 ( 0.329 -3.783 3.226) 4.982 13.185 ( -2.434 3.159 3.094) 5.047 13.307 ( -2.368 9.811 -3.672) 10.740 13.481 ( -1.087 -0.336 -0.471) 1.232 13.985 ( -3.415 -2.631 1.089) 4.446 14.013 ( 1.872 1.015 0.056) 2.130 14.634 ( 1.293 3.864 -1.555) 4.361 14.720 ( -0.162 1.022 0.502) 1.150 15.510 ( -1.181 -10.977 7.401) 13.292 15.600 ( 12.171 15.483 -14.135) 24.242 15.681 ( 3.219 -13.737 0.101) 14.110 16.044 ( 0.413 2.436 3.026) 3.906 16.488 ( -20.448 13.756 -3.946) 24.958 16.850 ( 7.135 0.765 12.526) 14.436 17.684 ( 16.498 -11.358 -0.581) 20.038 18.071 ( 6.446 2.031 -3.431) 7.580 18.292 ( 6.643 -8.736 4.255) 11.771 18.567 ( 4.188 -13.475 -4.882) 14.931 18.896 ( 0.713 1.652 1.335) 2.240 19.255 ( -26.059 11.111 -7.992) 29.434 20.134 ( 0.677 2.348 4.807) 5.392 20.609 ( 6.479 -1.255 1.265) 6.719 20.990 ( 10.240 -5.838 3.349) 12.253 21.856 ( -10.059 2.094 -3.641) 10.900 ======================= Grid point 6 (7/199) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.251 ( 0.000 -0.000 0.000) 0.000 3.351 ( 0.000 -0.000 0.000) 0.000 4.350 ( 0.000 -0.000 0.000) 0.000 4.799 ( 0.000 -0.000 0.000) 0.000 4.855 ( -0.000 -0.000 0.000) 0.000 5.123 ( -0.000 -0.000 -0.000) 0.000 5.861 ( 0.000 -0.000 0.000) 0.000 6.396 ( 0.000 -0.000 0.000) 0.000 6.590 ( 0.000 -0.000 -0.000) 0.000 6.866 ( 0.000 -0.000 0.000) 0.000 7.086 ( 0.000 0.000 0.000) 0.000 7.092 ( -0.000 -0.000 -0.000) 0.000 7.294 ( 0.000 0.000 0.000) 0.000 7.656 ( -0.000 -0.000 0.000) 0.000 7.959 ( -0.000 -0.000 -0.000) 0.000 8.017 ( 0.000 0.000 0.000) 0.000 8.269 ( 0.000 -0.000 -0.000) 0.000 8.415 ( -0.000 0.000 0.000) 0.000 8.468 ( 0.000 -0.000 0.000) 0.000 8.642 ( -0.000 -0.000 0.000) 0.000 8.674 ( 0.000 0.000 -0.000) 0.000 8.689 ( 0.000 -0.000 0.000) 0.000 8.895 ( 0.000 -0.000 0.000) 0.000 9.211 ( 0.000 -0.000 -0.000) 0.000 9.367 ( -0.000 -0.000 -0.000) 0.000 9.466 ( 0.000 -0.000 0.000) 0.000 9.483 ( 0.000 0.000 0.000) 0.000 9.545 ( 0.000 -0.000 0.000) 0.000 9.684 ( 0.000 -0.000 0.000) 0.000 9.698 ( -0.000 0.000 -0.000) 0.000 9.903 ( 0.000 0.000 0.000) 0.000 10.171 ( 0.000 -0.000 0.000) 0.000 10.236 ( -0.000 0.000 0.000) 0.000 10.548 ( -0.000 -0.000 -0.000) 0.000 10.620 ( 0.000 0.000 0.000) 0.000 11.260 ( 0.000 0.000 0.000) 0.000 11.296 ( 0.000 -0.000 -0.000) 0.000 11.340 ( -0.000 -0.000 -0.000) 0.000 11.625 ( 0.000 -0.000 0.000) 0.000 11.736 ( 0.000 -0.000 0.000) 0.000 11.884 ( 0.000 -0.000 -0.000) 0.000 11.987 ( 0.000 0.000 0.000) 0.000 12.082 ( 0.000 -0.000 -0.000) 0.000 12.116 ( -0.000 -0.000 0.000) 0.000 12.224 ( 0.000 0.000 -0.000) 0.000 12.463 ( 0.000 0.000 0.000) 0.000 12.713 ( -0.000 0.000 0.000) 0.000 12.870 ( 0.000 -0.000 0.000) 0.000 13.157 ( 0.000 -0.000 -0.000) 0.000 13.199 ( 0.000 -0.000 0.000) 0.000 13.218 ( -0.000 0.000 0.000) 0.000 13.474 ( 0.000 0.000 0.000) 0.000 13.970 ( 0.000 -0.000 0.000) 0.000 14.026 ( 0.000 -0.000 0.000) 0.000 14.623 ( 0.000 -0.000 0.000) 0.000 14.712 ( -0.000 -0.000 0.000) 0.000 15.561 ( -0.000 -0.000 0.000) 0.000 15.605 ( 0.000 0.000 -0.000) 0.000 15.931 ( -0.000 0.000 -0.000) 0.000 15.973 ( 0.000 -0.000 0.000) 0.000 16.146 ( -0.000 0.000 0.000) 0.000 16.932 ( 0.000 -0.000 0.000) 0.000 17.967 ( 0.000 -0.000 0.000) 0.000 18.071 ( 0.000 0.000 0.000) 0.000 18.397 ( 0.000 0.000 0.000) 0.000 18.727 ( 0.000 -0.000 0.000) 0.000 18.838 ( 0.000 0.000 0.000) 0.000 18.908 ( 0.000 -0.000 0.000) 0.000 20.137 ( 0.000 0.000 0.000) 0.000 20.672 ( 0.000 -0.000 0.000) 0.000 21.129 ( 0.000 -0.000 0.000) 0.000 21.737 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 14 (8/199) ======================= q-point: ( 0.08 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.474 ( 42.614 -0.000 8.277) 43.411 1.692 ( 33.405 -0.000 13.986) 36.215 2.448 ( 21.322 -0.000 1.951) 21.411 2.462 ( 4.679 -0.000 -1.278) 4.851 2.907 ( 85.934 -0.000 -8.367) 86.340 3.131 ( 20.013 -0.000 -14.769) 24.873 3.885 ( 47.526 -0.000 13.148) 49.311 5.535 ( -6.851 0.000 -5.000) 8.482 5.790 ( 10.910 -0.000 5.039) 12.018 6.062 ( 11.849 -0.000 -1.282) 11.919 6.802 ( 13.755 -0.000 -6.468) 15.199 7.137 ( 7.238 -0.000 4.717) 8.639 7.326 ( -3.649 0.000 -5.228) 6.375 7.670 ( -10.157 0.000 -0.207) 10.159 7.836 ( -3.666 0.000 5.803) 6.864 8.101 ( 4.119 -0.000 -1.757) 4.478 8.141 ( -16.859 0.000 -4.745) 17.514 8.314 ( -5.278 0.000 -6.928) 8.709 8.683 ( -0.531 0.000 6.844) 6.865 8.871 ( -5.099 0.000 -6.709) 8.427 8.890 ( -0.273 0.000 0.601) 0.660 8.949 ( 4.757 -0.000 2.561) 5.403 9.232 ( 4.940 -0.000 0.051) 4.941 9.447 ( -6.630 0.000 1.888) 6.893 9.575 ( 4.842 -0.000 -8.703) 9.959 9.593 ( -8.311 0.000 -3.115) 8.875 9.750 ( -7.080 0.000 -2.541) 7.522 9.841 ( -2.912 0.000 -6.070) 6.733 9.982 ( 6.589 -0.000 3.485) 7.454 10.343 ( 5.294 -0.000 7.673) 9.322 10.409 ( 2.854 -0.000 10.336) 10.723 10.928 ( -17.621 0.000 2.374) 17.780 10.971 ( -22.912 0.000 8.968) 24.604 11.190 ( -0.505 0.000 -5.968) 5.989 11.262 ( 2.568 -0.000 -16.120) 16.323 11.289 ( -21.902 0.000 -10.585) 24.325 11.480 ( -17.457 0.000 -2.173) 17.592 11.555 ( -2.967 0.000 -5.439) 6.196 11.753 ( -6.113 0.000 5.395) 8.153 11.979 ( -7.603 0.000 4.990) 9.094 12.004 ( -3.933 0.000 -3.922) 5.554 12.410 ( 3.144 -0.000 3.990) 5.079 12.616 ( -10.296 0.000 5.907) 11.871 12.699 ( -2.381 0.000 -2.815) 3.687 12.802 ( -3.681 0.000 3.511) 5.087 12.827 ( -5.957 0.000 -1.990) 6.281 13.184 ( -9.973 0.000 1.630) 10.105 13.236 ( -0.897 0.000 -5.668) 5.739 13.257 ( -3.622 0.000 6.030) 7.034 13.409 ( 3.349 -0.000 -2.345) 4.088 14.006 ( -9.757 0.000 1.398) 9.856 14.009 ( -9.654 0.000 6.433) 11.601 14.174 ( -1.570 0.000 0.261) 1.591 14.179 ( -11.857 0.000 2.819) 12.188 14.513 ( 12.351 -0.000 1.761) 12.476 14.598 ( 12.008 -0.000 -5.625) 13.260 15.197 ( -1.658 0.000 1.784) 2.436 15.206 ( 0.287 -0.000 1.485) 1.512 15.659 ( 7.349 -0.000 -7.821) 10.733 15.886 ( 15.813 -0.000 9.996) 18.708 16.220 ( 14.090 -0.000 -2.457) 14.303 16.627 ( 3.871 -0.000 13.124) 13.683 16.648 ( 4.466 -0.000 -10.001) 10.952 17.373 ( 25.863 -0.000 -3.220) 26.063 17.373 ( 22.214 -0.000 0.097) 22.215 18.304 ( -17.621 0.000 -16.522) 24.155 19.046 ( -3.779 0.000 10.103) 10.787 19.937 ( 10.098 -0.000 0.820) 10.131 19.943 ( 7.793 -0.000 0.351) 7.801 20.245 ( -5.824 0.000 -1.036) 5.916 21.149 ( -16.503 0.000 1.742) 16.595 22.409 ( -6.833 0.000 -10.284) 12.347 ======================= Grid point 15 (9/199) ======================= q-point: ( 0.17 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.937 ( 12.876 9.710 5.246) 16.959 2.302 ( 33.933 -17.273 6.277) 38.590 2.554 ( 4.408 -6.789 -0.501) 8.110 3.070 ( 42.735 -6.420 9.437) 44.233 3.547 ( 27.347 -10.109 -13.839) 32.273 4.334 ( 75.812 -17.352 -5.886) 77.995 4.738 ( 45.542 -2.146 13.876) 47.657 5.414 ( -3.872 1.703 -8.624) 9.606 6.030 ( 10.769 -9.299 3.360) 14.620 6.247 ( 7.915 -2.406 -1.538) 8.415 7.031 ( 15.206 -1.504 -5.648) 16.291 7.179 ( -4.820 -2.571 0.131) 5.464 7.341 ( 2.335 3.769 3.443) 5.614 7.559 ( -1.611 -6.850 0.448) 7.051 7.769 ( -10.248 -4.866 2.602) 11.639 7.893 ( -9.943 0.388 -0.656) 9.972 8.054 ( -8.215 -3.288 -4.599) 9.972 8.209 ( -3.390 0.353 -12.529) 12.984 8.706 ( 0.445 3.993 10.422) 11.170 8.747 ( -4.940 2.424 -5.420) 7.723 8.832 ( -7.269 -2.547 3.366) 8.406 9.058 ( 4.325 -2.194 2.063) 5.270 9.277 ( -1.421 3.977 1.465) 4.470 9.307 ( -6.589 0.538 -1.883) 6.874 9.475 ( -2.885 1.180 -2.941) 4.285 9.583 ( -6.975 1.866 -1.460) 7.366 9.600 ( -0.624 1.951 -4.499) 4.943 9.809 ( -0.219 0.436 -1.610) 1.683 9.896 ( -8.592 3.262 3.960) 10.007 10.341 ( -9.081 11.913 6.005) 16.138 10.507 ( -9.554 4.217 4.774) 11.482 10.651 ( -13.708 -0.315 2.307) 13.904 10.682 ( -14.314 -4.697 0.330) 15.068 11.009 ( 9.408 6.379 -4.673) 12.290 11.078 ( -14.467 4.648 -0.412) 15.201 11.189 ( -7.818 1.991 -5.715) 9.886 11.288 ( 1.741 -2.286 -9.425) 9.853 11.509 ( -1.949 -2.771 -5.230) 6.231 11.629 ( -6.844 6.650 4.330) 10.479 11.866 ( -10.534 -5.191 4.717) 12.656 11.917 ( -3.997 -0.217 -3.937) 5.615 12.406 ( -8.185 4.094 5.417) 10.635 12.427 ( -7.714 1.291 3.234) 8.464 12.574 ( -11.645 0.115 1.376) 11.726 12.663 ( -12.283 -2.539 -2.275) 12.747 12.805 ( 0.413 -1.843 1.877) 2.663 13.017 ( -6.165 5.242 -2.985) 8.626 13.119 ( -6.055 -0.063 1.182) 6.170 13.293 ( 2.675 2.785 -1.659) 4.203 13.441 ( -0.534 0.984 0.206) 1.138 13.791 ( -12.463 4.073 4.715) 13.934 13.889 ( -4.072 2.888 1.224) 5.140 14.056 ( -4.693 2.445 3.556) 6.375 14.127 ( -3.787 1.908 1.367) 4.455 14.693 ( 10.259 3.628 1.002) 10.928 14.747 ( 10.438 5.303 -8.581) 14.516 15.177 ( -4.587 -6.100 3.745) 8.502 15.233 ( -2.806 -8.518 1.242) 9.054 15.741 ( 9.471 4.944 -11.006) 15.339 16.189 ( 16.266 0.122 10.861) 19.559 16.337 ( 11.784 17.769 0.298) 21.323 16.721 ( 8.625 -7.327 -4.500) 12.179 16.972 ( 10.305 -25.884 8.252) 29.056 17.714 ( 17.470 3.364 -2.639) 17.986 17.808 ( 21.063 -5.734 -6.944) 22.907 17.904 ( -18.590 3.627 -4.921) 19.569 19.004 ( -2.859 1.631 7.400) 8.099 20.049 ( 1.062 4.132 -1.583) 4.550 20.149 ( 14.302 -1.100 1.005) 14.380 20.178 ( -0.786 -7.041 -5.493) 8.964 20.845 ( -16.919 4.905 9.896) 20.205 22.244 ( -10.588 -1.926 -9.783) 14.544 ======================= Grid point 16 (10/199) ======================= q-point: ( 0.25 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.025 ( 7.756 4.032 2.924) 9.218 2.727 ( 3.955 -16.773 0.200) 17.234 3.069 ( 35.861 -13.595 8.694) 39.324 3.875 ( 39.084 -9.657 7.316) 40.919 4.080 ( 26.540 -12.782 -10.595) 31.305 5.274 ( -1.510 0.230 -4.347) 4.607 5.449 ( 33.702 4.649 4.193) 34.279 5.638 ( 52.857 -19.418 -3.722) 56.434 6.300 ( 3.912 -14.634 0.344) 15.152 6.363 ( 5.477 -6.877 -0.865) 8.834 7.113 ( -4.486 -2.404 0.020) 5.089 7.247 ( -3.467 0.109 2.229) 4.123 7.298 ( 11.757 3.787 -2.334) 12.571 7.601 ( -14.716 -6.353 0.798) 16.048 7.683 ( 1.722 -8.342 -1.938) 8.736 7.836 ( 1.640 -1.328 6.187) 6.537 7.994 ( -0.692 -5.408 -6.945) 8.829 8.111 ( -2.067 1.172 -12.467) 12.692 8.594 ( -9.893 4.178 2.011) 10.926 8.647 ( -1.913 1.755 -5.008) 5.641 8.821 ( -0.462 -1.383 11.869) 11.959 9.023 ( -8.809 8.095 1.530) 12.061 9.165 ( 0.405 -1.979 -0.798) 2.172 9.283 ( -3.459 -3.563 0.973) 5.060 9.418 ( -8.095 11.172 5.451) 14.834 9.460 ( 2.962 2.044 -0.308) 3.612 9.562 ( -0.990 2.005 -5.659) 6.085 9.722 ( -3.315 0.786 1.488) 3.718 9.874 ( 0.566 0.354 -1.202) 1.375 10.000 ( -10.480 10.435 2.478) 14.995 10.207 ( -16.895 6.026 -1.242) 17.980 10.393 ( -17.291 -2.379 -1.083) 17.488 10.509 ( -8.501 2.737 4.906) 10.189 10.765 ( -11.919 4.894 1.120) 12.933 11.014 ( -6.454 6.834 -9.697) 13.505 11.255 ( 9.383 2.476 -1.133) 9.770 11.374 ( 10.719 -1.190 -2.237) 11.014 11.438 ( -7.224 4.381 -1.164) 8.529 11.527 ( -0.666 -3.719 -0.525) 3.814 11.756 ( -11.778 -7.915 2.015) 14.333 11.875 ( 1.154 2.700 -1.602) 3.345 12.133 ( -16.651 1.574 2.338) 16.887 12.312 ( -11.927 -0.263 5.394) 13.093 12.379 ( -12.365 -0.954 2.593) 12.670 12.524 ( -4.406 -0.499 -2.492) 5.087 12.750 ( -4.039 9.322 -2.875) 10.558 12.938 ( -1.319 -0.854 2.328) 2.809 13.022 ( -5.104 -0.659 0.886) 5.222 13.274 ( -1.522 4.359 -1.951) 5.013 13.375 ( -2.889 4.301 2.549) 5.774 13.587 ( -7.921 5.786 2.021) 10.015 13.775 ( -3.987 9.351 0.027) 10.166 13.981 ( -3.853 0.504 3.119) 4.982 14.045 ( -2.155 3.391 0.766) 4.090 14.771 ( 2.865 4.308 0.260) 5.180 14.778 ( 4.267 7.362 -5.562) 10.166 15.203 ( -3.858 -11.274 4.166) 12.623 15.293 ( -0.953 -12.162 -2.385) 12.430 15.823 ( 12.090 8.906 -11.425) 18.868 16.263 ( 7.499 17.210 -6.269) 19.792 16.557 ( 16.767 2.648 21.815) 27.641 16.980 ( 10.702 -14.993 -10.644) 21.275 17.329 ( -20.323 1.958 -6.288) 21.364 17.443 ( 1.364 -24.373 9.271) 26.113 18.035 ( 14.681 2.693 5.414) 15.878 18.181 ( 15.976 -5.436 -4.668) 17.509 18.987 ( 2.971 4.203 2.534) 5.737 19.828 ( -20.220 0.544 -12.386) 23.718 20.245 ( 3.178 3.014 0.713) 4.437 20.429 ( 16.077 -1.587 0.203) 16.156 20.691 ( 0.542 1.852 16.020) 16.136 22.042 ( -13.048 -3.296 -9.337) 16.380 ======================= Grid point 17 (11/199) ======================= q-point: ( 0.33 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.168 ( 11.737 3.330 4.874) 13.138 2.983 ( 5.486 -18.556 0.340) 19.353 3.775 ( 30.061 -12.859 7.960) 33.651 4.507 ( 22.031 -9.581 3.397) 24.263 4.550 ( 18.725 -9.512 -6.080) 21.865 5.172 ( -3.917 1.740 -10.893) 11.706 5.853 ( 19.852 8.511 6.325) 22.506 6.195 ( 7.823 -4.241 -3.482) 9.556 6.533 ( 2.901 -8.763 -2.722) 9.623 6.668 ( 15.234 -17.158 1.446) 22.991 7.129 ( 0.799 -4.315 -1.832) 4.756 7.138 ( -2.145 4.311 1.581) 5.069 7.276 ( -6.764 4.368 3.282) 8.695 7.540 ( -8.403 -13.202 -1.567) 15.727 7.849 ( 10.961 -6.507 -0.699) 12.766 7.866 ( -4.439 -3.697 3.388) 6.697 8.072 ( 8.920 -0.601 -5.221) 10.353 8.128 ( 5.246 -7.745 -10.841) 14.319 8.448 ( -0.204 2.614 2.802) 3.837 8.601 ( -1.593 0.043 -5.301) 5.535 8.759 ( -7.725 6.082 3.768) 10.529 8.917 ( 0.543 1.269 6.090) 6.244 9.088 ( -11.056 21.024 9.947) 25.753 9.200 ( -3.447 -7.117 0.604) 7.931 9.278 ( -4.477 -7.145 2.950) 8.933 9.493 ( -0.059 0.867 -4.795) 4.873 9.533 ( 2.529 0.672 -2.742) 3.790 9.684 ( 0.892 6.208 -2.097) 6.613 9.830 ( 2.911 0.016 0.059) 2.911 9.870 ( -10.208 6.060 1.220) 11.934 9.980 ( 3.371 7.144 -2.005) 8.150 10.156 ( -12.050 1.007 1.217) 12.153 10.387 ( -2.752 -0.738 1.657) 3.296 10.635 ( -3.370 2.269 6.421) 7.598 10.788 ( -6.569 10.104 -10.522) 15.999 11.246 ( -4.729 1.095 -0.746) 4.912 11.346 ( -0.512 1.008 -0.083) 1.134 11.455 ( -5.223 1.915 -1.876) 5.871 11.560 ( -1.014 -4.364 0.281) 4.488 11.679 ( -2.058 -5.332 -0.077) 5.716 11.840 ( -4.504 -0.471 -3.799) 5.911 11.940 ( -9.483 -3.505 3.972) 10.862 12.147 ( -8.539 -3.754 5.120) 10.641 12.190 ( -11.423 -0.436 1.843) 11.579 12.469 ( -0.691 6.179 0.409) 6.231 12.577 ( -3.535 7.086 -3.386) 8.613 12.860 ( -2.967 4.818 -0.620) 5.692 13.049 ( 0.068 -6.605 3.396) 7.427 13.135 ( -5.908 9.584 1.570) 11.368 13.287 ( -1.938 8.913 1.552) 9.253 13.462 ( -3.462 -0.879 -0.357) 3.589 13.578 ( -4.564 14.716 -1.690) 15.500 13.938 ( -2.902 -1.890 2.658) 4.365 14.013 ( -0.514 -0.104 -0.074) 0.530 14.718 ( -2.052 4.185 -0.943) 4.756 14.755 ( -0.249 3.168 -0.263) 3.189 15.261 ( -5.423 -12.800 4.785) 14.701 15.442 ( 6.731 -12.068 -5.021) 14.702 15.890 ( 11.897 11.817 -12.285) 20.787 16.198 ( 5.669 15.190 -4.776) 16.902 16.697 ( -17.000 7.977 -2.206) 18.907 16.863 ( -2.254 1.236 11.284) 11.573 17.393 ( 15.257 -18.591 0.373) 24.053 17.812 ( 4.687 -25.713 3.889) 26.425 18.193 ( 4.038 1.330 7.112) 8.286 18.406 ( 6.090 -5.197 -2.515) 8.392 19.041 ( 10.516 9.195 -2.873) 14.261 19.383 ( -23.923 3.347 -7.754) 25.370 20.239 ( 2.682 8.291 4.213) 9.679 20.656 ( 12.098 5.072 1.685) 13.226 20.868 ( 10.359 -6.796 7.222) 14.341 21.830 ( -13.231 -4.213 -8.045) 16.048 ======================= Grid point 18 (12/199) ======================= q-point: ( 0.42 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.340 ( 12.562 8.621 6.586) 16.598 3.206 ( 0.609 -14.411 -1.724) 14.527 4.294 ( 16.156 -5.158 4.380) 17.516 4.754 ( 0.020 -8.166 -1.529) 8.308 4.815 ( 7.326 -0.028 -0.410) 7.338 5.101 ( 0.333 -1.444 -6.592) 6.757 5.996 ( 9.421 12.365 0.551) 15.555 6.345 ( 4.834 -3.381 -0.245) 5.904 6.623 ( 5.454 0.122 -2.975) 6.214 6.853 ( -3.567 -3.890 2.729) 5.942 6.984 ( -3.273 -1.108 -1.929) 3.958 7.155 ( 1.561 1.527 7.316) 7.635 7.281 ( -1.871 -2.728 -3.714) 4.973 7.546 ( 0.332 -9.254 1.516) 9.383 7.777 ( -9.977 -8.964 -2.363) 13.619 8.053 ( 6.217 -3.333 -5.730) 9.088 8.227 ( 1.553 -7.366 1.838) 7.749 8.324 ( 4.883 -10.187 -6.138) 12.857 8.513 ( -4.644 7.411 -2.554) 9.111 8.605 ( 2.226 -0.352 3.400) 4.079 8.623 ( 9.095 0.229 4.403) 10.107 8.832 ( -0.493 9.608 3.371) 10.194 8.916 ( 1.096 4.491 2.578) 5.294 9.215 ( -6.757 -10.961 2.130) 13.051 9.259 ( -2.030 -2.218 1.543) 3.379 9.403 ( -10.189 -1.643 -8.922) 13.642 9.510 ( -6.931 1.256 -3.098) 7.695 9.614 ( 3.192 7.115 3.956) 8.744 9.772 ( 4.356 8.397 1.115) 9.525 9.867 ( 3.992 9.118 -0.883) 9.993 9.962 ( 3.004 4.853 0.302) 5.715 10.123 ( 6.493 -1.565 0.919) 6.741 10.346 ( -3.810 4.926 -1.948) 6.525 10.545 ( -4.559 1.725 -6.810) 8.374 10.675 ( 4.135 5.717 8.317) 10.907 11.189 ( -3.243 -4.909 -2.663) 6.458 11.262 ( -7.489 -4.158 -1.398) 8.679 11.373 ( 0.241 2.468 4.111) 4.801 11.589 ( -0.831 -4.088 2.465) 4.846 11.716 ( 0.063 -2.406 1.223) 2.700 11.772 ( -8.368 -7.230 -2.011) 11.240 11.816 ( -9.989 -9.686 1.494) 13.994 12.026 ( -5.980 -0.611 -1.438) 6.180 12.151 ( -0.705 0.283 3.997) 4.069 12.389 ( 1.160 7.894 -4.075) 8.959 12.508 ( 1.309 2.619 2.433) 3.807 12.806 ( 1.502 3.709 -2.355) 4.643 12.930 ( -4.269 11.959 0.322) 12.702 13.125 ( -0.578 -5.911 3.705) 7.000 13.196 ( -1.173 3.716 1.127) 4.056 13.374 ( -2.666 12.662 -1.794) 13.063 13.453 ( -0.458 -2.256 -0.777) 2.430 13.940 ( -1.121 -3.284 2.733) 4.417 14.011 ( 0.081 -0.589 -1.195) 1.334 14.638 ( -4.034 0.958 0.097) 4.148 14.727 ( -0.132 1.850 0.886) 2.056 15.287 ( -8.385 -13.639 5.363) 16.885 15.717 ( 12.974 -13.469 -2.952) 18.933 15.902 ( 8.090 14.381 -12.891) 20.939 16.134 ( 3.467 12.069 -5.117) 13.560 16.239 ( -18.958 7.298 0.730) 20.328 16.908 ( -1.951 -2.237 0.808) 3.076 17.790 ( 5.560 -15.414 14.150) 21.650 18.081 ( 3.310 -8.010 -13.649) 16.168 18.206 ( -6.091 -9.246 9.673) 14.702 18.485 ( 0.107 -11.740 0.593) 11.755 19.032 ( -4.576 10.183 4.554) 12.057 19.118 ( 9.552 14.265 -6.348) 18.304 20.207 ( 1.465 7.591 1.945) 7.972 20.746 ( 5.314 7.100 1.431) 8.983 21.098 ( 6.755 -3.410 1.785) 7.775 21.674 ( -7.213 -6.318 -5.119) 10.870 ======================= Grid point 19 (13/199) ======================= q-point: (-0.50 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.430 ( 9.713 15.894 7.184) 19.964 3.224 ( -8.845 -5.825 -5.400) 11.888 4.269 ( -14.710 9.674 -2.758) 17.821 4.760 ( -10.088 1.696 1.231) 10.303 4.856 ( 3.296 0.748 0.105) 3.382 5.150 ( 3.350 -0.391 2.609) 4.264 5.926 ( -0.784 14.464 -2.757) 14.746 6.441 ( 2.685 -4.297 0.319) 5.077 6.568 ( -3.703 10.850 4.786) 12.423 6.869 ( 3.824 -5.304 -3.159) 7.262 7.031 ( 2.275 -3.014 -6.629) 7.629 7.240 ( 6.434 0.364 6.067) 8.851 7.308 ( 3.714 -1.564 -0.068) 4.031 7.667 ( 2.867 -7.149 -1.510) 7.849 7.800 ( -2.343 -12.606 4.474) 13.580 8.124 ( -2.648 5.795 8.181) 10.369 8.161 ( -2.713 -9.413 -6.514) 11.765 8.258 ( -13.536 2.760 -1.509) 13.896 8.497 ( 4.789 3.660 -7.107) 9.319 8.631 ( -2.292 -1.603 -1.671) 3.258 8.736 ( 5.313 -0.005 2.057) 5.698 8.775 ( 0.679 5.045 1.677) 5.360 8.853 ( -4.607 9.888 -3.121) 11.347 9.180 ( -11.940 -4.495 -2.723) 13.045 9.253 ( -3.195 -3.272 -1.880) 4.945 9.387 ( 10.587 -10.494 1.173) 14.952 9.439 ( -0.319 -6.812 -3.236) 7.549 9.629 ( 4.137 4.492 7.045) 9.324 9.791 ( 0.790 3.098 -0.935) 3.331 9.816 ( 4.830 9.853 -2.356) 11.223 9.927 ( -0.154 9.692 3.880) 10.441 10.201 ( -1.417 -2.901 -4.516) 5.551 10.269 ( 3.450 6.966 -0.906) 7.827 10.520 ( 3.777 -3.216 -2.849) 5.720 10.714 ( 2.219 4.963 10.109) 11.478 11.219 ( 1.965 -5.793 -0.924) 6.186 11.291 ( 1.628 -3.272 -1.669) 4.018 11.399 ( 2.913 -2.559 6.295) 7.393 11.618 ( -0.700 -1.964 2.973) 3.631 11.686 ( -11.787 -17.535 2.010) 21.224 11.785 ( 2.276 -7.640 1.530) 8.117 11.842 ( 0.348 -5.821 1.738) 6.085 11.970 ( -2.029 -1.121 -6.450) 6.854 12.139 ( 2.451 1.304 2.210) 3.549 12.345 ( 3.352 5.010 -5.116) 7.906 12.587 ( 6.397 -1.949 0.904) 6.748 12.791 ( 3.540 10.519 2.086) 11.293 12.838 ( 0.767 -3.059 -1.652) 3.560 13.157 ( -0.101 -1.663 0.282) 1.690 13.189 ( 0.073 -1.823 -0.524) 1.898 13.261 ( 1.384 6.479 0.256) 6.630 13.467 ( -0.176 -1.841 -0.319) 1.877 13.949 ( -3.749 -4.827 1.551) 6.305 14.046 ( 6.385 3.100 -0.826) 7.145 14.578 ( -3.989 -2.268 0.461) 4.612 14.716 ( -0.333 0.776 0.957) 1.276 15.278 ( -11.347 -14.968 7.161) 20.101 15.732 ( -8.849 9.748 -0.594) 13.179 15.986 ( 6.377 17.961 -10.700) 21.858 16.033 ( 5.440 -2.016 -2.929) 6.499 16.207 ( 12.917 -12.554 0.455) 18.018 16.820 ( -9.571 -2.339 -10.394) 14.322 17.813 ( -16.828 0.815 10.106) 19.646 17.995 ( -4.681 -3.641 -0.847) 5.991 18.199 ( -11.773 -11.801 4.503) 17.267 18.829 ( 13.916 -5.867 -6.823) 16.572 18.974 ( 8.441 4.401 10.705) 14.325 19.104 ( 9.564 13.218 -0.801) 16.335 20.161 ( 0.486 5.294 -0.852) 5.384 20.705 ( -1.712 8.035 -0.005) 8.216 21.088 ( -6.477 4.274 -1.737) 7.952 21.744 ( 6.397 -9.451 -0.894) 11.447 ======================= Grid point 20 (14/199) ======================= q-point: (-0.42 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.407 ( 6.728 21.215 7.420) 23.460 3.024 ( -14.674 0.891 -7.864) 16.672 3.769 ( -27.228 15.932 -2.650) 31.658 4.394 ( -24.966 14.395 2.992) 28.974 4.729 ( -9.977 14.077 -0.489) 17.261 5.231 ( 3.443 -0.459 6.427) 7.305 5.719 ( -5.497 17.516 -5.469) 19.156 6.351 ( -7.509 4.720 6.231) 10.839 6.570 ( 0.448 6.809 -2.455) 7.252 6.968 ( 3.240 -1.736 -2.567) 4.483 7.096 ( 2.479 -3.109 -3.836) 5.525 7.208 ( -7.242 13.342 -2.064) 15.321 7.278 ( -11.484 2.397 0.586) 11.746 7.671 ( -2.900 -3.892 3.217) 5.823 7.836 ( -4.862 2.630 -0.577) 5.558 8.010 ( -0.579 0.029 6.501) 6.527 8.147 ( 3.020 5.180 0.765) 6.045 8.274 ( 8.950 -11.635 3.877) 15.183 8.490 ( 2.788 2.919 -1.580) 4.335 8.643 ( -1.305 -0.018 -6.551) 6.680 8.695 ( 0.474 1.009 -1.680) 2.016 8.767 ( 3.935 1.241 -2.578) 4.866 8.900 ( 5.706 -9.257 -0.779) 10.902 9.114 ( -1.825 -6.235 -1.919) 6.774 9.237 ( -0.093 -6.113 -2.772) 6.712 9.447 ( -1.599 -6.490 0.524) 6.704 9.614 ( 3.065 0.974 -6.049) 6.851 9.696 ( 2.940 7.419 -0.149) 7.981 9.771 ( -1.022 -3.029 4.284) 5.346 9.834 ( 3.460 -2.969 4.028) 6.084 9.908 ( 7.300 2.789 -1.166) 7.901 10.199 ( -2.641 -6.965 0.073) 7.449 10.321 ( 10.147 -1.742 -0.268) 10.299 10.598 ( -0.714 -2.124 0.945) 2.432 10.798 ( 7.998 -2.140 8.182) 11.640 11.275 ( -1.598 -0.931 -1.812) 2.589 11.333 ( 4.449 -0.554 2.301) 5.040 11.453 ( -1.929 2.826 -0.677) 3.488 11.601 ( -1.481 -2.512 4.957) 5.751 11.771 ( -5.410 2.047 -4.442) 7.293 11.841 ( 2.458 -23.237 4.745) 23.843 11.950 ( 6.769 -6.963 -0.793) 9.743 12.089 ( 11.468 -5.985 1.883) 13.072 12.243 ( 6.273 -4.104 0.235) 7.500 12.376 ( 5.066 0.407 -5.631) 7.585 12.734 ( 7.009 -4.890 -1.646) 8.703 12.780 ( 2.021 1.798 4.156) 4.959 12.933 ( 4.411 -3.753 -0.241) 5.797 13.165 ( -0.583 0.095 -3.952) 3.996 13.213 ( 4.831 -1.861 -0.934) 5.260 13.322 ( 5.531 -2.488 3.555) 7.030 13.480 ( -0.516 -2.918 -0.898) 3.096 13.940 ( -1.715 -3.447 0.222) 3.856 14.131 ( 8.899 6.286 -0.927) 10.935 14.553 ( -3.753 -5.022 1.995) 6.579 14.694 ( -2.240 0.275 -0.875) 2.421 15.246 ( -13.036 -15.896 8.833) 22.375 15.541 ( -4.836 6.137 6.404) 10.103 15.897 ( 6.699 17.968 -11.096) 22.156 16.041 ( 2.730 3.127 -11.439) 12.169 16.523 ( -10.914 -2.782 -9.099) 14.479 16.750 ( 15.186 -18.168 1.936) 23.758 17.526 ( -15.118 6.443 11.342) 19.968 17.909 ( -9.570 -2.164 -2.631) 10.159 18.092 ( -12.940 -4.898 5.222) 14.789 18.720 ( -2.064 24.169 -1.048) 24.280 18.981 ( 2.403 9.789 -2.382) 10.357 19.589 ( 25.905 -20.477 8.166) 34.016 20.122 ( 0.827 3.946 -3.031) 5.044 20.548 ( -6.970 8.599 -1.035) 11.117 20.868 ( -10.781 7.949 -2.403) 13.608 21.975 ( 9.500 -8.586 0.841) 12.833 ======================= Grid point 21 (15/199) ======================= q-point: (-0.33 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.302 ( 4.027 24.525 7.141) 25.859 2.674 ( -22.388 6.497 -6.164) 24.112 3.126 ( -28.858 15.110 -1.196) 32.596 3.739 ( -29.555 25.135 2.713) 38.893 4.331 ( -14.892 22.531 -1.094) 27.030 5.190 ( -14.146 11.644 7.687) 19.869 5.418 ( -1.618 16.566 -5.762) 17.614 5.821 ( -37.813 42.908 -3.138) 57.278 6.370 ( -6.479 3.459 -3.540) 8.153 6.757 ( -13.941 17.484 1.504) 22.412 6.890 ( -12.815 -0.409 -1.289) 12.886 7.180 ( 3.628 -3.376 -2.372) 5.494 7.375 ( 11.367 -11.554 0.002) 16.208 7.645 ( -5.540 7.542 3.368) 9.945 7.802 ( -0.962 -3.389 6.020) 6.975 7.927 ( -3.259 0.368 -1.985) 3.834 8.298 ( 7.426 4.033 11.358) 14.157 8.430 ( -2.276 -2.931 -3.378) 5.018 8.569 ( 15.530 5.542 0.690) 16.503 8.639 ( -1.307 -7.859 4.173) 8.994 8.747 ( 6.087 -3.644 -3.033) 7.715 8.921 ( 6.467 -11.122 -9.863) 16.212 9.115 ( 11.138 -7.615 -1.365) 13.562 9.194 ( 5.682 -4.472 -0.546) 7.251 9.336 ( 5.269 -1.511 -4.133) 6.865 9.523 ( 2.313 -4.980 2.934) 6.226 9.567 ( -5.359 3.206 -0.133) 6.246 9.668 ( 3.827 -6.145 -1.264) 7.349 9.775 ( 0.233 -2.278 -1.750) 2.883 9.910 ( 0.154 1.908 -3.742) 4.203 10.099 ( 8.895 -13.028 2.726) 16.008 10.307 ( 2.194 -13.544 1.691) 13.824 10.562 ( 7.118 -7.162 2.748) 10.465 10.675 ( 9.269 -11.780 0.513) 14.998 10.973 ( 3.414 -3.703 10.178) 11.356 11.170 ( -3.157 7.115 -7.449) 10.774 11.397 ( 1.224 0.864 1.158) 1.894 11.446 ( 6.243 0.008 2.993) 6.923 11.644 ( 0.751 0.663 5.214) 5.309 11.675 ( -1.652 -3.251 -4.165) 5.536 12.111 ( 9.161 -0.742 -0.822) 9.228 12.134 ( 4.362 -15.833 2.872) 16.672 12.370 ( 13.459 -5.217 3.107) 14.765 12.394 ( 5.461 -6.775 -0.599) 8.722 12.471 ( 5.321 -6.819 -3.447) 9.311 12.851 ( 2.679 -1.911 -4.927) 5.925 12.857 ( 5.211 -1.970 4.450) 7.130 12.999 ( -2.249 -5.824 -0.164) 6.245 13.167 ( 4.240 0.649 -7.054) 8.256 13.367 ( 6.492 -6.375 3.510) 9.752 13.460 ( 4.482 -6.315 4.176) 8.798 13.530 ( 2.235 -7.684 -3.035) 8.559 13.973 ( 3.485 -1.053 -1.607) 3.979 14.204 ( 7.246 6.288 -1.213) 9.670 14.543 ( -4.920 -4.168 2.260) 6.833 14.632 ( -3.810 0.090 -0.072) 3.811 15.210 ( -10.285 -12.665 7.770) 18.071 15.495 ( 0.664 2.651 9.928) 10.297 15.785 ( 1.476 14.506 -9.010) 17.140 16.006 ( 2.182 4.685 -18.491) 19.200 16.239 ( -12.881 2.292 -10.908) 17.034 17.214 ( -0.482 2.218 16.024) 16.184 17.300 ( 0.601 -11.008 11.640) 16.032 17.717 ( -13.161 -1.853 -4.632) 14.075 17.885 ( -8.987 8.192 -3.452) 12.640 18.384 ( -8.322 26.830 2.542) 28.206 18.944 ( 1.491 2.740 -2.473) 3.981 20.093 ( 1.477 4.528 -1.857) 5.112 20.212 ( 20.117 -17.671 6.639) 27.587 20.331 ( -6.309 6.391 -1.325) 9.078 20.599 ( -10.291 7.856 -4.054) 13.567 22.201 ( 7.760 -7.137 1.968) 10.725 ======================= Grid point 22 (16/199) ======================= q-point: (-0.25 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.965 ( -23.505 29.500 -1.738) 37.759 2.201 ( -15.198 13.763 11.414) 23.467 2.560 ( -25.502 12.246 -0.340) 28.292 3.079 ( -16.599 25.822 -1.493) 30.733 3.844 ( -13.987 25.563 -5.041) 29.573 4.481 ( -48.165 61.582 -11.598) 79.036 4.611 ( -24.288 36.918 9.871) 45.280 5.437 ( 1.712 -0.182 -1.423) 2.233 6.123 ( -12.681 9.530 -0.785) 15.882 6.435 ( -7.756 18.785 0.461) 20.329 6.708 ( -9.943 -5.058 0.814) 11.185 7.246 ( -1.916 -2.789 -1.796) 3.831 7.374 ( -13.617 4.659 1.145) 14.437 7.671 ( 11.766 -3.979 1.972) 12.576 7.842 ( -3.403 -4.994 2.288) 6.462 7.973 ( 6.173 -6.283 1.375) 8.914 8.334 ( -0.029 2.473 7.633) 8.024 8.456 ( 5.558 1.701 -3.219) 6.644 8.640 ( -4.686 -5.825 -0.938) 7.534 8.741 ( 3.219 -0.473 4.121) 5.251 8.883 ( 4.422 -1.812 -1.096) 4.903 9.070 ( 2.793 -4.471 -6.738) 8.555 9.288 ( 7.828 10.038 -1.340) 12.800 9.419 ( 11.261 -9.875 1.226) 15.028 9.456 ( 7.129 -6.594 -0.262) 9.715 9.471 ( -0.779 -1.789 2.673) 3.310 9.598 ( 1.973 -1.863 3.338) 4.301 9.757 ( -2.984 -9.357 -6.858) 11.979 9.873 ( 3.964 4.872 -1.012) 6.362 9.929 ( 8.259 -8.966 -1.430) 12.274 10.303 ( -2.274 -12.964 -2.387) 13.377 10.543 ( 8.891 -15.853 1.510) 18.238 10.823 ( 11.871 -16.160 3.753) 20.399 10.938 ( 2.050 -0.366 4.889) 5.314 11.053 ( 12.271 -10.787 -2.256) 16.493 11.193 ( 5.105 -4.388 1.077) 6.817 11.426 ( 2.409 2.806 6.183) 7.204 11.556 ( 5.406 -2.463 -2.326) 6.380 11.648 ( 2.768 1.154 3.989) 4.991 11.775 ( 4.339 -7.894 -1.122) 9.077 12.221 ( 5.051 2.211 1.295) 5.664 12.283 ( 3.072 -2.579 -2.163) 4.558 12.549 ( 5.887 -6.279 -1.324) 8.708 12.598 ( 7.185 -5.894 0.278) 9.297 12.686 ( 7.589 -11.545 2.595) 14.057 12.837 ( -2.181 -0.058 -5.116) 5.561 12.957 ( -3.302 -5.253 -1.207) 6.321 13.011 ( 2.002 -5.131 1.979) 5.852 13.244 ( 8.337 1.539 -6.159) 10.479 13.482 ( 1.982 0.242 4.067) 4.531 13.619 ( 3.116 -11.589 0.255) 12.003 13.715 ( 6.263 -16.774 -0.139) 17.906 14.059 ( 5.096 -2.021 -2.084) 5.864 14.224 ( -0.320 1.883 -2.934) 3.501 14.451 ( -7.333 -0.064 -0.168) 7.335 14.610 ( 0.815 1.514 4.655) 4.962 15.216 ( -1.563 -5.639 5.658) 8.140 15.534 ( 2.342 1.946 8.254) 8.798 15.585 ( -9.490 9.026 -7.450) 15.067 15.905 ( 0.981 7.169 -15.875) 17.446 16.072 ( -2.071 3.574 -8.352) 9.318 16.963 ( -13.164 10.871 14.185) 22.196 17.266 ( -17.933 7.986 -2.244) 19.759 17.497 ( -11.198 10.755 1.360) 15.586 17.922 ( 1.378 8.139 4.837) 9.567 18.011 ( 2.190 4.660 4.390) 6.766 18.961 ( 1.777 -2.337 -4.532) 5.400 20.044 ( -3.207 5.370 -1.116) 6.353 20.099 ( -5.630 8.504 -1.273) 10.277 20.379 ( -3.906 6.536 -0.172) 7.616 20.768 ( 16.200 -19.492 1.818) 25.411 22.371 ( 4.186 -6.020 2.876) 7.876 ======================= Grid point 23 (17/199) ======================= q-point: (-0.17 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.191 ( -32.427 26.229 0.759) 41.713 1.669 ( -22.736 41.404 19.720) 51.187 2.184 ( -8.796 3.756 -2.861) 9.983 2.703 ( -5.331 19.230 -2.026) 20.058 3.022 ( -41.005 75.454 -13.931) 86.998 3.386 ( -9.907 23.747 -8.690) 27.159 3.867 ( -18.259 45.828 12.169) 50.811 5.485 ( -0.143 -6.708 -1.494) 6.874 5.890 ( -2.032 11.660 -0.293) 11.839 6.101 ( -10.863 14.873 0.611) 18.427 6.661 ( -0.643 -0.542 1.087) 1.374 6.995 ( -17.442 3.136 0.421) 17.726 7.321 ( -1.149 -3.850 -0.951) 4.129 7.824 ( -2.945 -1.955 2.356) 4.248 7.876 ( 8.440 -3.219 2.182) 9.293 8.109 ( -1.587 -4.961 -0.314) 5.218 8.343 ( 0.334 -1.882 3.499) 3.987 8.528 ( 7.077 5.391 -3.905) 9.716 8.581 ( -6.986 -8.162 2.347) 10.997 8.778 ( 0.391 -0.115 1.773) 1.820 8.895 ( -1.451 1.355 -3.135) 3.711 9.045 ( -2.243 3.072 1.643) 4.144 9.270 ( 2.551 9.286 -1.942) 9.824 9.510 ( 0.566 -3.240 -5.134) 6.097 9.582 ( 1.604 0.033 2.981) 3.386 9.641 ( 2.200 -4.362 0.963) 4.979 9.674 ( 4.818 -8.148 3.736) 10.177 9.801 ( 2.754 -5.770 -2.683) 6.934 10.024 ( 13.162 5.379 8.099) 16.364 10.117 ( 4.941 -8.923 -2.813) 10.580 10.299 ( -0.513 -5.137 -7.770) 9.329 10.846 ( 6.226 -16.581 1.489) 17.774 11.071 ( 8.143 -9.424 0.139) 12.455 11.178 ( 2.973 -12.454 5.098) 13.782 11.282 ( 7.258 -12.166 -1.073) 14.207 11.385 ( 5.746 -1.790 6.992) 9.226 11.492 ( 4.347 -11.649 3.170) 12.832 11.702 ( 2.683 0.233 0.873) 2.831 11.703 ( 8.461 -3.579 0.072) 9.188 11.925 ( 4.868 -7.031 -0.517) 8.567 12.248 ( 1.488 4.181 1.900) 4.827 12.293 ( -0.081 3.091 -4.207) 5.221 12.667 ( 1.184 -5.929 -3.092) 6.791 12.735 ( 4.697 -2.034 -4.381) 6.737 12.806 ( 1.108 -0.464 0.404) 1.267 12.877 ( 3.758 -5.804 0.433) 6.928 12.907 ( -5.445 -5.543 -1.298) 7.878 13.112 ( 0.210 -7.499 -0.178) 7.504 13.373 ( 7.682 -1.996 -2.482) 8.316 13.466 ( -2.366 1.843 3.668) 4.738 13.822 ( 6.232 -11.038 0.118) 12.676 13.976 ( 5.075 -15.571 0.766) 16.395 14.112 ( -6.668 -7.926 -2.089) 10.566 14.175 ( 0.285 -3.361 -2.744) 4.348 14.358 ( -5.389 -3.363 0.046) 6.353 14.645 ( 8.707 10.615 3.373) 14.138 15.269 ( -8.306 -2.494 -3.561) 9.375 15.314 ( -0.963 6.103 0.909) 6.245 15.569 ( 4.967 7.357 3.880) 9.688 15.826 ( 1.143 12.067 -6.218) 13.623 15.980 ( -3.978 0.390 -5.020) 6.417 16.721 ( -9.218 6.299 11.033) 15.696 16.844 ( -15.357 10.695 -7.938) 20.329 17.226 ( -4.225 17.937 0.076) 18.428 17.520 ( -10.747 27.857 4.604) 30.211 18.363 ( 9.579 -15.265 9.647) 20.441 19.005 ( 1.344 -3.654 -5.267) 6.549 19.894 ( -4.523 6.540 -0.163) 7.953 19.958 ( -3.261 7.391 -0.680) 8.107 20.339 ( 1.915 0.954 -0.802) 2.285 21.146 ( 8.510 -15.075 1.466) 17.373 22.469 ( 0.105 -5.279 3.211) 6.180 ======================= Grid point 24 (18/199) ======================= q-point: (-0.08 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.562 ( 0.000 29.947 -0.000) 29.947 1.017 ( 0.000 52.939 -0.000) 52.939 1.757 ( 0.000 91.012 -0.000) 91.012 2.102 ( -0.000 -1.805 0.000) 1.805 2.491 ( 0.000 16.264 -0.000) 16.264 3.065 ( 0.000 18.755 -0.000) 18.755 3.310 ( 0.000 39.972 -0.000) 39.972 5.535 ( -0.000 -4.992 0.000) 4.992 5.805 ( 0.000 9.446 -0.000) 9.446 5.875 ( 0.000 7.619 -0.000) 7.619 6.686 ( 0.000 6.965 -0.000) 6.965 6.760 ( -0.000 -2.678 0.000) 2.678 7.341 ( -0.000 -3.660 0.000) 3.660 7.798 ( 0.000 1.150 -0.000) 1.150 7.987 ( 0.000 5.428 -0.000) 5.428 8.058 ( -0.000 -2.497 0.000) 2.497 8.382 ( -0.000 -2.305 0.000) 2.305 8.554 ( 0.000 4.237 -0.000) 4.237 8.610 ( -0.000 -9.760 0.000) 9.760 8.789 ( -0.000 -1.111 0.000) 1.111 8.861 ( -0.000 -1.160 0.000) 1.160 8.988 ( 0.000 5.783 -0.000) 5.783 9.206 ( 0.000 7.465 -0.000) 7.465 9.471 ( 0.000 3.470 -0.000) 3.470 9.633 ( -0.000 -0.422 0.000) 0.422 9.687 ( -0.000 -6.450 0.000) 6.450 9.807 ( -0.000 -6.672 0.000) 6.672 9.888 ( -0.000 -4.413 0.000) 4.413 10.121 ( 0.000 1.169 -0.000) 1.169 10.179 ( -0.000 -6.131 0.000) 6.131 10.422 ( -0.000 -3.644 0.000) 3.644 11.046 ( -0.000 -13.844 0.000) 13.844 11.254 ( -0.000 -9.522 0.000) 9.522 11.255 ( -0.000 -2.426 0.000) 2.426 11.438 ( -0.000 -2.196 0.000) 2.196 11.497 ( -0.000 -17.890 0.000) 17.890 11.708 ( 0.000 2.955 -0.000) 2.955 11.723 ( -0.000 -16.917 0.000) 16.917 11.825 ( -0.000 -2.708 0.000) 2.708 12.042 ( -0.000 -5.530 0.000) 5.530 12.206 ( 0.000 9.167 -0.000) 9.167 12.223 ( 0.000 5.013 -0.000) 5.013 12.725 ( -0.000 -5.699 0.000) 5.699 12.764 ( 0.000 0.006 -0.000) 0.006 12.853 ( -0.000 -3.109 0.000) 3.109 12.921 ( 0.000 1.487 -0.000) 1.487 12.940 ( -0.000 -9.002 0.000) 9.002 13.111 ( 0.000 0.408 -0.000) 0.408 13.439 ( 0.000 3.464 -0.000) 3.464 13.468 ( -0.000 -5.334 0.000) 5.334 13.936 ( -0.000 -8.264 0.000) 8.264 14.146 ( -0.000 -11.537 0.000) 11.537 14.194 ( -0.000 -14.969 0.000) 14.969 14.215 ( -0.000 -5.116 0.000) 5.116 14.346 ( -0.000 -3.155 0.000) 3.155 14.646 ( 0.000 12.872 -0.000) 12.872 15.119 ( -0.000 -2.691 0.000) 2.691 15.366 ( -0.000 -0.857 0.000) 0.857 15.553 ( 0.000 11.070 -0.000) 11.070 15.621 ( 0.000 18.462 -0.000) 18.462 15.936 ( 0.000 0.060 -0.000) 0.060 16.638 ( -0.000 -0.045 0.000) 0.045 16.639 ( 0.000 1.280 -0.000) 1.280 17.019 ( 0.000 19.006 -0.000) 19.006 17.153 ( 0.000 26.297 -0.000) 26.297 18.595 ( -0.000 -11.238 0.000) 11.238 19.038 ( -0.000 -2.790 0.000) 2.790 19.802 ( 0.000 4.472 -0.000) 4.472 19.863 ( 0.000 5.814 -0.000) 5.814 20.360 ( -0.000 -0.459 0.000) 0.459 21.339 ( -0.000 -10.064 0.000) 10.064 22.508 ( -0.000 -3.701 0.000) 3.701 ======================= Grid point 27 (19/199) ======================= q-point: ( 0.17 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.137 ( 7.689 -0.000 1.828) 7.904 2.475 ( 4.269 -0.000 -3.476) 5.505 2.942 ( 36.117 -0.000 13.383) 38.517 3.777 ( 39.301 -0.000 12.116) 41.127 3.952 ( 30.336 -0.000 -12.449) 32.791 5.279 ( 0.986 -0.000 -1.221) 1.569 5.421 ( 64.276 -0.000 -7.340) 64.693 5.547 ( 34.923 -0.000 1.091) 34.940 6.118 ( 5.192 -0.000 1.080) 5.303 6.306 ( 0.890 -0.000 -1.023) 1.356 7.137 ( 2.383 -0.000 -1.253) 2.693 7.138 ( 0.172 -0.000 1.826) 1.834 7.433 ( -5.860 0.000 1.543) 6.059 7.470 ( -1.908 0.000 -0.363) 1.942 7.590 ( -1.146 0.000 -2.804) 3.029 7.846 ( -0.451 0.000 7.928) 7.940 7.942 ( 1.933 -0.000 -9.148) 9.350 8.131 ( -2.114 0.000 -12.595) 12.771 8.633 ( -12.694 0.000 2.439) 12.927 8.665 ( -3.374 0.000 -5.522) 6.471 8.808 ( 2.812 -0.000 13.149) 13.446 9.111 ( 1.289 -0.000 1.883) 2.282 9.164 ( -9.075 0.000 -0.989) 9.129 9.217 ( -9.686 0.000 -0.349) 9.692 9.482 ( -3.965 0.000 -0.038) 3.966 9.510 ( 7.052 -0.000 -1.488) 7.207 9.573 ( -2.493 0.000 -6.544) 7.002 9.804 ( -3.674 0.000 5.108) 6.292 9.861 ( 4.356 -0.000 -0.816) 4.431 10.117 ( -21.371 0.000 6.360) 22.297 10.232 ( -20.216 0.000 2.888) 20.421 10.362 ( -16.384 0.000 -7.260) 17.920 10.531 ( -7.307 0.000 6.869) 10.029 10.815 ( -15.669 0.000 0.073) 15.670 11.091 ( -4.724 0.000 -8.140) 9.412 11.305 ( 3.201 -0.000 -3.962) 5.094 11.352 ( 19.990 -0.000 -1.523) 20.048 11.444 ( -2.042 0.000 -5.091) 5.485 11.568 ( -7.638 0.000 4.336) 8.783 11.618 ( -12.385 0.000 -0.355) 12.390 11.902 ( 0.451 -0.000 0.473) 0.653 12.145 ( -19.060 0.000 1.551) 19.123 12.335 ( -12.753 0.000 5.637) 13.943 12.336 ( -16.712 0.000 4.215) 17.235 12.537 ( 0.277 -0.000 -1.345) 1.373 12.816 ( 0.374 -0.000 2.636) 2.662 12.942 ( -5.322 0.000 -6.191) 8.165 13.020 ( -5.814 0.000 2.032) 6.159 13.311 ( -0.067 0.000 -2.548) 2.549 13.404 ( -5.740 0.000 4.384) 7.222 13.666 ( -5.688 0.000 0.760) 5.739 13.845 ( -3.939 0.000 0.840) 4.028 14.043 ( -1.879 0.000 4.360) 4.748 14.054 ( -6.091 0.000 2.208) 6.478 14.825 ( 1.400 -0.000 1.136) 1.803 14.912 ( 7.810 -0.000 -10.899) 13.409 15.082 ( -6.953 0.000 4.082) 8.063 15.105 ( -0.248 0.000 -2.291) 2.305 15.914 ( 11.551 -0.000 -10.731) 15.767 16.517 ( 18.537 -0.000 9.207) 20.698 16.637 ( 12.251 -0.000 -10.656) 16.237 16.790 ( 5.053 -0.000 -5.047) 7.142 17.031 ( 10.340 -0.000 20.943) 23.357 17.410 ( -29.205 0.000 -8.932) 30.540 18.082 ( 18.754 -0.000 2.603) 18.934 18.109 ( 12.418 -0.000 1.950) 12.570 19.030 ( 4.308 -0.000 2.585) 5.024 19.837 ( -21.012 0.000 -12.511) 24.455 20.278 ( 11.988 -0.000 -0.852) 12.018 20.400 ( 15.347 -0.000 1.671) 15.438 20.725 ( -3.923 0.000 16.769) 17.222 21.999 ( -13.673 0.000 -11.150) 17.643 ======================= Grid point 28 (20/199) ======================= q-point: ( 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.289 ( 15.762 7.618 3.839) 17.922 2.627 ( 6.147 -14.956 -4.448) 16.770 3.587 ( 31.784 -5.910 14.680) 35.506 4.360 ( 22.758 -4.270 7.273) 24.270 4.420 ( 26.191 -3.961 -8.122) 27.706 5.204 ( -3.780 1.154 -11.922) 12.560 6.037 ( 23.984 9.556 5.586) 26.415 6.209 ( 14.700 4.211 0.563) 15.301 6.276 ( 13.265 -10.977 -7.137) 18.638 6.404 ( 18.896 -12.441 1.808) 22.696 7.091 ( -0.689 2.977 -1.075) 3.239 7.204 ( -3.482 -2.417 4.971) 6.533 7.295 ( -10.707 -5.781 0.641) 12.185 7.363 ( -5.121 1.115 -5.342) 7.484 7.683 ( 7.424 -5.805 -1.592) 9.558 7.868 ( -1.949 0.707 6.667) 6.982 8.013 ( 3.796 -1.717 -10.757) 11.536 8.116 ( 7.187 0.787 -7.446) 10.378 8.483 ( -2.666 0.843 2.581) 3.805 8.608 ( -1.455 0.266 -5.482) 5.678 8.846 ( -6.201 2.454 6.901) 9.597 8.969 ( -4.137 4.157 3.881) 7.032 9.079 ( -8.478 -4.891 1.711) 9.936 9.165 ( 0.933 -3.715 0.179) 3.835 9.408 ( -6.252 7.167 3.332) 10.078 9.482 ( -4.944 -0.346 -8.347) 9.708 9.625 ( 3.529 9.267 2.873) 10.324 9.743 ( 3.123 1.882 0.091) 3.647 9.833 ( -1.921 0.433 -0.870) 2.153 9.939 ( -8.429 1.604 4.112) 9.514 10.023 ( -4.098 -9.544 2.758) 10.746 10.141 ( -5.695 3.358 -5.422) 8.550 10.377 ( -10.717 0.371 2.667) 11.050 10.664 ( -2.896 0.714 6.255) 6.930 10.956 ( -5.230 5.510 -8.380) 11.311 11.308 ( -4.525 4.506 0.236) 6.390 11.363 ( -4.151 0.370 -0.684) 4.223 11.460 ( -7.606 -2.141 -0.556) 7.921 11.473 ( -2.995 -3.716 -0.712) 4.826 11.615 ( 8.956 -0.689 -2.381) 9.293 11.825 ( -15.189 -0.718 -0.352) 15.210 11.871 ( -11.608 -2.596 -1.209) 11.956 12.117 ( -6.467 -0.097 5.965) 8.798 12.168 ( -10.489 -1.113 5.186) 11.754 12.550 ( 1.821 3.270 1.677) 4.102 12.727 ( -6.635 5.922 -5.364) 10.386 12.912 ( -0.356 -4.118 3.823) 5.630 12.921 ( -6.163 -0.290 0.074) 6.170 13.260 ( -2.985 4.971 0.300) 5.806 13.355 ( -1.896 -3.188 2.304) 4.366 13.553 ( -5.379 6.676 -0.590) 8.593 13.749 ( -6.364 3.115 0.543) 7.106 13.935 ( -5.584 2.063 3.213) 6.765 14.037 ( -0.288 1.124 1.499) 1.895 14.758 ( -7.127 0.551 1.265) 7.259 14.861 ( -3.852 5.961 0.301) 7.103 15.081 ( 1.448 -3.918 -4.486) 6.129 15.215 ( 6.132 -10.727 -5.725) 13.617 16.044 ( 10.264 4.497 -10.391) 15.282 16.582 ( 10.452 22.545 -14.502) 28.773 16.817 ( -8.368 5.328 5.132) 11.169 16.899 ( -16.569 1.613 4.189) 17.167 17.010 ( 14.720 -20.652 -3.151) 25.556 17.349 ( 7.369 -18.730 14.387) 24.741 18.207 ( -0.549 0.032 5.470) 5.498 18.355 ( 10.210 -0.732 3.136) 10.706 19.167 ( 13.063 3.453 -2.020) 13.662 19.418 ( -22.120 0.799 -6.926) 23.192 20.424 ( 9.487 9.490 0.448) 13.427 20.679 ( 14.689 -5.986 2.000) 15.988 20.799 ( 6.860 1.916 11.202) 13.275 21.738 ( -15.400 -3.746 -11.265) 19.445 ======================= Grid point 29 (21/199) ======================= q-point: ( 0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.536 ( 20.849 10.315 7.210) 24.353 2.878 ( 5.589 -16.746 -4.892) 18.319 4.162 ( 23.813 -8.376 11.465) 27.725 4.606 ( 0.133 -5.075 1.549) 5.308 4.801 ( 16.926 -1.589 -2.486) 17.182 5.092 ( -2.832 0.518 -12.830) 13.149 6.250 ( 13.729 10.111 2.316) 17.207 6.316 ( 7.146 2.494 0.689) 7.600 6.526 ( 10.235 -6.567 -4.251) 12.882 6.785 ( 9.296 -3.977 1.335) 10.199 7.026 ( -14.320 2.434 5.866) 15.665 7.102 ( 0.231 -5.185 -3.536) 6.280 7.252 ( -0.925 -0.434 4.574) 4.686 7.325 ( -1.328 -9.472 -4.184) 10.440 7.751 ( -8.606 3.054 1.460) 9.247 7.893 ( 3.629 -11.800 -1.073) 12.392 8.047 ( 1.356 -5.104 -12.439) 13.514 8.248 ( 8.335 -1.289 -2.696) 8.855 8.548 ( -1.308 -0.313 0.385) 1.399 8.613 ( 10.252 -1.232 1.091) 10.383 8.688 ( -4.202 4.056 -0.354) 5.851 8.915 ( -4.859 -1.096 1.666) 5.252 9.038 ( -2.861 -2.399 4.518) 5.861 9.146 ( -5.733 11.556 4.399) 13.629 9.224 ( -0.395 0.071 2.380) 2.414 9.360 ( -7.286 -0.895 -8.818) 11.474 9.553 ( -3.651 3.052 -1.453) 4.975 9.756 ( -2.198 6.591 -0.634) 6.977 9.901 ( 5.411 4.676 3.941) 8.166 9.944 ( 8.315 -0.033 2.897) 8.805 10.007 ( 1.688 -3.220 0.864) 3.736 10.151 ( 8.390 3.911 -3.303) 9.828 10.288 ( -3.885 -7.158 1.286) 8.245 10.635 ( -4.366 4.016 -3.416) 6.845 10.829 ( 3.047 8.535 4.836) 10.272 11.142 ( -10.904 -1.309 1.479) 11.082 11.175 ( -15.824 -1.209 -2.729) 16.103 11.419 ( 0.937 2.124 2.676) 3.543 11.496 ( -2.353 -5.002 -0.567) 5.557 11.625 ( -12.324 -5.452 1.654) 13.577 11.665 ( -4.810 -4.287 -0.583) 6.469 11.742 ( 0.227 0.095 -1.949) 1.965 12.024 ( -6.478 0.897 0.670) 6.574 12.138 ( 0.701 -1.893 4.694) 5.110 12.499 ( -2.639 5.320 -1.468) 6.117 12.589 ( -1.584 4.577 0.416) 4.861 12.819 ( -3.794 0.111 -3.520) 5.177 12.982 ( -1.582 -7.503 6.072) 9.781 13.169 ( -0.327 7.592 1.320) 7.712 13.348 ( -3.323 9.732 -0.244) 10.286 13.394 ( -2.563 -2.298 -0.633) 3.500 13.585 ( -6.886 7.145 -0.108) 9.923 13.867 ( -4.371 -2.901 3.059) 6.073 14.040 ( 3.985 3.687 -0.763) 5.483 14.635 ( -8.044 -1.444 0.631) 8.196 14.768 ( -4.198 0.966 5.912) 7.315 15.104 ( -1.445 -3.459 -5.678) 6.804 15.448 ( 9.603 -14.222 -4.692) 17.791 16.101 ( 6.316 7.331 -10.297) 14.131 16.343 ( -24.182 4.810 1.799) 24.722 16.488 ( 8.206 21.160 -15.794) 27.650 16.870 ( -3.099 -1.064 1.155) 3.474 17.444 ( 7.731 -18.640 14.842) 25.050 17.714 ( 12.520 -22.333 -1.512) 25.648 18.154 ( -7.933 -1.495 5.499) 9.768 18.373 ( -9.431 -1.359 -0.160) 9.530 19.175 ( -2.195 4.806 7.317) 9.026 19.339 ( 13.848 8.078 -3.732) 16.460 20.426 ( 5.033 14.678 1.073) 15.554 20.901 ( 6.362 7.139 4.441) 10.544 20.987 ( 12.515 -7.736 0.626) 14.726 21.521 ( -12.915 -8.553 -9.253) 18.044 ======================= Grid point 30 (22/199) ======================= q-point: (-0.58 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.761 ( 17.740 17.433 9.805) 26.735 3.042 ( -1.380 -11.789 -6.260) 13.419 4.421 ( -8.482 6.404 1.102) 10.685 4.645 ( 4.949 -11.977 5.448) 14.058 4.900 ( 0.272 3.976 -7.401) 8.405 5.126 ( 6.960 -2.059 -0.978) 7.324 6.253 ( 1.310 17.368 -2.676) 17.622 6.404 ( 4.748 0.931 1.833) 5.174 6.690 ( 4.074 -1.348 -3.610) 5.607 6.835 ( -0.578 3.728 4.913) 6.195 6.964 ( 5.751 -4.255 -0.963) 7.218 7.174 ( -2.006 -5.738 -6.666) 9.022 7.211 ( 3.831 -6.188 5.183) 8.935 7.485 ( -2.796 -14.392 3.367) 15.042 7.645 ( 4.021 1.994 2.121) 4.964 7.962 ( -7.508 -11.299 -1.340) 13.632 8.065 ( -2.921 -7.600 -10.027) 12.916 8.321 ( -0.997 1.608 -1.795) 2.608 8.491 ( -8.242 -7.894 6.481) 13.125 8.645 ( 6.853 9.687 -4.158) 12.573 8.790 ( 5.118 3.617 1.573) 6.462 8.854 ( 1.158 2.107 -0.666) 2.495 8.983 ( -5.741 -1.336 3.370) 6.790 9.133 ( 1.595 0.919 -0.201) 1.852 9.207 ( -7.416 -1.806 -7.100) 10.424 9.258 ( 3.575 -1.508 1.610) 4.201 9.425 ( -1.468 5.644 -3.849) 6.987 9.691 ( -0.118 2.105 6.964) 7.277 9.866 ( -1.330 4.908 -3.323) 6.074 10.026 ( 5.383 8.725 -2.625) 10.582 10.122 ( 4.447 7.659 3.819) 9.645 10.205 ( -0.046 3.137 -3.631) 4.798 10.337 ( 0.112 -2.297 0.428) 2.340 10.504 ( 2.994 3.357 -3.794) 5.885 10.843 ( 0.016 6.982 9.585) 11.858 11.050 ( -6.958 -17.989 1.807) 19.372 11.059 ( -0.507 -8.863 0.200) 8.879 11.359 ( -6.611 0.361 2.412) 7.046 11.480 ( -0.620 -1.716 1.546) 2.392 11.598 ( -5.283 -8.661 0.382) 10.152 11.641 ( 1.388 -0.158 2.583) 2.936 11.790 ( 5.061 -1.086 1.564) 5.407 11.953 ( -1.482 -0.008 -5.502) 5.698 12.151 ( -1.819 -1.267 5.372) 5.812 12.432 ( 0.597 3.597 -6.430) 7.392 12.566 ( 1.902 0.551 4.104) 4.557 12.778 ( -1.676 -2.088 -3.739) 4.599 13.001 ( -3.031 -0.384 4.965) 5.830 13.124 ( 3.525 8.064 0.592) 8.820 13.213 ( -0.950 2.921 -1.278) 3.327 13.412 ( -1.614 -1.363 -0.606) 2.198 13.416 ( -3.535 5.371 -0.530) 6.452 13.849 ( -3.288 -4.652 1.935) 6.016 14.114 ( 9.774 4.233 -0.764) 10.679 14.529 ( -7.386 -3.139 0.008) 8.025 14.733 ( -2.861 -0.912 8.619) 9.127 15.064 ( -6.249 -4.998 -4.462) 9.162 15.784 ( 12.790 -18.524 -0.704) 22.521 15.892 ( -15.629 6.887 3.883) 17.515 16.158 ( 2.857 3.612 -8.866) 9.991 16.381 ( 8.949 20.894 -16.620) 28.157 16.774 ( -9.391 -1.849 -6.950) 11.829 17.654 ( -7.510 -13.915 20.526) 25.910 17.982 ( -5.234 -1.041 -8.053) 9.661 18.023 ( -8.656 -5.368 3.331) 10.716 18.417 ( 12.629 -24.185 -0.638) 27.291 19.194 ( 5.610 10.714 14.856) 19.156 19.415 ( 8.771 14.234 -4.344) 17.274 20.339 ( 1.325 13.364 0.543) 13.440 20.876 ( -1.131 8.733 1.225) 8.891 21.142 ( -0.398 1.004 -2.172) 2.426 21.510 ( 2.950 -14.399 -4.773) 15.454 ======================= Grid point 31 (23/199) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.820 ( 6.293 18.448 8.820) 21.395 3.024 ( -3.094 1.640 -6.142) 7.070 4.029 ( -25.368 11.449 0.693) 27.840 4.634 ( -10.183 10.139 0.639) 14.384 4.883 ( -0.953 1.693 -2.721) 3.343 5.232 ( 4.320 0.282 3.038) 5.289 6.061 ( -1.008 16.297 -3.570) 16.714 6.399 ( -3.544 4.546 2.411) 6.248 6.715 ( 4.456 7.000 3.540) 9.021 6.887 ( 5.603 -3.409 -5.239) 8.394 7.038 ( 2.693 -1.801 -4.726) 5.729 7.223 ( -6.135 -5.869 -3.396) 9.144 7.374 ( 3.277 -3.104 5.392) 7.032 7.510 ( -4.659 -10.790 3.858) 12.370 7.830 ( 8.950 -3.415 2.148) 9.818 7.945 ( -4.539 -14.159 -0.158) 14.870 8.061 ( -4.242 -3.305 -6.871) 8.725 8.197 ( -2.307 3.115 1.691) 4.230 8.482 ( -6.110 -8.801 4.064) 11.459 8.636 ( 1.098 5.734 -3.009) 6.568 8.744 ( 2.419 2.475 -3.333) 4.805 8.889 ( -3.918 9.044 1.742) 10.009 8.892 ( -3.422 7.562 -2.254) 8.601 9.031 ( 1.987 -2.236 -1.357) 3.285 9.155 ( -0.307 -3.106 -3.438) 4.643 9.296 ( -0.523 -7.335 -1.061) 7.430 9.554 ( 7.889 -4.393 -2.016) 9.252 9.727 ( 1.935 0.074 5.594) 5.919 9.776 ( -3.771 2.710 0.210) 4.649 9.962 ( 1.155 11.915 -2.846) 12.305 10.027 ( -0.495 5.133 -2.459) 5.713 10.112 ( -6.075 -0.121 0.974) 6.154 10.357 ( 4.286 3.961 -1.464) 6.017 10.576 ( 0.134 -0.617 1.127) 1.292 10.801 ( 1.694 2.195 8.642) 9.076 11.227 ( 3.331 -5.199 1.475) 6.348 11.280 ( 6.712 -24.628 0.858) 25.541 11.315 ( 3.764 -1.748 3.004) 5.123 11.491 ( -0.617 -0.624 1.132) 1.432 11.601 ( -0.820 -1.110 0.764) 1.577 11.708 ( 1.929 -11.964 0.082) 12.119 11.869 ( -3.577 4.089 -5.907) 8.025 11.967 ( 9.843 -5.991 4.466) 12.358 12.197 ( 3.269 -2.849 4.629) 6.343 12.406 ( 1.730 1.902 -5.801) 6.345 12.650 ( 5.288 -2.347 0.423) 5.801 12.763 ( -1.183 -1.829 -0.916) 2.362 12.982 ( 1.626 2.748 2.346) 3.963 13.122 ( 0.541 -0.572 -0.561) 0.967 13.233 ( 3.721 1.891 0.482) 4.202 13.338 ( 2.468 3.118 -0.626) 4.026 13.411 ( -3.047 -3.980 -0.881) 5.089 13.867 ( 0.490 -3.634 0.992) 3.798 14.248 ( 10.609 5.246 -1.025) 11.880 14.453 ( -6.605 -5.598 0.165) 8.660 14.731 ( 0.485 2.810 5.942) 6.591 14.981 ( -10.451 -9.900 0.272) 14.398 15.655 ( -7.675 5.260 8.726) 12.756 16.070 ( 0.946 0.514 -8.825) 8.891 16.254 ( 12.349 -1.557 -8.380) 15.005 16.326 ( 12.695 2.930 -8.302) 15.449 16.565 ( -12.483 -1.675 -10.819) 16.603 17.570 ( -15.822 -1.990 19.328) 25.057 17.873 ( -9.271 -1.565 -0.714) 9.429 17.961 ( -2.842 -5.599 0.153) 6.281 18.934 ( 15.403 -19.060 -13.439) 27.949 19.190 ( 2.475 12.513 13.721) 18.734 19.352 ( 4.310 10.929 2.958) 12.115 20.253 ( 1.418 9.160 2.445) 9.586 20.725 ( -6.450 8.901 -0.187) 10.994 21.015 ( -7.273 7.110 -2.052) 10.376 21.756 ( 8.800 -13.897 -3.004) 16.721 ======================= Grid point 32 (24/199) ======================= q-point: (-0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.674 ( -9.206 8.935 1.088) 12.875 2.911 ( 3.961 21.786 1.395) 22.187 3.413 ( -32.386 15.700 1.966) 36.044 4.226 ( -17.872 24.724 2.378) 30.600 4.702 ( -8.776 14.996 -4.115) 17.856 5.268 ( -1.428 1.427 4.726) 5.139 5.871 ( 0.037 23.082 -4.625) 23.541 6.293 ( -5.267 3.733 2.275) 6.845 6.584 ( -10.143 19.055 -1.801) 21.662 6.889 ( -23.587 6.726 -1.101) 24.553 7.093 ( 4.045 -8.557 0.003) 9.465 7.112 ( 2.466 0.920 -1.444) 3.002 7.192 ( -6.330 10.713 -8.185) 14.894 7.642 ( 3.096 -9.506 4.558) 10.988 7.800 ( -7.359 2.689 0.237) 7.838 7.930 ( -5.053 -1.042 1.553) 5.388 8.232 ( 7.461 -12.854 1.769) 14.967 8.328 ( 6.715 -9.748 4.423) 12.636 8.432 ( -5.813 -4.501 0.628) 7.379 8.666 ( 0.726 0.115 3.894) 3.962 8.740 ( 1.163 3.740 -3.840) 5.485 8.765 ( 3.083 -5.207 -2.153) 6.423 8.893 ( 4.546 -7.871 -3.875) 9.881 9.076 ( 0.746 -7.638 -2.345) 8.025 9.300 ( 10.847 -5.264 -2.129) 12.244 9.417 ( 7.685 -3.979 -1.159) 8.731 9.590 ( -2.509 1.282 -4.822) 5.585 9.677 ( -5.641 2.362 5.138) 7.987 9.811 ( 0.661 -7.071 1.809) 7.328 9.820 ( -1.883 7.128 -0.191) 7.375 10.083 ( 3.962 -6.264 -3.482) 8.189 10.093 ( 2.308 1.111 1.586) 3.013 10.429 ( 6.158 -3.271 1.539) 7.140 10.526 ( -2.738 -3.340 0.483) 4.346 10.914 ( 5.384 -1.880 8.039) 9.857 11.266 ( 2.264 1.879 -2.733) 4.016 11.416 ( 1.281 1.850 1.319) 2.608 11.466 ( 1.163 0.110 1.717) 2.077 11.599 ( 3.384 0.600 1.290) 3.671 11.665 ( 4.524 -16.392 -0.591) 17.015 11.762 ( 2.195 -4.368 1.134) 5.019 11.987 ( 11.267 -15.227 -2.992) 19.177 12.226 ( 9.398 -6.993 4.840) 12.674 12.307 ( 4.988 -4.574 2.138) 7.097 12.417 ( 2.342 -1.000 -5.739) 6.279 12.757 ( 4.074 -1.762 -2.023) 4.878 12.795 ( 1.759 -5.309 0.272) 5.599 12.988 ( -0.111 1.499 2.170) 2.640 13.153 ( 2.216 -2.252 -0.640) 3.223 13.282 ( 4.624 -0.158 -0.174) 4.630 13.393 ( -2.598 -6.929 -2.991) 7.982 13.427 ( 5.419 -0.258 3.442) 6.425 13.938 ( 3.516 -2.630 0.429) 4.412 14.300 ( 0.312 2.899 -1.328) 3.204 14.442 ( -1.465 -6.417 0.692) 6.618 14.685 ( -3.046 5.635 -1.122) 6.503 14.978 ( -0.836 -9.341 6.708) 11.530 15.579 ( 0.262 5.192 11.784) 12.880 15.952 ( -6.663 3.960 -11.695) 14.031 16.233 ( 5.502 14.817 -21.381) 26.589 16.297 ( -4.161 5.564 -7.650) 10.334 16.842 ( 16.752 -24.829 8.547) 31.147 17.363 ( -15.366 2.924 19.274) 24.822 17.698 ( -11.534 -0.264 -3.007) 11.922 17.966 ( -0.586 1.379 -2.870) 3.238 18.875 ( -5.839 21.637 -5.710) 23.127 19.084 ( -2.742 11.502 3.196) 12.249 19.716 ( 17.158 -27.751 -0.992) 32.642 20.225 ( 2.517 6.929 7.240) 10.333 20.510 ( -8.203 9.609 -0.262) 12.636 20.784 ( -9.157 10.502 -1.338) 13.997 22.009 ( 6.949 -12.567 -1.957) 14.493 ======================= Grid point 33 (25/199) ======================= q-point: (-0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.335 ( -24.036 10.329 -0.719) 26.171 2.679 ( -5.817 33.453 1.761) 34.001 2.816 ( -14.540 14.497 7.229) 21.767 3.653 ( -16.381 33.030 1.814) 36.913 4.330 ( -10.250 24.365 -7.231) 27.405 5.163 ( -7.487 12.360 11.646) 18.560 5.532 ( -12.484 35.942 -6.909) 38.671 5.736 ( -23.031 46.064 -7.873) 52.099 6.256 ( -8.786 3.304 -2.730) 9.775 6.605 ( -5.888 -1.164 1.778) 6.259 6.806 ( -11.721 16.073 0.282) 19.895 7.181 ( -0.444 -3.535 -2.181) 4.177 7.331 ( -1.711 -9.863 -0.706) 10.035 7.636 ( -4.742 1.762 -1.826) 5.378 7.744 ( 0.024 -3.810 6.763) 7.762 7.878 ( -1.739 -4.517 1.872) 5.189 8.345 ( -4.385 -0.696 4.119) 6.057 8.421 ( 4.516 -6.328 1.309) 7.884 8.462 ( -7.762 -10.353 0.371) 12.945 8.729 ( 2.238 -2.885 7.052) 7.941 8.772 ( 2.356 -7.269 -4.815) 9.032 8.966 ( 11.011 -7.461 -6.564) 14.832 9.139 ( 9.811 -14.622 -1.612) 17.682 9.212 ( 1.287 -14.149 1.491) 14.286 9.455 ( -2.167 -1.230 -4.383) 5.042 9.521 ( 1.467 -1.973 -3.521) 4.294 9.590 ( 12.643 7.580 -1.475) 14.814 9.636 ( -0.264 1.483 4.195) 4.457 9.752 ( 2.663 -10.897 0.121) 11.219 9.955 ( 5.661 -4.346 -1.604) 7.314 10.109 ( 2.158 0.461 -0.199) 2.215 10.272 ( 8.452 -12.739 0.521) 15.297 10.561 ( 4.371 -8.390 2.302) 9.736 10.701 ( 7.901 -16.854 0.381) 18.618 11.006 ( 0.064 -0.453 9.532) 9.543 11.206 ( -0.030 5.468 -6.225) 8.285 11.445 ( 3.853 -0.864 0.464) 3.976 11.527 ( 2.162 -2.589 0.785) 3.463 11.653 ( -1.880 -0.290 1.798) 2.617 11.686 ( 7.369 -0.169 0.679) 7.402 12.106 ( 10.972 -14.337 2.332) 18.203 12.239 ( 6.674 -2.511 1.879) 7.374 12.382 ( 3.606 -8.640 2.994) 9.829 12.480 ( 4.399 -5.691 -6.106) 9.435 12.517 ( 9.335 -8.792 -1.806) 12.950 12.788 ( -1.050 -1.660 -3.981) 4.439 12.889 ( 1.748 -6.246 -1.674) 6.698 12.960 ( -1.589 1.973 2.736) 3.729 13.244 ( 5.122 -2.557 -0.031) 5.725 13.407 ( 6.374 -5.683 -0.034) 8.539 13.451 ( 2.389 -10.306 -2.106) 10.787 13.507 ( 1.132 -1.590 4.187) 4.620 13.998 ( -1.673 -4.836 0.773) 5.175 14.231 ( -6.926 -2.181 -1.365) 7.388 14.458 ( -4.841 1.835 -2.384) 5.700 14.606 ( 2.415 -2.006 2.854) 4.243 15.124 ( 7.951 -1.747 2.856) 8.627 15.609 ( 3.883 6.530 9.927) 12.500 15.735 ( -8.189 5.497 -4.629) 10.896 16.061 ( -3.232 6.479 -12.640) 14.567 16.243 ( 8.752 15.101 -15.102) 23.080 17.108 ( -16.896 4.597 18.968) 25.815 17.287 ( -0.181 -9.530 6.349) 11.453 17.545 ( 0.468 -6.086 0.806) 6.157 17.879 ( 0.200 9.599 -9.553) 13.544 18.502 ( -9.638 26.269 2.414) 28.085 18.963 ( -2.724 3.469 -0.141) 4.412 20.115 ( 5.435 -4.194 -12.151) 13.956 20.266 ( -4.792 5.610 2.105) 7.673 20.359 ( 6.221 -12.963 8.489) 16.698 20.542 ( -6.316 9.409 2.964) 11.713 22.204 ( 3.306 -11.157 -0.726) 11.659 ======================= Grid point 34 (26/199) ======================= q-point: (-0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.684 ( -28.785 24.224 3.140) 37.752 2.335 ( -7.023 13.010 -4.548) 15.468 2.475 ( -4.894 39.349 13.631) 41.930 3.152 ( -6.693 28.892 -0.853) 29.669 3.896 ( -7.443 28.965 -7.745) 30.892 4.489 ( -25.126 75.213 -10.492) 79.990 4.780 ( -9.323 44.388 13.826) 47.416 5.389 ( -5.272 -1.190 -5.058) 7.403 6.111 ( 0.553 10.129 -1.755) 10.294 6.417 ( -14.147 15.062 0.990) 20.687 6.626 ( 2.423 -0.124 0.398) 2.458 7.082 ( -12.946 3.757 2.071) 13.638 7.258 ( -3.014 -1.845 -3.285) 4.825 7.706 ( 2.076 -9.781 -0.047) 9.999 7.796 ( 0.568 -4.623 4.494) 6.472 7.942 ( -1.180 -9.524 0.955) 9.644 8.298 ( -3.581 -2.591 0.751) 4.484 8.399 ( -7.721 -7.754 0.960) 10.984 8.556 ( 4.649 -4.532 1.999) 6.793 8.784 ( 1.694 -0.937 3.147) 3.695 8.870 ( 0.149 -5.959 -4.495) 7.466 9.092 ( 1.596 1.143 -1.490) 2.464 9.331 ( 0.261 -11.911 0.017) 11.914 9.404 ( 4.683 -5.630 1.263) 7.431 9.483 ( 5.162 -4.072 -3.758) 7.573 9.520 ( 0.407 -2.323 -3.557) 4.267 9.627 ( -2.108 -4.647 0.734) 5.156 9.699 ( 5.258 -1.698 0.925) 5.602 9.989 ( 6.588 -7.740 -1.557) 10.283 10.125 ( -1.093 -11.661 -1.808) 11.851 10.159 ( 14.333 7.456 1.905) 16.268 10.547 ( 7.412 -13.039 1.412) 15.065 10.784 ( 4.696 -18.833 1.259) 19.450 10.944 ( 0.676 -7.114 4.347) 8.364 11.054 ( 3.472 -15.768 -0.124) 16.146 11.220 ( 2.600 -3.621 -1.187) 4.613 11.485 ( 0.598 2.248 1.477) 2.755 11.619 ( 5.502 -4.411 -0.227) 7.056 11.675 ( 0.342 -4.212 2.839) 5.091 11.824 ( 6.842 -2.187 0.035) 7.184 12.267 ( 2.532 -0.846 -2.823) 3.885 12.325 ( 1.132 -0.863 3.803) 4.061 12.546 ( 3.917 -6.776 1.958) 8.068 12.618 ( 3.031 -11.041 -2.755) 11.776 12.742 ( 7.708 -7.250 -4.544) 11.517 12.750 ( -1.417 -0.383 -2.886) 3.238 12.910 ( -0.898 0.624 1.537) 1.886 12.984 ( 2.042 -5.306 -0.845) 5.748 13.326 ( 1.353 -3.333 0.504) 3.633 13.467 ( -5.675 -1.613 2.940) 6.592 13.621 ( 11.376 -9.879 -2.766) 15.319 13.688 ( 7.702 -12.838 1.821) 15.082 13.984 ( -7.310 -7.623 1.611) 10.684 14.122 ( -8.205 -3.801 -2.701) 9.438 14.294 ( -9.389 0.113 -0.856) 9.428 14.774 ( 12.815 1.861 5.050) 13.899 15.205 ( -2.941 -1.117 -5.886) 6.674 15.459 ( -4.819 8.436 -1.928) 9.904 15.771 ( 13.032 11.891 13.214) 22.041 15.957 ( -0.405 2.452 -6.913) 7.346 16.152 ( 2.334 16.857 -12.746) 21.262 16.840 ( -13.494 5.441 12.785) 19.368 17.041 ( -15.122 10.187 -5.899) 19.164 17.624 ( 4.040 20.514 0.730) 20.921 17.975 ( 5.462 -15.767 2.335) 16.849 18.098 ( -6.948 23.215 3.759) 24.522 18.935 ( -0.570 -3.098 -2.021) 3.743 20.049 ( -3.287 9.020 -0.601) 9.619 20.116 ( -2.505 8.442 -1.059) 8.869 20.381 ( -0.633 3.892 -3.135) 5.037 20.768 ( 6.822 -23.955 5.241) 25.453 22.327 ( 0.006 -9.445 0.217) 9.447 ======================= Grid point 35 (27/199) ======================= q-point: (-0.17 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.139 ( 0.000 30.058 -0.000) 30.058 2.002 ( 0.000 48.722 -0.000) 48.722 2.168 ( 0.000 9.429 -0.000) 9.429 2.861 ( 0.000 22.768 -0.000) 22.768 3.450 ( 0.000 85.838 -0.000) 85.838 3.534 ( 0.000 28.905 -0.000) 28.905 4.235 ( 0.000 52.427 -0.000) 52.427 5.396 ( -0.000 -7.802 0.000) 7.802 6.053 ( 0.000 13.162 -0.000) 13.162 6.095 ( 0.000 15.571 -0.000) 15.571 6.687 ( -0.000 -4.187 0.000) 4.187 6.861 ( 0.000 10.467 -0.000) 10.467 7.261 ( -0.000 -4.236 0.000) 4.236 7.781 ( -0.000 -3.788 0.000) 3.788 7.909 ( -0.000 -10.339 0.000) 10.339 7.982 ( -0.000 -5.902 0.000) 5.902 8.317 ( -0.000 -5.438 0.000) 5.438 8.407 ( -0.000 -8.427 0.000) 8.427 8.632 ( -0.000 -0.800 0.000) 0.800 8.835 ( -0.000 -1.789 0.000) 1.789 8.844 ( 0.000 3.893 -0.000) 3.893 9.074 ( 0.000 3.210 -0.000) 3.210 9.358 ( 0.000 5.964 -0.000) 5.964 9.503 ( -0.000 -1.385 0.000) 1.385 9.507 ( -0.000 -10.501 0.000) 10.501 9.637 ( -0.000 -2.591 0.000) 2.591 9.658 ( -0.000 -8.640 0.000) 8.640 9.788 ( -0.000 -4.849 0.000) 4.849 10.073 ( -0.000 -2.482 0.000) 2.482 10.123 ( -0.000 -1.898 0.000) 1.898 10.342 ( -0.000 -3.610 0.000) 3.610 10.739 ( -0.000 -15.404 0.000) 15.404 11.025 ( -0.000 -21.897 0.000) 21.897 11.037 ( -0.000 -10.725 0.000) 10.725 11.241 ( -0.000 -9.428 0.000) 9.428 11.351 ( -0.000 -18.857 0.000) 18.857 11.462 ( 0.000 2.942 -0.000) 2.942 11.718 ( -0.000 -2.514 0.000) 2.514 11.736 ( -0.000 -5.765 0.000) 5.765 11.925 ( -0.000 -5.296 0.000) 5.296 12.282 ( 0.000 0.934 -0.000) 0.934 12.322 ( 0.000 2.655 -0.000) 2.655 12.628 ( -0.000 -4.354 0.000) 4.354 12.728 ( -0.000 -2.066 0.000) 2.066 12.748 ( -0.000 -10.577 0.000) 10.577 12.819 ( -0.000 -1.624 0.000) 1.624 12.944 ( 0.000 0.533 -0.000) 0.533 13.063 ( -0.000 -5.800 0.000) 5.800 13.366 ( -0.000 -3.953 0.000) 3.953 13.432 ( -0.000 -3.616 0.000) 3.616 13.877 ( -0.000 -1.042 0.000) 1.042 13.897 ( -0.000 -14.468 0.000) 14.468 13.925 ( -0.000 -11.683 0.000) 11.683 14.086 ( -0.000 -7.212 0.000) 7.212 14.224 ( -0.000 -5.623 0.000) 5.623 14.927 ( 0.000 14.282 -0.000) 14.282 15.049 ( -0.000 -5.529 0.000) 5.529 15.391 ( 0.000 3.776 -0.000) 3.776 15.842 ( 0.000 18.762 -0.000) 18.762 15.918 ( 0.000 5.664 -0.000) 5.664 15.950 ( 0.000 8.605 -0.000) 8.605 16.693 ( 0.000 4.486 -0.000) 4.486 16.767 ( 0.000 10.960 -0.000) 10.960 17.445 ( 0.000 24.277 -0.000) 24.277 17.707 ( 0.000 30.335 -0.000) 30.335 18.284 ( -0.000 -20.823 0.000) 20.823 18.967 ( -0.000 -4.309 0.000) 4.309 19.929 ( 0.000 8.626 -0.000) 8.626 20.006 ( 0.000 8.719 -0.000) 8.719 20.360 ( 0.000 0.843 -0.000) 0.843 21.048 ( -0.000 -20.371 0.000) 20.371 22.402 ( -0.000 -7.399 0.000) 7.399 ======================= Grid point 40 (28/199) ======================= q-point: ( 0.25 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.669 ( 10.156 -0.000 -6.611) 12.118 2.680 ( 22.943 -0.000 5.015) 23.485 4.057 ( 22.330 -0.000 15.769) 27.337 4.566 ( 2.759 -0.000 4.603) 5.367 4.779 ( 20.989 -0.000 -4.712) 21.512 5.102 ( -4.137 0.000 -14.876) 15.441 6.278 ( 8.243 -0.000 -3.569) 8.983 6.429 ( 9.888 -0.000 6.316) 11.733 6.483 ( 14.793 -0.000 4.090) 15.348 6.702 ( 15.008 -0.000 -4.124) 15.565 7.044 ( -7.211 0.000 6.394) 9.637 7.052 ( -6.603 0.000 -5.247) 8.434 7.241 ( -0.450 0.000 8.326) 8.338 7.243 ( -4.346 0.000 -10.369) 11.242 7.762 ( 2.584 -0.000 -0.729) 2.684 7.793 ( -6.328 0.000 3.202) 7.092 8.005 ( 1.312 -0.000 -14.088) 14.149 8.237 ( 6.853 -0.000 -2.847) 7.421 8.548 ( -7.154 0.000 0.043) 7.154 8.591 ( 12.075 -0.000 1.756) 12.202 8.720 ( -5.046 0.000 -1.443) 5.248 8.884 ( -4.668 0.000 0.243) 4.675 9.048 ( -1.042 0.000 8.651) 8.714 9.169 ( 1.440 -0.000 -1.073) 1.795 9.295 ( -9.066 0.000 -4.381) 10.069 9.384 ( -6.703 0.000 -4.304) 7.965 9.639 ( -1.631 0.000 -2.733) 3.182 9.844 ( 1.343 -0.000 7.037) 7.164 9.867 ( -6.610 0.000 2.366) 7.021 9.942 ( 13.989 -0.000 3.765) 14.487 9.946 ( 7.348 -0.000 5.351) 9.089 10.194 ( 8.242 -0.000 -5.452) 9.882 10.216 ( -7.222 0.000 -1.451) 7.366 10.669 ( -3.256 0.000 -1.149) 3.453 10.917 ( 0.679 -0.000 4.158) 4.213 11.103 ( -19.920 0.000 -0.325) 19.923 11.226 ( -12.722 0.000 1.659) 12.830 11.423 ( 0.136 -0.000 -2.765) 2.768 11.444 ( 2.975 -0.000 0.855) 3.096 11.557 ( -11.092 0.000 0.003) 11.092 11.636 ( -10.570 0.000 0.421) 10.578 11.743 ( 5.192 -0.000 -2.773) 5.886 12.057 ( -5.546 0.000 6.646) 8.656 12.095 ( -0.672 0.000 0.870) 1.099 12.599 ( -0.519 0.000 4.882) 4.909 12.605 ( -7.483 0.000 -7.721) 10.752 12.829 ( -4.201 0.000 -2.603) 4.942 12.890 ( -1.013 0.000 6.877) 6.952 13.271 ( -0.971 0.000 -2.848) 3.009 13.304 ( -0.598 0.000 4.822) 4.859 13.483 ( -6.767 0.000 -0.925) 6.830 13.642 ( -8.141 0.000 0.456) 8.154 13.852 ( -5.217 0.000 2.399) 5.742 14.092 ( 5.228 -0.000 1.591) 5.465 14.609 ( -10.125 0.000 1.580) 10.248 14.761 ( -9.190 0.000 5.341) 10.629 15.161 ( 7.731 -0.000 -10.757) 13.247 15.229 ( 5.185 -0.000 -4.700) 6.998 16.178 ( 7.307 -0.000 -11.793) 13.873 16.389 ( -28.083 0.000 2.264) 28.174 16.813 ( -0.678 0.000 -9.538) 9.562 16.846 ( 4.085 -0.000 -16.045) 16.557 17.200 ( 16.857 -0.000 12.644) 21.072 17.436 ( 8.527 -0.000 13.144) 15.668 18.138 ( -8.002 0.000 6.209) 10.128 18.368 ( -10.848 0.000 -0.580) 10.863 19.220 ( -0.483 0.000 8.442) 8.456 19.416 ( 14.315 -0.000 -1.770) 14.424 20.680 ( 11.725 -0.000 -4.259) 12.475 20.786 ( 4.714 -0.000 9.727) 10.809 21.011 ( 12.332 -0.000 0.713) 12.353 21.418 ( -15.908 0.000 -11.389) 19.565 ======================= Grid point 41 (29/199) ======================= q-point: ( 0.33 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.848 ( 8.090 -6.319 -6.917) 12.378 3.032 ( 20.367 8.703 6.881) 23.193 4.423 ( 11.243 -8.143 11.751) 18.188 4.508 ( -7.453 2.468 3.279) 8.508 4.976 ( -1.072 3.391 -12.770) 13.256 5.079 ( 11.648 -2.489 -2.456) 12.161 6.407 ( 5.466 2.049 -2.164) 6.225 6.577 ( 9.414 11.367 2.430) 14.958 6.604 ( 1.585 -4.305 0.451) 4.609 6.841 ( 0.628 -6.255 2.853) 6.903 6.943 ( 2.719 4.199 1.392) 5.192 7.056 ( 1.700 -5.755 -5.414) 8.082 7.160 ( -4.261 1.759 -3.433) 5.748 7.301 ( 1.723 -6.323 6.247) 9.054 7.664 ( -6.362 -1.457 4.484) 7.919 7.808 ( -1.071 -2.123 -1.358) 2.738 7.966 ( -2.195 -2.716 -15.473) 15.862 8.284 ( -4.106 -3.100 0.191) 5.148 8.420 ( -4.728 -0.738 2.549) 5.422 8.734 ( 4.044 0.523 -2.548) 4.808 8.806 ( 11.774 -0.417 0.071) 11.782 8.857 ( 0.099 -1.682 1.218) 2.079 8.996 ( -5.462 3.574 3.070) 7.213 9.157 ( -4.918 -0.346 -6.019) 7.781 9.186 ( 0.316 0.476 -1.902) 1.986 9.290 ( -0.340 2.010 0.491) 2.097 9.578 ( -1.398 8.084 -4.291) 9.258 9.752 ( -2.206 4.935 6.177) 8.208 9.913 ( -0.487 -1.161 -1.481) 1.944 10.071 ( -3.842 -8.518 7.599) 12.044 10.139 ( 10.268 1.805 1.944) 10.605 10.260 ( 10.236 4.388 -1.773) 11.277 10.336 ( 10.672 -0.226 -0.575) 10.690 10.536 ( -5.689 -0.913 -7.492) 9.451 10.787 ( -18.395 -6.386 -0.110) 19.472 10.864 ( -13.850 -1.872 4.541) 14.696 11.090 ( 4.251 6.433 6.326) 9.974 11.406 ( -1.737 4.035 -1.398) 4.610 11.444 ( -1.955 -2.983 2.717) 4.484 11.488 ( -1.574 -3.367 -0.361) 3.734 11.626 ( 4.990 -0.777 5.799) 7.690 11.789 ( 2.568 0.339 -4.317) 5.035 11.986 ( -1.768 3.522 0.871) 4.036 12.085 ( -4.112 -5.065 2.163) 6.874 12.484 ( -1.714 1.960 -6.130) 6.660 12.573 ( -3.701 -0.454 4.044) 5.501 12.780 ( 0.380 1.737 -2.919) 3.418 12.914 ( -1.524 -4.031 6.438) 7.748 13.232 ( 0.301 2.197 -1.776) 2.841 13.330 ( -4.010 0.042 -0.989) 4.131 13.350 ( -2.081 2.930 2.506) 4.381 13.501 ( -7.603 0.983 0.273) 7.671 13.810 ( -0.243 0.411 1.700) 1.766 14.200 ( 9.123 3.613 -2.088) 10.032 14.469 ( -7.961 -2.246 2.657) 8.688 14.648 ( -8.775 -5.045 8.282) 13.078 15.144 ( 2.807 11.425 -7.958) 14.204 15.431 ( 7.545 -17.552 -3.871) 19.493 15.986 ( -19.024 2.635 6.719) 20.348 16.221 ( 3.469 2.195 -13.284) 13.904 16.713 ( 0.599 8.318 -13.613) 15.964 16.781 ( -4.651 4.248 -9.944) 11.771 17.472 ( 6.525 -0.402 15.078) 16.434 17.748 ( 14.444 -19.291 -1.981) 24.181 18.004 ( -10.097 -0.432 4.275) 10.973 18.137 ( -12.386 -3.868 1.551) 13.068 19.336 ( 7.785 3.899 17.177) 19.258 19.595 ( 9.458 4.571 -1.077) 10.560 20.651 ( 1.308 18.068 -1.491) 18.176 20.945 ( -2.214 -6.695 4.294) 8.256 21.143 ( 4.258 2.206 -6.408) 8.004 21.259 ( 0.939 -9.487 -5.883) 11.203 ======================= Grid point 42 (30/199) ======================= q-point: (-0.58 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.929 ( -1.253 -0.656 -6.171) 6.331 3.220 ( 11.415 11.272 8.429) 18.122 4.227 ( -16.789 10.479 3.261) 20.058 4.714 ( 6.559 -5.616 5.321) 10.143 4.873 ( -2.596 2.203 -9.321) 9.924 5.236 ( 5.612 0.071 0.365) 5.624 6.304 ( -5.862 10.498 0.443) 12.032 6.569 ( 2.892 9.763 0.137) 10.183 6.729 ( 6.566 -4.559 -2.792) 8.468 6.909 ( 3.591 3.478 1.360) 5.181 7.043 ( -0.366 3.180 -3.957) 5.089 7.093 ( 5.891 -10.834 1.594) 12.434 7.148 ( -0.318 -7.912 -1.906) 8.145 7.389 ( -0.028 -4.509 5.747) 7.304 7.639 ( -5.270 -12.333 3.511) 13.864 7.847 ( 7.238 0.937 -0.726) 7.334 7.908 ( -5.699 -8.303 -11.693) 15.432 8.237 ( -5.934 -8.044 0.237) 9.999 8.357 ( -4.661 3.930 4.862) 7.797 8.733 ( -2.930 3.264 -0.852) 4.468 8.839 ( -7.654 -0.097 2.030) 7.919 8.913 ( 5.273 3.113 -3.378) 6.994 8.995 ( 6.426 1.944 -2.842) 7.291 9.075 ( -2.355 -3.645 -5.726) 7.184 9.138 ( -3.207 5.580 -1.702) 6.657 9.244 ( -3.498 2.463 2.106) 4.768 9.537 ( 3.748 1.366 -0.098) 3.990 9.712 ( -1.428 0.170 6.801) 6.952 9.822 ( -5.469 2.440 -2.871) 6.641 10.076 ( -7.753 -4.844 7.142) 11.601 10.173 ( -1.080 7.326 -3.682) 8.270 10.196 ( -5.522 12.278 -7.217) 15.276 10.436 ( 10.078 3.602 -4.239) 11.512 10.566 ( -2.258 0.157 3.484) 4.154 10.741 ( 4.731 -13.652 2.125) 14.605 10.896 ( 7.917 -13.410 1.646) 15.660 11.139 ( 5.866 2.524 7.133) 9.574 11.348 ( 0.713 4.469 0.263) 4.533 11.458 ( -2.335 -6.022 1.656) 6.668 11.490 ( 0.289 -0.084 1.762) 1.787 11.713 ( 3.367 3.702 1.133) 5.131 11.854 ( 3.321 -4.037 -5.067) 7.281 11.948 ( 1.703 2.046 0.695) 2.751 12.095 ( -1.718 -7.109 7.429) 10.425 12.442 ( -0.083 1.971 -5.751) 6.080 12.582 ( 2.074 -4.173 0.052) 4.660 12.780 ( 2.332 2.425 -1.433) 3.656 12.943 ( -1.111 -3.503 5.480) 6.598 13.186 ( -3.515 3.018 -2.233) 5.143 13.257 ( 1.157 0.285 0.150) 1.201 13.337 ( -3.508 -1.061 0.603) 3.714 13.410 ( -0.780 1.649 0.701) 1.955 13.839 ( 4.272 1.714 0.049) 4.603 14.262 ( -2.190 -5.650 -1.831) 6.330 14.403 ( -2.173 2.893 0.939) 3.739 14.677 ( 3.467 -7.302 9.222) 12.264 15.012 ( -2.495 11.773 -5.278) 13.141 15.683 ( -4.173 -8.720 7.972) 12.531 15.851 ( 6.874 -10.154 3.130) 12.655 16.179 ( -0.871 1.442 -14.588) 14.685 16.573 ( -9.603 2.858 -7.215) 12.347 16.633 ( 4.791 11.820 -17.997) 22.058 17.531 ( -4.110 2.811 18.181) 18.851 17.848 ( -9.264 -0.864 1.010) 9.359 17.917 ( 0.737 -0.338 -2.319) 2.456 18.383 ( 15.314 -31.177 -4.738) 35.057 19.424 ( 3.003 9.653 18.126) 20.754 19.605 ( -0.009 9.966 -1.928) 10.151 20.468 ( -2.621 13.116 0.686) 13.393 20.846 ( -8.504 2.676 1.674) 9.071 21.131 ( -1.155 4.847 -3.763) 6.244 21.477 ( 9.298 -13.897 -5.480) 17.596 ======================= Grid point 43 (31/199) ======================= q-point: (-0.50 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.798 ( -8.216 6.396 -4.266) 11.252 3.236 ( -1.966 7.939 7.616) 11.176 3.785 ( -16.068 24.094 3.032) 29.118 4.636 ( -5.851 17.119 0.048) 18.091 4.852 ( -2.583 -0.026 -3.188) 4.103 5.285 ( 0.639 0.331 1.319) 1.502 6.145 ( -1.378 8.399 -0.317) 8.517 6.450 ( -4.283 12.295 -0.610) 13.033 6.810 ( -1.978 2.600 -0.225) 3.274 6.894 ( -4.161 0.248 0.321) 4.180 7.042 ( 2.067 2.267 -2.405) 3.898 7.069 ( -0.559 0.205 -4.887) 4.923 7.375 ( 4.477 -16.262 4.505) 17.458 7.426 ( -0.763 2.714 0.790) 2.928 7.767 ( -2.742 -9.295 -1.757) 9.849 7.880 ( -2.351 -9.952 -0.690) 10.249 7.937 ( -0.392 -5.534 -2.583) 6.119 8.160 ( -0.835 -2.133 -1.336) 2.651 8.390 ( 3.412 -6.928 5.753) 9.630 8.615 ( -5.562 4.185 2.078) 7.264 8.717 ( -8.087 -6.573 -0.377) 10.428 8.821 ( -9.086 3.986 -3.534) 10.533 8.929 ( -1.685 11.000 -2.092) 11.323 9.014 ( -2.095 -0.737 -4.307) 4.846 9.194 ( 8.423 -3.796 -4.258) 10.173 9.306 ( 5.024 -6.451 0.844) 8.220 9.584 ( 0.530 -2.823 2.727) 3.961 9.729 ( -4.022 -1.232 7.497) 8.597 9.758 ( 4.090 2.468 1.292) 4.948 9.933 ( -9.460 2.582 -6.234) 11.620 10.021 ( -3.769 2.051 -0.141) 4.293 10.078 ( -0.440 0.966 0.642) 1.240 10.500 ( 2.651 4.625 1.919) 5.666 10.548 ( 1.534 7.340 -4.893) 8.954 10.910 ( 6.846 1.176 7.094) 9.928 11.230 ( 8.335 -15.722 -1.602) 17.867 11.286 ( 10.064 -4.476 3.113) 11.446 11.405 ( 3.745 -2.262 2.114) 4.859 11.497 ( -0.129 2.164 1.807) 2.823 11.590 ( 9.617 -16.851 -1.326) 19.447 11.703 ( 2.615 5.468 -0.297) 6.068 11.805 ( -2.227 0.351 -6.718) 7.086 12.111 ( 9.709 -4.575 6.477) 12.536 12.197 ( 1.080 -8.412 5.570) 10.146 12.413 ( 0.430 1.309 -4.730) 4.927 12.680 ( 3.526 -5.800 -3.702) 7.732 12.794 ( 2.815 2.701 -1.974) 4.372 12.981 ( 0.227 -1.766 5.244) 5.538 13.130 ( -0.612 0.040 -0.011) 0.614 13.264 ( -4.396 -6.275 -2.580) 8.084 13.309 ( 2.295 1.417 0.514) 2.746 13.430 ( 2.753 0.487 2.480) 3.738 13.891 ( 0.806 -1.239 0.840) 1.700 14.268 ( -6.906 -7.794 -0.605) 10.431 14.343 ( -0.155 -1.704 1.704) 2.414 14.791 ( -6.161 2.408 -8.376) 10.673 14.941 ( 16.334 8.061 8.266) 20.003 15.667 ( 0.430 3.308 15.316) 15.676 15.987 ( -6.620 -0.500 -11.724) 13.473 16.317 ( 9.658 -15.899 1.819) 18.691 16.366 ( -4.947 -1.708 -5.751) 7.776 16.591 ( 10.066 10.741 -19.484) 24.420 17.417 ( -10.117 5.891 18.237) 21.672 17.705 ( -7.761 0.966 -1.908) 8.050 17.978 ( 6.267 0.543 -2.207) 6.666 18.902 ( 12.264 -25.276 -14.938) 31.819 19.336 ( -5.234 12.792 7.891) 15.915 19.448 ( -4.145 6.809 8.779) 11.858 20.359 ( -0.631 7.164 6.141) 9.457 20.662 ( -9.300 5.674 1.641) 11.017 20.989 ( -4.986 10.907 -3.210) 12.415 21.740 ( 6.997 -15.047 -4.759) 17.264 ======================= Grid point 44 (32/199) ======================= q-point: (-0.42 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.524 ( -14.777 10.251 -1.657) 18.061 2.998 ( -20.314 7.505 4.655) 22.151 3.373 ( 2.093 34.306 3.469) 34.545 4.277 ( -9.467 30.569 2.779) 32.122 4.707 ( -5.225 12.949 -5.156) 14.885 5.256 ( -3.046 2.030 3.014) 4.742 6.032 ( -4.082 15.384 -0.825) 15.938 6.241 ( -7.219 4.244 -0.954) 8.428 6.596 ( -17.842 22.072 -1.652) 28.430 6.679 ( -2.856 11.590 -1.534) 12.035 7.028 ( -6.507 6.073 -2.846) 9.344 7.155 ( 4.571 -6.763 -2.636) 8.578 7.191 ( -4.585 11.394 -3.456) 12.759 7.569 ( -1.680 -10.226 3.488) 10.934 7.690 ( -4.134 -3.535 -0.640) 5.477 7.840 ( -6.137 0.995 6.111) 8.718 8.148 ( 2.537 -19.473 -1.931) 19.732 8.293 ( 1.729 -8.497 -1.585) 8.815 8.363 ( -3.987 2.734 3.006) 5.692 8.587 ( -3.548 -7.934 1.841) 8.884 8.682 ( -6.050 -8.321 0.822) 10.321 8.840 ( 8.454 -5.056 1.364) 9.944 8.869 ( 6.164 -6.265 -4.358) 9.810 9.033 ( 2.548 -4.680 -4.306) 6.851 9.361 ( 6.806 -5.081 -3.205) 9.078 9.455 ( 3.700 -10.728 -1.891) 11.505 9.548 ( -6.086 0.721 5.248) 8.068 9.694 ( -8.526 0.309 0.471) 8.544 9.818 ( 2.179 1.131 2.400) 3.433 9.848 ( 9.037 4.206 2.252) 10.219 9.999 ( -0.579 -8.207 -0.963) 8.284 10.157 ( 4.760 -5.195 -0.352) 7.055 10.461 ( -1.662 -4.495 -1.517) 5.027 10.557 ( 8.028 5.571 -1.009) 9.823 11.007 ( 3.856 1.349 6.537) 7.708 11.303 ( -0.456 1.413 -2.588) 2.983 11.433 ( -1.529 0.972 -0.720) 1.949 11.457 ( 1.879 -2.815 2.073) 3.969 11.615 ( 1.778 -4.910 -4.336) 6.787 11.736 ( 7.485 3.101 1.636) 8.265 11.834 ( 14.694 -10.716 3.825) 18.584 12.045 ( 14.923 -16.117 -1.890) 22.046 12.285 ( 0.477 -4.323 4.811) 6.486 12.331 ( 6.870 -8.254 2.802) 11.098 12.408 ( 1.101 -1.589 -6.004) 6.307 12.769 ( 1.305 -5.734 -2.956) 6.581 12.798 ( 0.827 0.766 -5.151) 5.273 12.997 ( -0.342 1.421 4.561) 4.789 13.168 ( 1.759 -4.247 2.254) 5.120 13.267 ( -0.470 -7.440 -2.904) 8.001 13.376 ( 5.937 -0.662 -0.864) 6.036 13.474 ( -0.441 -1.852 4.090) 4.512 13.872 ( -8.374 -7.520 3.221) 11.707 14.153 ( -11.414 -5.000 -0.054) 12.461 14.486 ( 10.573 -2.010 -0.214) 10.765 14.603 ( -6.611 5.314 -4.451) 9.579 15.169 ( 14.049 5.752 -0.406) 15.187 15.740 ( 5.022 5.973 12.546) 14.775 15.819 ( -3.841 3.865 -0.119) 5.450 16.166 ( -6.056 5.077 -7.465) 10.871 16.547 ( 10.968 12.607 -17.545) 24.230 16.871 ( 13.534 -25.937 4.698) 29.631 17.202 ( -14.775 5.989 14.760) 21.726 17.557 ( -6.261 4.614 -2.850) 8.284 18.055 ( 7.518 6.909 -5.384) 11.543 18.891 ( -8.343 12.032 -8.590) 16.975 19.121 ( -9.036 12.519 7.706) 17.255 19.679 ( 12.345 -28.605 -2.572) 31.261 20.314 ( -1.924 4.364 9.731) 10.836 20.454 ( -8.385 7.112 1.597) 11.110 20.765 ( -6.112 13.501 -1.919) 14.944 21.957 ( 3.510 -14.445 -3.225) 15.211 ======================= Grid point 45 (33/199) ======================= q-point: (-0.33 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.088 ( -19.863 18.119 2.465) 26.998 2.617 ( -9.537 15.201 -1.666) 18.022 3.147 ( 3.599 31.292 5.345) 31.948 3.806 ( -7.162 37.775 2.176) 38.509 4.426 ( -4.229 24.474 -5.568) 25.453 5.208 ( -0.360 2.832 6.895) 7.462 5.652 ( -12.521 27.357 -1.410) 30.119 5.844 ( -16.148 61.470 -7.035) 63.944 6.174 ( -2.588 -2.700 -2.415) 4.452 6.594 ( 1.048 4.619 -1.694) 5.031 6.786 ( -8.050 12.618 0.978) 14.999 7.097 ( -3.685 1.656 3.934) 5.639 7.241 ( -1.361 -2.491 -1.938) 3.437 7.553 ( -1.628 -4.736 -4.364) 6.642 7.728 ( -0.957 -5.597 3.446) 6.642 7.763 ( -4.862 -4.070 4.302) 7.662 8.263 ( -4.242 -0.728 -1.580) 4.585 8.302 ( -2.729 -4.238 3.554) 6.168 8.368 ( 1.266 -14.094 -2.264) 14.331 8.678 ( 1.659 -11.367 1.392) 11.572 8.728 ( 0.200 -6.316 -0.243) 6.324 9.017 ( 5.286 -13.046 -2.206) 14.248 9.094 ( 2.396 -5.552 0.798) 6.100 9.178 ( 7.918 -12.663 -1.445) 15.005 9.444 ( -3.685 -1.058 -1.313) 4.052 9.475 ( 1.729 -4.300 -2.612) 5.320 9.559 ( -5.140 -2.953 0.171) 5.931 9.682 ( 5.227 -10.465 5.349) 12.863 9.813 ( 1.836 2.606 -3.960) 5.084 9.959 ( 1.057 -5.979 1.931) 6.372 10.159 ( 5.884 -15.346 0.821) 16.456 10.299 ( 5.241 -3.536 0.275) 6.328 10.580 ( 2.829 -16.052 -1.218) 16.345 10.693 ( 11.113 -0.888 -0.624) 11.166 11.025 ( -2.992 4.455 6.762) 8.633 11.207 ( -2.146 2.371 -4.064) 5.171 11.468 ( 1.058 -4.575 0.085) 4.697 11.536 ( 3.494 -3.615 0.871) 5.102 11.613 ( -1.271 -1.313 -1.144) 2.156 11.833 ( 6.435 2.401 1.478) 7.025 12.191 ( 9.562 -7.970 -0.410) 12.455 12.300 ( 0.237 -1.255 5.915) 6.051 12.396 ( 8.417 -9.189 4.579) 13.276 12.436 ( 1.839 -6.744 -6.790) 9.745 12.552 ( 7.352 -11.513 -3.504) 14.102 12.767 ( -0.797 1.035 -2.861) 3.145 12.820 ( -2.389 -7.841 -3.272) 8.826 12.986 ( 0.596 2.641 2.560) 3.726 13.240 ( 0.594 -6.073 0.787) 6.152 13.391 ( 2.912 -6.399 -0.230) 7.034 13.459 ( -1.476 -5.318 2.515) 6.065 13.522 ( 7.535 -5.539 -1.483) 9.469 13.804 ( -10.983 -10.294 4.820) 15.806 14.018 ( -10.088 -5.665 -0.966) 11.610 14.397 ( -4.894 9.070 -3.781) 10.978 14.735 ( 11.164 -4.278 2.436) 12.201 15.248 ( 2.142 4.714 -4.912) 7.137 15.616 ( -3.812 7.633 -2.557) 8.906 15.981 ( 15.836 8.966 18.496) 25.947 16.020 ( -2.528 4.930 -3.625) 6.621 16.507 ( 7.007 18.472 -20.039) 28.140 16.921 ( -15.725 3.895 11.269) 19.734 17.196 ( -3.061 -0.256 2.148) 3.749 17.500 ( 3.820 -16.550 0.295) 16.988 18.036 ( 5.596 16.287 -6.681) 18.472 18.592 ( -6.993 21.858 3.052) 23.151 18.913 ( -6.375 2.019 1.092) 6.776 20.122 ( 11.219 -16.752 -15.476) 25.417 20.248 ( -4.222 3.769 4.885) 7.476 20.307 ( -4.449 -4.099 10.905) 12.470 20.552 ( -4.466 10.929 1.561) 11.909 22.113 ( 0.624 -12.878 -1.397) 12.968 ======================= Grid point 46 (34/199) ======================= q-point: (-0.25 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.679 ( 0.000 25.693 -0.000) 25.693 2.392 ( 0.000 15.153 -0.000) 15.153 2.864 ( 0.000 37.521 -0.000) 37.521 3.394 ( 0.000 34.461 -0.000) 34.461 4.111 ( 0.000 29.934 -0.000) 29.934 5.004 ( 0.000 75.895 -0.000) 75.895 5.162 ( 0.000 41.831 -0.000) 41.831 5.274 ( -0.000 -4.683 0.000) 4.683 6.176 ( -0.000 -1.393 0.000) 1.393 6.474 ( 0.000 23.578 -0.000) 23.578 6.646 ( -0.000 -0.816 0.000) 0.816 7.031 ( 0.000 6.013 -0.000) 6.013 7.209 ( -0.000 -0.383 0.000) 0.383 7.636 ( -0.000 -10.615 0.000) 10.615 7.737 ( -0.000 -4.691 0.000) 4.691 7.824 ( -0.000 -10.352 0.000) 10.352 8.219 ( -0.000 -1.923 0.000) 1.923 8.319 ( -0.000 -3.093 0.000) 3.093 8.518 ( -0.000 -11.812 0.000) 11.812 8.781 ( -0.000 -4.120 0.000) 4.120 8.796 ( -0.000 -8.116 0.000) 8.116 9.114 ( 0.000 0.875 -0.000) 0.875 9.196 ( -0.000 -15.538 0.000) 15.538 9.392 ( -0.000 -13.025 0.000) 13.025 9.476 ( -0.000 -7.871 0.000) 7.871 9.508 ( -0.000 -3.721 0.000) 3.721 9.510 ( 0.000 0.670 -0.000) 0.670 9.755 ( 0.000 2.410 -0.000) 2.410 9.929 ( -0.000 -15.985 0.000) 15.985 10.033 ( -0.000 -6.851 0.000) 6.851 10.319 ( 0.000 1.097 -0.000) 1.097 10.449 ( -0.000 -22.744 0.000) 22.744 10.758 ( -0.000 -6.553 0.000) 6.553 10.883 ( -0.000 -5.212 0.000) 5.212 10.910 ( -0.000 -8.754 0.000) 8.754 11.205 ( -0.000 -2.823 0.000) 2.823 11.506 ( -0.000 -0.223 0.000) 0.223 11.619 ( -0.000 -5.060 0.000) 5.060 11.628 ( -0.000 -5.322 0.000) 5.322 11.882 ( 0.000 0.379 -0.000) 0.379 12.284 ( -0.000 -0.181 0.000) 0.181 12.318 ( -0.000 -2.487 0.000) 2.487 12.500 ( -0.000 -9.054 0.000) 9.054 12.596 ( -0.000 -5.120 0.000) 5.120 12.686 ( -0.000 -6.585 0.000) 6.585 12.757 ( -0.000 -1.310 0.000) 1.310 12.893 ( -0.000 -11.720 0.000) 11.720 12.971 ( 0.000 2.548 -0.000) 2.548 13.335 ( 0.000 0.392 -0.000) 0.392 13.337 ( -0.000 -6.416 0.000) 6.416 13.633 ( -0.000 -13.270 0.000) 13.270 13.717 ( -0.000 -10.148 0.000) 10.148 13.757 ( -0.000 -10.058 0.000) 10.058 13.966 ( -0.000 -5.576 0.000) 5.576 14.256 ( 0.000 8.180 -0.000) 8.180 14.919 ( -0.000 -7.363 0.000) 7.363 15.154 ( 0.000 9.366 -0.000) 9.366 15.508 ( 0.000 8.039 -0.000) 8.039 15.949 ( 0.000 2.213 -0.000) 2.213 16.167 ( 0.000 9.722 -0.000) 9.722 16.249 ( 0.000 23.279 -0.000) 23.279 16.770 ( 0.000 2.941 -0.000) 2.941 17.021 ( 0.000 14.733 -0.000) 14.733 17.804 ( -0.000 -27.076 0.000) 27.076 17.892 ( 0.000 21.539 -0.000) 21.539 18.284 ( 0.000 27.646 -0.000) 27.646 18.886 ( -0.000 -3.852 0.000) 3.852 20.109 ( 0.000 9.297 -0.000) 9.297 20.172 ( 0.000 7.848 -0.000) 7.848 20.422 ( 0.000 6.887 -0.000) 6.887 20.570 ( -0.000 -29.356 0.000) 29.356 22.227 ( -0.000 -10.968 0.000) 10.968 ======================= Grid point 53 (35/199) ======================= q-point: (-0.67 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.920 ( 5.258 -0.000 -6.318) 8.220 3.323 ( 4.357 -0.000 6.642) 7.944 4.412 ( -4.451 0.000 2.056) 4.903 4.549 ( 4.530 -0.000 9.787) 10.784 4.918 ( -1.556 0.000 -11.155) 11.263 5.235 ( 6.595 -0.000 -0.442) 6.610 6.494 ( 1.104 -0.000 -2.494) 2.728 6.518 ( -5.230 0.000 4.153) 6.679 6.813 ( 6.676 -0.000 5.307) 8.528 6.830 ( 4.759 -0.000 -0.610) 4.798 6.989 ( 1.439 -0.000 -5.878) 6.052 7.064 ( 5.400 -0.000 -7.663) 9.375 7.180 ( 3.598 -0.000 2.481) 4.371 7.294 ( 1.255 -0.000 7.046) 7.156 7.512 ( -10.333 0.000 2.641) 10.665 7.809 ( -9.800 0.000 -14.833) 17.777 7.884 ( 10.075 -0.000 2.546) 10.391 8.122 ( -8.819 0.000 1.915) 9.024 8.416 ( -0.819 0.000 1.171) 1.429 8.763 ( -1.090 0.000 0.558) 1.224 8.811 ( -7.869 0.000 0.493) 7.884 8.962 ( 0.749 -0.000 -1.671) 1.831 9.005 ( 11.602 -0.000 1.174) 11.662 9.041 ( -5.349 0.000 -10.264) 11.574 9.179 ( -1.570 0.000 -2.439) 2.900 9.304 ( -3.357 0.000 2.733) 4.329 9.528 ( -4.627 0.000 -1.771) 4.955 9.772 ( -4.541 0.000 2.712) 5.289 9.892 ( -8.583 0.000 3.953) 9.450 9.938 ( -1.667 0.000 7.220) 7.410 10.248 ( 0.722 -0.000 -4.879) 4.932 10.381 ( -10.776 0.000 -8.986) 14.031 10.445 ( 11.018 -0.000 1.723) 11.152 10.536 ( 12.469 -0.000 -2.889) 12.799 10.607 ( 1.131 -0.000 5.247) 5.367 10.716 ( 5.326 -0.000 -0.567) 5.356 11.225 ( 2.761 -0.000 6.941) 7.470 11.396 ( -1.540 0.000 2.486) 2.924 11.454 ( -0.984 0.000 4.283) 4.395 11.456 ( 1.780 -0.000 -1.666) 2.438 11.756 ( 7.063 -0.000 3.799) 8.020 11.790 ( 0.785 -0.000 -4.881) 4.944 11.962 ( -2.487 0.000 -3.952) 4.670 12.018 ( -1.313 0.000 7.637) 7.749 12.469 ( 1.854 -0.000 -5.948) 6.230 12.533 ( -1.220 0.000 2.078) 2.410 12.809 ( 2.160 -0.000 -2.210) 3.091 12.907 ( 0.283 -0.000 7.329) 7.335 13.198 ( -3.526 0.000 -3.537) 4.994 13.245 ( -4.585 0.000 -2.014) 5.008 13.380 ( -5.910 0.000 0.832) 5.968 13.389 ( 1.570 -0.000 4.951) 5.194 13.889 ( 8.236 -0.000 0.103) 8.237 14.170 ( -10.431 0.000 -4.065) 11.195 14.468 ( -10.841 0.000 6.304) 12.541 14.575 ( 16.501 -0.000 1.192) 16.544 15.263 ( -3.415 0.000 4.670) 5.785 15.397 ( 9.772 -0.000 -6.271) 11.611 15.819 ( -5.139 0.000 9.779) 11.047 16.195 ( -2.781 0.000 -16.733) 16.962 16.622 ( -7.642 0.000 -5.313) 9.307 16.719 ( -2.932 0.000 -11.251) 11.627 17.778 ( 15.082 -0.000 2.441) 15.278 17.806 ( 11.902 -0.000 -0.914) 11.937 17.842 ( -10.023 0.000 1.485) 10.133 17.969 ( -4.559 0.000 3.912) 6.008 19.522 ( 4.041 -0.000 20.594) 20.987 19.696 ( -0.442 0.000 -1.806) 1.859 20.664 ( -10.626 0.000 -4.893) 11.699 20.824 ( -5.422 0.000 6.607) 8.547 21.190 ( 7.010 -0.000 -6.421) 9.507 21.313 ( 5.770 -0.000 -5.172) 7.749 ======================= Grid point 55 (36/199) ======================= q-point: (-0.58 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.926 ( -0.872 5.743 -4.298) 7.225 3.251 ( -13.882 -3.132 7.336) 16.010 4.257 ( -1.493 22.390 1.254) 22.475 4.703 ( 0.845 -13.267 2.561) 13.539 4.858 ( -0.355 5.345 -4.672) 7.108 5.287 ( 0.413 0.111 -0.026) 0.429 6.345 ( -3.025 12.358 2.049) 12.886 6.542 ( -5.889 -5.243 0.988) 7.947 6.802 ( -1.171 4.238 -0.970) 4.502 6.957 ( -0.563 -7.062 -2.035) 7.370 7.007 ( 3.352 1.241 1.917) 4.056 7.150 ( 6.047 1.220 -3.902) 7.299 7.235 ( 6.858 9.331 1.150) 11.637 7.377 ( 0.267 -2.122 5.446) 5.851 7.492 ( 5.490 -15.175 -0.811) 16.158 7.617 ( -11.258 -12.105 -9.931) 19.285 7.981 ( -1.541 4.584 0.274) 4.844 8.161 ( 10.153 -5.275 1.528) 11.543 8.338 ( -5.129 5.886 1.414) 7.935 8.576 ( -18.684 -7.014 1.038) 19.984 8.701 ( -4.925 2.500 2.189) 5.941 8.893 ( -8.924 1.299 -9.223) 12.899 9.022 ( 3.464 2.447 -2.326) 4.837 9.107 ( -2.490 5.861 0.858) 6.426 9.152 ( 0.143 -1.336 -2.970) 3.260 9.205 ( -0.539 -3.521 -0.003) 3.562 9.515 ( -0.351 -4.580 -0.297) 4.603 9.698 ( -5.015 2.348 9.403) 10.912 9.810 ( 2.260 1.954 2.355) 3.804 9.932 ( -3.561 -5.523 4.355) 7.884 10.068 ( -12.790 6.933 -7.121) 16.197 10.176 ( -6.165 2.454 -3.950) 7.722 10.607 ( 0.553 6.970 3.084) 7.642 10.699 ( 13.079 7.230 -5.130) 15.800 10.851 ( 18.717 -8.909 0.364) 20.732 10.968 ( 14.436 -9.633 -0.669) 17.368 11.250 ( 3.199 0.723 5.317) 6.247 11.383 ( -0.273 -1.990 0.859) 2.184 11.419 ( 0.556 2.395 2.017) 3.180 11.513 ( 1.878 -1.559 2.218) 3.298 11.798 ( 1.165 0.582 -4.565) 4.747 11.813 ( 0.437 1.404 -5.114) 5.321 12.016 ( 4.463 -4.186 6.297) 8.781 12.052 ( 2.612 -4.255 7.339) 8.877 12.474 ( 2.240 4.463 -3.590) 6.150 12.571 ( 2.436 -5.306 -3.340) 6.726 12.832 ( 1.770 1.059 -2.681) 3.383 12.950 ( 1.523 -0.990 7.207) 7.432 13.113 ( -6.001 -2.235 -2.071) 6.730 13.188 ( -2.361 -0.946 -1.530) 2.968 13.323 ( -0.650 0.331 0.959) 1.205 13.429 ( 1.015 -0.544 3.973) 4.136 13.925 ( -6.491 4.408 -1.432) 7.976 14.103 ( 2.108 -7.812 -1.080) 8.164 14.324 ( -5.941 -0.523 4.423) 7.425 14.811 ( 7.847 0.596 -10.787) 13.352 15.202 ( 10.095 15.895 12.038) 22.349 15.627 ( 5.513 -10.832 6.642) 13.851 15.877 ( 4.781 -6.309 6.438) 10.204 16.072 ( -4.176 -2.587 -11.701) 12.691 16.445 ( -8.693 3.850 -4.587) 10.556 16.685 ( 2.252 -0.362 -10.834) 11.071 17.636 ( -8.069 8.754 -0.608) 11.921 17.788 ( 5.184 15.498 3.170) 16.647 17.989 ( 8.329 0.440 -1.439) 8.464 18.307 ( 14.322 -32.082 -5.532) 35.566 19.533 ( -8.786 7.062 3.438) 11.785 19.583 ( -7.010 2.943 11.658) 13.918 20.485 ( -5.556 4.875 3.031) 7.988 20.718 ( -9.395 0.560 4.512) 10.438 21.201 ( 1.823 11.403 -5.419) 12.756 21.458 ( 5.421 -13.806 -6.009) 16.003 ======================= Grid point 56 (37/199) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.730 ( -11.654 11.186 0.407) 16.159 3.053 ( -13.950 -1.901 3.579) 14.526 3.986 ( -0.630 29.227 0.825) 29.246 4.741 ( -1.968 15.929 0.737) 16.067 4.775 ( -2.800 -5.252 -2.021) 6.286 5.272 ( -2.031 -0.293 0.139) 2.057 6.207 ( -2.909 8.601 1.984) 9.294 6.381 ( -11.169 6.496 0.989) 12.958 6.698 ( -7.010 2.462 -2.450) 7.824 6.887 ( -8.465 7.322 0.996) 11.237 7.028 ( -0.028 -7.202 -3.219) 7.889 7.195 ( 6.320 6.908 -1.955) 9.564 7.303 ( 0.745 -6.497 0.215) 6.543 7.477 ( 4.194 -0.812 3.802) 5.719 7.644 ( 0.290 -6.682 -2.724) 7.222 7.783 ( 5.907 -7.923 -2.867) 10.290 7.813 ( -7.849 -2.966 1.569) 8.536 8.168 ( 3.312 -2.374 -1.034) 4.204 8.407 ( -11.531 -6.360 -2.681) 13.439 8.460 ( 3.819 0.976 5.723) 6.949 8.651 ( -12.292 2.927 -5.228) 13.675 8.666 ( 6.365 -2.919 2.626) 7.478 8.970 ( -3.255 6.799 -2.312) 7.884 8.982 ( -0.295 -0.544 -2.196) 2.282 9.258 ( 0.215 -8.515 -0.958) 8.572 9.271 ( 5.752 -5.397 -1.597) 8.048 9.546 ( -1.831 -2.740 -1.154) 3.491 9.659 ( -4.298 -3.075 7.723) 9.358 9.713 ( -9.735 -2.000 0.198) 9.940 9.960 ( -1.711 -1.170 0.359) 2.104 10.018 ( -1.017 2.802 0.949) 3.129 10.048 ( 7.908 2.184 1.370) 8.318 10.496 ( -6.132 5.262 -1.339) 8.190 10.698 ( 2.783 7.434 -2.566) 8.342 11.072 ( 5.904 5.350 3.102) 8.550 11.241 ( 6.391 -5.147 -1.164) 8.288 11.430 ( 1.925 -0.650 -0.484) 2.089 11.440 ( 8.266 -3.311 2.036) 9.134 11.527 ( 4.071 -1.943 -1.309) 4.697 11.619 ( 13.088 -12.433 0.934) 18.077 11.767 ( 4.725 -1.087 -4.758) 6.793 11.869 ( 7.581 0.744 0.878) 7.667 12.129 ( 0.306 -8.989 5.063) 10.321 12.215 ( 5.990 -5.320 5.896) 9.948 12.450 ( 1.687 4.798 -2.985) 5.898 12.645 ( 0.683 -6.351 -6.557) 9.154 12.822 ( -0.389 1.453 -3.628) 3.928 12.999 ( -0.363 -1.331 5.147) 5.329 13.060 ( -4.030 -6.549 -0.846) 7.736 13.188 ( 1.893 -1.414 0.356) 2.390 13.349 ( 2.058 -2.159 0.423) 3.013 13.452 ( -0.391 -0.402 2.914) 2.967 13.759 ( -11.505 -3.418 1.516) 12.097 14.067 ( -10.555 -3.571 1.020) 11.189 14.434 ( 12.379 -2.197 0.437) 12.580 14.749 ( -2.625 7.648 -8.017) 11.386 15.335 ( 13.828 12.068 0.180) 18.354 15.795 ( 2.389 -1.067 5.760) 6.326 15.899 ( 4.319 4.374 11.506) 13.045 16.257 ( -7.497 4.141 -4.242) 9.558 16.314 ( 11.132 -25.022 4.247) 27.713 16.712 ( 4.962 0.244 -13.203) 14.107 17.391 ( -10.093 10.172 -3.803) 14.826 17.722 ( 3.387 15.743 3.621) 16.505 18.144 ( 12.221 2.854 -3.935) 13.153 18.796 ( 9.783 -25.447 -12.619) 30.041 19.253 ( -12.803 1.997 -2.339) 13.167 19.445 ( -9.282 6.341 17.531) 20.825 20.392 ( -3.663 3.509 6.683) 8.390 20.550 ( -9.494 2.902 3.309) 10.465 21.045 ( -2.339 15.581 -4.098) 16.280 21.663 ( 3.367 -16.087 -4.651) 17.081 ======================= Grid point 57 (38/199) ======================= q-point: (-0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.385 ( -14.373 13.160 2.545) 19.653 2.854 ( -6.618 8.627 0.040) 10.873 3.712 ( 0.722 28.432 0.887) 28.455 4.478 ( -3.277 29.531 2.342) 29.804 4.730 ( -1.716 5.238 -2.790) 6.178 5.229 ( -2.336 0.889 0.742) 2.607 6.017 ( -10.459 11.089 1.241) 15.294 6.175 ( -4.024 6.093 0.221) 7.305 6.555 ( -4.729 0.973 -4.177) 6.384 6.690 ( -6.489 9.957 2.921) 12.239 7.063 ( -4.664 23.169 -2.794) 23.798 7.126 ( 1.130 -6.278 -3.763) 7.406 7.304 ( 3.600 12.863 0.453) 13.365 7.452 ( -3.133 -6.355 1.585) 7.260 7.590 ( -3.371 -1.945 1.369) 4.125 7.849 ( 2.697 4.834 2.453) 6.055 7.992 ( 1.891 -17.226 -2.934) 17.577 8.251 ( -3.088 -1.145 -0.889) 3.411 8.313 ( -1.739 -0.024 -1.113) 2.065 8.475 ( -0.371 -8.465 -1.678) 8.638 8.506 ( -2.325 -11.817 3.495) 12.541 8.887 ( -0.590 0.562 -1.441) 1.655 8.948 ( 9.489 -9.549 2.222) 13.645 9.043 ( 6.299 -2.453 -2.193) 7.107 9.363 ( -5.551 -4.708 2.668) 7.752 9.380 ( 4.158 -11.919 -2.284) 12.828 9.491 ( -0.282 1.165 -2.660) 2.918 9.561 ( -6.642 -2.472 2.849) 7.638 9.778 ( 2.065 -11.240 2.246) 11.647 9.879 ( -4.128 -5.192 -0.888) 6.692 9.987 ( -2.301 6.421 0.316) 6.828 10.209 ( 4.866 -9.766 1.592) 11.026 10.390 ( -1.709 0.226 -1.010) 1.998 10.743 ( 8.701 3.229 0.009) 9.281 11.105 ( 2.903 3.877 1.686) 5.129 11.287 ( -2.334 3.530 -0.916) 4.330 11.401 ( -1.403 0.162 -0.911) 1.681 11.481 ( 1.694 -2.263 0.424) 2.859 11.594 ( 0.497 -1.070 -2.632) 2.884 11.884 ( 6.301 1.803 1.161) 6.656 12.010 ( 14.700 -9.586 2.081) 17.673 12.155 ( 16.012 -13.839 -0.497) 21.170 12.215 ( -1.164 -7.800 1.884) 8.109 12.364 ( 3.043 -7.792 4.251) 9.384 12.425 ( 1.363 4.057 -2.675) 5.047 12.655 ( -6.003 -8.705 -6.292) 12.305 12.784 ( -1.005 1.232 -1.894) 2.473 13.008 ( -0.249 -2.144 1.041) 2.396 13.088 ( -1.918 -8.170 0.425) 8.403 13.280 ( 4.260 -5.201 1.556) 6.900 13.403 ( -2.135 -1.770 2.342) 3.630 13.447 ( 2.242 -1.932 -2.918) 4.156 13.639 ( -9.419 -5.986 4.805) 12.151 13.931 ( -8.772 -3.334 -0.151) 9.385 14.599 ( -1.846 11.220 -3.968) 12.043 14.655 ( 9.470 -3.625 0.376) 10.147 15.367 ( 3.100 7.902 -3.792) 9.297 15.744 ( -0.637 5.820 -1.984) 6.182 16.087 ( -0.760 4.216 -1.382) 4.501 16.150 ( 12.349 6.146 20.916) 25.055 16.704 ( 6.431 -6.187 0.104) 8.925 16.807 ( 6.910 -21.016 -9.579) 24.108 17.076 ( -13.324 12.337 -4.016) 18.597 17.605 ( 0.268 17.454 2.037) 17.575 18.276 ( 10.228 8.582 -5.807) 14.559 18.827 ( -4.257 3.776 -5.508) 7.920 19.062 ( -12.642 9.422 6.044) 16.886 19.560 ( 6.695 -29.800 0.691) 30.550 20.317 ( -3.835 3.315 5.977) 7.837 20.391 ( -5.914 4.395 1.912) 7.612 20.832 ( -2.723 16.998 -1.979) 17.328 21.840 ( 1.057 -15.573 -2.361) 15.787 ======================= Grid point 58 (39/199) ======================= q-point: (-0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.100 ( 0.000 18.290 -0.000) 18.290 2.685 ( 0.000 14.057 -0.000) 14.057 3.460 ( 0.000 27.597 -0.000) 27.597 4.122 ( 0.000 37.787 -0.000) 37.787 4.596 ( 0.000 18.105 -0.000) 18.105 5.214 ( -0.000 -1.541 0.000) 1.541 5.755 ( 0.000 21.389 -0.000) 21.389 6.116 ( -0.000 -0.896 0.000) 0.896 6.299 ( 0.000 54.385 -0.000) 54.385 6.566 ( -0.000 -7.025 0.000) 7.025 6.830 ( 0.000 10.244 -0.000) 10.244 7.200 ( 0.000 16.748 -0.000) 16.748 7.201 ( -0.000 -4.225 0.000) 4.225 7.475 ( -0.000 -4.729 0.000) 4.729 7.611 ( -0.000 -9.843 0.000) 9.843 7.780 ( 0.000 8.320 -0.000) 8.320 8.191 ( -0.000 -20.128 0.000) 20.128 8.236 ( 0.000 0.398 -0.000) 0.398 8.266 ( -0.000 -0.599 0.000) 0.599 8.587 ( -0.000 -12.235 0.000) 12.235 8.644 ( -0.000 -12.112 0.000) 12.112 8.930 ( -0.000 -9.193 0.000) 9.193 9.118 ( -0.000 -9.537 0.000) 9.537 9.145 ( -0.000 -0.335 0.000) 0.335 9.309 ( -0.000 -7.995 0.000) 7.995 9.492 ( 0.000 0.809 -0.000) 0.809 9.507 ( -0.000 -1.189 0.000) 1.189 9.595 ( -0.000 -17.098 0.000) 17.098 9.848 ( 0.000 2.779 -0.000) 2.779 9.910 ( -0.000 -1.999 0.000) 1.999 10.003 ( -0.000 -21.355 0.000) 21.355 10.362 ( 0.000 2.605 -0.000) 2.605 10.409 ( -0.000 -19.236 0.000) 19.236 10.834 ( -0.000 -0.183 0.000) 0.183 11.071 ( 0.000 10.102 -0.000) 10.102 11.190 ( 0.000 2.397 -0.000) 2.397 11.427 ( -0.000 -4.665 0.000) 4.665 11.535 ( -0.000 -4.362 0.000) 4.362 11.594 ( 0.000 0.077 -0.000) 0.077 11.916 ( 0.000 2.591 -0.000) 2.591 12.233 ( -0.000 -6.464 0.000) 6.464 12.243 ( -0.000 -5.404 0.000) 5.404 12.403 ( 0.000 0.935 -0.000) 0.935 12.483 ( -0.000 -7.705 0.000) 7.705 12.485 ( -0.000 -12.341 0.000) 12.341 12.640 ( -0.000 -13.481 0.000) 13.481 12.764 ( 0.000 0.677 -0.000) 0.677 13.019 ( 0.000 1.385 -0.000) 1.385 13.171 ( -0.000 -10.936 0.000) 10.936 13.350 ( -0.000 -1.892 0.000) 1.892 13.414 ( -0.000 -6.391 0.000) 6.391 13.544 ( -0.000 -7.647 0.000) 7.647 13.594 ( -0.000 -5.903 0.000) 5.903 13.879 ( -0.000 -3.474 0.000) 3.474 14.461 ( 0.000 12.274 -0.000) 12.274 14.789 ( -0.000 -5.917 0.000) 5.917 15.304 ( 0.000 7.272 -0.000) 7.272 15.670 ( 0.000 8.241 -0.000) 8.241 16.009 ( 0.000 3.807 -0.000) 3.807 16.316 ( 0.000 6.016 -0.000) 6.016 16.693 ( 0.000 21.684 -0.000) 21.684 16.792 ( -0.000 -0.677 0.000) 0.677 17.128 ( -0.000 -21.214 0.000) 21.214 17.450 ( 0.000 9.229 -0.000) 9.229 18.240 ( 0.000 14.535 -0.000) 14.535 18.751 ( 0.000 20.292 -0.000) 20.292 18.830 ( -0.000 -1.892 0.000) 1.892 19.953 ( -0.000 -34.391 0.000) 34.391 20.248 ( 0.000 4.991 -0.000) 4.991 20.296 ( 0.000 5.484 -0.000) 5.484 20.645 ( 0.000 15.681 -0.000) 15.681 21.986 ( -0.000 -14.165 0.000) 14.165 ======================= Grid point 67 (40/199) ======================= q-point: (-0.58 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.914 ( -22.256 0.000 7.004) 23.332 2.957 ( 0.037 -0.000 -2.626) 2.626 4.396 ( -0.839 0.000 -4.241) 4.323 4.589 ( -2.679 0.000 2.699) 3.802 4.887 ( 0.509 -0.000 -0.847) 0.988 5.268 ( -2.210 0.000 0.498) 2.265 6.302 ( -10.819 0.000 -0.132) 10.819 6.479 ( -0.137 0.000 4.242) 4.244 6.769 ( -3.091 0.000 -1.663) 3.511 6.850 ( -7.489 0.000 -1.850) 7.714 7.011 ( -8.042 0.000 5.043) 9.492 7.247 ( -8.889 0.000 -4.017) 9.755 7.275 ( 4.583 -0.000 -1.962) 4.985 7.414 ( 6.161 -0.000 7.498) 9.704 7.480 ( 13.005 -0.000 -3.237) 13.402 7.621 ( 12.048 -0.000 -7.510) 14.197 7.976 ( 2.927 -0.000 1.245) 3.180 8.118 ( -19.522 0.000 -0.786) 19.537 8.328 ( -1.805 0.000 -1.963) 2.667 8.462 ( 17.512 -0.000 5.039) 18.223 8.595 ( -11.528 0.000 1.231) 11.594 8.781 ( -0.163 0.000 -2.245) 2.251 8.991 ( -11.309 0.000 -3.443) 11.821 9.050 ( -4.988 0.000 -2.418) 5.543 9.148 ( 5.195 -0.000 1.737) 5.478 9.204 ( 0.865 -0.000 -5.608) 5.674 9.489 ( -0.632 0.000 -5.653) 5.688 9.634 ( -5.132 0.000 8.955) 10.321 9.726 ( -12.308 0.000 4.132) 12.983 9.902 ( 1.468 -0.000 0.838) 1.690 10.047 ( -9.545 0.000 -1.901) 9.733 10.111 ( 11.190 -0.000 3.279) 11.660 10.566 ( -8.595 0.000 -1.395) 8.708 10.781 ( -1.734 0.000 -2.600) 3.126 11.140 ( 5.813 -0.000 0.903) 5.883 11.204 ( 19.057 -0.000 -1.220) 19.096 11.383 ( 15.001 -0.000 -0.326) 15.004 11.398 ( 6.313 -0.000 0.039) 6.313 11.453 ( 0.152 -0.000 3.110) 3.113 11.549 ( 4.945 -0.000 0.423) 4.964 11.760 ( 1.484 -0.000 -7.225) 7.376 11.887 ( 4.232 -0.000 2.190) 4.765 12.045 ( 1.108 -0.000 6.749) 6.839 12.145 ( 5.864 -0.000 5.615) 8.119 12.519 ( -1.316 0.000 -1.758) 2.196 12.570 ( 4.359 -0.000 -8.083) 9.183 12.841 ( -0.202 0.000 -3.558) 3.564 12.977 ( -6.997 0.000 -0.448) 7.012 12.979 ( -0.511 0.000 5.274) 5.298 13.178 ( 1.243 -0.000 0.284) 1.275 13.322 ( 0.537 -0.000 0.870) 1.022 13.449 ( 0.256 -0.000 3.510) 3.520 13.734 ( -12.184 0.000 -1.320) 12.255 14.031 ( -9.173 0.000 2.207) 9.435 14.413 ( 12.607 -0.000 0.180) 12.609 14.831 ( -0.424 0.000 -9.130) 9.140 15.620 ( 1.598 -0.000 -5.047) 5.294 15.634 ( 19.791 -0.000 14.370) 24.458 15.988 ( 7.918 -0.000 16.221) 18.050 15.998 ( 2.413 -0.000 -3.193) 4.002 16.303 ( -8.619 0.000 -3.468) 9.291 16.698 ( 2.884 -0.000 -7.187) 7.744 17.480 ( -10.155 0.000 -9.706) 14.047 18.098 ( 7.835 -0.000 5.326) 9.474 18.210 ( 14.426 -0.000 -11.533) 18.469 18.271 ( 14.385 -0.000 -2.526) 14.605 19.290 ( -18.019 0.000 -5.571) 18.861 19.526 ( -10.907 0.000 18.499) 21.475 20.430 ( -4.806 0.000 5.164) 7.054 20.574 ( -9.590 0.000 4.386) 10.545 21.342 ( -1.137 0.000 -5.016) 5.143 21.361 ( 4.002 -0.000 -4.915) 6.339 ======================= Grid point 69 (41/199) ======================= q-point: (-0.50 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.575 ( -14.849 5.868 3.992) 16.458 2.943 ( -1.366 1.494 -0.812) 2.181 4.215 ( -1.577 22.704 -1.192) 22.789 4.641 ( -2.176 -12.013 -0.733) 12.230 4.846 ( -0.711 8.466 0.539) 8.513 5.234 ( -1.798 -0.024 0.335) 1.829 6.122 ( -8.846 1.567 0.341) 8.991 6.391 ( -3.928 11.502 1.770) 12.283 6.605 ( -7.098 7.811 -2.514) 10.850 6.779 ( -7.882 1.602 1.228) 8.136 6.899 ( -2.003 -12.542 0.392) 12.707 7.234 ( 1.699 -3.845 0.921) 4.303 7.327 ( 2.235 -0.664 -1.958) 3.045 7.533 ( 3.330 -1.982 3.501) 5.222 7.654 ( -3.639 4.591 -3.377) 6.762 7.785 ( 8.148 -4.066 -0.607) 9.126 7.859 ( 7.245 2.503 0.929) 7.722 8.168 ( 5.811 -8.458 -2.813) 10.640 8.311 ( 1.890 3.363 -0.920) 3.966 8.406 ( -10.650 -0.141 2.342) 10.906 8.578 ( -9.642 15.679 0.751) 18.422 8.800 ( 10.759 -4.549 -0.866) 11.713 8.908 ( -0.571 -4.818 -3.840) 6.187 8.999 ( 1.721 -2.830 1.868) 3.803 9.180 ( -0.636 -4.140 -6.259) 7.531 9.265 ( 1.363 -5.613 2.003) 6.113 9.460 ( -0.413 -2.440 -5.523) 6.052 9.555 ( -6.834 -0.121 7.312) 10.009 9.658 ( 1.021 0.155 3.100) 3.267 9.858 ( -11.254 0.120 -0.303) 11.258 9.963 ( 2.722 -4.886 0.480) 5.613 10.190 ( -3.192 3.881 2.588) 5.653 10.413 ( -5.540 0.687 -1.996) 5.929 10.793 ( 6.300 1.626 1.630) 6.708 11.167 ( 0.643 1.884 -1.306) 2.380 11.336 ( 4.833 3.205 0.406) 5.814 11.450 ( -0.287 1.220 -0.681) 1.427 11.458 ( -1.844 0.533 -0.754) 2.063 11.567 ( 2.707 -1.799 -1.771) 3.701 11.816 ( 18.164 -6.319 0.492) 19.239 11.909 ( 13.942 -2.440 -1.004) 14.189 11.964 ( 5.865 -3.542 0.398) 6.863 12.097 ( 0.660 -3.075 4.691) 5.648 12.239 ( 0.180 -4.786 5.240) 7.099 12.479 ( -2.897 -1.750 -2.936) 4.480 12.576 ( -0.507 3.266 -6.837) 7.594 12.816 ( -0.500 0.750 -1.743) 1.963 12.894 ( -4.913 -4.776 -0.999) 6.925 12.975 ( -3.566 -4.876 2.466) 6.525 13.220 ( 2.049 -1.087 2.010) 3.069 13.353 ( 1.462 -1.987 0.896) 2.625 13.453 ( 0.297 0.858 -0.595) 1.086 13.577 ( -7.167 -1.193 1.975) 7.529 13.891 ( -7.679 -0.993 0.880) 7.793 14.606 ( 8.637 -1.321 -0.431) 8.748 14.773 ( -0.615 5.454 -4.309) 6.978 15.549 ( 0.735 9.280 -2.865) 9.739 15.852 ( 4.709 6.663 -0.162) 8.160 16.148 ( -1.048 1.167 0.096) 1.571 16.207 ( 9.109 -9.795 9.921) 16.654 16.257 ( 8.252 -10.793 12.951) 18.770 16.728 ( 1.926 -1.511 -5.357) 5.890 17.256 ( -9.782 4.822 -13.222) 17.140 18.051 ( 6.403 26.977 2.048) 27.802 18.378 ( 12.852 2.813 -5.989) 14.456 18.683 ( 9.418 -24.282 -7.542) 27.114 19.002 ( -14.134 -3.858 -1.067) 14.690 19.353 ( -11.598 2.632 13.131) 17.716 20.366 ( -3.515 1.543 4.015) 5.555 20.442 ( -6.362 1.155 2.625) 6.979 21.170 ( -1.086 17.693 -2.744) 17.937 21.526 ( 0.981 -16.928 -2.776) 17.182 ======================= Grid point 70 (42/199) ======================= q-point: (-0.42 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.374 ( 0.000 10.265 -0.000) 10.265 2.886 ( 0.000 6.663 -0.000) 6.663 3.968 ( 0.000 25.507 -0.000) 25.507 4.689 ( 0.000 10.670 -0.000) 10.670 4.723 ( 0.000 4.153 -0.000) 4.153 5.215 ( 0.000 0.533 -0.000) 0.533 6.007 ( 0.000 6.093 -0.000) 6.093 6.230 ( 0.000 12.348 -0.000) 12.348 6.487 ( 0.000 1.344 -0.000) 1.344 6.699 ( 0.000 2.491 -0.000) 2.491 7.022 ( -0.000 -13.112 0.000) 13.112 7.282 ( 0.000 17.459 -0.000) 17.459 7.324 ( -0.000 -8.820 0.000) 8.820 7.477 ( 0.000 13.353 -0.000) 13.353 7.568 ( 0.000 1.155 -0.000) 1.155 7.869 ( -0.000 -11.046 0.000) 11.046 8.022 ( 0.000 16.901 -0.000) 16.901 8.157 ( -0.000 -6.634 0.000) 6.634 8.302 ( -0.000 -2.131 0.000) 2.131 8.374 ( -0.000 -8.197 0.000) 8.197 8.438 ( -0.000 -1.124 0.000) 1.124 8.874 ( 0.000 1.053 -0.000) 1.053 8.936 ( -0.000 -6.397 0.000) 6.397 9.184 ( -0.000 -4.908 0.000) 4.908 9.205 ( -0.000 -2.973 0.000) 2.973 9.278 ( -0.000 -10.722 0.000) 10.722 9.483 ( -0.000 -1.050 0.000) 1.050 9.516 ( 0.000 0.074 -0.000) 0.074 9.704 ( -0.000 -7.586 0.000) 7.586 9.767 ( -0.000 -4.581 0.000) 4.581 10.043 ( 0.000 8.986 -0.000) 8.986 10.101 ( -0.000 -12.748 0.000) 12.748 10.383 ( -0.000 -1.007 0.000) 1.007 10.861 ( 0.000 2.323 -0.000) 2.323 11.150 ( 0.000 1.302 -0.000) 1.302 11.332 ( 0.000 8.587 -0.000) 8.587 11.391 ( 0.000 1.041 -0.000) 1.041 11.465 ( -0.000 -2.745 0.000) 2.745 11.589 ( -0.000 -0.632 0.000) 0.632 11.955 ( 0.000 1.112 -0.000) 1.112 12.088 ( -0.000 -7.304 0.000) 7.304 12.129 ( -0.000 -5.294 0.000) 5.294 12.253 ( -0.000 -11.165 0.000) 11.165 12.279 ( -0.000 -11.856 0.000) 11.856 12.453 ( -0.000 -4.705 0.000) 4.705 12.495 ( 0.000 6.219 -0.000) 6.219 12.788 ( 0.000 2.248 -0.000) 2.248 12.946 ( -0.000 -11.673 0.000) 11.673 12.986 ( -0.000 -4.863 0.000) 4.863 13.255 ( -0.000 -2.777 0.000) 2.777 13.394 ( -0.000 -2.238 0.000) 2.238 13.458 ( -0.000 -0.123 0.000) 0.123 13.526 ( -0.000 -1.803 0.000) 1.803 13.833 ( -0.000 -1.449 0.000) 1.449 14.686 ( 0.000 9.987 -0.000) 9.987 14.702 ( -0.000 -3.159 0.000) 3.159 15.460 ( 0.000 9.373 -0.000) 9.373 15.814 ( 0.000 7.334 -0.000) 7.334 16.082 ( 0.000 3.371 -0.000) 3.371 16.400 ( 0.000 2.891 -0.000) 2.891 16.559 ( -0.000 -29.557 0.000) 29.557 16.756 ( -0.000 -2.404 0.000) 2.404 17.041 ( 0.000 11.879 -0.000) 11.879 17.847 ( 0.000 26.728 -0.000) 26.728 18.443 ( 0.000 6.810 -0.000) 6.810 18.813 ( -0.000 -0.168 0.000) 0.168 18.979 ( -0.000 -3.671 0.000) 3.671 19.347 ( -0.000 -21.217 0.000) 21.217 20.319 ( 0.000 2.750 -0.000) 2.750 20.374 ( 0.000 2.522 -0.000) 2.522 20.979 ( 0.000 18.547 -0.000) 18.547 21.691 ( -0.000 -16.610 0.000) 16.610 ======================= Grid point 82 (43/199) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 109 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.476 ( 0.000 0.000 -0.000) 0.000 2.947 ( 0.000 0.000 -0.000) 0.000 4.338 ( 0.000 0.000 -0.000) 0.000 4.528 ( 0.000 0.000 -0.000) 0.000 4.878 ( 0.000 0.000 -0.000) 0.000 5.221 ( 0.000 0.000 -0.000) 0.000 6.050 ( 0.000 0.000 -0.000) 0.000 6.392 ( 0.000 0.000 -0.000) 0.000 6.613 ( -0.000 -0.000 0.000) 0.000 6.729 ( 0.000 0.000 -0.000) 0.000 6.791 ( 0.000 0.000 -0.000) 0.000 7.234 ( 0.000 0.000 -0.000) 0.000 7.335 ( 0.000 0.000 -0.000) 0.000 7.567 ( 0.000 0.000 -0.000) 0.000 7.640 ( 0.000 0.000 -0.000) 0.000 7.768 ( 0.000 0.000 -0.000) 0.000 8.055 ( 0.000 0.000 -0.000) 0.000 8.232 ( 0.000 0.000 -0.000) 0.000 8.288 ( 0.000 0.000 -0.000) 0.000 8.361 ( 0.000 0.000 -0.000) 0.000 8.470 ( 0.000 0.000 -0.000) 0.000 8.896 ( 0.000 0.000 -0.000) 0.000 8.903 ( 0.000 0.000 -0.000) 0.000 8.963 ( 0.000 0.000 -0.000) 0.000 9.133 ( 0.000 0.000 -0.000) 0.000 9.294 ( 0.000 0.000 -0.000) 0.000 9.473 ( 0.000 0.000 -0.000) 0.000 9.486 ( 0.000 0.000 -0.000) 0.000 9.689 ( 0.000 0.000 -0.000) 0.000 9.721 ( 0.000 0.000 -0.000) 0.000 9.957 ( 0.000 0.000 -0.000) 0.000 10.158 ( 0.000 0.000 -0.000) 0.000 10.350 ( 0.000 0.000 -0.000) 0.000 10.889 ( 0.000 0.000 -0.000) 0.000 11.164 ( 0.000 0.000 -0.000) 0.000 11.421 ( 0.000 0.000 -0.000) 0.000 11.426 ( 0.000 0.000 -0.000) 0.000 11.438 ( 0.000 0.000 -0.000) 0.000 11.577 ( 0.000 0.000 -0.000) 0.000 11.962 ( 0.000 0.000 -0.000) 0.000 12.017 ( -0.000 -0.000 0.000) 0.000 12.073 ( 0.000 0.000 -0.000) 0.000 12.121 ( 0.000 0.000 -0.000) 0.000 12.146 ( 0.000 0.000 -0.000) 0.000 12.405 ( 0.000 0.000 -0.000) 0.000 12.603 ( 0.000 0.000 -0.000) 0.000 12.791 ( 0.000 0.000 -0.000) 0.000 12.837 ( 0.000 0.000 -0.000) 0.000 12.901 ( -0.000 -0.000 0.000) 0.000 13.237 ( 0.000 0.000 -0.000) 0.000 13.362 ( 0.000 0.000 -0.000) 0.000 13.468 ( 0.000 0.000 -0.000) 0.000 13.510 ( 0.000 0.000 -0.000) 0.000 13.820 ( 0.000 0.000 -0.000) 0.000 14.671 ( 0.000 0.000 -0.000) 0.000 14.790 ( 0.000 0.000 -0.000) 0.000 15.588 ( 0.000 0.000 -0.000) 0.000 15.976 ( 0.000 0.000 -0.000) 0.000 16.118 ( 0.000 0.000 -0.000) 0.000 16.134 ( 0.000 0.000 -0.000) 0.000 16.427 ( 0.000 0.000 -0.000) 0.000 16.728 ( 0.000 0.000 -0.000) 0.000 17.155 ( 0.000 0.000 -0.000) 0.000 18.302 ( -0.000 -0.000 0.000) 0.000 18.506 ( 0.000 0.000 -0.000) 0.000 18.625 ( 0.000 0.000 -0.000) 0.000 18.813 ( 0.000 0.000 -0.000) 0.000 19.266 ( 0.000 0.000 -0.000) 0.000 20.348 ( 0.000 0.000 -0.000) 0.000 20.396 ( 0.000 0.000 -0.000) 0.000 21.284 ( 0.000 0.000 -0.000) 0.000 21.406 ( 0.000 0.000 -0.000) 0.000 ======================= Grid point 151 (44/199) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.813 ( 20.493 -0.000 37.847) 43.039 0.822 ( -31.681 0.000 38.239) 49.658 1.634 ( -8.814 0.000 75.997) 76.507 2.199 ( -2.058 0.000 -0.028) 2.058 2.252 ( 1.616 -0.000 -0.723) 1.770 2.713 ( 14.611 -0.000 -15.063) 20.985 2.724 ( -9.968 0.000 -15.408) 18.352 5.411 ( 3.341 -0.000 -30.632) 30.814 5.612 ( 3.045 -0.000 3.674) 4.772 5.804 ( -1.782 0.000 -0.218) 1.796 6.579 ( -4.954 0.000 1.563) 5.195 6.776 ( -0.494 0.000 -1.761) 1.829 7.493 ( -32.156 0.000 -6.049) 32.720 7.750 ( 2.380 -0.000 -5.036) 5.570 7.823 ( -4.777 0.000 -2.915) 5.596 7.978 ( -10.219 0.000 3.984) 10.968 8.081 ( 23.878 -0.000 0.828) 23.892 8.387 ( 0.756 -0.000 -1.628) 1.795 8.576 ( 9.605 -0.000 2.592) 9.949 8.642 ( -0.167 0.000 -3.554) 3.558 8.822 ( 1.489 -0.000 -0.493) 1.569 8.941 ( -4.475 0.000 -0.574) 4.512 9.005 ( 6.307 -0.000 5.117) 8.122 9.162 ( -0.814 0.000 2.829) 2.943 9.520 ( -5.245 0.000 6.528) 8.374 9.740 ( 1.700 -0.000 -0.157) 1.708 9.751 ( -0.186 0.000 0.401) 0.442 9.927 ( 1.793 -0.000 -0.478) 1.856 9.937 ( -15.221 0.000 -6.076) 16.389 10.344 ( 2.656 -0.000 -3.514) 4.405 10.464 ( 10.619 -0.000 5.314) 11.875 10.492 ( 3.134 -0.000 3.246) 4.512 11.037 ( -1.323 0.000 -12.388) 12.459 11.346 ( 0.606 -0.000 3.092) 3.151 11.489 ( -6.446 0.000 -6.147) 8.907 11.758 ( 4.192 -0.000 10.394) 11.208 11.810 ( -2.196 0.000 0.432) 2.239 11.824 ( -5.798 0.000 2.166) 6.189 11.995 ( -6.079 0.000 0.874) 6.141 12.059 ( -9.648 0.000 0.517) 9.662 12.122 ( 3.809 -0.000 1.466) 4.081 12.263 ( 11.570 -0.000 8.580) 14.404 12.710 ( 6.798 -0.000 -6.027) 9.085 12.800 ( 1.491 -0.000 -5.015) 5.232 12.849 ( -1.215 0.000 2.018) 2.356 12.973 ( -9.472 0.000 0.310) 9.477 13.123 ( -0.591 0.000 5.454) 5.486 13.299 ( 2.082 -0.000 4.573) 5.025 13.515 ( 3.824 -0.000 -1.243) 4.020 13.539 ( 3.055 -0.000 1.234) 3.295 14.123 ( -4.530 0.000 -2.310) 5.085 14.124 ( 3.898 -0.000 -3.861) 5.487 14.311 ( 0.217 -0.000 1.552) 1.568 14.332 ( -0.267 0.000 0.755) 0.801 14.378 ( 0.236 -0.000 0.009) 0.236 14.442 ( 6.890 -0.000 -1.108) 6.979 15.245 ( -3.335 0.000 -4.556) 5.646 15.246 ( -0.576 0.000 2.087) 2.165 15.361 ( -4.540 0.000 -5.948) 7.482 15.381 ( 13.828 -0.000 0.163) 13.829 16.061 ( 0.039 -0.000 11.985) 11.985 16.690 ( -9.266 0.000 -0.883) 9.308 16.703 ( 10.049 -0.000 -1.615) 10.178 16.784 ( 0.738 -0.000 3.201) 3.285 16.829 ( -4.423 0.000 2.988) 5.338 17.436 ( -0.728 0.000 -20.903) 20.915 19.275 ( -2.632 0.000 16.812) 17.016 19.770 ( 0.183 -0.000 0.492) 0.525 19.801 ( 0.252 -0.000 -0.182) 0.310 20.275 ( 1.865 -0.000 -8.752) 8.948 21.469 ( -1.606 0.000 3.021) 3.421 21.660 ( 5.154 -0.000 -1.454) 5.355 ======================= Grid point 152 (45/199) ======================= q-point: ( 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.130 ( 50.823 13.973 13.801) 54.486 1.653 ( 19.329 -16.309 47.440) 53.760 2.120 ( 28.393 -25.948 24.437) 45.570 2.260 ( 14.514 -15.759 13.101) 25.113 2.426 ( 11.030 -14.962 1.647) 18.661 2.723 ( 2.987 -24.036 -19.084) 30.836 3.223 ( 42.886 -6.916 -6.949) 43.992 5.313 ( -1.131 2.623 -29.318) 29.457 5.743 ( 7.232 -4.796 3.979) 9.546 5.876 ( 7.804 -5.759 -1.730) 9.852 6.578 ( 2.156 -2.815 -2.196) 4.171 6.970 ( 15.511 0.341 -1.432) 15.581 7.308 ( -2.458 -3.624 -1.508) 4.631 7.771 ( -8.109 -5.949 -5.765) 11.592 7.865 ( 9.792 5.208 -0.130) 11.091 8.063 ( 1.499 -9.609 5.165) 11.012 8.217 ( -5.667 4.913 -8.611) 11.419 8.463 ( -8.796 -15.686 -1.156) 18.021 8.614 ( 3.128 2.967 -6.785) 8.039 8.823 ( 0.296 2.972 1.779) 3.476 8.868 ( 7.058 -0.624 2.346) 7.464 8.995 ( 2.319 -9.046 0.292) 9.343 9.167 ( 2.724 0.784 -0.341) 2.855 9.329 ( 16.801 -5.327 -11.604) 21.102 9.504 ( -0.420 -4.428 2.091) 4.915 9.688 ( -9.600 0.846 -1.705) 9.787 9.698 ( -4.023 3.775 -0.918) 5.593 9.771 ( -1.621 -1.870 -1.686) 2.995 9.947 ( 3.653 2.463 2.360) 4.998 10.443 ( 0.696 7.113 5.933) 9.289 10.467 ( 4.280 1.483 -1.137) 4.670 10.758 ( 15.873 -8.446 -7.386) 19.438 10.941 ( -4.460 4.292 -13.212) 14.590 11.220 ( -9.749 8.661 -13.568) 18.819 11.294 ( -13.589 4.006 6.468) 15.574 11.601 ( -15.645 3.156 9.118) 18.381 11.647 ( -10.111 6.712 2.918) 12.482 11.746 ( -13.572 0.813 3.028) 13.929 11.860 ( -2.918 7.523 0.670) 8.097 11.987 ( -2.246 -2.907 -0.585) 3.720 12.163 ( -1.215 -1.007 2.917) 3.317 12.415 ( 4.304 1.305 5.550) 7.144 12.729 ( 0.813 5.634 -5.339) 7.804 12.788 ( -1.695 -0.192 0.549) 1.792 12.820 ( -3.363 -0.541 1.197) 3.610 12.880 ( -4.781 -5.817 1.773) 7.736 13.110 ( 1.634 8.965 1.876) 9.304 13.276 ( -1.744 -4.204 -2.633) 5.258 13.426 ( -6.928 9.208 2.612) 11.816 13.533 ( -5.706 -1.250 5.906) 8.306 14.041 ( 1.173 10.071 -0.769) 10.168 14.149 ( -2.545 3.751 -2.000) 4.954 14.255 ( -7.607 -2.108 0.886) 7.943 14.305 ( 4.067 4.008 0.692) 5.752 14.388 ( 4.409 0.762 -1.450) 4.704 14.449 ( -5.572 2.556 -1.912) 6.422 15.201 ( -0.873 -1.037 -2.410) 2.765 15.254 ( 2.847 -5.568 1.844) 6.520 15.409 ( 5.523 0.093 -5.103) 7.520 15.694 ( 15.593 -8.249 -3.544) 17.993 16.165 ( 5.824 -1.124 13.773) 14.996 16.566 ( -3.190 0.443 1.923) 3.751 16.784 ( 5.457 -6.867 3.859) 9.582 16.953 ( 15.524 -4.770 -4.461) 16.842 17.070 ( 16.469 -10.196 1.055) 19.398 17.761 ( 13.236 -8.801 -38.696) 41.833 19.341 ( 0.011 0.062 15.009) 15.010 19.825 ( 5.047 -1.858 0.595) 5.411 19.858 ( 4.480 -3.349 -0.202) 5.597 20.246 ( -2.197 -0.262 -8.144) 8.440 21.372 ( -8.096 4.614 3.642) 10.005 21.967 ( 13.814 -9.087 -21.539) 27.154 ======================= Grid point 153 (46/199) ======================= q-point: ( 0.17 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.797 ( 28.729 4.114 -0.018) 29.022 2.214 ( 23.092 -10.451 44.269) 51.011 2.482 ( 22.656 -3.161 5.110) 23.439 2.680 ( 14.698 -20.876 -1.221) 25.560 3.105 ( 15.454 -31.940 -15.065) 38.548 3.635 ( 54.805 -52.495 16.116) 77.582 4.099 ( 51.020 -9.653 -2.576) 51.989 5.188 ( -1.701 0.042 -24.955) 25.013 5.957 ( 12.036 -6.375 0.485) 13.629 6.117 ( 9.349 -11.812 -1.905) 15.184 6.692 ( 10.445 -1.827 -3.979) 11.325 7.238 ( 14.507 -2.809 0.483) 14.785 7.302 ( -3.650 -5.153 1.251) 6.437 7.650 ( -8.072 -1.827 -3.378) 8.938 7.911 ( -1.150 8.059 -1.920) 8.364 8.002 ( -8.725 -0.934 -3.067) 9.295 8.091 ( -5.447 -0.659 -2.266) 5.937 8.391 ( -15.995 -16.294 -0.440) 22.837 8.658 ( 3.003 4.755 -4.745) 7.358 8.794 ( 0.116 2.195 4.960) 5.425 8.990 ( 4.135 -0.573 7.012) 8.161 9.085 ( -1.015 -8.969 -0.464) 9.038 9.215 ( 4.800 2.462 0.667) 5.435 9.347 ( -7.090 2.823 -3.030) 8.211 9.484 ( -4.751 1.654 -2.821) 5.768 9.583 ( -4.853 1.499 -1.433) 5.277 9.605 ( -0.006 3.257 -1.093) 3.436 9.756 ( -0.421 -3.808 -1.141) 3.997 9.992 ( 0.120 4.775 3.214) 5.757 10.311 ( -1.117 16.229 6.184) 17.403 10.585 ( 7.752 3.670 3.168) 9.143 10.741 ( -5.551 4.941 -9.277) 11.887 10.836 ( -15.402 10.505 -13.664) 23.115 10.987 ( -12.867 7.281 5.430) 15.749 11.041 ( 5.010 -4.124 -8.020) 10.316 11.337 ( -14.065 5.530 1.146) 15.156 11.362 ( -16.658 6.589 7.464) 19.406 11.559 ( -7.190 -1.516 -0.142) 7.349 11.719 ( -5.792 7.329 1.448) 9.453 11.923 ( -3.781 4.865 -0.475) 6.180 12.135 ( -6.484 -5.280 2.299) 8.672 12.429 ( -0.630 3.750 3.401) 5.102 12.643 ( -2.716 4.786 -2.151) 5.909 12.705 ( -10.441 2.420 2.955) 11.118 12.777 ( -2.589 3.425 -0.339) 4.306 12.837 ( -4.211 -2.865 -1.821) 5.409 13.041 ( -3.344 2.339 -0.676) 4.137 13.195 ( -3.745 6.991 -0.091) 7.932 13.310 ( -2.869 -0.437 3.724) 4.721 13.484 ( -3.668 -0.089 4.750) 6.002 13.874 ( -4.858 13.933 0.190) 14.757 14.037 ( -5.078 11.114 1.708) 12.338 14.148 ( -6.362 0.189 1.605) 6.564 14.200 ( -8.329 2.455 -2.630) 9.073 14.415 ( 6.414 0.787 -5.953) 8.786 14.537 ( 9.562 0.318 2.051) 9.784 15.223 ( 6.895 4.560 -2.868) 8.750 15.344 ( -1.409 -2.294 -4.739) 5.450 15.501 ( 1.731 -11.832 4.655) 12.832 16.025 ( 15.385 -9.869 -5.081) 18.972 16.290 ( 2.796 0.694 15.311) 15.580 16.594 ( 5.008 -2.567 2.976) 6.366 17.079 ( 15.827 -8.144 -0.976) 17.826 17.301 ( 20.535 -4.918 -7.666) 22.464 17.470 ( 17.067 -13.679 2.705) 22.039 17.766 ( -1.668 -3.021 -22.472) 22.736 19.310 ( -5.820 4.732 15.687) 17.388 19.958 ( 6.176 -2.110 -1.048) 6.610 19.995 ( 7.293 -4.677 0.493) 8.678 20.173 ( -4.371 -3.270 -8.386) 10.006 21.165 ( -10.158 8.764 8.892) 16.095 22.064 ( -0.563 -5.594 -21.709) 22.425 ======================= Grid point 154 (47/199) ======================= q-point: ( 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.044 ( 6.491 -3.936 4.057) 8.607 2.796 ( 12.128 -9.405 9.843) 18.233 2.927 ( 28.026 -16.988 19.843) 38.312 3.359 ( 40.204 -12.638 4.259) 42.359 3.678 ( 21.029 -30.262 -10.323) 38.270 4.821 ( 26.839 -7.537 -13.931) 31.164 5.061 ( 46.317 -38.571 1.680) 60.298 5.202 ( 14.575 -7.745 -2.763) 16.735 6.260 ( 13.387 -9.668 -1.888) 16.620 6.368 ( 7.923 -16.381 -0.904) 18.219 6.938 ( 18.041 0.227 -3.079) 18.303 7.278 ( -5.477 -2.473 4.316) 7.399 7.367 ( -5.712 -3.505 -0.235) 6.706 7.619 ( 3.151 1.248 1.500) 3.706 7.664 ( -7.044 4.355 -10.583) 13.438 7.963 ( -6.974 -2.937 -8.293) 11.227 7.995 ( -1.007 -2.030 3.930) 4.537 8.284 ( -16.295 -17.433 1.215) 23.894 8.571 ( -3.122 5.509 -3.884) 7.429 8.745 ( -4.112 7.492 5.450) 10.136 8.992 ( -2.519 8.391 4.409) 9.807 9.132 ( -5.135 -2.030 0.962) 5.605 9.207 ( -0.694 -0.135 4.295) 4.353 9.227 ( -0.663 0.682 -3.571) 3.695 9.431 ( -1.938 -1.702 -3.660) 4.477 9.489 ( -2.361 0.093 -1.857) 3.005 9.540 ( -1.769 7.461 3.591) 8.467 9.829 ( -2.384 2.961 -1.651) 4.145 9.857 ( -4.214 -3.475 4.366) 6.992 10.051 ( -11.549 15.887 -1.661) 19.711 10.395 ( -11.192 14.389 -3.162) 18.501 10.543 ( -9.561 8.596 1.288) 12.921 10.687 ( -9.015 7.357 3.598) 12.180 10.784 ( 2.817 8.653 -4.264) 10.050 10.941 ( -14.904 9.109 -2.521) 17.648 11.168 ( 7.275 -3.913 -5.662) 10.015 11.249 ( -1.850 -3.941 6.624) 7.927 11.467 ( -6.112 1.833 -2.491) 6.850 11.585 ( -2.461 2.307 0.156) 3.377 11.829 ( -1.009 4.601 1.639) 4.987 12.054 ( -10.890 -5.719 0.955) 12.337 12.335 ( -6.887 7.090 0.565) 9.900 12.485 ( -9.180 2.847 4.387) 10.565 12.528 ( -4.373 7.370 -0.681) 8.597 12.646 ( -4.439 7.922 0.293) 9.086 12.746 ( -12.150 -5.410 -1.155) 13.350 13.005 ( -1.000 1.723 2.940) 3.551 13.096 ( -2.549 1.290 -2.346) 3.696 13.274 ( -2.921 2.350 3.900) 5.410 13.413 ( -4.007 3.821 0.951) 5.618 13.654 ( -3.969 16.396 -1.989) 16.986 13.790 ( -9.670 11.414 3.917) 15.464 14.042 ( -2.769 4.297 -0.533) 5.139 14.102 ( -5.025 -3.029 0.234) 5.872 14.497 ( 6.188 1.754 -6.446) 9.106 14.683 ( 7.241 0.909 2.914) 7.858 15.261 ( 4.065 9.604 -12.919) 16.603 15.328 ( 4.818 -0.845 1.488) 5.113 15.658 ( -4.524 -19.002 10.283) 22.074 16.219 ( -4.022 -7.635 3.972) 9.500 16.507 ( 22.657 -0.520 7.576) 23.895 16.728 ( 4.503 -3.303 -3.766) 6.736 17.216 ( 0.600 7.475 -15.196) 16.946 17.631 ( 19.341 -4.380 -9.306) 21.906 17.835 ( 8.070 -8.833 2.135) 12.154 17.930 ( 16.789 -17.428 7.213) 25.252 19.182 ( -7.770 6.096 14.048) 17.172 19.884 ( -12.757 1.727 -11.011) 16.940 20.179 ( 5.956 -4.873 -0.409) 7.706 20.232 ( 8.355 -6.493 -2.587) 10.893 20.983 ( -4.209 9.187 17.118) 19.878 21.981 ( -6.992 -4.661 -19.444) 21.182 ======================= Grid point 155 (48/199) ======================= q-point: ( 0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.194 ( 4.700 -5.079 8.327) 10.827 3.072 ( 7.378 -12.989 3.031) 15.243 3.620 ( 28.364 -14.028 17.316) 36.072 4.121 ( 35.227 -10.187 1.648) 36.708 4.266 ( 19.682 -24.219 -6.509) 31.880 4.897 ( 0.331 -1.881 -23.652) 23.729 5.647 ( 18.625 -5.439 7.116) 20.666 5.942 ( 19.818 -17.267 -6.433) 27.061 6.588 ( 9.571 -11.290 4.998) 15.622 6.705 ( 8.196 -24.281 0.751) 25.638 7.112 ( 4.747 5.837 -2.108) 7.813 7.175 ( -5.364 -1.513 1.683) 5.822 7.342 ( -2.837 0.935 5.532) 6.287 7.569 ( 12.630 -2.276 -9.308) 15.854 7.749 ( 6.020 -4.871 0.858) 7.792 7.854 ( -4.010 1.311 -9.038) 9.974 8.018 ( -4.312 -6.303 1.725) 7.830 8.182 ( -11.207 -10.867 2.309) 15.781 8.494 ( -2.608 1.778 -3.647) 4.823 8.597 ( -4.551 2.506 2.773) 5.889 8.853 ( -2.943 6.883 1.360) 7.608 9.008 ( -8.353 2.845 0.669) 8.850 9.187 ( 0.967 13.136 4.773) 14.010 9.276 ( 4.011 1.425 3.514) 5.519 9.354 ( -3.871 -2.199 -1.691) 4.762 9.358 ( -6.624 6.475 -7.197) 11.730 9.566 ( 0.793 -5.473 -0.147) 5.532 9.686 ( -4.242 -1.802 3.072) 5.539 9.756 ( -5.173 9.705 -1.964) 11.171 9.933 ( -1.954 -1.379 1.519) 2.833 10.089 ( -11.365 10.125 6.355) 16.494 10.304 ( -8.722 5.762 -1.504) 10.561 10.465 ( -11.044 8.092 1.372) 13.760 10.579 ( -2.308 10.043 -7.801) 12.925 10.755 ( -5.215 3.460 0.208) 6.262 11.261 ( -0.415 -0.012 -1.456) 1.514 11.337 ( -3.069 1.471 -2.249) 4.080 11.399 ( 9.237 -2.993 1.916) 9.897 11.559 ( -0.225 1.779 -2.332) 2.941 11.819 ( -0.488 0.940 2.089) 2.342 11.878 ( -11.676 -3.913 -0.785) 12.339 12.158 ( -5.113 5.192 4.233) 8.427 12.349 ( -6.741 9.586 1.230) 11.783 12.367 ( -4.150 7.839 3.101) 9.396 12.508 ( -7.255 2.408 3.316) 8.332 12.596 ( -10.537 -7.789 -0.287) 13.106 12.888 ( -6.669 6.355 0.140) 9.213 13.110 ( 0.455 -3.855 -2.830) 4.803 13.146 ( -5.322 12.267 2.015) 13.523 13.295 ( -4.392 4.996 -1.825) 6.898 13.422 ( -3.416 15.841 -1.661) 16.290 13.611 ( -5.123 2.576 6.181) 8.432 13.997 ( 1.489 2.956 -0.712) 3.385 14.052 ( -4.698 -2.589 0.755) 5.417 14.546 ( 4.877 3.127 -5.018) 7.665 14.746 ( 0.846 2.201 1.486) 2.787 15.236 ( 7.999 5.255 -12.481) 15.728 15.445 ( 8.315 1.296 1.935) 8.635 15.772 ( -8.284 -20.356 12.461) 25.264 16.190 ( -6.606 -3.296 6.169) 9.620 16.668 ( -7.280 7.598 -11.205) 15.372 16.953 ( 21.551 -2.045 5.847) 22.423 17.110 ( 2.394 -2.215 -12.798) 13.207 17.954 ( 16.723 -2.669 -5.776) 17.892 18.050 ( 11.482 0.976 2.662) 11.827 18.375 ( 11.121 -18.720 11.270) 24.518 19.045 ( -6.857 3.659 9.613) 12.362 19.524 ( -20.562 5.011 -12.831) 24.749 20.257 ( 0.000 -1.649 2.495) 2.990 20.452 ( 10.407 -4.441 -1.447) 11.407 20.977 ( 4.211 3.749 15.694) 16.676 21.830 ( -9.068 -3.907 -16.766) 19.457 ======================= Grid point 156 (49/199) ======================= q-point: ( 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.333 ( 4.716 -0.344 11.234) 12.188 3.282 ( 3.253 -9.008 -0.151) 9.578 4.175 ( 17.769 -9.181 8.238) 21.631 4.631 ( 5.912 -9.865 -8.209) 14.130 4.675 ( 19.413 -6.035 -0.042) 20.330 4.931 ( 6.983 -8.588 -10.321) 15.134 5.856 ( 4.585 -0.212 2.832) 5.393 6.268 ( 11.705 -9.181 -2.744) 15.127 6.590 ( -7.475 1.812 3.947) 8.645 6.952 ( -2.822 -11.937 -4.340) 13.011 7.048 ( -3.145 4.934 2.776) 6.476 7.248 ( -2.676 1.961 -3.666) 4.945 7.276 ( 2.049 -4.247 6.273) 7.848 7.634 ( -4.777 0.964 -4.259) 6.472 7.854 ( 5.258 5.624 -0.396) 7.710 7.949 ( -5.633 -1.802 -4.288) 7.305 8.063 ( 17.545 -11.309 -4.047) 21.263 8.329 ( 7.483 -23.382 3.367) 24.780 8.410 ( 4.093 5.797 -0.025) 7.096 8.588 ( -3.854 -5.666 -1.506) 7.017 8.772 ( -8.964 4.188 1.016) 9.946 8.829 ( 1.078 7.912 -0.094) 7.986 9.006 ( -6.369 9.771 9.638) 15.130 9.228 ( -0.324 0.388 -9.456) 9.470 9.378 ( 8.014 4.067 -1.178) 9.064 9.392 ( 4.373 -1.449 2.118) 5.071 9.572 ( -5.573 6.960 -0.422) 8.927 9.583 ( -8.483 -6.316 -0.668) 10.597 9.690 ( -8.800 0.799 3.794) 9.616 9.822 ( 6.703 4.170 -0.669) 7.923 9.886 ( -8.744 7.198 4.654) 12.244 10.181 ( -3.778 -4.387 1.085) 5.890 10.323 ( -5.604 6.162 -2.060) 8.580 10.438 ( -1.879 0.007 -10.200) 10.372 10.707 ( 2.951 4.702 7.621) 9.428 11.210 ( -2.441 -0.826 -2.725) 3.750 11.332 ( -0.828 -0.167 -0.884) 1.223 11.412 ( -4.126 2.244 1.211) 4.850 11.573 ( 4.304 1.514 -2.871) 5.390 11.748 ( -0.175 0.190 1.295) 1.320 11.877 ( -2.585 -4.533 2.069) 5.613 12.081 ( 0.239 5.916 1.295) 6.061 12.166 ( -8.080 2.341 4.657) 9.615 12.204 ( -2.397 13.572 0.782) 13.804 12.389 ( -7.926 -3.145 6.703) 10.847 12.520 ( -9.069 -4.815 -0.814) 10.301 12.742 ( -1.932 6.006 -1.706) 6.535 12.937 ( -4.476 7.883 0.422) 9.075 13.135 ( 0.460 0.523 -3.132) 3.208 13.177 ( -2.508 4.473 -5.258) 7.344 13.268 ( -1.625 6.640 1.525) 7.004 13.571 ( -2.119 -0.441 6.906) 7.237 13.992 ( -1.433 1.261 -0.547) 1.986 14.023 ( 0.548 -0.721 0.721) 1.157 14.572 ( 3.175 2.706 -3.726) 5.593 14.709 ( -1.328 1.793 -1.266) 2.566 15.326 ( 11.966 7.475 -10.044) 17.319 15.614 ( 10.643 -4.935 3.535) 12.253 15.855 ( -9.949 -21.072 13.523) 26.942 16.104 ( -7.492 -0.130 2.275) 7.831 16.375 ( -11.613 9.985 -5.377) 16.232 17.000 ( -5.838 -0.377 -0.892) 5.918 17.450 ( 23.877 -2.477 -16.053) 28.878 18.128 ( 2.314 -1.382 6.528) 7.062 18.278 ( 19.971 3.368 -2.872) 20.456 18.679 ( 2.761 -10.692 11.162) 15.702 18.955 ( -6.096 -3.427 3.557) 7.845 19.104 ( -15.716 9.444 -5.042) 19.016 20.241 ( -2.818 1.542 4.843) 5.811 20.618 ( 5.840 -2.053 -1.580) 6.389 21.090 ( 5.492 0.038 7.275) 9.115 21.680 ( -6.676 -3.329 -12.485) 14.544 ======================= Grid point 157 (50/199) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.404 ( 3.122 7.303 13.625) 15.771 3.305 ( -6.277 -1.782 -4.888) 8.153 4.301 ( -6.340 3.108 -4.561) 8.406 4.770 ( 5.809 -3.897 -1.426) 7.139 4.875 ( 1.122 1.290 1.952) 2.595 5.095 ( 5.107 -5.140 -3.083) 7.875 5.889 ( -3.953 0.252 2.450) 4.658 6.454 ( 0.922 -3.405 3.524) 4.986 6.544 ( 6.047 0.134 -2.281) 6.464 6.883 ( -6.453 7.794 1.497) 10.229 6.949 ( -1.732 -3.138 -4.751) 5.951 7.233 ( 1.291 -4.704 -2.381) 5.428 7.305 ( -0.677 6.748 7.770) 10.314 7.630 ( 5.620 -4.044 -2.297) 7.295 7.852 ( 0.634 -4.539 -6.250) 7.750 7.967 ( 7.547 1.046 -3.742) 8.489 8.288 ( -2.587 1.020 -2.599) 3.807 8.374 ( 2.421 -2.296 -1.218) 3.552 8.467 ( -8.956 -2.431 -1.331) 9.375 8.638 ( 1.246 4.359 -0.859) 4.614 8.663 ( -9.696 0.216 1.666) 9.841 8.730 ( 0.854 8.108 2.427) 8.506 8.991 ( -1.861 -4.000 7.149) 8.401 9.183 ( -4.187 1.361 -1.944) 4.813 9.313 ( -1.214 -3.860 -1.047) 4.180 9.437 ( 5.293 6.774 -2.881) 9.067 9.505 ( -5.548 -6.155 -3.279) 8.911 9.569 ( 8.217 -2.818 5.361) 10.208 9.705 ( 1.809 2.553 0.442) 3.160 9.744 ( -1.807 -1.432 4.285) 4.866 9.917 ( 5.380 2.286 0.989) 5.929 10.135 ( -6.340 3.860 -3.820) 8.348 10.203 ( -1.361 -7.863 -2.131) 8.260 10.428 ( 1.833 -0.665 -5.208) 5.561 10.768 ( 4.803 3.523 7.789) 9.805 11.211 ( 0.926 -3.378 -2.485) 4.295 11.267 ( -1.762 0.058 -2.665) 3.195 11.428 ( 4.027 2.944 5.206) 7.210 11.610 ( 3.570 2.061 -0.721) 4.185 11.775 ( 1.041 0.133 2.996) 3.174 11.872 ( 0.999 -0.134 0.862) 1.326 12.023 ( -1.809 2.605 -0.219) 3.179 12.096 ( 4.271 9.109 1.228) 10.135 12.111 ( -0.678 -2.030 2.012) 2.937 12.283 ( -15.212 -9.703 3.700) 18.419 12.465 ( 3.072 1.132 0.493) 3.311 12.709 ( 2.797 0.370 0.010) 2.821 12.885 ( -0.274 -1.449 0.392) 1.525 13.064 ( -1.626 3.561 -6.257) 7.381 13.146 ( 0.354 0.096 -2.635) 2.661 13.250 ( 1.583 -1.393 1.106) 2.381 13.566 ( -1.362 0.021 6.188) 6.336 13.961 ( 0.277 1.925 -0.647) 2.050 14.040 ( -0.335 -0.411 1.062) 1.187 14.582 ( 1.374 -0.107 -3.429) 3.695 14.689 ( 0.507 0.161 -1.768) 1.846 15.381 ( 7.452 9.453 -7.186) 14.019 15.860 ( -7.746 -14.742 11.854) 20.441 15.961 ( -3.842 3.170 1.937) 5.344 15.989 ( 8.023 -13.538 3.815) 16.193 16.141 ( -5.133 2.561 0.410) 5.750 16.843 ( -11.315 0.647 -7.785) 13.750 17.634 ( 7.993 9.190 -20.341) 23.709 18.160 ( -0.533 0.402 3.671) 3.732 18.583 ( -2.983 7.253 9.994) 12.703 18.666 ( 8.591 -6.354 -2.713) 11.025 18.911 ( 5.621 10.019 5.181) 12.602 18.978 ( -3.425 -12.700 5.265) 14.168 20.177 ( -3.660 2.727 4.156) 6.173 20.662 ( -0.947 0.281 -2.142) 2.359 21.119 ( -3.149 3.396 0.525) 4.661 21.659 ( 3.678 -5.458 -7.137) 9.709 ======================= Grid point 158 (51/199) ======================= q-point: (-0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.384 ( 1.664 13.829 16.501) 21.594 3.106 ( -12.887 3.657 -7.601) 15.402 3.974 ( -20.846 12.897 -1.730) 24.574 4.700 ( -15.670 10.910 2.047) 19.203 4.765 ( -7.411 6.413 -1.440) 9.906 5.181 ( 2.682 -2.640 -5.231) 6.444 5.711 ( -13.052 4.292 -0.770) 13.761 6.484 ( 0.016 5.572 3.373) 6.513 6.499 ( -5.458 5.068 1.513) 7.600 6.902 ( 3.956 0.368 -3.509) 5.300 7.010 ( 8.521 -10.012 -2.984) 13.482 7.249 ( 0.406 13.195 8.087) 15.481 7.264 ( -2.051 0.744 -2.189) 3.090 7.790 ( -5.636 7.659 -4.432) 10.491 7.823 ( 5.001 -4.313 0.713) 6.642 7.975 ( -7.327 5.664 -3.733) 9.985 8.171 ( -2.887 5.898 -1.545) 6.746 8.334 ( -2.513 -3.829 1.433) 4.798 8.400 ( 1.548 -13.412 -4.539) 14.244 8.514 ( 3.048 5.658 -0.190) 6.430 8.637 ( -1.440 1.881 1.944) 3.065 8.726 ( 5.649 -0.447 1.721) 5.923 8.894 ( -6.211 3.487 2.000) 7.399 9.206 ( -0.467 -2.338 -4.247) 4.871 9.338 ( -7.464 -10.903 1.042) 13.254 9.444 ( 7.109 8.880 -1.906) 11.533 9.512 ( -1.211 -7.346 -2.442) 7.835 9.633 ( -2.872 -0.624 1.017) 3.110 9.797 ( 2.897 0.378 1.770) 3.416 9.837 ( 7.196 -10.329 5.056) 13.566 9.951 ( 3.628 5.476 3.136) 7.279 10.090 ( 7.575 0.533 -2.830) 8.104 10.278 ( 0.736 -9.408 -1.675) 9.584 10.508 ( 7.490 -1.135 -3.882) 8.512 10.852 ( 5.441 -1.959 6.688) 8.841 11.250 ( 2.667 2.171 -3.064) 4.606 11.275 ( 1.460 -3.170 -1.421) 3.768 11.465 ( -0.701 -0.055 1.414) 1.579 11.648 ( 3.068 2.315 -0.276) 3.854 11.761 ( -1.669 3.120 0.445) 3.566 11.933 ( 3.060 -0.314 1.612) 3.473 12.020 ( 4.510 0.786 8.497) 9.652 12.134 ( 1.730 0.672 -3.988) 4.399 12.175 ( 10.169 1.620 1.924) 10.476 12.263 ( -1.652 -18.861 3.305) 19.220 12.557 ( 8.597 1.323 0.337) 8.705 12.794 ( 2.761 -3.365 1.882) 4.743 12.935 ( 3.708 -4.258 -3.252) 6.515 13.009 ( -0.467 -0.432 -4.786) 4.828 13.173 ( 2.548 -2.980 -0.173) 3.925 13.344 ( 3.884 -8.297 0.320) 9.167 13.561 ( -0.905 0.595 5.380) 5.488 13.962 ( 3.042 3.116 -0.847) 4.436 14.017 ( -2.997 -0.427 0.432) 3.058 14.613 ( 1.020 -3.681 -3.626) 5.267 14.701 ( 0.409 -1.834 -0.851) 2.063 15.360 ( 3.502 9.263 -6.200) 11.684 15.722 ( -9.408 3.859 5.682) 11.648 15.965 ( -7.577 -1.905 9.058) 11.962 15.972 ( -9.214 -14.533 3.549) 17.569 16.510 ( 20.077 -10.744 -2.228) 22.880 16.595 ( -7.763 -1.106 -8.624) 11.656 17.497 ( -1.704 15.160 -15.116) 21.476 18.109 ( -6.092 0.809 1.428) 6.310 18.303 ( -11.512 13.973 2.980) 18.348 18.756 ( -2.371 10.173 9.950) 14.426 18.912 ( -6.877 -8.798 2.589) 11.463 19.367 ( 29.084 -12.061 0.656) 31.492 20.104 ( -2.529 3.672 3.807) 5.863 20.575 ( -6.935 2.097 -2.691) 7.728 20.947 ( -9.596 8.210 0.557) 12.641 21.825 ( 10.132 -6.434 -6.379) 13.592 ======================= Grid point 159 (52/199) ======================= q-point: (-0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.312 ( 1.259 16.970 19.653) 25.997 2.814 ( -13.683 4.471 -8.067) 16.502 3.414 ( -27.455 18.567 4.270) 33.417 4.127 ( -32.023 22.086 0.695) 38.908 4.448 ( -19.791 11.242 -1.296) 22.798 5.182 ( -2.048 3.989 -12.747) 13.512 5.404 ( -15.808 5.396 0.986) 16.732 6.130 ( -36.893 24.857 -1.734) 44.519 6.407 ( -3.043 2.909 1.803) 4.580 6.701 ( -9.996 18.411 1.330) 20.992 7.095 ( -4.383 -4.728 -1.455) 6.609 7.200 ( -3.179 0.841 -0.145) 3.292 7.307 ( 8.248 -5.243 4.414) 10.724 7.664 ( 2.620 4.507 -2.993) 6.011 7.704 ( -1.579 6.407 -7.366) 9.890 7.971 ( 2.950 10.961 2.371) 11.596 8.215 ( 10.849 -2.018 6.355) 12.735 8.375 ( -2.046 -2.389 -7.175) 7.834 8.425 ( 0.409 10.185 7.783) 12.825 8.653 ( 8.573 -9.644 -1.456) 12.985 8.754 ( 5.885 -13.117 -9.100) 17.015 8.790 ( -0.817 0.160 7.091) 7.140 8.901 ( 12.050 -6.307 -2.487) 13.826 9.196 ( -0.076 -1.459 -3.210) 3.527 9.320 ( -4.098 -6.711 0.819) 7.906 9.469 ( 5.188 6.140 -1.851) 8.249 9.591 ( 2.049 -6.213 -2.258) 6.921 9.645 ( 1.630 -6.696 4.179) 8.060 9.793 ( -2.465 -1.198 -1.874) 3.320 9.933 ( 3.236 1.483 3.308) 4.859 10.115 ( 8.784 -10.009 4.419) 14.031 10.362 ( 19.052 -2.281 -1.717) 19.265 10.392 ( 5.219 -7.423 0.337) 9.080 10.632 ( 7.823 -3.962 -2.712) 9.179 11.045 ( 7.358 -8.232 4.790) 12.035 11.221 ( -11.367 -0.201 -0.171) 11.370 11.301 ( 4.939 -2.145 -4.420) 6.967 11.442 ( -0.103 0.400 1.589) 1.642 11.647 ( -1.705 0.077 -7.597) 7.786 11.709 ( 1.392 2.567 6.294) 6.939 12.009 ( 5.795 -0.325 3.687) 6.877 12.157 ( 6.870 1.805 1.880) 7.348 12.206 ( 8.607 -0.778 0.124) 8.643 12.373 ( 11.450 -2.176 2.657) 11.954 12.497 ( 7.408 -14.136 3.167) 16.271 12.692 ( 7.600 0.925 0.542) 7.675 12.870 ( 3.364 -2.715 1.350) 4.529 12.948 ( 1.107 1.477 -6.907) 7.149 13.116 ( 1.202 -14.072 0.429) 14.129 13.297 ( 9.083 -2.383 -0.008) 9.391 13.519 ( 3.341 -10.322 1.970) 11.027 13.569 ( 1.258 -3.563 2.509) 4.536 13.963 ( -2.360 -0.498 -0.412) 2.447 14.004 ( 4.626 2.468 -1.024) 5.342 14.622 ( -3.405 -3.569 -5.428) 7.334 14.750 ( 0.395 -5.808 3.012) 6.555 15.293 ( 2.045 9.568 -7.208) 12.153 15.567 ( -6.050 5.698 6.677) 10.661 15.845 ( -6.981 -1.246 -7.753) 10.507 15.994 ( -11.930 -16.011 14.697) 24.793 16.300 ( -13.084 0.951 -3.910) 13.689 17.104 ( 24.240 -9.849 -9.524) 27.844 17.253 ( -0.483 15.659 -7.750) 17.478 17.937 ( -18.224 -1.397 1.015) 18.305 17.976 ( -7.571 19.171 4.974) 21.203 18.530 ( -15.176 10.524 8.396) 20.287 18.919 ( 0.214 -2.824 3.798) 4.738 19.917 ( 11.588 -15.258 -13.212) 23.273 20.117 ( 15.669 3.540 12.004) 20.054 20.392 ( -10.484 3.543 -2.306) 11.304 20.687 ( -10.159 11.360 4.345) 15.847 22.038 ( 10.653 -5.314 -8.209) 14.460 ======================= Grid point 160 (53/199) ======================= q-point: (-0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.210 ( -2.077 18.490 23.268) 29.792 2.537 ( -14.715 0.635 -5.314) 15.658 2.786 ( -27.081 20.054 8.622) 34.783 3.317 ( -34.844 27.303 1.314) 44.286 3.927 ( -27.247 11.984 -4.640) 30.126 4.751 ( -27.137 25.002 -4.512) 37.174 4.948 ( -62.599 31.398 4.878) 70.202 5.286 ( -1.668 -3.360 -12.358) 12.915 6.237 ( -14.937 9.519 -2.407) 17.875 6.377 ( -5.936 16.318 -0.345) 17.367 6.981 ( -13.200 -6.190 -2.286) 14.757 7.233 ( 2.591 -3.334 0.168) 4.225 7.395 ( 6.509 13.842 2.315) 15.470 7.635 ( -0.480 -0.477 -0.229) 0.715 7.793 ( 8.673 -0.778 -3.419) 9.355 7.924 ( 4.895 5.515 1.123) 7.459 8.242 ( 0.189 5.868 -7.982) 9.908 8.387 ( 6.117 8.805 0.576) 10.737 8.506 ( 6.849 -5.385 6.969) 11.157 8.825 ( 4.846 -0.524 1.782) 5.190 8.859 ( 4.208 -3.901 7.164) 9.179 8.953 ( 5.509 -10.107 -5.377) 12.705 9.106 ( 1.932 -1.553 -1.708) 3.010 9.313 ( 11.564 -11.676 -5.477) 17.322 9.388 ( 6.448 -3.116 2.392) 7.550 9.503 ( 3.339 0.339 1.755) 3.788 9.658 ( 3.072 -1.672 2.351) 4.214 9.758 ( -2.160 -3.298 -3.982) 5.604 9.806 ( 7.526 -4.072 1.773) 8.739 10.034 ( 0.012 -10.754 0.357) 10.760 10.316 ( 4.881 -5.128 -3.752) 8.012 10.569 ( 11.248 -7.407 3.106) 13.822 10.737 ( 18.088 -4.397 1.568) 18.680 10.891 ( -9.945 -4.715 -2.716) 11.336 10.931 ( 10.182 -8.991 -1.355) 13.651 11.278 ( 4.754 -5.289 7.216) 10.131 11.402 ( 3.490 -4.056 -3.646) 6.475 11.468 ( 3.957 0.541 1.159) 4.159 11.614 ( 1.263 -2.224 -4.647) 5.304 11.779 ( 4.892 -0.292 4.460) 6.627 12.141 ( 9.175 2.464 4.455) 10.492 12.227 ( 1.944 -2.098 -1.481) 3.221 12.361 ( 8.870 0.477 -1.009) 8.940 12.582 ( 10.470 -0.486 0.006) 10.481 12.727 ( 5.933 -4.424 2.291) 7.748 12.789 ( 4.634 -1.614 1.633) 5.172 12.947 ( 5.449 0.276 -3.890) 6.700 12.986 ( 2.602 -5.985 -0.555) 6.549 13.231 ( -4.542 -12.789 4.170) 14.198 13.476 ( 8.992 0.461 1.160) 9.078 13.617 ( 4.955 -6.292 1.276) 8.110 13.740 ( 5.785 -9.843 -0.662) 11.436 13.972 ( 0.995 -5.825 -0.012) 5.910 14.072 ( 6.816 2.472 -1.569) 7.419 14.537 ( -8.222 -2.724 -5.866) 10.461 14.787 ( -5.587 -4.789 5.809) 9.375 15.225 ( 4.425 9.498 -8.735) 13.642 15.445 ( -4.266 6.384 6.087) 9.798 15.699 ( -10.511 -5.121 -14.365) 18.522 15.938 ( -9.606 -2.034 12.804) 16.136 16.166 ( -9.114 -10.499 6.667) 15.419 16.916 ( -5.141 21.166 -11.339) 24.556 17.501 ( -6.214 14.071 0.475) 15.390 17.612 ( -9.963 -1.847 -8.387) 13.154 17.795 ( 5.431 -2.474 3.329) 6.834 18.132 ( -20.520 13.584 5.144) 25.141 18.999 ( 3.962 -2.524 9.490) 10.589 19.974 ( -0.229 -2.132 -5.545) 5.945 20.166 ( -11.016 4.369 -1.175) 11.909 20.344 ( -5.755 4.253 -7.923) 10.676 20.689 ( 22.327 -2.767 14.416) 26.720 22.209 ( 8.048 -3.270 -11.888) 14.724 ======================= Grid point 161 (54/199) ======================= q-point: (-0.17 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.937 ( -15.691 30.535 26.433) 43.327 2.123 ( -33.061 19.493 24.572) 45.572 2.330 ( -12.665 -3.217 -6.241) 14.481 2.637 ( -15.743 17.529 -0.776) 23.573 3.327 ( -32.524 9.580 -10.089) 35.375 3.495 ( -71.732 26.818 11.425) 77.429 3.980 ( -30.410 36.893 -2.443) 47.873 5.301 ( 3.322 -5.454 -19.411) 20.435 5.869 ( -10.992 12.999 -2.134) 17.156 6.143 ( -9.253 9.125 -1.316) 13.062 6.822 ( -11.133 -5.364 -0.819) 12.385 7.139 ( -9.503 9.905 -3.209) 14.097 7.390 ( 1.774 -2.475 3.184) 4.405 7.725 ( 10.805 4.303 -0.199) 11.632 7.844 ( 3.723 2.496 0.512) 4.511 8.088 ( 7.360 -1.216 -0.343) 7.468 8.198 ( 4.932 2.413 -10.729) 12.053 8.410 ( 5.498 7.464 2.324) 9.557 8.632 ( 0.780 -3.209 4.887) 5.898 8.859 ( -1.143 -0.534 0.510) 1.361 8.941 ( -1.299 -2.834 5.716) 6.511 9.058 ( 3.965 3.578 0.870) 5.411 9.122 ( -1.150 -5.300 -6.098) 8.160 9.481 ( 3.985 7.943 0.690) 8.913 9.581 ( 5.749 -7.192 -0.682) 9.232 9.641 ( 9.525 -8.643 -0.332) 12.866 9.719 ( 2.022 -0.265 -0.759) 2.176 9.794 ( -0.703 -6.756 -0.116) 6.793 9.993 ( -0.344 -4.841 6.402) 8.033 10.054 ( 1.482 -10.579 -2.601) 10.994 10.288 ( -7.975 1.277 -3.761) 8.909 10.697 ( 8.916 6.957 -13.516) 17.623 10.894 ( 14.025 -9.631 7.199) 18.474 11.211 ( 17.940 -14.927 -0.314) 23.340 11.281 ( 4.282 -3.561 -1.763) 5.842 11.376 ( 8.873 -8.093 -1.628) 12.120 11.496 ( 4.519 -5.389 1.779) 7.254 11.574 ( 7.979 -4.221 -1.797) 9.203 11.705 ( 4.809 -2.459 5.320) 7.581 11.902 ( 7.421 -2.767 1.065) 7.991 12.227 ( 2.734 5.834 5.154) 8.251 12.251 ( -1.422 -1.948 -0.150) 2.417 12.499 ( 8.375 -0.412 -3.747) 9.184 12.691 ( 4.959 0.809 -6.490) 8.208 12.807 ( -0.911 -4.965 3.240) 5.999 12.872 ( 4.655 1.233 6.294) 7.925 13.066 ( 1.949 -6.161 -2.986) 7.118 13.107 ( 10.123 0.767 -3.954) 10.895 13.262 ( -4.461 -11.055 7.379) 14.020 13.553 ( 1.953 2.544 4.501) 5.526 13.828 ( 8.472 -9.730 0.762) 12.924 13.936 ( 11.290 -3.695 -1.463) 11.969 14.091 ( 4.258 -7.449 0.462) 8.592 14.181 ( 7.395 -1.735 -1.659) 7.775 14.379 ( -9.757 -0.938 -6.152) 11.572 14.667 ( -11.633 1.197 3.389) 12.176 15.207 ( 4.788 7.787 -4.926) 10.384 15.337 ( -2.990 6.728 4.445) 8.601 15.532 ( -12.025 -9.121 -12.612) 19.669 15.830 ( -5.484 6.379 7.613) 11.346 16.162 ( -9.243 -12.036 9.155) 17.723 16.619 ( -3.855 15.872 -7.814) 18.107 17.113 ( -15.593 15.440 8.551) 23.552 17.319 ( -17.914 3.554 -3.890) 18.673 17.622 ( -21.034 18.929 1.910) 28.362 18.070 ( 10.936 -6.864 -22.331) 25.795 19.150 ( 5.691 -3.077 17.083) 18.267 19.946 ( -3.430 1.897 -1.813) 4.319 19.957 ( -8.707 3.852 -0.016) 9.522 20.209 ( 0.505 2.805 -6.994) 7.553 21.121 ( 17.303 -6.279 7.196) 19.764 22.265 ( 1.248 0.271 -19.931) 19.972 ======================= Grid point 162 (55/199) ======================= q-point: (-0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.184 ( -21.121 56.524 14.089) 61.964 1.622 ( -32.279 9.012 51.616) 61.542 2.016 ( -68.941 13.964 32.512) 77.491 2.227 ( -9.840 -8.808 -0.824) 13.232 2.376 ( -6.039 9.039 -1.850) 11.027 2.839 ( -18.884 3.958 -16.584) 25.443 3.177 ( -21.170 32.002 -6.223) 38.872 5.372 ( 5.959 -5.790 -24.671) 26.032 5.647 ( -2.831 8.849 -0.402) 9.300 5.917 ( -8.427 4.612 -0.528) 9.621 6.704 ( -8.627 -1.402 2.613) 9.122 6.892 ( -7.341 3.948 -6.467) 10.550 7.471 ( -0.585 -11.325 1.234) 11.407 7.825 ( 8.224 8.603 -5.932) 13.298 7.890 ( 0.521 -0.639 3.837) 3.924 8.012 ( -4.310 9.778 2.044) 10.879 8.324 ( 3.753 -5.501 -4.477) 8.025 8.460 ( 7.741 4.092 0.252) 8.760 8.645 ( -2.440 -3.432 -0.274) 4.220 8.833 ( -1.526 0.184 -0.374) 1.582 8.942 ( -3.357 -2.684 3.699) 5.671 9.026 ( -5.203 2.969 -0.612) 6.022 9.069 ( -8.554 4.657 -15.718) 18.491 9.305 ( -10.460 18.345 -9.702) 23.239 9.630 ( -10.930 -4.409 4.024) 12.453 9.715 ( 1.939 -0.563 -2.007) 2.847 9.741 ( -0.553 2.499 2.214) 3.384 9.849 ( 5.407 -4.858 -0.760) 7.309 10.020 ( 6.046 0.816 -3.517) 7.042 10.264 ( 3.552 -2.650 6.212) 7.631 10.323 ( 10.750 -7.534 1.597) 13.224 10.670 ( -4.269 9.944 -27.607) 29.652 11.137 ( -6.780 -3.681 -10.103) 12.712 11.224 ( 6.843 -2.874 1.912) 7.664 11.510 ( 3.672 -6.951 -6.305) 10.077 11.596 ( 7.501 -5.056 6.648) 11.226 11.708 ( 7.784 -6.772 -0.528) 10.331 11.772 ( 10.823 -0.782 1.033) 10.900 11.902 ( 8.544 -11.537 11.048) 18.115 12.043 ( 4.684 -2.199 -0.657) 5.217 12.165 ( 1.043 12.256 8.078) 14.715 12.212 ( -6.134 -1.495 -0.931) 6.382 12.592 ( 4.467 -4.147 -5.854) 8.451 12.758 ( 5.305 -0.031 -4.128) 6.722 12.833 ( -2.294 -5.538 2.652) 6.554 12.994 ( 7.292 0.528 11.876) 13.946 13.108 ( -0.038 -2.660 -2.257) 3.489 13.152 ( -0.839 -0.230 2.436) 2.587 13.408 ( 7.096 -4.508 1.761) 8.589 13.562 ( 0.372 2.079 3.295) 3.914 13.999 ( 0.662 -7.785 1.953) 8.054 14.175 ( 12.598 -1.946 -1.256) 12.809 14.228 ( 4.068 -3.975 1.819) 5.972 14.241 ( -1.101 -1.008 -3.312) 3.632 14.338 ( 5.131 -3.288 -2.878) 6.739 14.459 ( -8.296 3.127 -0.179) 8.868 15.196 ( 1.164 1.006 0.132) 1.544 15.265 ( 1.700 5.909 0.343) 6.158 15.405 ( -8.853 -5.105 -8.205) 13.106 15.622 ( -10.663 12.255 -0.120) 16.245 16.102 ( -8.723 -2.367 9.340) 12.997 16.528 ( 3.661 -1.676 -1.620) 4.340 16.831 ( -6.490 7.798 6.962) 12.304 16.992 ( -14.904 5.809 -0.867) 16.020 17.108 ( -18.435 16.521 -1.449) 24.797 18.018 ( -11.792 6.569 -42.919) 44.992 19.292 ( 0.282 -0.722 17.506) 17.523 19.817 ( -4.607 2.191 0.451) 5.121 19.846 ( -3.669 2.650 -0.376) 4.542 20.239 ( 4.889 -0.109 -8.295) 9.629 21.394 ( 7.401 -3.926 4.529) 9.524 22.038 ( -16.752 10.244 -29.411) 35.364 ======================= Grid point 164 (56/199) ======================= q-point: ( 0.08 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.965 ( 12.934 -0.000 10.052) 16.381 2.086 ( 31.670 -0.000 35.891) 47.866 2.337 ( 5.252 -0.000 -10.622) 11.850 2.600 ( 36.067 -0.000 13.432) 38.487 2.796 ( 22.811 -0.000 -14.062) 26.797 2.969 ( 68.316 -0.000 17.124) 70.430 4.017 ( 54.186 -0.000 -1.805) 54.216 5.195 ( -3.014 0.000 -26.495) 26.666 5.892 ( 10.117 -0.000 4.175) 10.944 6.001 ( 11.252 -0.000 -4.558) 12.140 6.662 ( 10.448 -0.000 -5.752) 11.927 7.201 ( 9.153 -0.000 3.555) 9.819 7.242 ( 1.592 -0.000 -3.446) 3.796 7.616 ( -5.945 0.000 -4.567) 7.497 7.958 ( -9.837 0.000 1.272) 9.919 8.056 ( -9.336 0.000 1.295) 9.425 8.065 ( 2.773 -0.000 -1.485) 3.145 8.175 ( -15.473 0.000 -4.529) 16.123 8.706 ( 5.684 -0.000 -4.407) 7.192 8.844 ( 1.235 -0.000 3.179) 3.410 8.941 ( 3.883 -0.000 3.474) 5.210 8.997 ( 0.904 -0.000 1.583) 1.823 9.238 ( 3.614 -0.000 -0.109) 3.616 9.465 ( -0.032 0.000 -0.049) 0.058 9.488 ( -2.504 0.000 0.549) 2.563 9.521 ( -8.630 0.000 -1.859) 8.828 9.689 ( 4.030 -0.000 -6.228) 7.418 9.699 ( -6.382 0.000 -1.822) 6.638 10.051 ( 1.836 -0.000 2.455) 3.065 10.529 ( 6.961 -0.000 9.924) 12.122 10.559 ( 3.101 -0.000 -0.041) 3.102 10.762 ( -7.950 0.000 -16.699) 18.494 10.960 ( -17.604 0.000 -15.676) 23.572 10.975 ( 11.163 -0.000 -3.476) 11.692 11.088 ( -17.639 0.000 8.891) 19.753 11.373 ( -15.121 0.000 8.483) 17.338 11.457 ( -20.472 0.000 1.295) 20.513 11.533 ( -7.030 0.000 1.351) 7.158 11.850 ( -5.810 0.000 3.392) 6.728 11.899 ( -4.848 0.000 -3.308) 5.869 12.101 ( -6.552 0.000 4.269) 7.820 12.482 ( 0.959 -0.000 2.727) 2.890 12.685 ( -3.657 0.000 -0.142) 3.660 12.727 ( -9.961 0.000 3.445) 10.540 12.769 ( -5.102 0.000 -2.333) 5.611 12.812 ( 0.103 -0.000 -0.708) 0.715 13.124 ( -8.883 0.000 -5.569) 10.484 13.181 ( -3.786 0.000 -0.266) 3.795 13.373 ( -4.451 0.000 5.435) 7.025 13.462 ( -0.719 0.000 5.200) 5.249 14.033 ( -9.914 0.000 1.037) 9.968 14.096 ( -7.272 0.000 0.443) 7.286 14.169 ( 2.638 -0.000 -1.337) 2.957 14.237 ( -9.666 0.000 1.893) 9.850 14.464 ( 6.285 -0.000 -6.924) 9.352 14.544 ( 10.279 -0.000 2.444) 10.565 15.242 ( 4.385 -0.000 1.847) 4.758 15.252 ( -0.488 0.000 3.620) 3.653 15.469 ( 3.677 -0.000 -8.581) 9.335 15.887 ( 13.970 -0.000 -11.157) 17.878 16.316 ( 7.273 -0.000 11.383) 13.508 16.621 ( 7.527 -0.000 8.341) 11.235 16.885 ( 10.714 -0.000 9.732) 14.474 17.260 ( 23.141 -0.000 -6.956) 24.164 17.387 ( 23.474 -0.000 2.056) 23.564 17.727 ( -0.627 0.000 -31.843) 31.849 19.355 ( -4.965 0.000 15.775) 16.538 19.942 ( 7.597 -0.000 -0.453) 7.611 19.947 ( 10.163 -0.000 0.028) 10.163 20.141 ( -7.473 0.000 -8.481) 11.304 21.249 ( -10.485 0.000 7.420) 12.845 21.990 ( 0.870 -0.000 -22.499) 22.515 ======================= Grid point 165 (57/199) ======================= q-point: ( 0.17 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.062 ( 4.929 4.672 4.550) 8.175 2.440 ( 2.935 -18.553 -6.312) 19.816 2.769 ( 33.339 -2.861 31.077) 45.667 3.259 ( 29.454 -11.384 -11.217) 33.511 3.308 ( 44.744 3.723 12.337) 46.563 4.320 ( 67.398 -24.112 4.588) 71.728 4.840 ( 34.812 -0.557 -14.848) 37.850 5.137 ( 12.126 -0.758 -7.138) 14.091 6.085 ( 8.623 -6.648 1.554) 10.999 6.177 ( 8.284 -3.896 -4.645) 10.265 6.887 ( 16.887 -3.383 -7.156) 18.650 7.197 ( -2.830 -3.832 1.690) 5.055 7.393 ( 2.842 4.998 1.882) 6.050 7.552 ( 0.964 -5.005 -0.949) 5.185 7.729 ( -13.828 -2.882 -5.105) 15.020 7.869 ( -12.566 0.230 -5.435) 13.693 8.024 ( -3.331 -0.087 0.504) 3.370 8.036 ( -6.877 -5.377 1.506) 8.859 8.664 ( -4.228 3.262 -1.265) 5.488 8.865 ( -5.044 5.239 4.737) 8.679 8.991 ( 1.467 -4.146 8.028) 9.154 9.081 ( 4.418 -4.183 1.011) 6.167 9.264 ( -2.131 2.399 -2.260) 3.925 9.305 ( -6.076 8.551 0.805) 10.520 9.411 ( -2.083 -0.038 -3.266) 3.874 9.485 ( -2.952 -1.668 -2.326) 4.112 9.584 ( -5.983 -2.315 -0.008) 6.415 9.768 ( 4.838 -1.148 -1.631) 5.233 9.952 ( -9.003 4.369 1.174) 10.076 10.339 ( -15.335 12.215 -7.875) 21.128 10.543 ( -17.000 -0.628 -10.429) 19.954 10.659 ( -7.660 5.069 7.744) 12.014 10.725 ( -9.870 -1.366 4.753) 11.040 10.960 ( 14.155 6.749 2.209) 15.836 11.073 ( -19.929 3.047 -3.786) 20.513 11.130 ( 3.086 -0.224 -2.945) 4.271 11.192 ( -5.048 -1.453 6.219) 8.140 11.458 ( -3.770 -1.351 -0.136) 4.007 11.684 ( -7.380 7.311 0.317) 10.393 11.833 ( -7.643 -6.526 -0.894) 10.090 11.996 ( -6.296 1.388 3.753) 7.460 12.448 ( -7.213 4.248 -1.029) 8.434 12.520 ( -9.986 0.875 5.718) 11.540 12.596 ( -6.970 1.860 1.162) 7.307 12.644 ( -11.962 -3.832 -0.376) 12.566 12.801 ( -1.142 4.344 -3.447) 5.662 12.957 ( -5.721 -2.967 -1.086) 6.535 13.108 ( -5.242 -0.338 -1.391) 5.434 13.328 ( -1.728 2.093 3.624) 4.528 13.478 ( 0.448 2.512 3.287) 4.161 13.873 ( -8.582 6.215 1.151) 10.659 13.928 ( -8.930 0.300 3.276) 9.517 14.126 ( -2.829 5.553 2.238) 6.622 14.153 ( -2.051 4.700 0.529) 5.156 14.548 ( 8.496 2.965 -9.683) 13.219 14.704 ( 8.259 0.946 1.129) 8.389 15.225 ( -5.008 -3.041 1.415) 6.028 15.326 ( -3.197 -11.071 6.633) 13.296 15.510 ( 9.734 6.864 -9.362) 15.150 16.087 ( 9.845 -4.960 -14.459) 18.182 16.466 ( 8.374 -2.689 6.026) 10.661 16.783 ( 11.875 8.115 14.119) 20.155 17.196 ( 10.129 -10.776 3.532) 15.205 17.442 ( -4.523 -6.293 -14.072) 16.064 17.742 ( 23.748 3.273 -5.922) 24.693 17.824 ( 21.232 -3.474 2.353) 21.643 19.272 ( -8.567 2.657 15.796) 18.165 19.919 ( -13.642 1.828 -10.076) 17.058 20.103 ( 7.740 -3.566 -1.721) 8.694 20.151 ( 13.442 -1.215 -0.902) 13.527 21.109 ( -7.207 3.510 14.633) 16.685 21.880 ( -7.569 -4.111 -22.147) 23.763 ======================= Grid point 166 (58/199) ======================= q-point: ( 0.25 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.157 ( 8.301 0.809 7.824) 11.436 2.678 ( 2.650 -24.435 -4.542) 24.994 3.446 ( 32.596 -4.499 25.638) 41.714 3.859 ( 29.120 -15.959 -9.307) 34.487 4.022 ( 37.591 -1.264 6.547) 38.177 4.885 ( 0.157 0.363 -27.371) 27.373 5.522 ( 44.038 -16.132 -3.384) 47.022 5.679 ( 32.843 -0.632 8.818) 34.012 6.306 ( 3.669 -15.729 -0.233) 16.153 6.355 ( 10.437 -9.885 0.610) 14.388 7.115 ( -3.814 -3.660 0.103) 5.287 7.234 ( 8.306 1.697 -3.164) 9.049 7.312 ( -0.632 0.627 3.412) 3.526 7.557 ( -4.517 -1.143 -7.288) 8.650 7.633 ( 3.042 -5.510 -0.167) 6.296 7.828 ( 0.595 -10.686 -2.690) 11.036 7.893 ( -7.043 1.314 -6.441) 9.634 8.041 ( -2.691 -2.428 7.111) 7.981 8.557 ( -2.979 4.198 -0.871) 5.221 8.677 ( -11.671 3.546 2.963) 12.553 9.002 ( -6.271 6.934 1.795) 9.520 9.052 ( -4.012 4.344 2.319) 6.352 9.190 ( 0.813 -6.735 4.579) 8.185 9.287 ( -0.209 -1.803 -2.872) 3.397 9.385 ( -0.957 3.357 -4.955) 6.061 9.447 ( 1.977 0.015 -1.246) 2.336 9.532 ( -4.690 0.141 2.857) 5.493 9.739 ( -8.710 8.126 -1.643) 12.024 9.832 ( -2.149 -3.022 -0.823) 3.799 9.985 ( -5.275 9.218 -3.496) 11.181 10.250 ( -14.754 4.194 -0.030) 15.339 10.358 ( -16.041 0.672 2.001) 16.179 10.607 ( -14.859 5.919 2.667) 16.216 10.791 ( -1.648 3.784 2.712) 4.938 10.840 ( -9.004 10.396 -5.871) 14.954 11.259 ( 3.285 0.209 1.431) 3.589 11.338 ( 10.030 -1.185 -1.027) 10.152 11.398 ( -0.831 1.766 0.099) 1.954 11.557 ( -2.402 -0.517 0.265) 2.471 11.751 ( -10.451 -7.473 -0.277) 12.851 11.885 ( -4.829 3.909 0.445) 6.229 12.198 ( -13.748 0.040 2.864) 14.043 12.418 ( -12.336 -1.248 2.928) 12.740 12.436 ( -11.754 0.727 3.387) 12.254 12.506 ( -1.079 0.652 1.550) 1.997 12.651 ( -5.810 7.946 -5.270) 11.165 12.990 ( -6.160 1.408 -3.535) 7.240 12.998 ( 0.817 -4.103 2.369) 4.808 13.280 ( -2.690 2.889 1.640) 4.275 13.436 ( -0.920 7.149 2.945) 7.787 13.672 ( -8.969 5.386 4.923) 11.562 13.767 ( -5.425 12.410 -0.101) 13.544 14.042 ( -2.669 3.258 1.980) 4.654 14.061 ( -2.239 4.346 0.461) 4.911 14.620 ( 7.216 4.352 -7.265) 11.127 14.784 ( 1.707 1.862 0.501) 2.575 15.197 ( -0.811 -5.933 -3.365) 6.869 15.394 ( -8.210 -18.088 9.998) 22.238 15.594 ( 12.300 9.912 -7.896) 17.660 16.170 ( 2.550 1.560 -5.591) 6.340 16.672 ( 4.702 -8.285 -11.301) 14.780 16.966 ( 16.667 6.808 14.312) 22.999 17.084 ( -12.576 0.039 -13.858) 18.714 17.680 ( 5.892 -22.404 8.797) 24.780 18.097 ( 22.284 3.953 -3.584) 22.914 18.215 ( 19.495 -1.183 10.382) 22.119 19.141 ( -7.287 4.710 11.885) 14.715 19.585 ( -19.326 1.853 -10.963) 22.296 20.242 ( 6.488 0.268 -0.444) 6.509 20.395 ( 14.493 -1.615 -3.258) 14.942 21.054 ( -1.144 3.508 18.158) 18.530 21.713 ( -10.622 -7.064 -20.816) 24.414 ======================= Grid point 167 (59/199) ======================= q-point: ( 0.33 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.360 ( 13.317 2.193 11.715) 17.871 2.946 ( 2.105 -24.164 -4.062) 24.594 4.045 ( 25.909 -3.789 16.960) 31.198 4.400 ( 19.481 -12.656 -7.385) 24.377 4.563 ( 21.785 -5.126 1.796) 22.451 4.819 ( 1.464 -2.876 -20.370) 20.624 5.945 ( 13.739 7.504 -0.751) 15.673 6.146 ( 18.045 -2.456 1.087) 18.244 6.465 ( -2.291 -13.589 -1.188) 13.832 6.729 ( 9.807 -10.607 1.719) 14.548 7.087 ( 0.259 -6.317 -2.108) 6.665 7.172 ( -1.630 2.951 1.070) 3.537 7.339 ( -2.511 3.208 4.364) 5.970 7.565 ( -7.579 -9.064 2.638) 12.106 7.837 ( 8.355 -9.134 0.845) 12.408 7.864 ( 1.212 -6.013 -9.356) 11.187 7.959 ( 13.006 -1.775 -5.288) 14.152 7.990 ( -4.845 -4.753 4.222) 7.994 8.497 ( 1.739 3.614 0.891) 4.108 8.527 ( -2.746 0.359 -1.110) 2.983 8.817 ( -6.473 3.647 1.632) 7.607 8.997 ( -1.818 6.110 1.294) 6.504 9.191 ( -9.656 -1.105 -0.372) 9.726 9.219 ( -4.081 -1.706 -9.191) 10.200 9.332 ( -5.866 8.286 7.646) 12.709 9.404 ( -0.135 -2.775 3.111) 4.171 9.533 ( 6.706 2.345 -1.251) 7.213 9.600 ( -3.805 -1.244 -2.234) 4.584 9.798 ( 1.803 6.347 -1.617) 6.793 9.941 ( 0.424 2.994 1.452) 3.355 10.014 ( -4.792 5.237 5.630) 9.060 10.143 ( -11.270 0.663 -2.245) 11.511 10.385 ( -4.127 -0.414 -1.774) 4.511 10.552 ( -9.719 11.190 -9.609) 17.664 10.810 ( 4.762 5.857 8.784) 11.582 11.214 ( -5.361 2.202 -1.742) 6.052 11.329 ( -1.704 0.460 -1.290) 2.186 11.438 ( -2.964 0.944 0.545) 3.158 11.579 ( 2.235 -2.373 0.174) 3.264 11.706 ( -0.783 -6.480 2.759) 7.086 11.790 ( -4.271 -0.550 -0.731) 4.368 12.021 ( -15.332 -7.382 3.141) 17.304 12.202 ( -13.417 1.479 -0.487) 13.507 12.290 ( -6.166 -2.245 6.623) 9.324 12.463 ( -5.638 7.530 -2.032) 9.624 12.525 ( 2.933 3.011 0.847) 4.288 12.828 ( -6.148 4.034 -3.630) 8.200 13.063 ( 0.953 -1.013 -0.075) 1.393 13.191 ( -3.553 5.285 1.985) 6.670 13.305 ( -4.011 12.234 -0.142) 12.875 13.532 ( -3.385 14.182 -1.473) 14.655 13.551 ( -5.200 1.713 7.090) 8.958 13.991 ( -1.713 0.784 1.159) 2.212 14.018 ( -1.609 -0.622 0.953) 1.970 14.653 ( 3.959 5.598 -4.220) 8.051 14.738 ( -3.119 1.277 -1.277) 3.604 15.330 ( 9.893 -7.601 -5.063) 13.464 15.457 ( -10.201 -19.767 12.846) 25.687 15.665 ( 9.903 9.173 -6.328) 14.908 16.138 ( -1.111 4.402 -2.449) 5.158 16.542 ( -12.333 6.959 -9.118) 16.842 16.938 ( -7.306 -6.386 -7.026) 11.980 17.338 ( 22.569 -6.630 -1.081) 23.548 17.952 ( 0.830 -17.233 6.829) 18.555 18.345 ( 11.668 3.442 3.079) 12.548 18.498 ( 5.478 -3.950 11.308) 13.171 19.035 ( -0.450 7.871 2.852) 8.383 19.257 ( -9.792 5.809 -3.697) 11.971 20.296 ( 2.609 4.554 2.114) 5.658 20.614 ( 12.136 0.854 -5.663) 13.419 21.099 ( 2.480 0.611 13.993) 14.224 21.558 ( -9.731 -8.770 -17.028) 21.484 ======================= Grid point 168 (60/199) ======================= q-point: ( 0.42 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.578 ( 13.744 9.550 14.662) 22.251 3.124 ( -3.919 -16.538 -6.575) 18.223 4.368 ( 5.780 4.414 -0.376) 7.282 4.665 ( 9.916 -6.697 -2.650) 12.256 4.827 ( 2.313 -5.042 1.253) 5.687 4.953 ( 10.591 -8.768 -6.538) 15.225 6.015 ( 6.458 11.799 1.187) 13.503 6.394 ( 7.008 -1.908 3.596) 8.105 6.512 ( 2.760 -4.766 -5.034) 7.461 6.872 ( 3.587 -3.890 -1.084) 5.401 7.025 ( -5.556 4.751 3.514) 8.111 7.160 ( -6.933 -1.953 -5.547) 9.091 7.299 ( 3.040 -5.064 5.603) 8.141 7.604 ( 1.996 1.647 3.556) 4.398 7.768 ( -7.030 -6.151 0.594) 9.360 7.900 ( -0.411 -6.570 -7.488) 9.970 8.164 ( 4.875 -11.623 -4.784) 13.481 8.241 ( 5.450 -11.537 -2.771) 13.057 8.479 ( -2.418 3.937 -0.886) 4.704 8.631 ( 10.017 -0.607 0.625) 10.054 8.730 ( -2.056 1.877 3.960) 4.841 8.863 ( -3.384 5.936 -0.134) 6.834 9.022 ( -2.784 9.547 4.034) 10.732 9.155 ( -3.389 -3.172 -5.582) 7.260 9.316 ( -3.119 -10.669 4.020) 11.820 9.346 ( -10.010 -1.122 2.345) 10.342 9.432 ( -9.550 3.323 -2.462) 10.407 9.685 ( 11.837 2.872 1.102) 12.231 9.766 ( 3.543 9.842 -0.908) 10.499 9.848 ( -3.896 7.291 0.137) 8.268 10.019 ( 9.111 4.911 4.050) 11.115 10.119 ( 0.901 -0.835 -2.245) 2.559 10.252 ( -4.796 8.840 -5.645) 11.533 10.404 ( 0.320 -2.086 -4.688) 5.141 10.865 ( 5.446 6.883 7.567) 11.589 11.132 ( -3.062 -4.071 -2.072) 5.500 11.230 ( -5.500 -3.116 -1.743) 6.557 11.470 ( 4.085 1.195 3.867) 5.751 11.642 ( 3.231 0.133 1.365) 3.510 11.747 ( -4.280 -5.608 1.107) 7.141 11.785 ( 1.074 -4.791 3.966) 6.312 11.854 ( -16.045 -14.815 2.656) 22.000 11.993 ( -10.100 -1.315 -1.456) 10.289 12.241 ( -3.414 2.497 -0.707) 4.288 12.327 ( -3.090 5.893 2.613) 7.149 12.529 ( 3.669 5.127 -0.515) 6.325 12.752 ( 0.342 -1.050 -2.988) 3.186 12.970 ( -2.419 14.360 3.084) 14.885 13.133 ( -1.965 -1.831 -2.105) 3.412 13.168 ( -1.405 5.001 -2.946) 5.972 13.350 ( -0.960 11.791 -0.282) 11.833 13.537 ( -2.350 -2.815 6.755) 7.686 13.980 ( 0.995 0.548 -1.117) 1.593 14.008 ( -2.380 -2.754 2.635) 4.493 14.604 ( -2.763 1.623 -2.933) 4.344 14.707 ( 1.528 2.731 -2.355) 3.917 15.503 ( -11.585 -18.790 14.269) 26.284 15.561 ( 12.776 3.888 -10.505) 16.991 15.769 ( 10.514 -6.440 1.319) 12.400 16.046 ( -2.489 5.840 -3.365) 7.185 16.246 ( -11.975 6.343 0.017) 13.552 16.820 ( -10.431 -2.918 -8.160) 13.561 17.701 ( 13.868 -2.608 -14.411) 20.169 18.090 ( -1.432 -9.555 7.556) 12.265 18.457 ( -1.821 -8.894 9.864) 13.405 18.515 ( -10.180 -10.114 3.432) 14.755 18.999 ( 8.871 12.867 -4.663) 16.310 19.187 ( 8.669 13.408 9.103) 18.379 20.271 ( 0.519 6.986 4.806) 8.495 20.717 ( 5.326 4.860 -5.752) 9.223 21.163 ( 0.030 0.925 5.841) 5.914 21.495 ( -2.424 -11.261 -11.223) 16.082 ======================= Grid point 169 (61/199) ======================= q-point: (-0.50 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.697 ( 10.459 17.536 17.125) 26.649 3.074 ( -11.753 -6.425 -9.198) 16.248 4.207 ( -12.408 11.829 -2.889) 17.385 4.795 ( -4.555 0.032 0.759) 4.618 4.844 ( -2.045 0.213 1.218) 2.390 5.125 ( 5.241 -3.387 -5.659) 8.423 5.904 ( -3.805 15.028 0.985) 15.534 6.477 ( 0.394 -0.258 1.702) 1.766 6.631 ( 7.022 -0.577 0.811) 7.092 6.856 ( -3.302 2.639 3.660) 5.591 6.936 ( 1.950 -0.067 -2.595) 3.247 7.191 ( 3.010 -7.532 -6.409) 10.337 7.440 ( 3.914 1.220 7.192) 8.279 7.607 ( 2.124 -7.246 -3.666) 8.394 7.849 ( 1.382 -6.918 0.196) 7.058 7.967 ( 2.637 -6.167 -8.299) 10.670 8.240 ( -12.350 -8.142 0.238) 14.794 8.260 ( -0.554 -1.925 -1.056) 2.264 8.357 ( -2.980 9.678 -2.113) 10.345 8.581 ( -1.402 9.527 -2.367) 9.916 8.760 ( 5.613 1.955 1.172) 6.058 8.809 ( -0.659 2.261 0.402) 2.389 8.907 ( -7.576 4.934 6.710) 11.258 9.143 ( -7.922 -5.742 -0.498) 9.797 9.160 ( -3.155 0.233 -4.629) 5.607 9.368 ( -1.136 -6.856 -1.364) 7.082 9.454 ( 3.477 -9.341 2.734) 10.336 9.737 ( 5.097 9.298 1.843) 10.763 9.750 ( 2.611 3.421 -1.159) 4.457 9.860 ( 4.227 3.121 5.315) 7.473 10.022 ( -3.058 0.599 2.705) 4.126 10.086 ( 2.374 -1.169 -4.093) 4.874 10.217 ( 4.620 8.421 -3.859) 10.351 10.480 ( 8.203 -1.445 -1.773) 8.516 10.881 ( 1.399 4.462 5.506) 7.223 11.204 ( 3.844 -4.828 -0.983) 6.249 11.239 ( 2.660 -4.199 -2.433) 5.534 11.503 ( 0.608 2.837 2.317) 3.713 11.669 ( -0.910 -0.722 0.176) 1.175 11.749 ( -8.465 -17.330 2.602) 19.461 11.789 ( -5.433 -11.098 1.189) 12.414 11.873 ( -5.783 -5.230 -0.645) 7.823 11.962 ( 8.340 -5.118 7.089) 12.083 12.170 ( 1.451 2.703 -3.419) 4.594 12.266 ( 1.863 4.775 2.016) 5.508 12.584 ( 5.883 0.523 -1.010) 5.992 12.812 ( 5.031 -2.260 -0.782) 5.570 12.863 ( 0.857 6.166 3.944) 7.369 13.074 ( -1.188 3.542 -6.871) 7.821 13.145 ( 1.916 0.833 -1.124) 2.372 13.292 ( 1.782 2.159 0.999) 2.972 13.544 ( -2.350 -2.440 5.735) 6.661 13.977 ( -3.034 -2.875 0.556) 4.216 14.025 ( 4.126 2.471 -0.731) 4.865 14.555 ( -2.397 -2.609 -2.525) 4.351 14.693 ( 0.117 1.891 -2.566) 3.190 15.503 ( -10.918 -11.627 11.004) 19.377 15.593 ( 3.344 5.440 -7.306) 9.704 15.907 ( -3.022 4.516 -2.819) 6.122 16.024 ( -5.894 4.188 5.886) 9.323 16.227 ( 19.614 -16.023 1.351) 25.363 16.604 ( -13.411 0.318 -8.483) 15.872 17.716 ( -0.673 7.821 -11.591) 13.999 18.085 ( -9.309 -2.486 5.569) 11.129 18.406 ( -14.277 -9.571 8.242) 19.062 18.610 ( 2.533 -9.591 -8.776) 13.245 19.075 ( 11.510 8.151 0.247) 14.106 19.260 ( 12.396 9.367 9.537) 18.230 20.233 ( 2.288 8.768 8.076) 12.138 20.670 ( -1.802 7.164 -4.333) 8.565 21.079 ( -6.997 5.354 2.392) 9.129 21.636 ( 6.978 -13.134 -9.051) 17.410 ======================= Grid point 170 (62/199) ======================= q-point: (-0.42 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.701 ( 6.233 21.605 19.009) 29.444 2.847 ( -14.343 0.226 -9.098) 16.987 3.763 ( -22.842 17.894 2.847) 29.156 4.496 ( -22.864 15.053 5.878) 27.998 4.667 ( -12.541 11.081 -5.183) 17.519 5.189 ( 3.066 -1.173 -10.723) 11.214 5.668 ( -5.824 18.507 1.341) 19.448 6.406 ( -4.716 1.983 -2.407) 5.653 6.599 ( -11.109 16.677 5.948) 20.903 6.933 ( 3.122 1.437 -1.347) 3.691 7.044 ( 8.791 -11.508 -0.084) 14.482 7.139 ( -17.651 9.183 -3.661) 20.231 7.272 ( -9.226 2.179 -0.616) 9.500 7.693 ( 1.407 -3.635 -1.918) 4.344 7.815 ( -1.158 4.566 -2.663) 5.411 8.067 ( -2.158 -7.769 2.081) 8.328 8.166 ( 8.011 3.383 0.422) 8.706 8.336 ( 7.005 -5.307 -9.075) 12.633 8.397 ( 9.162 -9.808 6.567) 14.942 8.570 ( 1.735 -0.550 -5.702) 5.985 8.697 ( -0.708 14.342 6.675) 15.835 8.812 ( -1.820 2.064 4.233) 5.049 8.878 ( 6.668 -4.344 -1.278) 8.061 9.071 ( -3.603 -8.642 -2.426) 9.672 9.181 ( 1.303 -5.343 -1.145) 5.618 9.402 ( -1.822 -6.567 -3.511) 7.666 9.535 ( 0.079 -4.659 -1.579) 4.920 9.687 ( 2.986 10.326 0.618) 10.767 9.845 ( -0.408 5.268 -0.848) 5.352 9.901 ( 5.246 -5.131 4.736) 8.734 9.983 ( -1.329 -2.404 6.874) 7.403 10.198 ( 1.931 -10.344 -0.762) 10.550 10.299 ( 13.309 -2.680 -1.886) 13.706 10.591 ( 2.555 -0.288 -1.858) 3.172 10.928 ( 5.559 -3.028 3.340) 7.157 11.227 ( -2.419 -0.852 -2.442) 3.542 11.334 ( 2.264 4.665 -1.916) 5.528 11.451 ( 1.089 1.096 0.863) 1.769 11.634 ( -4.266 -1.807 -3.498) 5.805 11.753 ( -1.382 1.717 3.448) 4.093 11.891 ( 3.704 -15.881 0.079) 16.308 11.980 ( 1.163 -20.610 3.550) 20.946 12.207 ( 10.457 -0.733 2.900) 10.877 12.235 ( 7.066 -6.762 -0.375) 9.787 12.313 ( 5.151 -0.264 4.589) 6.904 12.688 ( 5.097 -2.966 -2.553) 6.426 12.880 ( 2.639 0.211 4.650) 5.350 12.924 ( 4.578 -2.883 -0.797) 5.468 13.012 ( 0.892 3.984 -7.683) 8.701 13.234 ( 8.893 -2.432 1.233) 9.301 13.359 ( 4.408 -4.111 0.295) 6.034 13.533 ( -3.606 -2.712 4.850) 6.624 13.950 ( -2.525 -1.119 0.934) 2.916 14.080 ( 7.205 4.685 -3.538) 9.294 14.552 ( -2.152 -4.539 -2.909) 5.805 14.667 ( -1.662 -1.498 -0.744) 2.358 15.442 ( -7.615 -3.546 6.817) 10.818 15.556 ( -1.797 0.932 -6.417) 6.729 15.805 ( -4.151 3.294 -4.298) 6.823 15.922 ( -2.973 4.043 10.449) 11.592 16.340 ( -12.513 2.776 -4.079) 13.451 16.794 ( 24.282 -19.904 -0.839) 31.409 17.548 ( -3.521 12.743 -6.794) 14.864 17.897 ( -15.951 -1.688 0.175) 16.041 18.226 ( -14.990 1.635 5.023) 15.894 18.614 ( -2.500 2.766 -4.075) 5.523 19.068 ( 2.658 16.014 6.700) 17.561 19.577 ( 14.814 -17.102 -7.300) 23.775 20.255 ( 8.222 9.339 12.332) 17.519 20.514 ( -6.214 8.626 -2.391) 10.897 20.879 ( -9.289 8.631 4.989) 13.626 21.868 ( 8.967 -12.302 -10.732) 18.626 ======================= Grid point 171 (63/199) ======================= q-point: (-0.33 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.527 ( -15.394 2.477 -5.716) 16.607 2.657 ( 2.830 23.213 20.083) 30.825 3.169 ( -27.308 20.123 7.826) 34.813 3.864 ( -28.491 28.133 8.196) 40.870 4.223 ( -20.175 18.297 -8.757) 28.610 5.176 ( -0.239 3.922 -18.029) 18.452 5.339 ( -10.273 24.493 6.923) 27.448 5.716 ( -46.183 43.847 -5.374) 63.909 6.325 ( -7.428 2.049 -0.704) 7.738 6.762 ( -10.187 18.317 -0.655) 20.969 6.872 ( -12.337 -3.059 -0.638) 12.726 7.164 ( 2.158 -3.691 0.683) 4.330 7.414 ( 10.017 -13.911 3.275) 17.453 7.698 ( -3.693 10.267 1.323) 10.991 7.783 ( 6.096 -0.743 -5.843) 8.477 7.966 ( -10.183 -2.957 3.953) 11.316 8.303 ( 0.721 1.101 -6.247) 6.384 8.464 ( 11.445 -0.234 -4.955) 12.474 8.583 ( 1.242 6.406 4.219) 7.770 8.678 ( 3.384 -11.614 -1.271) 12.164 8.742 ( 13.598 -8.949 4.456) 16.878 8.831 ( 2.967 0.939 3.235) 4.489 9.102 ( 15.052 -2.882 0.113) 15.326 9.182 ( 6.724 -12.776 -1.073) 14.478 9.242 ( 4.014 3.065 -3.058) 5.904 9.479 ( 1.598 -10.600 -4.060) 11.463 9.592 ( -0.743 -5.961 0.918) 6.077 9.676 ( 6.090 0.968 0.966) 6.241 9.768 ( -2.539 3.400 0.477) 4.270 9.895 ( -7.347 -4.176 2.920) 8.941 10.165 ( 6.250 -9.882 2.288) 11.914 10.356 ( 4.191 -13.067 3.003) 14.047 10.592 ( 8.585 -6.672 -0.725) 10.897 10.663 ( 9.822 -12.982 -1.400) 16.339 11.019 ( -3.044 6.851 -6.446) 9.887 11.167 ( 3.867 -3.996 7.375) 9.236 11.347 ( 4.163 -1.004 -4.361) 6.112 11.497 ( 1.538 1.543 -0.064) 2.180 11.584 ( 0.777 -0.395 -3.435) 3.543 11.768 ( 1.322 -0.966 5.930) 6.152 12.116 ( 7.650 -8.336 0.089) 11.315 12.162 ( 4.743 -4.443 -1.711) 6.720 12.372 ( 6.598 -3.069 2.487) 7.690 12.429 ( 5.846 -12.879 0.497) 14.153 12.515 ( 8.008 -10.525 7.376) 15.143 12.755 ( 0.266 -3.362 -4.318) 5.479 12.940 ( 1.595 0.364 1.166) 2.009 12.997 ( 2.440 -2.068 -0.210) 3.205 13.027 ( 5.991 -1.049 -3.225) 6.884 13.459 ( 11.084 -4.064 1.773) 11.938 13.481 ( 1.378 -8.249 1.721) 8.539 13.546 ( 1.482 -5.746 3.104) 6.697 13.940 ( 2.262 1.233 -0.967) 2.752 14.141 ( 5.772 3.800 -3.703) 7.839 14.508 ( -4.973 -0.787 -4.820) 6.970 14.687 ( -1.370 -5.746 3.935) 7.098 15.378 ( -4.145 -0.158 5.699) 7.049 15.476 ( -3.639 0.497 -12.302) 12.838 15.659 ( -6.457 5.038 -6.296) 10.330 15.916 ( 0.071 1.630 16.142) 16.224 16.133 ( -7.577 4.213 1.759) 8.846 17.265 ( 2.207 8.086 -13.676) 16.040 17.410 ( 13.141 -10.159 -0.144) 16.610 17.615 ( -16.982 0.785 -3.055) 17.273 17.914 ( -17.666 8.762 4.983) 20.339 18.441 ( -8.290 16.075 3.519) 18.426 19.006 ( 1.976 5.595 7.468) 9.538 19.866 ( 6.284 -11.492 -12.870) 18.362 20.302 ( -7.802 9.529 -0.671) 12.334 20.378 ( 4.320 2.625 0.974) 5.148 20.726 ( 1.860 5.396 16.893) 17.831 22.079 ( 7.286 -10.266 -13.110) 18.176 ======================= Grid point 172 (64/199) ======================= q-point: (-0.25 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.220 ( -18.859 0.226 -2.467) 19.020 2.439 ( -14.872 25.664 33.619) 44.834 2.633 ( -11.624 20.824 5.571) 24.491 3.146 ( -23.022 33.170 9.047) 41.378 3.651 ( -20.004 22.770 -12.213) 32.677 4.310 ( -53.075 55.373 -3.514) 76.782 4.777 ( -18.070 43.955 2.195) 47.575 5.210 ( 0.871 -3.391 -16.686) 17.050 6.093 ( -11.011 9.243 -1.722) 14.479 6.426 ( -8.244 19.368 -1.396) 21.096 6.717 ( -9.700 -5.545 -0.246) 11.176 7.225 ( -0.924 -1.165 0.017) 1.487 7.406 ( -15.923 2.321 1.602) 16.170 7.729 ( 11.128 -3.496 3.475) 12.171 7.831 ( -0.592 -1.770 -2.737) 3.312 7.985 ( 5.316 -7.480 -1.672) 9.328 8.268 ( 1.550 2.582 -7.612) 8.186 8.559 ( 0.921 -2.589 -3.018) 4.082 8.596 ( 0.971 4.849 8.351) 9.705 8.820 ( -0.331 -10.244 -0.928) 10.291 8.860 ( 1.309 1.267 0.953) 2.056 8.995 ( 9.632 -2.426 0.988) 9.981 9.246 ( 4.536 9.221 -2.761) 10.641 9.373 ( 8.286 -10.851 -4.458) 14.363 9.470 ( 7.125 -8.791 3.552) 11.860 9.592 ( -8.129 -12.503 -3.374) 15.290 9.610 ( 9.259 0.429 5.051) 10.556 9.694 ( -0.153 -1.219 3.592) 3.796 9.872 ( 5.220 -6.843 -3.634) 9.342 9.900 ( 8.690 -3.989 2.814) 9.967 10.257 ( -4.001 -5.391 -1.568) 6.895 10.630 ( 10.185 -14.998 5.657) 18.992 10.801 ( 4.288 -6.291 -5.142) 9.187 10.925 ( 7.887 -4.009 -0.969) 8.900 11.044 ( 13.939 -16.974 -0.611) 21.972 11.309 ( 1.816 -2.985 1.730) 3.899 11.389 ( 0.385 -3.565 -6.034) 7.019 11.526 ( 6.166 -1.687 -0.659) 6.427 11.673 ( 7.947 -0.915 -0.168) 8.001 11.828 ( 1.270 -3.766 5.170) 6.521 12.190 ( 0.044 -3.049 -3.166) 4.395 12.332 ( 7.278 1.799 4.367) 8.676 12.485 ( 6.524 -1.539 -0.987) 6.776 12.636 ( 2.904 -7.865 -4.126) 9.344 12.679 ( -0.991 -7.756 2.313) 8.154 12.827 ( 3.848 -9.272 3.780) 10.727 12.953 ( 1.491 -0.499 0.662) 1.706 13.061 ( -2.834 -8.259 2.632) 9.120 13.156 ( 12.037 3.448 -2.127) 12.700 13.581 ( 1.308 0.046 2.548) 2.864 13.608 ( 4.558 -11.397 2.397) 12.506 13.749 ( 6.910 -14.410 1.983) 16.104 14.011 ( 6.791 -0.190 -2.372) 7.196 14.155 ( -1.365 0.042 -2.198) 2.588 14.396 ( -5.470 1.331 -4.921) 7.477 14.716 ( -0.152 1.062 4.922) 5.038 15.331 ( -11.812 -8.524 0.817) 14.589 15.371 ( 3.358 5.869 -13.996) 15.544 15.489 ( -2.117 10.706 -1.429) 11.007 15.970 ( 1.952 1.718 16.188) 16.396 16.015 ( -3.474 4.169 3.934) 6.703 16.954 ( -12.327 15.087 -12.726) 23.271 17.311 ( -13.146 8.178 3.616) 15.899 17.507 ( -14.637 13.666 2.319) 20.159 17.845 ( 11.862 -15.601 -16.140) 25.389 18.069 ( -12.501 25.079 4.183) 28.333 19.081 ( 3.601 -3.386 14.092) 14.934 19.966 ( 2.303 -1.002 -6.439) 6.911 20.088 ( -6.474 9.235 0.341) 11.283 20.275 ( -4.426 4.334 -6.270) 8.814 20.969 ( 12.024 -8.607 14.175) 20.484 22.206 ( 3.035 -6.730 -17.314) 18.822 ======================= Grid point 173 (65/199) ======================= q-point: (-0.17 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.831 ( -25.535 10.626 38.583) 47.472 2.127 ( -11.260 11.269 2.935) 16.198 2.174 ( -20.214 28.843 23.481) 42.331 2.663 ( -5.110 21.792 0.124) 22.384 2.873 ( -34.599 71.843 2.499) 79.779 3.140 ( -12.024 25.469 -12.855) 30.959 3.992 ( -20.749 49.536 -1.371) 53.723 5.243 ( 3.821 -6.543 -21.058) 22.379 5.872 ( -1.951 12.595 -0.802) 12.771 6.097 ( -9.976 14.474 -0.947) 17.604 6.669 ( -1.190 -2.540 -0.508) 2.851 6.990 ( -16.893 5.510 -0.808) 17.787 7.324 ( -1.830 -5.110 1.576) 5.651 7.846 ( -0.493 -3.036 -1.018) 3.240 7.913 ( 8.282 -0.547 1.531) 8.440 8.088 ( -5.491 -5.615 -1.537) 8.002 8.251 ( 1.566 -0.677 -10.675) 10.810 8.503 ( -8.520 -7.666 0.827) 11.491 8.620 ( 5.996 7.047 2.934) 9.706 8.842 ( -2.596 0.575 -0.836) 2.787 8.879 ( 1.368 -1.323 5.645) 5.958 9.091 ( -1.075 2.641 1.815) 3.380 9.201 ( 4.074 7.889 -5.330) 10.356 9.450 ( -1.256 -3.892 -0.540) 4.125 9.609 ( 1.249 0.329 -4.422) 4.606 9.648 ( 0.677 -9.034 0.712) 9.087 9.685 ( 3.526 -4.204 -0.974) 5.572 9.807 ( 2.809 -2.020 4.402) 5.599 10.006 ( 4.944 -2.498 -5.009) 7.468 10.176 ( 7.522 -4.715 -1.222) 8.961 10.226 ( 8.260 -1.793 8.170) 11.755 10.822 ( 2.806 3.700 -14.069) 14.815 10.953 ( 5.888 -14.940 5.431) 16.952 11.147 ( -5.743 -10.880 -15.744) 19.981 11.284 ( 4.781 -7.955 -4.685) 10.397 11.399 ( 8.027 -15.699 0.671) 17.645 11.514 ( 4.527 -10.723 4.184) 12.368 11.712 ( 9.522 -4.512 0.340) 10.543 11.797 ( 4.866 -0.932 6.686) 8.322 11.933 ( 3.381 -7.892 0.628) 8.609 12.199 ( 0.128 -0.175 -2.524) 2.533 12.351 ( 0.608 5.862 4.356) 7.329 12.523 ( -2.594 -2.005 -3.087) 4.504 12.746 ( 0.014 -3.620 1.485) 3.912 12.748 ( 8.473 -2.606 -3.387) 9.489 12.946 ( 0.097 -5.157 6.028) 7.934 13.025 ( 1.432 -5.532 2.077) 6.080 13.105 ( 1.136 -4.381 5.314) 6.980 13.334 ( 9.982 -2.119 -1.725) 10.349 13.566 ( -3.919 -1.229 3.862) 5.637 13.851 ( 7.649 -10.603 3.451) 13.522 14.004 ( 5.737 -14.197 1.774) 15.415 14.079 ( -4.131 -4.041 -2.460) 6.281 14.116 ( -0.724 -7.452 -0.683) 7.518 14.311 ( -2.592 -1.183 -4.354) 5.204 14.683 ( 4.446 14.685 -0.231) 15.345 15.175 ( -11.820 -7.833 -4.611) 14.911 15.369 ( 0.502 4.269 3.434) 5.502 15.416 ( 8.274 10.811 -10.337) 17.094 15.898 ( -3.923 13.631 5.699) 15.287 16.034 ( -0.453 -1.984 10.212) 10.413 16.607 ( -8.057 7.817 -8.184) 13.892 17.019 ( -13.069 11.264 11.488) 20.728 17.202 ( -3.956 15.851 -2.156) 16.479 17.563 ( -14.765 28.222 -0.694) 31.859 18.039 ( 3.011 -6.141 -30.545) 31.301 19.234 ( 2.227 -5.426 18.672) 19.571 19.898 ( -3.992 5.839 0.276) 7.078 19.942 ( -2.276 7.159 -0.633) 7.538 20.234 ( 3.408 -0.280 -8.285) 8.963 21.249 ( 5.362 -10.993 7.654) 14.428 22.179 ( -2.418 1.688 -24.410) 24.587 ======================= Grid point 174 (66/199) ======================= q-point: (-0.08 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.162 ( -43.596 41.504 15.646) 62.193 1.549 ( -7.562 15.154 53.359) 55.982 2.034 ( 12.014 38.505 13.186) 42.436 2.200 ( 11.036 30.687 21.464) 39.041 2.471 ( 2.381 17.105 -0.259) 17.272 2.869 ( 13.508 20.747 -16.045) 29.502 3.230 ( -13.482 42.222 -8.920) 45.211 5.316 ( 4.239 -7.095 -25.183) 26.505 5.761 ( 2.239 13.186 0.103) 13.376 5.878 ( -1.628 7.614 -0.086) 7.787 6.679 ( -5.033 6.775 -0.296) 8.445 6.753 ( 3.113 -2.176 -0.721) 3.866 7.353 ( -0.736 -2.212 1.787) 2.938 7.781 ( -5.832 1.186 -1.259) 6.083 7.977 ( -6.458 -2.237 -3.758) 7.800 8.053 ( 9.669 4.304 0.506) 10.595 8.256 ( -2.696 -2.840 -9.650) 10.414 8.504 ( 0.692 -7.598 -4.469) 8.842 8.635 ( 0.793 4.910 2.561) 5.594 8.781 ( -1.554 1.462 -0.588) 2.213 8.928 ( -0.015 5.467 5.672) 7.878 8.984 ( -1.777 2.898 -0.208) 3.406 9.211 ( 5.115 6.341 -1.508) 8.285 9.373 ( 2.159 24.113 -18.690) 30.585 9.559 ( -1.534 4.029 3.688) 5.673 9.699 ( -1.348 -5.388 1.280) 5.699 9.732 ( -2.367 -1.478 -0.491) 2.834 9.867 ( 2.657 -5.055 -1.475) 5.898 9.985 ( -9.411 4.047 -7.628) 12.773 10.296 ( 4.299 -7.840 6.772) 11.217 10.465 ( 0.478 -2.730 2.141) 3.502 10.640 ( 7.489 16.907 -21.455) 28.324 10.989 ( -2.990 -4.227 -10.375) 11.595 11.209 ( -0.801 -13.880 -2.531) 14.131 11.392 ( -5.021 -9.611 -2.258) 11.076 11.620 ( 1.142 -11.839 4.619) 12.760 11.679 ( -2.432 -11.180 4.364) 12.246 11.823 ( -0.960 -3.606 0.976) 3.857 11.874 ( -4.613 -6.603 5.770) 9.908 12.029 ( -1.642 -5.058 -0.739) 5.369 12.173 ( 0.720 4.370 -0.563) 4.465 12.337 ( 3.200 5.056 6.577) 8.892 12.591 ( 7.508 -6.974 -4.997) 11.401 12.780 ( 0.363 -2.694 1.114) 2.938 12.848 ( 3.099 0.985 -4.015) 5.167 13.002 ( -0.545 -5.601 3.602) 6.681 13.040 ( -5.485 -0.538 2.117) 5.903 13.251 ( 5.459 -7.066 10.575) 13.841 13.415 ( -4.884 -1.358 2.235) 5.540 13.545 ( 0.342 -4.036 0.607) 4.096 13.948 ( 0.605 -3.739 2.977) 4.818 14.150 ( -4.258 -9.592 -2.170) 10.717 14.184 ( 2.016 -11.603 1.938) 11.935 14.217 ( 3.625 -10.438 0.030) 11.050 14.317 ( 2.363 -4.170 -2.528) 5.419 14.576 ( -0.549 12.468 -5.961) 13.830 15.153 ( 4.393 -1.764 2.783) 5.491 15.337 ( -2.365 2.263 -1.596) 3.642 15.388 ( 1.695 8.485 -8.729) 12.290 15.675 ( 1.004 18.242 -1.142) 18.305 16.071 ( 1.540 0.575 12.293) 12.403 16.553 ( 2.608 -1.607 0.197) 3.069 16.813 ( -3.372 6.178 8.246) 10.841 17.022 ( -2.828 17.283 -0.924) 17.537 17.092 ( -2.788 25.410 -4.303) 25.922 17.880 ( -0.028 15.408 -41.597) 44.359 19.315 ( -1.970 -0.248 16.225) 16.346 19.812 ( -0.000 4.448 0.862) 4.531 19.861 ( 0.564 5.772 -0.279) 5.807 20.269 ( 2.078 -0.491 -8.359) 8.627 21.386 ( -2.245 -8.681 4.179) 9.893 21.986 ( 3.898 17.331 -24.436) 30.211 ======================= Grid point 177 (67/199) ======================= q-point: ( 0.17 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.205 ( 8.432 -0.000 4.617) 9.614 2.366 ( 3.331 -0.000 -6.505) 7.309 3.408 ( 33.540 -0.000 28.044) 43.719 3.699 ( 32.775 -0.000 -10.466) 34.406 4.027 ( 34.269 -0.000 10.830) 35.939 4.895 ( -0.481 0.000 -28.821) 28.825 5.313 ( 60.240 -0.000 -2.707) 60.301 5.715 ( 36.501 -0.000 9.084) 37.615 6.139 ( 3.109 -0.000 0.946) 3.249 6.263 ( 5.822 -0.000 -2.691) 6.414 7.082 ( 8.399 -0.000 -3.903) 9.262 7.169 ( 0.528 -0.000 0.477) 0.712 7.449 ( -9.539 0.000 1.011) 9.592 7.454 ( -4.573 0.000 -2.000) 4.991 7.584 ( 2.674 -0.000 3.430) 4.349 7.716 ( 3.745 -0.000 -10.529) 11.175 7.921 ( -5.844 0.000 -6.536) 8.768 8.021 ( 0.442 -0.000 7.699) 7.711 8.606 ( -3.908 0.000 0.410) 3.929 8.709 ( -13.365 0.000 3.555) 13.830 9.063 ( 1.663 -0.000 10.060) 10.196 9.089 ( -0.973 0.000 -2.068) 2.286 9.199 ( -8.927 0.000 3.200) 9.483 9.222 ( -5.821 0.000 -1.675) 6.057 9.397 ( -6.098 0.000 -4.297) 7.460 9.466 ( 9.584 -0.000 -3.034) 10.052 9.486 ( -2.363 0.000 -1.499) 2.799 9.808 ( -0.711 0.000 -3.633) 3.702 9.859 ( -3.515 0.000 -0.057) 3.516 10.111 ( -13.388 0.000 -6.928) 15.074 10.230 ( -14.564 0.000 -5.077) 15.423 10.378 ( -21.411 0.000 9.557) 23.447 10.666 ( -14.856 0.000 3.327) 15.224 10.811 ( -4.036 0.000 2.837) 4.933 10.969 ( -9.863 0.000 -4.065) 10.667 11.274 ( 6.624 -0.000 1.598) 6.814 11.316 ( 14.681 -0.000 -0.151) 14.681 11.409 ( 0.023 -0.000 0.533) 0.533 11.599 ( -9.539 0.000 -0.406) 9.548 11.621 ( -9.272 0.000 0.056) 9.272 11.937 ( -4.578 0.000 1.080) 4.703 12.175 ( -19.923 0.000 1.194) 19.959 12.420 ( -11.287 0.000 1.858) 11.439 12.431 ( -14.141 0.000 4.426) 14.818 12.536 ( 1.955 -0.000 1.989) 2.789 12.728 ( -7.311 0.000 -9.883) 12.293 12.914 ( 2.692 -0.000 2.442) 3.635 13.030 ( -5.159 0.000 -0.615) 5.195 13.307 ( -2.210 0.000 1.223) 2.525 13.501 ( -1.831 0.000 4.492) 4.850 13.735 ( -9.446 0.000 5.220) 10.792 13.852 ( -4.229 0.000 -0.371) 4.245 14.120 ( -5.083 0.000 3.214) 6.014 14.134 ( -2.349 0.000 3.200) 3.970 14.677 ( 8.929 -0.000 -10.670) 13.914 14.809 ( 2.786 -0.000 -1.195) 3.031 15.128 ( -4.542 0.000 4.632) 6.487 15.174 ( -7.929 0.000 4.603) 9.168 15.703 ( 11.133 -0.000 -8.595) 14.065 16.216 ( 12.565 -0.000 -20.795) 24.296 16.538 ( 3.246 -0.000 1.243) 3.476 17.060 ( -0.092 0.000 -0.815) 0.820 17.166 ( -5.565 0.000 2.560) 6.125 17.347 ( 10.035 -0.000 8.981) 13.467 18.148 ( 21.555 -0.000 -0.365) 21.558 18.205 ( 21.664 -0.000 8.608) 23.312 19.189 ( -6.985 0.000 12.366) 14.202 19.602 ( -19.188 0.000 -10.325) 21.789 20.250 ( 10.786 -0.000 -1.441) 10.882 20.383 ( 15.106 -0.000 -2.757) 15.355 21.091 ( -2.861 0.000 17.911) 18.138 21.630 ( -11.398 0.000 -22.665) 25.370 ======================= Grid point 178 (68/199) ======================= q-point: ( 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.396 ( 15.540 1.822 5.359) 16.538 2.523 ( 6.570 -15.439 -4.439) 17.357 4.006 ( 27.678 -1.058 23.735) 36.477 4.225 ( 29.288 -4.601 -8.811) 30.929 4.491 ( 18.029 -2.097 3.746) 18.533 4.796 ( -1.126 -0.215 -24.646) 24.672 6.044 ( 21.881 1.318 -7.507) 23.170 6.192 ( 21.169 6.158 5.132) 22.636 6.284 ( 12.529 -2.707 3.165) 13.203 6.458 ( 15.408 -14.385 2.459) 21.222 7.053 ( -3.980 4.042 -1.835) 5.962 7.200 ( -5.322 -6.299 -5.690) 10.019 7.324 ( -3.776 -1.158 4.954) 6.336 7.396 ( -3.685 -4.250 4.929) 7.479 7.683 ( 5.961 -4.101 2.881) 7.788 7.787 ( -2.232 -1.705 -9.663) 10.063 7.941 ( 14.635 -0.258 -8.357) 16.855 8.003 ( -5.809 1.460 6.050) 8.513 8.546 ( -2.951 1.484 2.353) 4.056 8.560 ( -1.180 1.378 1.028) 2.085 8.920 ( -10.723 6.438 1.466) 12.593 9.044 ( -9.369 -5.427 2.788) 11.181 9.106 ( -0.605 3.034 -0.678) 3.167 9.183 ( -3.727 -2.940 -5.330) 7.138 9.351 ( 0.037 -2.251 4.000) 4.590 9.445 ( -4.150 -0.843 1.309) 4.433 9.618 ( -4.787 1.944 -9.367) 10.698 9.661 ( 7.032 8.655 -0.332) 11.156 9.843 ( 4.765 2.548 0.012) 5.404 9.994 ( -1.862 1.972 -1.976) 3.356 10.059 ( -6.032 -4.196 1.090) 7.428 10.127 ( -10.017 0.268 4.855) 11.135 10.376 ( -13.943 -0.057 -2.446) 14.156 10.712 ( -10.502 4.070 -3.998) 11.951 10.916 ( 6.620 4.172 7.212) 10.642 11.304 ( -4.277 5.931 -0.336) 7.320 11.361 ( -0.486 2.968 0.611) 3.069 11.442 ( -6.843 -1.352 -0.261) 6.980 11.486 ( -3.197 -5.654 1.247) 6.614 11.583 ( 4.285 -4.502 -0.491) 6.235 11.803 ( -9.227 1.035 -1.761) 9.450 11.890 ( -18.047 -4.894 2.080) 18.815 12.231 ( -11.653 1.057 2.886) 12.051 12.266 ( -6.048 -0.341 4.401) 7.488 12.553 ( -7.416 2.154 -7.720) 10.920 12.582 ( 3.141 2.159 -0.136) 3.814 12.905 ( -7.085 3.350 -1.691) 8.017 12.995 ( 2.287 -3.690 2.902) 5.222 13.260 ( -2.632 2.150 0.197) 3.405 13.462 ( -3.021 1.000 4.951) 5.885 13.591 ( -7.805 4.863 5.006) 10.471 13.748 ( -6.363 3.797 -0.658) 7.439 14.023 ( -5.907 1.473 3.859) 7.208 14.073 ( -1.198 6.078 1.527) 6.381 14.755 ( -4.581 3.010 -1.712) 5.742 14.778 ( 6.999 3.948 -6.103) 10.091 15.114 ( -7.407 -12.116 4.903) 15.024 15.174 ( 3.003 -7.767 4.974) 9.700 15.819 ( 8.892 4.639 -9.835) 14.046 16.283 ( 6.880 9.486 -14.867) 18.930 16.598 ( -2.690 -3.144 -9.778) 10.617 16.790 ( -14.158 -5.268 -8.574) 17.370 17.304 ( 12.206 3.882 13.021) 18.265 17.597 ( 4.409 -15.974 8.206) 18.492 18.395 ( 5.906 1.471 9.896) 11.618 18.483 ( 5.306 0.398 7.013) 8.803 19.161 ( 4.387 3.964 1.775) 6.173 19.328 ( -6.380 1.799 -1.381) 6.771 20.401 ( 9.328 4.921 -1.012) 10.595 20.620 ( 14.563 -0.536 -5.636) 15.625 21.113 ( -0.543 0.825 16.069) 16.099 21.395 ( -11.853 -6.295 -20.402) 24.420 ======================= Grid point 179 (69/199) ======================= q-point: ( 0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.705 ( 16.868 -3.074 5.655) 18.054 2.775 ( 8.185 -10.474 -2.419) 13.511 4.453 ( 17.129 1.978 13.508) 21.904 4.554 ( 8.232 -1.585 -6.273) 10.470 4.734 ( -0.358 -3.702 -8.198) 9.002 4.795 ( 15.068 -7.778 -7.182) 18.415 6.239 ( 12.893 4.001 -3.610) 13.974 6.356 ( 4.371 3.473 2.471) 6.105 6.482 ( 10.990 5.203 1.206) 12.219 6.804 ( 8.976 -6.093 -0.087) 10.848 7.008 ( -2.509 -6.125 -4.772) 8.160 7.108 ( -7.257 -0.413 0.786) 7.311 7.262 ( -6.499 -3.527 5.013) 8.934 7.477 ( 3.655 -6.999 9.766) 12.558 7.764 ( -2.727 -5.178 -10.352) 11.892 7.805 ( -5.076 3.270 0.735) 6.083 7.887 ( 0.691 -10.490 1.588) 10.633 8.137 ( 8.217 -2.435 -7.162) 11.169 8.548 ( 2.381 2.765 0.395) 3.670 8.637 ( 10.048 0.040 1.505) 10.160 8.737 ( -6.648 0.904 2.986) 7.344 8.949 ( -5.953 -0.756 1.153) 6.111 9.040 ( -4.056 -4.032 -5.916) 8.228 9.148 ( -1.632 0.821 -0.867) 2.022 9.276 ( -7.689 4.706 1.042) 9.075 9.356 ( -4.462 3.210 8.383) 10.024 9.472 ( -6.639 0.213 -4.045) 7.777 9.743 ( 6.615 5.540 -2.293) 8.928 9.921 ( -1.032 4.352 -2.700) 5.224 9.955 ( -0.129 3.707 -1.180) 3.892 10.047 ( 9.244 -1.169 2.912) 9.762 10.150 ( 11.172 3.257 2.299) 11.862 10.292 ( -1.677 -7.127 -1.456) 7.465 10.466 ( -7.745 7.903 -7.462) 13.346 11.010 ( 6.641 7.133 7.169) 12.099 11.125 ( -11.996 4.668 -1.462) 12.955 11.169 ( -10.492 -2.777 1.678) 10.982 11.467 ( 3.215 -2.316 0.607) 4.009 11.525 ( -7.076 -8.090 3.205) 11.216 11.635 ( -9.964 -8.463 -0.307) 13.077 11.674 ( -1.934 -1.169 0.902) 2.434 11.737 ( -0.419 -2.292 1.836) 2.966 12.020 ( -9.871 4.217 -0.529) 10.747 12.254 ( -0.581 -2.067 4.052) 4.586 12.392 ( -6.142 1.774 -6.076) 8.820 12.615 ( 2.070 3.366 1.013) 4.079 12.748 ( -5.019 2.363 -3.592) 6.609 13.061 ( -0.067 -3.776 1.551) 4.083 13.191 ( -1.514 3.806 0.157) 4.100 13.350 ( -5.982 12.687 1.105) 14.070 13.478 ( -3.586 -2.026 6.822) 7.968 13.573 ( -6.410 8.358 -0.840) 10.567 13.943 ( -5.200 -2.161 2.697) 6.243 14.033 ( 2.986 4.789 0.680) 5.685 14.617 ( -7.593 0.464 -1.922) 7.846 14.821 ( 6.197 8.552 -3.575) 11.150 15.140 ( -10.220 -17.817 12.098) 23.838 15.406 ( 11.204 -13.321 1.623) 17.482 15.851 ( 5.476 6.800 -11.402) 14.361 16.214 ( 2.518 11.575 -10.685) 15.953 16.355 ( -14.266 5.209 -0.556) 15.198 16.729 ( -6.077 -7.159 -10.760) 14.281 17.576 ( 14.868 -7.386 -1.002) 16.632 17.811 ( 0.172 -16.197 8.178) 18.145 18.376 ( -11.439 -1.045 14.152) 18.227 18.400 ( -11.540 -2.402 0.996) 11.830 19.248 ( 13.294 10.842 -6.218) 18.246 19.387 ( 12.223 7.173 11.636) 18.337 20.442 ( 4.911 10.517 2.167) 11.808 20.811 ( 10.988 3.536 -9.840) 15.168 21.145 ( -0.787 -2.814 10.208) 10.618 21.265 ( -7.207 -10.969 -13.513) 18.838 ======================= Grid point 180 (70/199) ======================= q-point: (-0.58 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.895 ( -3.182 -10.622 -7.467) 13.368 2.998 ( 17.278 12.245 11.387) 24.045 4.426 ( -6.556 10.859 -1.843) 12.818 4.730 ( -2.386 -6.049 -5.099) 8.263 4.784 ( 7.641 -4.768 6.691) 11.220 5.056 ( 9.679 -3.602 -5.886) 11.887 6.234 ( -0.235 18.158 0.936) 18.183 6.461 ( 7.309 -2.825 2.966) 8.378 6.580 ( 5.510 0.129 -4.975) 7.425 6.937 ( 3.971 0.732 -1.360) 4.261 6.968 ( -8.506 1.068 4.782) 9.816 7.037 ( 3.079 -4.440 -4.183) 6.833 7.290 ( 2.037 -9.662 2.714) 10.241 7.578 ( -7.578 -5.154 2.079) 9.397 7.720 ( 7.439 -2.240 4.694) 9.077 7.813 ( 2.417 -6.337 -7.212) 9.901 7.978 ( -8.506 -15.388 -0.241) 17.584 8.218 ( 1.087 -2.489 -7.258) 7.749 8.537 ( 0.698 4.226 -1.474) 4.530 8.670 ( -3.022 -0.052 5.481) 6.259 8.786 ( 4.897 3.661 -1.513) 6.298 8.853 ( -1.959 3.931 -0.354) 4.406 9.020 ( -5.925 -2.359 0.259) 6.382 9.103 ( -2.707 3.652 -0.404) 4.564 9.176 ( -5.265 -3.351 1.884) 6.519 9.311 ( 6.992 3.697 1.131) 7.990 9.337 ( -5.399 1.078 0.113) 5.507 9.793 ( -1.962 2.137 -2.939) 4.130 9.807 ( 3.300 -2.274 0.190) 4.012 9.986 ( 5.005 10.179 -0.178) 11.344 10.092 ( -6.533 8.082 -3.607) 11.000 10.191 ( 6.453 6.814 1.226) 9.464 10.317 ( -2.853 -1.716 -1.480) 3.643 10.493 ( 13.989 4.116 0.795) 14.604 10.968 ( -3.407 -1.634 1.854) 4.209 11.066 ( -1.024 -12.320 -0.519) 12.374 11.112 ( 1.113 -0.853 4.562) 4.773 11.386 ( -12.973 -8.215 0.419) 15.361 11.539 ( 1.340 -1.178 1.236) 2.170 11.613 ( -3.973 -8.079 1.687) 9.160 11.667 ( -1.333 -0.131 -0.663) 1.495 11.837 ( -2.487 -3.096 1.811) 4.365 11.902 ( 6.572 0.410 2.867) 7.182 12.241 ( 0.236 3.955 -5.602) 6.861 12.305 ( -3.037 -1.106 3.109) 4.485 12.586 ( 0.312 -0.088 -2.803) 2.822 12.734 ( 1.599 -1.899 -0.244) 2.495 13.057 ( -3.398 -1.431 -0.162) 3.690 13.136 ( 0.477 15.119 1.615) 15.212 13.181 ( 1.591 0.935 -1.561) 2.417 13.404 ( -3.860 7.320 -0.221) 8.279 13.478 ( -3.239 -3.878 5.238) 7.278 13.905 ( -3.689 -3.776 2.852) 6.000 14.083 ( 7.555 3.713 -1.885) 8.626 14.499 ( -6.987 -2.848 -2.442) 7.931 14.797 ( 2.432 8.650 -4.478) 10.039 15.172 ( -11.602 -17.196 17.014) 26.828 15.773 ( 14.349 -2.270 -8.603) 16.884 15.824 ( 3.695 -6.533 -2.581) 7.937 16.111 ( -1.154 7.673 -1.868) 7.981 16.127 ( -5.032 5.895 -0.090) 7.751 16.601 ( -9.821 -0.770 -7.777) 12.551 17.790 ( 4.655 -0.584 -9.269) 10.388 17.965 ( -4.024 -12.186 9.431) 15.926 18.190 ( -16.767 -6.137 9.729) 20.333 18.354 ( 1.435 -14.199 -4.550) 14.979 19.299 ( 9.463 14.452 -6.854) 18.584 19.530 ( 10.319 13.587 14.068) 22.113 20.417 ( 3.781 10.501 8.000) 13.732 20.818 ( 0.801 7.658 -7.576) 10.802 21.146 ( -4.558 1.672 3.620) 6.056 21.342 ( 4.661 -16.934 -10.292) 20.357 ======================= Grid point 181 (71/199) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.812 ( -9.913 -1.106 -7.594) 12.536 3.116 ( 10.718 18.146 11.676) 24.093 4.093 ( -18.102 16.456 5.264) 25.024 4.669 ( -8.835 3.165 2.113) 9.620 4.831 ( -3.922 5.066 -1.106) 6.502 5.165 ( 4.352 -1.234 -9.556) 10.573 6.030 ( -1.592 18.384 0.869) 18.473 6.459 ( -4.271 4.833 2.526) 6.927 6.778 ( 12.783 -6.333 0.701) 14.283 6.832 ( -5.226 4.720 2.740) 7.557 6.976 ( 3.242 -0.322 -1.384) 3.540 7.111 ( -3.745 -5.512 -6.786) 9.510 7.422 ( -6.415 3.505 -1.784) 7.525 7.521 ( 0.122 -12.519 -1.703) 12.635 7.863 ( 4.259 0.196 0.674) 4.316 7.939 ( -4.522 -9.244 -2.599) 10.614 7.977 ( 2.147 -13.472 1.421) 13.716 8.184 ( -2.386 -6.040 -1.333) 6.630 8.481 ( 2.269 11.100 -3.658) 11.906 8.636 ( -6.475 -9.176 -1.544) 11.336 8.705 ( 3.443 6.988 3.631) 8.595 8.887 ( -0.691 3.544 1.372) 3.862 8.939 ( -1.405 7.162 2.566) 7.737 9.021 ( -3.148 1.391 0.506) 3.478 9.108 ( 1.539 -2.744 -0.411) 3.173 9.312 ( 0.114 -4.112 2.791) 4.971 9.436 ( 2.706 -1.802 -6.576) 7.336 9.820 ( 2.723 -2.711 2.389) 4.525 9.881 ( 1.141 1.638 6.864) 7.148 9.913 ( -0.404 0.279 -3.178) 3.216 9.949 ( -2.376 7.016 -1.260) 7.514 10.154 ( -2.147 5.943 1.620) 6.523 10.292 ( 3.627 1.141 -4.328) 5.761 10.609 ( 0.991 1.707 0.833) 2.142 10.934 ( 1.110 2.395 3.442) 4.338 11.200 ( 2.539 -5.083 -2.885) 6.372 11.314 ( 8.483 -10.770 2.355) 13.910 11.395 ( 4.838 -16.522 2.466) 17.391 11.530 ( -1.989 4.325 1.292) 4.933 11.591 ( -4.763 -5.621 -1.821) 7.590 11.687 ( 0.492 -9.239 -1.547) 9.380 11.779 ( -3.124 -0.868 -0.392) 3.265 12.115 ( 10.023 -4.370 7.213) 13.099 12.222 ( 3.675 1.248 -8.764) 9.585 12.315 ( 1.374 -1.063 5.135) 5.421 12.635 ( 3.134 -3.160 -2.411) 5.062 12.777 ( -0.104 -4.007 1.737) 4.368 13.018 ( 0.873 2.900 0.330) 3.047 13.074 ( 2.736 4.670 -2.368) 5.907 13.247 ( 6.854 2.236 0.636) 7.238 13.327 ( 0.329 0.884 -0.038) 0.944 13.464 ( -4.328 -3.931 4.432) 7.336 13.914 ( -0.004 -2.411 3.318) 4.102 14.172 ( 8.543 4.989 -5.411) 11.276 14.433 ( -5.666 -7.241 -1.910) 9.391 14.721 ( -1.112 6.085 -4.951) 7.923 15.185 ( -10.962 -14.159 17.517) 25.050 15.722 ( 2.034 8.203 -12.724) 15.276 15.940 ( 0.947 9.741 -7.547) 12.359 16.014 ( -1.517 5.183 7.200) 9.000 16.352 ( 10.044 -15.692 1.927) 18.731 16.426 ( -0.822 -3.670 -0.268) 3.771 17.734 ( -2.953 7.082 -3.576) 8.466 17.873 ( -14.572 -0.956 0.484) 14.612 18.073 ( -11.590 -12.512 9.350) 19.450 18.601 ( 9.338 -11.255 -15.441) 21.267 19.282 ( 4.425 6.827 -2.628) 8.549 19.534 ( 3.577 14.721 9.900) 18.097 20.436 ( 5.768 9.085 13.388) 17.177 20.691 ( -3.993 9.127 -3.096) 10.432 21.013 ( -8.027 5.391 3.022) 10.130 21.586 ( 8.283 -16.542 -12.545) 22.353 ======================= Grid point 182 (72/199) ======================= q-point: (-0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.577 ( -12.857 4.411 -7.295) 15.427 3.100 ( 5.798 19.792 10.728) 23.247 3.565 ( -26.054 21.866 13.664) 36.656 4.346 ( -17.112 21.463 8.309) 28.680 4.575 ( -11.567 16.763 -7.304) 21.637 5.177 ( 0.737 -0.405 -14.034) 14.059 5.840 ( 0.406 23.168 2.404) 23.296 6.348 ( -6.647 2.140 2.803) 7.525 6.500 ( -21.627 33.077 -5.770) 39.938 6.821 ( -18.862 1.114 -4.159) 19.347 7.053 ( 1.416 3.362 -2.928) 4.678 7.117 ( 10.297 -14.028 2.592) 17.594 7.128 ( -7.113 5.550 1.041) 9.082 7.678 ( 3.988 -6.879 -2.588) 8.362 7.830 ( -10.713 -3.610 2.820) 11.651 7.924 ( 0.876 2.673 -0.485) 2.855 8.199 ( 4.317 -15.502 -3.586) 16.487 8.357 ( 2.632 -15.220 -2.670) 15.675 8.439 ( 3.552 0.493 -1.862) 4.041 8.673 ( 1.264 -3.213 0.016) 3.452 8.728 ( 1.118 7.167 4.563) 8.570 8.848 ( 3.675 -10.085 3.073) 11.165 8.905 ( 2.291 2.200 7.323) 7.982 9.027 ( 1.656 -6.514 -2.271) 7.094 9.244 ( 4.507 -8.846 -2.527) 10.245 9.408 ( 5.342 -5.127 0.062) 7.404 9.450 ( 6.909 6.403 -5.879) 11.103 9.767 ( -8.627 3.903 0.840) 9.506 9.845 ( -4.798 3.011 4.476) 7.220 9.854 ( 1.591 0.550 0.190) 1.694 10.041 ( 6.941 -5.208 1.502) 8.807 10.139 ( 0.113 -5.281 1.041) 5.383 10.411 ( 8.310 -8.631 -2.713) 12.285 10.542 ( -4.558 -1.464 -0.068) 4.788 11.041 ( 8.700 -1.468 2.444) 9.155 11.206 ( -0.825 3.874 -1.956) 4.417 11.379 ( 0.177 4.073 -3.361) 5.284 11.497 ( -1.897 -1.318 -0.204) 2.319 11.608 ( 6.330 2.190 1.043) 6.779 11.705 ( -0.714 -10.245 4.087) 11.053 11.829 ( 9.337 -15.678 3.332) 18.549 11.914 ( 10.901 -17.529 -3.293) 20.903 12.233 ( 2.598 -3.047 -8.726) 9.601 12.358 ( 6.969 -5.269 4.053) 9.631 12.382 ( 3.204 -2.658 6.381) 7.619 12.696 ( 1.695 -2.197 -3.902) 4.788 12.831 ( -0.341 -6.724 2.205) 7.084 13.017 ( 1.731 2.770 -0.017) 3.266 13.107 ( 7.074 3.909 -2.181) 8.371 13.334 ( 2.921 -4.259 4.061) 6.570 13.369 ( -1.892 -5.935 0.583) 6.256 13.499 ( 5.587 -1.296 2.769) 6.369 13.959 ( 2.724 0.123 1.667) 3.196 14.213 ( 3.281 3.844 -5.698) 7.617 14.439 ( -2.665 -7.450 -1.841) 8.124 14.633 ( -2.965 0.750 -2.512) 3.958 15.193 ( -7.107 -9.496 12.892) 17.518 15.628 ( 0.316 7.774 -13.902) 15.931 15.834 ( 2.603 12.710 -7.753) 15.113 15.982 ( 0.153 4.659 8.307) 9.525 16.252 ( -3.059 7.259 8.403) 11.518 16.934 ( 18.852 -25.402 -0.889) 31.646 17.514 ( -16.083 4.292 -7.820) 18.391 17.665 ( -6.395 5.083 1.445) 8.296 17.989 ( -10.525 -0.619 5.647) 11.960 18.668 ( 1.890 6.569 -8.578) 10.968 19.230 ( -3.234 13.501 5.883) 15.078 19.591 ( 7.888 -11.334 -6.981) 15.473 20.477 ( 0.202 7.722 6.926) 10.375 20.513 ( -3.075 10.499 3.270) 11.419 20.836 ( -6.805 5.522 9.557) 12.967 21.832 ( 7.423 -15.134 -14.459) 22.208 ======================= Grid point 183 (73/199) ======================= q-point: (-0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.287 ( -12.403 7.289 -5.314) 15.336 2.922 ( -27.153 17.056 12.249) 34.326 3.020 ( 0.964 26.938 18.930) 32.938 3.797 ( -19.379 33.869 11.984) 40.820 4.133 ( -12.125 26.102 -10.818) 30.747 5.125 ( -1.434 2.275 -18.502) 18.697 5.463 ( -23.703 51.149 -3.381) 56.476 5.585 ( -14.553 40.703 1.675) 43.259 6.217 ( -8.294 3.900 -0.640) 9.188 6.614 ( -6.440 -2.818 -0.836) 7.080 6.803 ( -10.750 16.169 -0.421) 19.421 7.176 ( 2.183 -3.294 1.579) 4.255 7.346 ( -4.567 -8.432 1.713) 9.741 7.605 ( -7.789 -5.401 -1.231) 9.557 7.841 ( 2.757 -8.017 0.196) 8.480 7.900 ( 1.958 6.806 2.115) 7.391 8.296 ( -0.361 -0.877 -6.677) 6.744 8.405 ( -6.309 -9.839 -4.295) 12.452 8.544 ( -4.828 -13.134 6.468) 15.416 8.653 ( 3.512 -3.860 -3.912) 6.522 8.869 ( 3.093 -3.659 -0.292) 4.800 8.953 ( 7.393 -2.289 9.137) 11.974 9.158 ( 7.873 -16.095 3.180) 18.197 9.177 ( 6.558 -12.446 -4.577) 14.794 9.342 ( -0.936 -6.875 -6.812) 9.723 9.443 ( -2.242 -2.253 -0.075) 3.180 9.592 ( 9.233 6.350 1.381) 11.291 9.729 ( 7.715 -7.523 -1.613) 10.896 9.754 ( -3.022 3.265 4.559) 6.370 9.914 ( 10.805 3.698 -1.340) 11.499 10.131 ( 0.645 -4.248 0.903) 4.390 10.343 ( 7.588 -16.641 5.893) 19.215 10.557 ( 1.380 -8.749 -2.678) 9.253 10.686 ( 8.665 -18.202 -2.007) 20.259 11.076 ( -1.643 10.258 -3.616) 11.000 11.217 ( 4.504 -4.953 7.324) 9.923 11.386 ( 1.390 1.613 -6.556) 6.893 11.486 ( 2.638 -2.449 -2.268) 4.255 11.693 ( 7.296 2.654 -0.898) 7.815 11.745 ( -2.035 -5.442 6.430) 8.667 12.105 ( 4.158 -6.688 -3.274) 8.529 12.270 ( 13.227 -9.577 -1.710) 16.419 12.364 ( 6.671 -15.710 -2.235) 17.214 12.430 ( 1.204 -3.691 3.301) 5.096 12.542 ( 3.442 -6.027 3.757) 7.892 12.721 ( 1.595 -1.885 -2.227) 3.325 12.890 ( -0.937 -6.215 0.878) 6.347 13.024 ( 1.872 2.728 3.005) 4.469 13.210 ( 8.621 1.797 -2.274) 9.095 13.390 ( -0.811 -10.090 0.291) 10.126 13.507 ( 6.098 -9.634 4.549) 12.275 13.588 ( 0.980 -1.041 3.116) 3.428 13.996 ( 0.081 -2.082 -1.398) 2.509 14.181 ( -2.501 1.573 -1.488) 3.308 14.392 ( -7.123 -1.158 -4.630) 8.574 14.675 ( 5.771 -4.983 3.797) 8.518 15.183 ( -5.879 -3.956 1.268) 7.198 15.517 ( 0.005 7.530 -6.863) 10.188 15.741 ( 5.632 15.144 -10.186) 19.100 15.977 ( 1.238 3.001 5.482) 6.371 16.212 ( 3.447 11.293 17.043) 20.734 17.131 ( -20.109 4.381 -13.119) 24.406 17.413 ( 9.978 -14.098 -5.140) 18.020 17.536 ( -3.649 -0.263 3.480) 5.049 17.776 ( -6.443 13.388 0.908) 14.886 18.516 ( -5.804 18.737 0.653) 19.626 19.074 ( -3.304 4.666 9.117) 10.761 19.839 ( 8.668 -12.668 -12.767) 19.966 20.287 ( -6.356 11.084 1.031) 12.819 20.399 ( -5.182 8.722 -1.510) 10.256 20.837 ( 1.443 -4.546 19.489) 20.064 22.019 ( 4.510 -12.391 -16.217) 20.902 ======================= Grid point 184 (74/199) ======================= q-point: (-0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.002 ( -14.038 9.897 11.148) 20.476 2.392 ( -15.514 18.431 16.566) 29.237 2.779 ( -11.291 28.789 14.197) 34.027 3.194 ( -13.155 34.412 7.260) 37.549 3.672 ( -4.469 31.323 -12.476) 34.011 4.361 ( -15.264 76.312 -0.650) 77.826 4.917 ( -15.888 38.779 -10.548) 43.215 5.176 ( 0.912 5.588 -5.764) 8.079 6.081 ( 0.200 8.441 -0.693) 8.471 6.429 ( -12.738 17.511 -0.217) 21.655 6.614 ( 1.994 -1.560 -1.227) 2.813 7.080 ( -16.242 3.506 -2.264) 16.770 7.256 ( 0.240 -2.036 3.337) 3.917 7.710 ( 1.404 -11.886 0.163) 11.970 7.891 ( 2.348 0.699 3.935) 4.636 7.942 ( -2.686 -8.210 -1.105) 8.709 8.248 ( -2.083 -0.168 -10.807) 11.007 8.307 ( -11.190 -10.022 -2.257) 15.191 8.624 ( 0.408 -7.458 4.667) 8.807 8.765 ( 2.175 -5.422 -1.669) 6.076 8.936 ( 3.069 -0.522 5.601) 6.408 9.082 ( -0.367 -4.159 1.121) 4.322 9.274 ( 0.592 -2.504 -6.065) 6.589 9.390 ( 8.158 -6.938 -4.391) 11.574 9.460 ( 2.042 -11.542 -1.014) 11.765 9.479 ( 5.024 -3.104 5.044) 7.767 9.633 ( -2.739 -5.312 0.836) 6.035 9.739 ( 2.924 0.156 1.965) 3.527 9.957 ( 7.914 -4.244 -1.663) 9.133 10.093 ( 4.458 -4.804 0.044) 6.554 10.230 ( 11.032 1.782 3.880) 11.830 10.637 ( 5.987 -15.301 5.379) 17.289 10.721 ( 1.930 -18.781 -6.311) 19.907 10.926 ( -2.264 -2.308 -2.371) 4.010 11.031 ( 4.497 -17.065 -1.359) 17.700 11.309 ( 1.010 2.985 -9.369) 9.885 11.359 ( 1.646 -4.500 3.039) 5.675 11.619 ( 6.892 -4.957 -0.053) 8.489 11.773 ( -3.324 -6.546 5.333) 9.074 11.812 ( 7.713 -0.247 -0.904) 7.770 12.168 ( 2.178 -2.975 -5.399) 6.538 12.381 ( -0.885 -2.091 -1.990) 3.019 12.500 ( -1.423 -1.429 2.779) 3.434 12.629 ( 8.533 -8.507 -4.027) 12.704 12.676 ( 4.533 -7.020 3.901) 9.222 12.803 ( 3.781 -5.444 3.260) 7.386 12.937 ( 1.006 -4.959 0.594) 5.095 13.052 ( 1.204 -0.311 6.892) 7.004 13.309 ( 4.355 -1.557 -1.624) 4.902 13.524 ( -3.661 -5.298 1.300) 6.570 13.599 ( 4.906 -10.857 1.441) 12.001 13.749 ( 7.496 -11.786 3.345) 14.363 13.990 ( -4.599 -7.077 -2.788) 8.889 14.096 ( -5.672 2.070 3.113) 6.793 14.256 ( -8.077 -2.143 -3.201) 8.949 14.887 ( 14.295 0.912 5.764) 15.440 15.051 ( -9.463 1.468 -9.064) 13.185 15.453 ( -0.628 5.118 1.611) 5.402 15.687 ( 9.942 15.734 -12.552) 22.449 15.990 ( 0.947 2.359 4.053) 4.784 16.196 ( 0.359 12.646 13.574) 18.555 16.750 ( -11.877 6.830 -8.365) 16.053 17.247 ( -13.868 12.340 14.058) 23.285 17.549 ( 3.691 16.781 -7.839) 18.886 17.811 ( 7.087 -13.909 -15.814) 22.220 18.122 ( -12.936 28.018 -0.797) 30.870 19.111 ( 0.136 -6.486 15.652) 16.943 19.982 ( 2.825 -0.279 -6.751) 7.324 20.105 ( -3.275 9.601 0.641) 10.165 20.256 ( -0.423 4.450 -5.763) 7.293 21.000 ( -0.151 -13.848 14.303) 19.909 22.115 ( 1.940 -7.461 -18.680) 20.208 ======================= Grid point 185 (75/199) ======================= q-point: (-0.17 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.705 ( -15.977 14.034 33.335) 39.541 2.074 ( -16.423 39.190 7.663) 43.178 2.261 ( 2.322 17.214 13.518) 22.010 2.854 ( 0.988 24.444 0.845) 24.479 3.382 ( 12.522 31.221 -12.987) 36.058 3.619 ( 15.164 80.058 15.132) 82.875 4.171 ( -14.803 51.416 -7.390) 54.012 5.203 ( 5.456 -3.096 -18.458) 19.495 6.045 ( 4.645 14.190 0.006) 14.931 6.092 ( -4.163 15.057 -0.615) 15.634 6.689 ( 0.664 -3.954 0.424) 4.032 6.825 ( -1.653 7.501 -3.053) 8.265 7.310 ( 2.620 -1.937 4.820) 5.818 7.774 ( -3.646 -3.217 -0.192) 4.866 7.880 ( -6.852 -7.112 -3.376) 10.437 8.016 ( 5.279 -6.998 3.314) 9.371 8.194 ( -1.088 -2.013 -13.414) 13.608 8.313 ( 0.209 -10.293 -3.800) 10.974 8.678 ( -1.892 -2.773 4.160) 5.346 8.800 ( -0.603 -0.368 1.539) 1.693 9.009 ( 3.479 2.191 9.233) 10.107 9.044 ( -3.110 1.602 -2.780) 4.468 9.309 ( 4.198 1.346 -5.240) 6.848 9.502 ( -2.503 -4.081 -0.035) 4.787 9.565 ( -1.520 -2.200 -3.406) 4.330 9.592 ( 7.596 -5.304 2.424) 9.577 9.684 ( 1.656 -5.576 2.568) 6.358 9.782 ( -3.104 -3.783 1.934) 5.262 10.043 ( 2.585 3.720 -3.407) 5.668 10.148 ( -0.834 -5.529 3.704) 6.707 10.382 ( -0.692 -5.027 2.479) 5.647 10.753 ( -5.312 -5.445 -4.028) 8.608 10.878 ( 1.316 -15.778 -8.554) 17.995 10.916 ( -1.332 -9.326 -6.961) 11.713 11.232 ( -1.462 -6.336 -7.894) 10.227 11.317 ( 2.599 -14.820 -4.070) 15.587 11.466 ( -1.357 -8.779 9.301) 12.862 11.734 ( -0.217 -5.368 -0.162) 5.375 11.774 ( -4.907 -5.117 3.943) 8.112 11.914 ( -0.233 -5.458 -0.833) 5.526 12.217 ( 2.786 -0.338 -2.475) 3.742 12.386 ( 0.011 -0.703 0.261) 0.750 12.506 ( 2.841 -2.332 -1.863) 4.121 12.734 ( -0.048 -5.844 -2.266) 6.268 12.773 ( 1.174 -2.740 2.757) 4.060 12.935 ( 1.652 -3.214 3.509) 5.037 13.027 ( 3.350 -1.856 1.113) 3.988 13.102 ( -2.166 -7.226 8.831) 11.614 13.385 ( -1.791 -1.936 3.177) 4.129 13.436 ( -3.583 -5.913 -0.339) 6.922 13.867 ( 3.161 -14.085 -1.210) 14.486 13.929 ( -1.273 -11.334 0.361) 11.411 13.957 ( -4.999 -4.761 3.686) 7.826 14.085 ( 6.089 -5.865 1.697) 8.623 14.201 ( 0.631 -3.040 -1.495) 3.447 14.807 ( -9.291 8.771 -8.979) 15.617 15.153 ( 16.320 1.876 7.046) 17.875 15.387 ( -2.875 3.783 0.292) 4.760 15.603 ( -3.672 13.099 -12.449) 18.441 15.957 ( 3.326 8.919 -3.465) 10.130 16.105 ( 0.521 5.524 10.357) 11.750 16.622 ( 1.642 7.631 4.221) 8.874 16.994 ( -3.414 12.015 11.618) 17.059 17.421 ( 2.274 22.296 -3.161) 22.634 17.627 ( -7.653 29.388 -6.866) 31.134 17.915 ( 1.337 -6.705 -25.745) 26.638 19.227 ( -1.765 -7.801 17.642) 19.370 19.933 ( 0.328 7.477 -0.060) 7.484 20.002 ( 0.734 8.422 -0.359) 8.461 20.260 ( 3.047 -0.133 -8.350) 8.890 21.144 ( -4.553 -16.246 8.287) 18.797 22.131 ( 3.603 -0.221 -21.021) 21.329 ======================= Grid point 186 (76/199) ======================= q-point: (-0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.374 ( 17.068 29.886 -2.577) 34.513 1.891 ( 12.643 16.153 46.685) 50.993 2.293 ( 7.800 9.892 9.911) 16.029 2.715 ( 7.857 20.432 -0.596) 21.898 3.400 ( 37.019 69.689 20.111) 81.434 3.449 ( 5.104 31.963 -3.955) 32.609 3.535 ( 28.400 39.941 -16.520) 51.718 5.250 ( 2.970 -2.450 -24.513) 24.814 5.895 ( 2.698 10.533 0.579) 10.889 6.088 ( 10.769 15.506 -0.460) 18.884 6.631 ( -0.825 1.297 -1.514) 2.157 6.981 ( 17.623 1.865 -0.625) 17.732 7.369 ( -0.156 1.265 4.032) 4.229 7.771 ( 4.693 -2.952 -1.854) 5.846 7.818 ( -7.805 -2.664 -3.847) 9.100 8.098 ( -5.701 -7.445 -2.890) 9.812 8.184 ( 0.662 0.097 -7.728) 7.757 8.485 ( 9.104 -9.342 -3.981) 13.638 8.633 ( -4.820 2.398 4.891) 7.273 8.809 ( 0.986 -0.290 3.485) 3.634 8.942 ( -2.955 3.943 -0.157) 4.930 9.089 ( 6.137 3.730 6.610) 9.761 9.290 ( -2.775 9.232 -0.105) 9.640 9.479 ( 1.979 -0.490 -12.636) 12.799 9.523 ( -6.884 -1.365 -2.720) 7.527 9.619 ( -10.044 0.094 0.955) 10.090 9.695 ( -2.249 1.669 6.809) 7.363 9.845 ( -6.334 3.126 -5.674) 9.060 9.861 ( 3.511 -1.672 2.856) 4.824 10.216 ( -5.326 -12.657 6.388) 15.145 10.417 ( 3.526 -7.428 0.779) 8.259 10.767 ( -2.758 -10.935 -8.012) 13.833 10.936 ( -1.182 -2.926 -4.389) 5.405 10.966 ( -1.054 -9.613 -15.251) 18.059 11.175 ( -9.865 -5.340 -3.213) 11.669 11.435 ( -7.343 -14.935 -1.488) 16.709 11.484 ( -10.273 -7.774 10.806) 16.815 11.706 ( -9.269 -2.528 0.933) 9.652 11.736 ( -4.504 -5.647 1.600) 7.398 11.924 ( -3.609 -6.598 -0.280) 7.526 12.228 ( -0.077 3.491 0.373) 3.511 12.396 ( 0.213 -1.030 4.084) 4.217 12.596 ( 0.974 -8.174 -5.012) 9.637 12.797 ( -3.140 -5.514 -2.749) 6.915 12.803 ( 3.289 1.167 -0.059) 3.490 12.887 ( -9.635 -3.530 6.286) 12.034 13.039 ( 1.060 2.431 2.152) 3.415 13.164 ( -5.161 -11.907 5.274) 14.008 13.354 ( -1.001 -0.854 -1.376) 1.904 13.510 ( -0.807 -3.580 4.792) 6.036 13.843 ( -8.276 -9.926 2.465) 13.156 13.961 ( -3.346 -14.031 -0.943) 14.455 14.144 ( 3.758 -9.245 0.524) 9.993 14.231 ( 2.591 -2.903 1.355) 4.120 14.326 ( 7.973 -4.281 -0.694) 9.076 14.546 ( -7.869 8.661 -6.172) 13.229 15.227 ( -9.239 2.301 -4.161) 10.391 15.409 ( 1.398 6.659 -4.451) 8.130 15.427 ( 13.276 3.504 5.499) 14.791 15.918 ( 7.985 14.243 -4.402) 16.912 16.201 ( 6.911 1.757 15.947) 17.469 16.591 ( 0.364 3.608 3.114) 4.780 16.994 ( 8.014 12.386 3.674) 15.203 17.141 ( 4.063 15.705 -8.920) 18.513 17.435 ( 11.555 25.292 -1.999) 27.879 17.870 ( 0.650 0.983 -27.083) 27.108 19.291 ( -3.908 -5.627 16.150) 17.543 19.903 ( 4.241 6.149 0.530) 7.488 19.965 ( 3.996 7.431 -0.085) 8.438 20.257 ( -0.346 1.042 -8.022) 8.097 21.198 ( -8.706 -13.592 6.085) 17.250 22.129 ( 5.743 4.612 -21.791) 23.003 ======================= Grid point 190 (77/199) ======================= q-point: ( 0.25 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.540 ( 9.601 -0.000 -5.048) 10.847 2.782 ( 22.924 -0.000 4.476) 23.357 4.433 ( 16.961 -0.000 17.604) 24.445 4.637 ( 3.243 -0.000 -1.122) 3.432 4.656 ( 25.153 -0.000 -4.916) 25.628 4.701 ( -2.200 0.000 -18.529) 18.659 6.205 ( 8.904 -0.000 -3.312) 9.500 6.540 ( 10.112 -0.000 4.388) 11.023 6.590 ( 12.135 -0.000 4.991) 13.121 6.624 ( 16.442 -0.000 -3.538) 16.818 6.954 ( -9.190 0.000 -3.798) 9.944 7.072 ( -3.259 0.000 -5.154) 6.098 7.205 ( -5.092 0.000 8.814) 10.179 7.430 ( 1.759 -0.000 8.309) 8.493 7.707 ( -1.735 0.000 -13.512) 13.623 7.751 ( 2.671 -0.000 1.770) 3.204 7.889 ( -8.868 0.000 5.750) 10.569 8.114 ( 8.107 -0.000 -7.912) 11.328 8.579 ( -0.177 0.000 3.116) 3.121 8.624 ( 9.362 -0.000 0.743) 9.391 8.758 ( -10.564 0.000 4.143) 11.347 8.895 ( -3.194 0.000 1.308) 3.451 9.028 ( -5.110 0.000 -10.166) 11.378 9.164 ( -0.015 0.000 0.991) 0.991 9.313 ( -8.208 0.000 6.680) 10.583 9.387 ( -3.293 0.000 3.908) 5.111 9.486 ( -3.525 0.000 -9.545) 10.175 9.860 ( -0.366 0.000 -5.337) 5.350 9.927 ( 1.629 -0.000 1.489) 2.207 10.008 ( 10.597 -0.000 1.548) 10.710 10.015 ( 5.787 -0.000 0.319) 5.796 10.183 ( -6.956 0.000 -2.530) 7.402 10.189 ( 13.584 -0.000 4.581) 14.336 10.540 ( -10.404 0.000 -6.217) 12.120 11.109 ( 9.512 -0.000 10.099) 13.873 11.111 ( -19.819 0.000 0.892) 19.839 11.251 ( -17.432 0.000 1.108) 17.467 11.362 ( -0.004 0.000 -2.677) 2.677 11.474 ( 1.368 -0.000 1.253) 1.855 11.546 ( -7.023 0.000 -1.830) 7.257 11.660 ( -0.685 0.000 2.719) 2.804 11.710 ( -2.289 0.000 -0.546) 2.353 12.110 ( -8.231 0.000 -0.071) 8.231 12.183 ( -3.279 0.000 4.812) 5.823 12.412 ( -5.429 0.000 -10.062) 11.433 12.649 ( 1.955 -0.000 0.937) 2.168 12.792 ( -7.171 0.000 -1.509) 7.328 13.012 ( 0.454 -0.000 3.823) 3.850 13.229 ( -2.484 0.000 -1.070) 2.705 13.413 ( -4.295 0.000 3.386) 5.469 13.517 ( -5.707 0.000 5.184) 7.710 13.641 ( -7.953 0.000 -0.533) 7.971 13.938 ( -5.906 0.000 4.808) 7.616 14.102 ( 1.172 -0.000 -1.007) 1.545 14.643 ( -8.275 0.000 0.573) 8.295 14.918 ( -8.932 0.000 3.745) 9.685 14.956 ( 10.736 -0.000 -1.943) 10.910 15.224 ( 5.142 -0.000 6.694) 8.441 15.917 ( 4.492 -0.000 -12.080) 12.889 16.352 ( -6.013 0.000 -10.566) 12.158 16.515 ( -4.951 0.000 -7.738) 9.187 16.540 ( -0.923 0.000 -11.834) 11.870 17.519 ( 7.806 -0.000 12.249) 14.525 17.609 ( 4.781 -0.000 3.918) 6.181 18.372 ( -11.652 0.000 15.188) 19.143 18.382 ( -14.133 0.000 0.204) 14.135 19.358 ( 14.809 -0.000 -5.611) 15.837 19.455 ( 13.861 -0.000 12.652) 18.767 20.596 ( 9.610 -0.000 -1.948) 9.805 20.809 ( 10.872 -0.000 -6.023) 12.429 21.109 ( -10.608 0.000 -17.127) 20.146 21.150 ( -0.780 0.000 11.275) 11.302 ======================= Grid point 191 (78/199) ======================= q-point: ( 0.33 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.720 ( 7.805 -5.740 -4.665) 10.753 3.147 ( 19.895 3.450 3.703) 20.529 4.588 ( -6.850 3.861 4.601) 9.110 4.644 ( 2.692 -0.147 -16.414) 16.634 4.702 ( 8.428 -3.374 12.606) 15.534 4.992 ( 14.138 -2.610 -5.452) 15.376 6.372 ( 8.308 -2.295 -1.467) 8.744 6.595 ( 6.037 15.865 0.770) 16.993 6.638 ( 0.762 4.834 1.715) 5.186 6.864 ( 1.128 -5.564 -6.656) 8.748 6.900 ( 5.605 -9.965 1.875) 11.585 6.979 ( -5.510 -2.795 -0.769) 6.226 7.214 ( -0.916 2.128 6.999) 7.373 7.479 ( -0.757 -3.414 7.817) 8.564 7.644 ( -2.720 -3.886 -12.872) 13.718 7.753 ( -7.156 -6.454 1.920) 9.826 7.818 ( 2.028 2.721 4.277) 5.460 8.183 ( 2.146 -0.987 -8.363) 8.691 8.508 ( -6.830 -2.924 4.946) 8.925 8.726 ( 2.737 2.953 0.382) 4.045 8.779 ( 6.765 -2.304 -0.122) 7.148 8.918 ( -0.630 1.723 -2.463) 3.071 8.946 ( 1.400 -2.551 0.804) 3.019 9.139 ( -5.268 1.409 2.636) 6.056 9.163 ( -5.597 0.684 1.709) 5.892 9.367 ( -1.155 0.976 3.835) 4.122 9.427 ( 0.971 3.846 -7.599) 8.572 9.770 ( -3.369 0.159 -5.019) 6.047 9.911 ( 1.520 8.641 -0.113) 8.774 10.110 ( 5.568 2.808 -0.500) 6.256 10.162 ( 0.036 -8.531 -1.321) 8.632 10.225 ( 5.072 1.390 -3.974) 6.592 10.340 ( 2.475 7.995 1.596) 8.520 10.510 ( 10.854 -4.640 4.840) 12.758 10.807 ( -16.813 -7.492 1.485) 18.466 10.910 ( -18.794 -1.285 0.757) 18.853 11.240 ( 5.367 6.959 6.903) 11.175 11.364 ( 0.913 2.693 -2.485) 3.776 11.476 ( -2.979 -4.136 -0.292) 5.106 11.500 ( 2.134 -4.059 0.980) 4.690 11.666 ( -2.069 -0.382 -5.403) 5.798 11.786 ( 6.216 -1.364 7.994) 10.218 11.938 ( -5.188 2.503 -3.205) 6.591 12.209 ( -1.017 -5.486 6.871) 8.851 12.318 ( -1.672 2.320 -9.192) 9.626 12.602 ( -5.225 1.191 -1.168) 5.484 12.739 ( 1.772 1.066 -1.109) 2.346 13.023 ( -1.215 -1.111 3.008) 3.429 13.186 ( -1.304 0.118 -1.652) 2.108 13.324 ( -6.094 1.298 0.646) 6.264 13.457 ( -1.923 3.572 5.697) 6.994 13.503 ( -6.605 1.795 -0.006) 6.844 13.874 ( -2.301 0.908 3.898) 4.617 14.132 ( 4.109 0.178 -3.769) 5.579 14.497 ( -6.717 3.521 -0.424) 7.596 14.830 ( -9.930 -10.330 1.706) 14.430 15.062 ( 7.491 11.322 7.544) 15.531 15.441 ( 9.007 -17.270 6.327) 20.480 15.905 ( 0.821 2.484 -14.471) 14.706 16.176 ( -9.177 1.831 7.753) 12.153 16.364 ( 1.863 13.286 -14.427) 19.701 16.551 ( -3.839 -5.550 -11.455) 13.295 17.709 ( 9.744 -5.323 0.225) 11.106 17.733 ( 2.555 -7.785 6.964) 10.753 18.151 ( -15.424 0.192 6.703) 16.818 18.184 ( -11.929 -3.951 3.331) 13.000 19.523 ( 9.640 7.020 -7.533) 14.104 19.714 ( 12.599 5.095 16.532) 21.401 20.632 ( 2.713 11.254 2.731) 11.894 20.935 ( 0.700 3.719 -11.532) 12.137 21.016 ( 3.001 -14.538 -4.656) 15.557 21.160 ( -1.144 -0.594 1.986) 2.367 ======================= Grid point 192 (79/199) ======================= q-point: (-0.58 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.806 ( 0.381 0.614 -4.846) 4.900 3.355 ( 9.047 6.373 3.518) 11.612 4.372 ( -13.185 11.646 9.831) 20.152 4.669 ( 3.213 -0.505 -8.213) 8.833 4.851 ( 1.369 -2.595 6.546) 7.174 5.145 ( 5.844 -0.803 -8.717) 10.525 6.335 ( -3.914 12.582 2.126) 13.348 6.588 ( -0.026 7.507 1.469) 7.649 6.678 ( 10.589 -1.991 -1.558) 10.886 6.873 ( -1.179 -0.828 -5.046) 5.247 6.954 ( 0.275 -2.128 -1.142) 2.431 7.113 ( 4.069 3.830 0.671) 5.628 7.209 ( 2.201 -13.682 5.036) 14.744 7.451 ( -4.516 -0.762 -3.743) 5.914 7.674 ( -7.781 -13.272 -0.654) 15.398 7.714 ( 0.122 -11.557 -0.028) 11.558 7.908 ( 7.435 2.157 3.601) 8.538 8.153 ( -3.513 -2.125 -6.821) 7.962 8.465 ( -7.296 -3.618 5.071) 9.594 8.700 ( -0.501 6.779 -3.240) 7.530 8.823 ( -2.345 3.506 -2.319) 4.814 8.884 ( -1.149 -5.560 1.559) 5.888 8.954 ( -3.063 2.845 2.170) 4.710 9.077 ( -1.082 1.280 1.464) 2.225 9.127 ( 0.395 1.901 1.615) 2.525 9.264 ( -4.824 2.105 -1.371) 5.439 9.486 ( 7.721 1.314 -1.721) 8.019 9.741 ( -0.010 -3.652 -4.669) 5.928 9.845 ( -1.530 4.488 1.314) 4.921 10.076 ( -6.511 10.068 -0.714) 12.011 10.124 ( 0.881 6.205 1.052) 6.355 10.206 ( -7.495 -1.137 2.563) 8.002 10.358 ( 7.369 6.034 -2.753) 9.914 10.636 ( -2.003 1.111 1.986) 3.032 10.788 ( 4.073 -21.210 2.012) 21.691 10.911 ( 5.066 -11.265 -0.139) 12.352 11.264 ( 5.365 4.784 4.361) 8.407 11.343 ( 3.251 5.030 -1.071) 6.084 11.469 ( -3.101 -3.709 0.700) 4.885 11.573 ( 0.964 -2.237 3.944) 4.635 11.645 ( 1.137 1.203 -7.693) 7.869 11.759 ( -4.582 -0.293 -0.870) 4.673 12.043 ( 8.915 -4.495 5.755) 11.524 12.237 ( -1.793 -1.325 -1.454) 2.662 12.283 ( 2.074 -0.261 -0.978) 2.308 12.556 ( 0.101 -3.204 -3.022) 4.405 12.759 ( 1.187 0.604 -0.737) 1.522 13.021 ( 0.373 -0.013 1.462) 1.509 13.157 ( -1.867 1.356 -0.592) 2.382 13.259 ( -0.977 -1.608 0.741) 2.022 13.367 ( -4.908 1.848 0.985) 5.336 13.446 ( 0.993 3.305 2.577) 4.307 13.883 ( 2.562 0.249 3.990) 4.748 14.205 ( 1.963 -5.669 -3.097) 6.751 14.367 ( -3.000 4.910 -4.048) 7.035 14.755 ( -9.483 -7.356 -4.586) 12.848 15.086 ( 4.159 8.673 15.893) 18.578 15.775 ( 0.843 -8.116 -4.288) 9.218 15.908 ( 11.801 -12.665 -4.331) 17.845 16.089 ( -1.845 4.519 14.255) 15.068 16.241 ( 3.103 11.790 -15.449) 19.680 16.462 ( -5.147 1.388 -2.314) 5.811 17.825 ( -2.690 1.021 4.629) 5.450 17.844 ( -1.179 -2.826 -0.296) 3.076 17.883 ( -13.497 -3.525 1.877) 14.076 18.257 ( 7.662 -19.216 -6.460) 21.672 19.481 ( -0.642 10.903 -7.316) 13.145 19.822 ( 3.997 12.238 14.827) 19.637 20.593 ( 2.047 7.410 11.257) 13.632 20.838 ( -3.018 6.077 -3.548) 7.657 21.082 ( -5.616 1.028 0.760) 5.759 21.272 ( 8.974 -14.597 -13.237) 21.652 ======================= Grid point 193 (80/199) ======================= q-point: (-0.50 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.702 ( -5.246 8.304 -4.195) 10.681 3.349 ( -3.308 6.132 2.137) 7.287 3.996 ( -16.301 22.043 15.852) 31.668 4.647 ( -1.434 9.475 0.512) 9.597 4.803 ( -5.830 6.488 -0.543) 8.739 5.174 ( 1.273 0.096 -11.861) 11.930 6.177 ( -0.156 13.147 3.135) 13.516 6.465 ( -5.202 9.520 1.916) 11.016 6.765 ( -8.611 0.020 -3.914) 9.459 6.889 ( 5.790 -4.159 0.745) 7.168 6.999 ( -3.419 10.839 -3.086) 11.777 7.010 ( 2.091 -2.904 -0.814) 3.670 7.328 ( -6.449 4.887 -5.528) 9.799 7.490 ( 7.331 -11.437 3.804) 14.108 7.721 ( -3.447 -8.604 -2.379) 9.569 7.856 ( -0.820 -17.179 0.155) 17.199 7.947 ( -1.365 -0.380 0.788) 1.622 8.105 ( 1.157 -4.939 -3.091) 5.940 8.465 ( 2.461 -6.301 1.164) 6.864 8.602 ( -0.716 2.907 -4.586) 5.477 8.737 ( -6.848 1.041 2.296) 7.297 8.813 ( -14.639 -5.497 4.654) 16.314 8.884 ( -2.119 -0.167 0.748) 2.253 9.062 ( -1.326 8.132 5.432) 9.869 9.132 ( 7.314 -1.930 -1.997) 7.824 9.259 ( 1.312 -6.642 -4.542) 8.153 9.630 ( 8.706 1.325 2.327) 9.109 9.750 ( -1.048 1.990 -5.039) 5.518 9.824 ( 0.840 -5.505 0.231) 5.574 9.917 ( -3.904 2.853 8.085) 9.421 10.011 ( -5.125 9.474 0.527) 10.784 10.119 ( -1.513 -3.512 1.399) 4.072 10.411 ( 5.728 7.838 -6.275) 11.560 10.557 ( -5.335 2.778 1.308) 6.155 11.032 ( 7.556 -0.231 3.841) 8.480 11.172 ( 7.286 -13.105 -2.945) 15.281 11.342 ( 8.571 -5.078 1.055) 10.018 11.464 ( 0.146 -4.136 2.247) 4.709 11.522 ( -2.476 0.893 -0.309) 2.650 11.554 ( 11.383 -10.927 -1.255) 15.829 11.658 ( 2.257 -0.584 -1.021) 2.545 11.736 ( 2.772 -0.315 -0.900) 2.931 12.215 ( 1.144 0.471 -7.169) 7.275 12.256 ( 7.279 -6.018 4.741) 10.568 12.334 ( 1.540 -2.089 3.854) 4.646 12.617 ( 1.301 -6.559 -3.531) 7.562 12.763 ( 0.310 -0.336 -0.518) 0.691 13.051 ( 2.612 0.758 1.075) 2.924 13.143 ( 1.800 0.125 0.853) 1.996 13.250 ( -5.826 -5.482 1.286) 8.103 13.319 ( 1.064 0.776 1.077) 1.701 13.482 ( 4.015 -0.158 1.349) 4.239 13.945 ( 1.138 -1.084 4.154) 4.441 14.240 ( -6.230 -6.236 -2.404) 9.137 14.325 ( 6.412 1.717 -2.901) 7.244 14.630 ( -8.430 -2.246 -6.531) 10.898 15.143 ( 5.194 5.481 12.555) 14.651 15.719 ( -1.753 2.323 -10.462) 10.859 16.077 ( 1.241 5.245 8.671) 10.209 16.121 ( 6.226 15.262 -13.143) 21.082 16.356 ( 5.312 -5.040 9.209) 11.765 16.445 ( 9.774 -16.844 5.020) 20.111 17.539 ( -19.463 -0.124 -8.392) 21.196 17.765 ( -3.253 4.675 6.667) 8.769 17.950 ( 2.922 -1.727 1.333) 3.646 18.583 ( 9.907 -16.436 -13.699) 23.579 19.327 ( -4.278 4.207 -3.310) 6.852 19.710 ( -4.240 15.917 10.074) 19.309 20.606 ( 0.659 5.157 13.214) 14.200 20.696 ( -5.372 8.235 2.426) 10.128 20.937 ( -7.293 5.252 0.414) 8.997 21.526 ( 8.255 -16.278 -15.123) 23.703 ======================= Grid point 194 (81/199) ======================= q-point: (-0.42 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.484 ( -6.903 12.675 -2.102) 14.585 3.127 ( -18.396 6.233 4.821) 20.012 3.582 ( -7.336 29.027 16.962) 34.410 4.393 ( -9.479 27.168 7.986) 29.862 4.570 ( -6.145 17.362 -7.212) 19.779 5.129 ( -0.914 0.331 -15.334) 15.365 6.067 ( -0.714 16.783 4.359) 17.354 6.245 ( -11.365 9.284 0.747) 14.694 6.492 ( -18.004 23.370 -6.420) 30.191 6.634 ( -2.789 16.752 -2.855) 17.221 6.981 ( -8.076 0.077 -0.645) 8.102 7.105 ( 3.387 -3.323 0.660) 4.790 7.216 ( 4.966 0.292 2.492) 5.563 7.587 ( -11.820 1.218 -3.591) 12.413 7.666 ( 1.721 -9.618 1.181) 9.842 7.967 ( 0.329 -1.610 4.552) 4.840 8.078 ( 3.675 -19.694 -4.097) 20.449 8.247 ( 0.626 -7.893 -2.919) 8.439 8.428 ( -6.106 3.289 2.888) 7.513 8.550 ( -8.680 -8.874 -4.041) 13.054 8.712 ( -4.186 -9.707 2.345) 10.828 8.800 ( 3.614 -13.172 -1.140) 13.706 8.933 ( 6.894 -5.079 5.155) 9.995 9.031 ( 2.687 0.842 2.861) 4.014 9.259 ( 5.435 -4.134 -6.217) 9.235 9.385 ( 6.163 -3.229 -1.642) 7.148 9.598 ( -8.059 -4.593 -0.785) 9.310 9.716 ( -0.705 1.976 1.097) 2.367 9.864 ( -1.410 6.008 2.412) 6.626 9.961 ( 9.400 4.645 5.966) 12.063 10.020 ( 2.721 -13.592 3.259) 14.240 10.141 ( 3.614 0.251 -1.046) 3.771 10.407 ( 0.763 -6.909 -3.377) 7.728 10.510 ( 3.007 1.702 -3.502) 4.919 11.151 ( 4.169 -1.641 6.472) 7.872 11.240 ( 0.505 4.826 -3.583) 6.032 11.413 ( 1.498 0.950 -2.009) 2.680 11.445 ( -1.277 -1.234 -1.798) 2.527 11.619 ( -0.964 -6.296 4.007) 7.525 11.749 ( 7.410 1.003 0.228) 7.481 11.906 ( 14.123 -11.845 2.772) 18.640 11.973 ( 16.369 -16.911 -4.588) 23.979 12.209 ( 1.225 -2.809 -8.802) 9.320 12.370 ( 1.223 -2.466 1.958) 3.378 12.447 ( 4.934 -4.421 6.303) 9.145 12.671 ( 0.146 -5.294 -4.760) 7.121 12.791 ( 0.873 -3.035 2.036) 3.758 13.078 ( 1.411 2.408 2.640) 3.842 13.197 ( -1.436 -6.000 1.419) 6.331 13.237 ( 2.045 -3.146 -1.031) 3.891 13.383 ( 4.431 -3.629 2.204) 6.137 13.542 ( -0.828 -3.756 1.500) 4.129 13.927 ( -7.128 -4.789 0.929) 8.637 14.157 ( -8.752 -3.912 0.952) 9.634 14.426 ( 2.454 5.002 -4.898) 7.419 14.562 ( 4.283 -5.368 0.854) 6.920 15.198 ( 3.826 5.060 3.641) 7.314 15.639 ( -0.479 5.270 -5.643) 7.736 15.997 ( 0.600 8.292 -8.820) 12.121 16.119 ( 10.079 13.580 -3.011) 17.177 16.411 ( 4.550 9.040 21.957) 24.177 16.925 ( 10.869 -27.852 -1.820) 29.953 17.188 ( -16.514 0.777 -12.938) 20.993 17.669 ( -4.997 7.784 9.857) 13.517 17.978 ( 3.604 7.427 -1.287) 8.355 18.711 ( 1.500 1.664 -7.119) 7.463 19.238 ( -7.912 5.478 2.062) 9.841 19.593 ( 3.003 -5.436 -3.158) 6.967 20.491 ( -6.900 9.699 2.701) 12.206 20.575 ( -3.793 8.317 5.487) 10.661 20.801 ( -5.806 1.168 11.527) 12.959 21.752 ( 6.176 -15.217 -15.840) 22.817 ======================= Grid point 195 (82/199) ======================= q-point: (-0.33 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.238 ( -8.253 14.201 6.736) 17.753 2.722 ( -16.752 14.432 10.846) 24.628 3.297 ( -3.038 26.605 10.696) 28.834 3.909 ( -12.565 37.815 7.634) 40.573 4.256 ( -1.070 28.053 -9.766) 29.724 5.062 ( -0.817 0.043 -19.854) 19.871 5.707 ( -10.440 53.442 -3.513) 54.566 5.742 ( -10.037 34.308 7.081) 36.441 6.178 ( -0.514 5.363 2.693) 6.023 6.556 ( 0.130 0.293 -1.679) 1.709 6.775 ( -7.440 11.196 -1.436) 13.519 7.141 ( -6.181 3.253 -0.625) 7.013 7.250 ( -1.236 2.300 2.873) 3.882 7.482 ( 1.678 -9.322 -1.355) 9.568 7.758 ( -2.801 -10.708 -0.028) 11.068 7.927 ( -6.611 1.886 8.890) 11.238 8.202 ( -2.973 -0.249 -3.582) 4.661 8.231 ( -2.938 -3.575 -9.644) 10.697 8.376 ( -0.706 -14.948 3.749) 15.428 8.628 ( 3.422 -10.448 -3.272) 11.470 8.799 ( -1.469 -12.313 3.159) 12.796 8.935 ( 2.183 -11.344 -3.804) 12.162 9.123 ( 2.845 -7.233 -0.547) 7.792 9.179 ( 6.545 -10.414 0.461) 12.308 9.358 ( 3.930 -2.142 -6.927) 8.247 9.413 ( -0.609 -3.692 2.991) 4.790 9.579 ( -2.679 -2.734 0.770) 3.905 9.782 ( -0.320 -3.686 0.803) 3.786 9.822 ( 6.916 -0.380 4.850) 8.456 10.003 ( -1.346 -3.962 2.752) 5.008 10.237 ( 4.091 -16.365 6.025) 17.912 10.302 ( 7.819 -2.382 -0.006) 8.174 10.518 ( 4.102 -8.887 -5.265) 11.114 10.621 ( 6.286 -11.177 -5.118) 13.807 11.101 ( -5.697 9.770 0.826) 11.339 11.255 ( 2.001 -3.284 7.342) 8.288 11.404 ( 1.776 2.524 -6.791) 7.459 11.528 ( 5.259 -4.804 -0.585) 7.147 11.638 ( -3.467 -5.547 2.890) 7.152 11.840 ( 5.293 2.128 -0.176) 5.708 12.102 ( 2.874 -3.860 -7.842) 9.201 12.282 ( 0.584 -8.288 -3.701) 9.095 12.393 ( 13.001 -11.862 -3.360) 17.917 12.472 ( 6.721 -4.585 6.943) 10.696 12.540 ( 1.169 -5.267 1.924) 5.728 12.729 ( 2.409 -5.593 -1.165) 6.201 12.848 ( 0.829 -3.435 4.303) 5.568 13.070 ( -1.118 1.545 4.835) 5.198 13.236 ( -1.123 -7.398 -0.253) 7.487 13.355 ( 7.116 -5.882 -3.217) 9.776 13.506 ( -4.135 -3.894 2.535) 6.220 13.551 ( 2.159 -9.460 2.613) 10.049 13.849 ( -7.361 -7.028 -1.820) 10.339 14.032 ( -12.451 -6.332 2.736) 14.234 14.343 ( 0.435 9.321 -0.540) 9.346 14.779 ( 8.948 -6.817 1.434) 11.340 15.187 ( 2.824 8.032 -0.765) 8.548 15.571 ( 0.325 7.024 -1.256) 7.142 15.934 ( 4.650 8.013 -6.181) 11.137 16.128 ( 6.507 13.111 -7.889) 16.628 16.403 ( -3.954 8.692 10.644) 14.300 16.866 ( -7.114 4.849 -2.607) 8.996 17.366 ( 8.270 -22.946 -9.385) 26.134 17.484 ( -9.771 12.501 13.716) 20.973 17.946 ( 7.594 15.494 -2.940) 17.503 18.584 ( -6.534 17.817 -2.747) 19.176 19.036 ( -7.139 0.422 9.240) 11.684 19.820 ( 9.126 -15.375 -13.209) 22.230 20.296 ( -5.499 9.761 2.504) 11.479 20.422 ( -2.129 11.430 -1.172) 11.685 20.778 ( -7.267 -8.050 18.246) 21.226 21.922 ( 4.327 -12.282 -16.082) 20.693 ======================= Grid point 196 (83/199) ======================= q-point: (-0.25 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.989 ( -7.641 15.717 21.381) 27.614 2.475 ( 1.062 15.507 6.185) 16.729 2.928 ( -10.562 36.104 10.029) 38.931 3.417 ( -2.307 35.443 2.825) 35.630 4.000 ( 9.997 32.128 -9.722) 35.024 4.897 ( -8.047 15.268 -21.181) 27.322 5.088 ( 10.682 71.542 7.138) 72.687 5.358 ( 1.459 25.286 3.516) 25.571 6.204 ( 5.290 1.588 2.707) 6.151 6.451 ( -3.499 21.571 -2.168) 21.961 6.643 ( 1.205 -0.489 0.117) 1.306 6.927 ( -3.895 4.051 -7.509) 9.379 7.301 ( 3.439 0.530 7.157) 7.959 7.631 ( 2.002 -10.338 0.281) 10.533 7.759 ( -6.194 -5.696 -1.032) 8.478 7.868 ( -3.222 -6.250 5.794) 9.111 8.162 ( -1.400 -1.477 -13.166) 13.322 8.198 ( 3.002 -1.134 -2.350) 3.977 8.536 ( -0.521 -12.252 3.248) 12.686 8.747 ( 0.799 -6.102 0.651) 6.188 8.896 ( -1.823 -10.719 4.340) 11.708 9.046 ( 2.478 -5.959 -6.348) 9.052 9.216 ( 0.831 -6.288 0.078) 6.343 9.354 ( 1.293 -14.878 -4.213) 15.517 9.414 ( 2.745 -5.622 -4.063) 7.460 9.497 ( -1.684 -8.305 2.069) 8.723 9.590 ( 3.323 -1.692 5.376) 6.542 9.748 ( -2.823 0.754 1.345) 3.216 10.023 ( 4.000 -8.051 2.138) 9.241 10.042 ( -1.868 -6.979 4.633) 8.583 10.319 ( -4.340 -0.212 -0.362) 4.361 10.491 ( -1.401 -23.076 2.950) 23.305 10.682 ( 7.848 -4.738 -8.097) 12.231 10.802 ( -4.111 -10.934 -2.726) 11.995 10.908 ( -5.035 -1.301 0.125) 5.202 11.326 ( 0.068 -2.189 4.741) 5.223 11.388 ( 3.025 4.161 -6.749) 8.487 11.635 ( 0.629 -4.895 0.857) 5.009 11.643 ( -4.208 -7.293 2.005) 8.655 11.863 ( -1.172 -0.310 -1.792) 2.164 12.170 ( 3.865 -4.039 -5.519) 7.856 12.321 ( -0.739 -5.315 -3.621) 6.473 12.471 ( -3.507 -2.097 0.478) 4.114 12.586 ( -0.882 -7.829 0.334) 7.885 12.739 ( 7.352 -3.751 2.804) 8.717 12.857 ( 4.220 -6.416 3.160) 8.304 12.903 ( -1.660 -6.723 2.920) 7.516 13.049 ( -1.954 -0.373 6.553) 6.849 13.306 ( 1.984 -6.367 -1.748) 6.894 13.378 ( -8.300 -0.718 3.264) 8.948 13.607 ( 7.757 -12.046 -2.692) 14.578 13.673 ( -1.851 -13.917 -1.404) 14.109 13.827 ( -9.853 -8.378 3.433) 13.381 13.961 ( 2.644 -6.117 -0.561) 6.687 14.293 ( 4.555 9.568 4.418) 11.481 14.855 ( -6.787 -2.465 -5.501) 9.077 15.240 ( 12.560 6.218 7.197) 15.755 15.498 ( 0.237 7.770 -0.564) 7.794 15.856 ( -12.000 12.496 -15.439) 23.206 16.030 ( 5.218 1.811 3.513) 6.545 16.290 ( 4.129 11.211 -5.941) 13.342 16.793 ( 0.353 9.021 9.029) 12.769 17.248 ( -4.774 14.210 13.229) 19.993 17.584 ( -0.321 -13.194 -14.042) 19.271 17.931 ( 9.573 17.297 0.474) 19.775 18.184 ( -8.506 27.203 -8.798) 29.829 19.065 ( -1.789 -8.192 14.326) 16.600 20.005 ( 4.839 -4.299 -10.617) 12.435 20.161 ( -0.322 8.519 0.889) 8.571 20.320 ( 2.687 8.396 -3.882) 9.632 20.811 ( -9.230 -16.495 16.015) 24.774 22.041 ( 4.353 -8.237 -16.219) 18.704 ======================= Grid point 197 (84/199) ======================= q-point: (-0.17 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.872 ( 8.611 19.881 7.179) 22.825 2.376 ( 6.376 27.647 7.780) 29.420 2.558 ( 3.890 21.950 22.276) 31.514 3.177 ( 7.901 28.502 1.656) 29.623 3.949 ( 19.523 27.800 -3.614) 34.162 4.450 ( 0.756 41.114 -16.918) 44.465 4.758 ( 27.179 69.215 13.964) 75.660 5.301 ( 8.617 11.228 -13.202) 19.355 6.133 ( -1.541 13.651 0.097) 13.738 6.399 ( 15.456 14.207 -0.574) 21.001 6.606 ( -4.153 -1.575 -1.150) 4.588 7.019 ( 16.078 0.174 -3.147) 16.384 7.374 ( 2.416 0.475 7.696) 8.080 7.703 ( -0.069 -4.062 -0.452) 4.088 7.730 ( -4.185 -5.713 -2.295) 7.445 7.917 ( -3.740 -10.439 -0.949) 11.130 8.151 ( 2.728 -2.528 -12.603) 13.140 8.332 ( 9.772 -5.331 -1.593) 11.245 8.587 ( -4.280 -6.057 4.387) 8.617 8.785 ( -2.110 -3.777 2.753) 5.128 8.940 ( -3.175 -4.697 0.976) 5.753 9.120 ( 4.080 -1.621 -0.221) 4.396 9.293 ( 0.368 -9.238 -3.561) 9.907 9.393 ( -5.191 -5.366 0.508) 7.483 9.478 ( -1.328 -3.818 -2.961) 5.010 9.606 ( -0.422 -8.484 -0.158) 8.496 9.681 ( -5.106 4.146 3.770) 7.581 9.699 ( 1.736 -8.196 6.464) 10.582 10.004 ( -9.939 -4.727 -0.559) 11.020 10.154 ( -7.463 -16.178 -1.284) 17.863 10.162 ( -1.658 9.783 4.301) 10.815 10.554 ( -9.594 -9.601 -0.702) 13.591 10.737 ( -4.757 -13.474 -2.279) 14.469 10.775 ( 0.291 -5.375 -6.683) 8.581 11.015 ( -4.857 -19.407 -2.765) 20.196 11.302 ( 0.572 5.024 -8.598) 9.975 11.385 ( -3.241 -1.332 6.644) 7.511 11.631 ( -5.691 -5.844 0.382) 8.166 11.648 ( -3.524 -3.526 -0.139) 4.987 11.817 ( -4.915 -3.497 -0.411) 6.046 12.243 ( 1.318 -2.281 -1.286) 2.931 12.342 ( -2.884 -5.050 1.286) 5.956 12.435 ( -4.305 -8.385 -5.097) 10.715 12.650 ( -0.467 -6.928 0.441) 6.958 12.826 ( -0.745 -1.907 2.232) 3.029 12.849 ( -5.416 -0.407 2.990) 6.200 12.956 ( -4.295 -9.025 4.739) 11.062 13.067 ( -1.881 -0.305 5.937) 6.235 13.288 ( -1.840 -5.483 -2.202) 6.188 13.425 ( 3.238 -4.152 -0.068) 5.266 13.674 ( -7.831 -9.556 0.908) 12.388 13.705 ( -9.745 -10.378 3.928) 14.768 13.936 ( 9.450 -12.602 -3.164) 16.066 14.134 ( 7.331 -5.284 -1.658) 9.188 14.357 ( 9.513 5.463 6.324) 12.662 14.664 ( -10.575 3.266 -5.851) 12.519 15.287 ( -12.525 3.812 1.016) 13.131 15.469 ( -5.687 4.382 -8.915) 11.447 15.569 ( 15.518 7.189 5.028) 17.826 16.213 ( 10.548 -0.209 12.473) 16.336 16.219 ( 6.130 16.650 -8.892) 19.846 16.699 ( -2.809 6.764 5.990) 9.462 17.188 ( 4.612 8.257 4.967) 10.683 17.453 ( -8.796 9.577 -13.090) 18.452 17.871 ( 1.949 9.599 -12.527) 15.902 17.967 ( 12.858 24.170 -0.006) 27.378 19.149 ( -3.476 -8.146 14.808) 17.254 20.027 ( 2.848 4.578 -4.066) 6.753 20.120 ( 3.839 8.127 -0.417) 8.998 20.302 ( 3.078 4.778 -7.039) 9.047 20.870 ( -9.943 -19.512 12.437) 25.184 22.126 ( 4.000 -4.317 -16.653) 17.662 ======================= Grid point 198 (85/199) ======================= q-point: (-0.08 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.932 ( 19.214 15.925 -10.111) 26.926 2.453 ( 19.717 14.941 34.922) 42.796 2.644 ( 19.336 12.599 10.284) 25.266 3.124 ( 16.146 25.822 1.962) 30.518 3.831 ( 5.553 37.241 -6.103) 38.144 4.405 ( 37.375 24.556 -10.341) 45.900 4.750 ( 40.911 58.921 12.694) 72.846 5.248 ( 2.472 8.929 -18.319) 20.529 6.118 ( 12.855 10.098 -1.178) 16.389 6.407 ( 6.484 16.592 -2.045) 17.931 6.693 ( 10.950 -1.749 -0.489) 11.100 7.279 ( 10.762 0.299 0.512) 10.778 7.395 ( 3.064 4.700 4.412) 7.138 7.644 ( -9.176 -2.878 -1.242) 9.696 7.744 ( -4.380 -7.985 -5.457) 10.617 7.945 ( -0.209 -5.837 -1.353) 5.995 8.144 ( -2.540 3.220 -8.204) 9.172 8.527 ( 4.348 -5.379 -3.424) 7.717 8.581 ( -3.580 -1.633 4.027) 5.630 8.762 ( -6.466 -2.655 2.445) 7.405 8.925 ( -1.338 -3.811 2.931) 4.991 9.184 ( -0.169 -2.555 1.190) 2.824 9.315 ( -5.557 4.167 1.493) 7.104 9.349 ( -10.746 8.464 -3.190) 14.046 9.420 ( -3.236 -9.999 -0.792) 10.539 9.473 ( -0.792 -0.426 -1.752) 1.969 9.566 ( -6.871 -3.462 1.042) 7.764 9.820 ( 1.036 -1.775 -1.195) 2.377 9.977 ( -4.821 -17.023 4.997) 18.384 9.989 ( -3.321 8.637 7.915) 12.177 10.325 ( -1.084 -20.518 -1.513) 20.602 10.536 ( -6.094 -13.793 -0.257) 15.081 10.722 ( -5.846 -6.338 -8.989) 12.456 10.785 ( -7.160 -9.522 -0.284) 11.917 11.041 ( -8.919 -12.700 -2.498) 15.719 11.216 ( -2.179 3.996 -9.812) 10.816 11.329 ( -6.091 1.035 8.355) 10.391 11.563 ( -6.781 -2.819 -2.614) 7.795 11.610 ( -3.831 -2.635 0.762) 4.712 11.799 ( -2.935 -6.019 1.790) 6.931 12.223 ( -4.335 2.471 0.805) 5.054 12.336 ( -4.859 -8.259 2.454) 9.892 12.476 ( -0.967 -10.302 -4.528) 11.295 12.631 ( -10.160 -5.384 -0.759) 11.523 12.709 ( -9.317 -1.948 6.254) 11.389 12.877 ( 1.169 0.377 -2.382) 2.680 12.980 ( -2.897 -6.753 2.846) 7.880 13.059 ( -0.698 -3.341 3.332) 4.770 13.316 ( -2.195 -3.004 -0.968) 3.845 13.452 ( -4.119 -3.117 1.910) 5.507 13.607 ( -7.205 -11.272 0.835) 13.404 13.760 ( -4.036 -14.044 2.974) 14.912 14.082 ( -2.799 -5.402 -0.882) 6.148 14.213 ( -1.305 1.103 -3.737) 4.110 14.455 ( 1.302 3.910 0.365) 4.137 14.544 ( 6.254 0.782 -0.284) 6.309 15.094 ( -1.720 -6.007 -5.937) 8.619 15.381 ( -1.935 1.800 -4.514) 5.231 15.778 ( 9.240 12.965 10.802) 19.240 16.178 ( 12.336 8.345 2.184) 15.053 16.354 ( -1.409 5.690 16.970) 17.954 16.688 ( 7.392 5.024 -3.775) 9.703 17.120 ( 1.312 -1.241 -17.055) 17.150 17.413 ( 14.908 6.711 -5.539) 17.261 17.807 ( 4.335 7.746 -10.854) 14.021 17.943 ( 11.072 25.519 5.484) 28.353 19.188 ( -5.689 -7.173 14.191) 16.888 20.010 ( -0.250 2.327 -5.427) 5.910 20.122 ( 6.364 8.370 0.768) 10.543 20.262 ( 0.981 6.048 -7.208) 9.460 20.923 ( -8.485 -15.868 13.635) 22.577 22.127 ( -0.882 0.089 -17.846) 17.868 ======================= Grid point 203 (86/199) ======================= q-point: (-0.67 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.818 ( 6.492 -0.000 -2.871) 7.099 3.400 ( 6.366 -0.000 0.456) 6.382 4.481 ( -7.214 0.000 1.739) 7.421 4.710 ( 5.927 -0.000 -5.433) 8.041 4.780 ( 0.156 -0.000 11.280) 11.281 5.137 ( 7.044 -0.000 -8.351) 10.925 6.465 ( 2.604 -0.000 -0.923) 2.762 6.615 ( -3.802 0.000 4.850) 6.163 6.800 ( 2.885 -0.000 -4.239) 5.128 6.827 ( 0.833 -0.000 -1.015) 1.313 6.899 ( 8.073 -0.000 -4.271) 9.133 6.994 ( 6.498 -0.000 3.670) 7.463 7.240 ( -0.141 0.000 1.837) 1.843 7.443 ( -4.745 0.000 4.439) 6.498 7.519 ( -4.447 0.000 -11.217) 12.067 7.584 ( -8.458 0.000 6.178) 10.474 7.949 ( 10.443 -0.000 3.541) 11.027 8.100 ( -7.432 0.000 -5.125) 9.028 8.440 ( -2.985 0.000 2.734) 4.048 8.767 ( -5.520 0.000 -3.451) 6.510 8.812 ( 2.976 -0.000 4.163) 5.117 8.854 ( -4.104 0.000 -4.823) 6.333 9.002 ( -7.418 0.000 3.983) 8.420 9.068 ( 5.350 -0.000 3.675) 6.491 9.143 ( -0.877 0.000 -1.039) 1.359 9.382 ( -2.258 0.000 3.608) 4.257 9.392 ( -2.167 0.000 -9.457) 9.702 9.737 ( 2.834 -0.000 -3.424) 4.445 9.969 ( -7.407 0.000 -2.339) 7.767 10.069 ( -1.269 0.000 4.720) 4.888 10.192 ( 0.767 -0.000 0.093) 0.773 10.270 ( -5.764 0.000 -0.322) 5.773 10.473 ( 3.475 -0.000 1.803) 3.915 10.482 ( 8.745 -0.000 -1.717) 8.912 10.693 ( 0.634 -0.000 -1.875) 1.979 10.721 ( 2.314 -0.000 4.240) 4.830 11.347 ( 0.734 -0.000 5.427) 5.477 11.432 ( -0.075 0.000 0.880) 0.883 11.445 ( 0.304 -0.000 0.082) 0.315 11.532 ( 2.990 -0.000 1.289) 3.256 11.640 ( 6.178 -0.000 -8.780) 10.735 11.757 ( -7.685 0.000 -1.267) 7.789 11.984 ( 7.962 -0.000 4.659) 9.224 12.198 ( -1.210 0.000 8.727) 8.810 12.300 ( 1.501 -0.000 -9.589) 9.705 12.531 ( -2.366 0.000 -2.314) 3.310 12.767 ( 1.337 -0.000 -1.860) 2.291 13.029 ( 0.939 -0.000 3.175) 3.311 13.155 ( -1.912 0.000 -0.453) 1.965 13.226 ( -5.026 0.000 0.212) 5.031 13.390 ( -5.756 0.000 0.102) 5.757 13.494 ( 0.066 -0.000 4.073) 4.074 13.919 ( 5.581 -0.000 2.816) 6.251 14.095 ( -5.874 0.000 -2.590) 6.420 14.503 ( 3.920 -0.000 -6.564) 7.645 14.591 ( -12.176 0.000 3.436) 12.651 15.347 ( 10.830 -0.000 3.159) 11.282 15.454 ( 6.425 -0.000 13.815) 15.236 15.863 ( -0.712 0.000 -14.074) 14.092 16.135 ( -1.279 0.000 14.351) 14.407 16.423 ( 0.846 -0.000 -14.904) 14.928 16.434 ( -1.861 0.000 -6.084) 6.362 17.794 ( 6.368 -0.000 0.116) 6.369 17.841 ( 9.624 -0.000 2.745) 10.008 17.870 ( -19.023 0.000 -0.259) 19.025 18.039 ( -3.492 0.000 1.651) 3.863 19.599 ( -2.315 0.000 -8.033) 8.360 19.945 ( 5.028 -0.000 17.551) 18.257 20.688 ( -2.746 0.000 7.192) 7.699 20.932 ( -3.964 0.000 2.380) 4.624 20.995 ( 7.455 -0.000 -11.131) 13.397 21.160 ( 1.858 -0.000 -7.199) 7.435 ======================= Grid point 205 (87/199) ======================= q-point: (-0.58 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.858 ( 1.684 6.169 -1.975) 6.693 3.369 ( -10.256 -1.907 2.807) 10.803 4.334 ( -6.760 11.022 5.692) 14.127 4.740 ( 1.109 2.724 0.178) 2.947 4.829 ( -0.021 -2.876 3.202) 4.304 5.182 ( 2.234 0.541 -9.573) 9.846 6.398 ( -3.002 9.165 2.299) 9.915 6.587 ( -4.328 0.556 3.113) 5.361 6.754 ( -1.879 3.932 -3.512) 5.597 6.876 ( 0.680 -6.237 -4.742) 7.864 7.004 ( 6.805 9.085 0.024) 11.351 7.175 ( 1.718 -0.623 1.820) 2.579 7.239 ( 8.850 -1.893 -0.663) 9.075 7.338 ( -6.209 -4.727 -5.370) 9.473 7.512 ( 3.376 -9.026 2.982) 10.088 7.590 ( -2.274 -10.000 5.577) 11.674 7.957 ( -5.221 1.195 -3.260) 6.270 8.144 ( 5.141 2.369 -2.749) 6.293 8.354 ( -3.129 -1.548 0.807) 3.583 8.569 ( -14.909 -4.832 -0.890) 15.697 8.741 ( -7.979 -0.828 -0.839) 8.066 8.821 ( -4.056 3.081 5.531) 7.519 8.950 ( -1.843 6.978 -2.649) 7.688 9.107 ( 2.730 -3.372 -0.242) 4.346 9.124 ( -1.899 -3.324 -3.289) 5.047 9.236 ( -2.730 8.084 1.238) 8.622 9.450 ( -2.819 -12.555 -2.631) 13.133 9.814 ( -5.094 4.705 0.113) 6.935 9.891 ( 15.867 3.764 4.007) 16.793 9.984 ( -7.058 -2.439 0.581) 7.491 10.047 ( -12.144 3.736 5.834) 13.981 10.154 ( -5.116 2.237 2.016) 5.937 10.577 ( 8.304 8.051 -6.337) 13.188 10.651 ( -3.104 6.893 0.770) 7.599 10.855 ( 21.220 -13.066 0.124) 24.920 10.943 ( 14.971 -10.090 -1.279) 18.099 11.352 ( -0.520 2.019 4.485) 4.946 11.387 ( -0.252 -1.603 -0.786) 1.803 11.442 ( 2.315 3.040 0.152) 3.824 11.564 ( -1.794 -2.499 -0.586) 3.131 11.654 ( -2.746 -0.195 -2.701) 3.857 11.771 ( 8.557 2.064 -1.795) 8.984 12.138 ( 5.854 -3.282 4.096) 7.863 12.213 ( -0.010 -2.402 7.023) 7.423 12.318 ( 4.015 0.500 -7.835) 8.818 12.514 ( -0.738 -2.961 -3.743) 4.829 12.772 ( 0.638 0.643 -2.477) 2.637 13.059 ( 1.715 0.401 2.448) 3.016 13.119 ( -4.002 -2.333 2.403) 5.218 13.178 ( -1.949 -1.407 0.569) 2.471 13.329 ( -1.153 0.106 -0.206) 1.176 13.491 ( -0.546 0.589 0.488) 0.939 13.942 ( -6.242 0.909 3.447) 7.188 14.099 ( 4.675 -5.695 0.849) 7.417 14.390 ( -6.117 2.559 0.671) 6.665 14.578 ( 2.215 -2.028 -10.244) 10.675 15.370 ( 7.570 16.168 6.512) 19.003 15.711 ( 2.708 -5.723 -0.807) 6.383 15.936 ( 10.249 -16.635 2.530) 19.702 16.162 ( 0.317 2.207 2.481) 3.336 16.366 ( 5.050 8.919 -5.258) 11.519 16.447 ( 1.818 -0.031 7.553) 7.769 17.537 ( -19.004 0.076 -9.496) 21.245 17.872 ( 3.704 6.846 3.739) 8.635 17.952 ( 7.644 2.803 -1.730) 8.324 18.197 ( 9.655 -19.816 -4.750) 22.549 19.433 ( -10.837 4.121 -5.309) 12.752 19.955 ( -5.578 7.530 14.439) 17.213 20.666 ( -2.425 1.432 12.760) 13.067 20.816 ( -7.359 3.809 4.675) 9.515 21.042 ( 0.899 6.058 -8.338) 10.346 21.243 ( 6.619 -12.183 -13.690) 19.485 ======================= Grid point 206 (88/199) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.742 ( -3.567 13.414 0.535) 13.890 3.163 ( -17.224 -2.372 5.050) 18.105 4.082 ( -5.878 22.357 8.643) 24.680 4.718 ( -1.717 1.019 -1.851) 2.723 4.787 ( -2.740 10.472 2.231) 11.052 5.151 ( -0.434 1.901 -11.205) 11.373 6.271 ( -4.038 7.614 3.868) 9.446 6.421 ( -10.258 8.629 2.493) 13.635 6.596 ( -8.456 4.945 -6.594) 11.808 6.930 ( -4.897 4.007 1.780) 6.573 6.985 ( 1.347 -9.546 0.054) 9.641 7.138 ( 5.089 13.443 -3.355) 14.761 7.274 ( 0.034 -1.778 -1.865) 2.577 7.530 ( 4.161 -4.620 2.333) 6.641 7.607 ( -2.867 -3.981 -2.781) 5.639 7.726 ( 6.226 -8.090 0.025) 10.208 7.872 ( -3.669 -6.810 2.285) 8.066 8.119 ( 5.699 -4.383 -2.890) 7.748 8.339 ( -12.789 -8.422 -3.704) 15.754 8.562 ( 0.719 5.742 2.464) 6.289 8.618 ( -7.448 -2.431 3.807) 8.711 8.645 ( -1.491 1.312 -5.069) 5.444 8.879 ( 2.909 -0.858 1.680) 3.467 9.116 ( -2.488 4.684 5.096) 7.355 9.148 ( 0.670 -7.391 -4.092) 8.474 9.299 ( 7.894 -5.602 -0.632) 9.700 9.471 ( -5.902 -8.546 -1.556) 10.502 9.724 ( -4.141 -0.136 -0.769) 4.214 9.849 ( -7.300 0.455 8.801) 11.443 9.960 ( -2.957 -0.342 -0.706) 3.059 10.054 ( -4.428 -2.988 2.851) 6.055 10.138 ( 14.015 8.339 6.185) 17.442 10.449 ( -7.722 6.306 -3.219) 10.477 10.592 ( 4.346 5.757 -6.936) 10.006 11.158 ( 3.596 1.885 4.375) 5.969 11.214 ( 8.884 -4.486 -1.060) 10.008 11.407 ( 2.848 -1.069 -1.859) 3.565 11.466 ( -3.113 -0.844 -1.698) 3.645 11.527 ( 8.593 -2.836 3.589) 9.734 11.632 ( 14.792 -11.831 -0.824) 18.959 11.675 ( 6.910 -5.047 -2.175) 8.829 11.878 ( 7.476 1.856 -0.018) 7.703 12.182 ( -0.675 -0.928 -3.510) 3.693 12.315 ( 2.608 -3.999 2.633) 5.452 12.387 ( 5.980 -0.944 1.663) 6.278 12.529 ( -2.103 -7.621 -4.950) 9.328 12.775 ( 1.351 0.608 -0.568) 1.587 13.069 ( -6.733 -5.218 3.407) 9.175 13.095 ( 0.937 -1.305 2.120) 2.660 13.206 ( 3.361 -1.160 0.768) 3.638 13.342 ( 1.710 -1.295 -0.524) 2.208 13.468 ( -3.840 -3.127 -2.115) 5.385 13.835 ( -9.372 -4.101 4.775) 11.289 14.088 ( -10.366 -2.564 0.622) 10.696 14.453 ( 11.238 -2.337 1.660) 11.598 14.574 ( 2.982 5.342 -7.777) 9.895 15.360 ( 5.173 11.307 2.549) 12.693 15.727 ( 2.448 4.494 -2.402) 5.653 16.103 ( -1.801 3.759 -5.342) 6.775 16.338 ( 8.558 -8.921 -3.257) 12.784 16.423 ( 13.004 -7.467 -3.585) 15.418 16.548 ( 4.723 4.768 26.726) 27.556 17.203 ( -15.110 0.889 -13.320) 20.163 17.838 ( 1.380 10.776 6.027) 12.423 18.072 ( 9.775 3.066 -2.760) 10.610 18.547 ( 10.407 -17.908 -10.498) 23.221 19.212 ( -10.017 -0.774 -1.462) 10.152 19.732 ( -12.719 11.120 8.876) 19.084 20.623 ( -7.280 2.844 9.563) 12.351 20.668 ( -6.923 2.894 11.356) 13.611 20.921 ( -1.689 10.876 -6.315) 12.689 21.454 ( 6.724 -15.648 -14.776) 22.548 ======================= Grid point 207 (89/199) ======================= q-point: (-0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.514 ( -8.616 13.990 7.480) 18.053 2.914 ( -11.343 5.653 4.654) 13.501 3.800 ( -3.188 25.608 8.521) 27.176 4.542 ( -6.449 25.993 3.556) 27.017 4.643 ( 0.401 9.993 -4.975) 11.170 5.080 ( -0.494 2.567 -14.368) 14.604 6.083 ( -11.103 9.519 4.425) 15.280 6.167 ( -6.927 9.673 -1.126) 11.951 6.467 ( 0.169 1.389 -3.899) 4.142 6.766 ( -9.207 8.790 3.728) 13.264 6.959 ( 0.732 24.325 -3.530) 24.591 7.138 ( 4.727 -3.492 2.721) 6.477 7.315 ( 4.569 0.986 0.489) 4.700 7.446 ( -6.198 3.974 -3.571) 8.183 7.584 ( -3.329 -3.937 0.971) 5.247 7.936 ( 4.298 -18.228 -2.023) 18.837 7.966 ( 0.177 0.559 6.530) 6.556 8.221 ( -4.238 -2.426 -2.586) 5.526 8.292 ( 0.005 -2.627 -0.127) 2.631 8.394 ( -0.754 -6.602 -5.256) 8.472 8.573 ( -4.274 -8.100 2.745) 9.561 8.747 ( 2.698 -5.355 -6.179) 8.610 9.057 ( 6.644 -1.198 0.842) 6.804 9.071 ( 3.808 -2.048 2.920) 5.218 9.269 ( 4.236 -7.352 0.350) 8.492 9.354 ( -5.443 -3.211 -6.171) 8.833 9.511 ( 2.101 -5.662 4.932) 7.797 9.648 ( -5.011 -3.342 1.572) 6.225 9.843 ( -0.502 -8.109 4.010) 9.060 9.930 ( -3.556 -4.868 5.944) 8.466 10.012 ( -3.834 4.460 1.613) 6.099 10.215 ( 1.215 -11.162 -1.132) 11.284 10.379 ( 0.886 1.695 0.169) 1.920 10.639 ( 9.582 5.415 -8.974) 14.201 11.201 ( 1.339 -0.548 6.483) 6.643 11.282 ( -0.996 5.906 0.353) 6.000 11.403 ( -0.175 -1.387 0.732) 1.578 11.447 ( 2.633 -2.450 -3.310) 4.888 11.596 ( 0.474 0.099 2.511) 2.557 11.873 ( 6.239 0.200 -1.532) 6.428 12.012 ( 5.644 -5.251 -4.224) 8.791 12.065 ( 13.882 -13.940 -3.996) 20.075 12.203 ( 6.070 -5.353 -3.138) 8.680 12.402 ( 5.199 -3.635 2.911) 6.980 12.463 ( -1.595 -3.494 -0.062) 3.841 12.576 ( -1.069 -8.741 1.158) 8.882 12.809 ( 2.123 -0.779 3.074) 3.816 13.038 ( -4.486 -7.061 2.934) 8.865 13.121 ( -0.548 -1.911 1.495) 2.487 13.296 ( 5.009 -2.473 -1.097) 5.693 13.380 ( -3.945 -6.684 -2.349) 8.110 13.427 ( -2.015 -4.161 0.272) 4.631 13.743 ( -7.547 -3.985 3.264) 9.137 13.933 ( -10.567 -3.581 0.497) 11.168 14.540 ( 3.787 10.158 -1.178) 10.905 14.672 ( 8.761 -4.230 1.471) 9.839 15.342 ( 3.953 8.732 1.183) 9.658 15.707 ( 2.325 7.006 -1.242) 7.486 16.039 ( 0.631 4.140 -1.814) 4.563 16.383 ( 5.159 10.352 -15.074) 19.000 16.520 ( -9.026 2.951 2.135) 9.733 16.781 ( 4.590 -19.306 -1.020) 19.870 17.080 ( 6.176 1.190 9.897) 11.727 17.733 ( -3.161 14.018 9.008) 16.960 18.180 ( 11.107 8.785 -3.754) 14.651 18.730 ( 3.841 -1.360 -5.048) 6.487 19.105 ( -10.715 -0.172 -0.254) 10.720 19.530 ( -2.777 -8.205 -2.210) 8.939 20.454 ( -7.581 6.416 4.963) 11.102 20.586 ( -6.712 1.667 13.617) 15.273 20.770 ( -2.527 10.208 -1.137) 10.578 21.660 ( 5.653 -14.885 -14.345) 21.431 ======================= Grid point 208 (90/199) ======================= q-point: (-0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.279 ( -5.570 14.038 14.054) 20.631 2.744 ( -0.106 11.981 3.970) 12.622 3.524 ( -3.545 28.031 8.128) 29.400 4.140 ( -4.508 36.741 1.950) 37.068 4.531 ( 6.662 20.638 -5.842) 22.460 5.007 ( 0.463 3.354 -18.061) 18.376 5.830 ( -3.125 18.030 5.203) 19.024 6.045 ( 4.285 10.760 -3.962) 12.241 6.411 ( 0.926 34.821 7.235) 35.576 6.566 ( 4.236 -4.436 0.173) 6.136 6.809 ( 1.499 12.692 -0.754) 12.803 7.129 ( -5.830 16.525 -5.339) 18.318 7.290 ( 1.589 -0.296 6.826) 7.015 7.455 ( 4.075 -7.427 -0.833) 8.512 7.597 ( -2.541 -8.719 -0.950) 9.131 7.888 ( -5.151 6.329 8.070) 11.477 8.105 ( -0.770 -8.276 -8.453) 11.855 8.235 ( 2.861 1.720 -0.605) 3.393 8.266 ( 1.472 -8.405 1.441) 8.654 8.544 ( 1.639 -13.597 -3.053) 14.032 8.650 ( -1.606 -15.750 -0.650) 15.845 8.838 ( 2.051 -9.778 -5.458) 11.385 9.092 ( -0.283 -8.765 -5.693) 10.456 9.187 ( 0.902 1.306 3.555) 3.893 9.307 ( -2.126 -6.864 0.049) 7.186 9.388 ( 2.874 -3.389 -1.713) 4.762 9.564 ( 1.090 -0.645 2.303) 2.628 9.663 ( -4.422 -9.892 2.522) 11.125 9.910 ( -3.705 -6.456 1.753) 7.647 9.951 ( 4.302 0.524 6.779) 8.046 10.061 ( -1.681 -18.114 5.675) 19.057 10.344 ( -3.970 -2.547 -1.572) 4.972 10.396 ( 2.891 -14.164 -1.373) 14.521 10.691 ( 2.756 0.759 -10.842) 11.212 11.114 ( -5.226 11.625 2.809) 13.051 11.282 ( 2.172 -1.125 7.295) 7.694 11.431 ( 0.864 -1.203 -1.623) 2.197 11.515 ( -0.283 -4.926 -0.133) 4.936 11.604 ( 1.503 1.103 0.726) 2.000 11.880 ( -2.090 1.718 -3.285) 4.256 12.083 ( 2.728 -4.515 -8.442) 9.954 12.206 ( -0.314 -6.565 -4.393) 7.905 12.374 ( -8.854 -8.965 -1.143) 12.652 12.473 ( 4.900 -3.941 1.420) 6.447 12.625 ( -1.429 -9.500 5.317) 10.981 12.637 ( 8.169 -10.039 1.662) 13.049 12.860 ( 0.625 -1.273 6.424) 6.579 13.048 ( -2.386 -0.755 2.858) 3.799 13.160 ( 1.389 -8.215 -1.397) 8.448 13.349 ( -3.866 -5.052 -0.509) 6.382 13.416 ( 1.799 -7.185 -0.338) 7.414 13.453 ( 0.650 -6.707 -3.432) 7.563 13.689 ( -7.532 -5.407 4.757) 10.421 13.868 ( 1.767 -3.609 -1.052) 4.154 14.501 ( 4.019 11.553 3.998) 12.869 14.782 ( -1.925 -4.114 -0.833) 4.618 15.359 ( 6.409 6.439 5.152) 10.444 15.660 ( 1.794 8.440 -0.748) 8.661 16.048 ( -9.965 6.557 -10.589) 15.950 16.068 ( -5.824 3.010 -2.759) 7.113 16.481 ( 8.362 7.090 -14.212) 17.949 16.900 ( -0.665 -1.739 0.327) 1.891 17.292 ( 3.289 -9.134 13.190) 16.378 17.535 ( -4.355 15.351 9.540) 18.591 18.254 ( 11.102 14.209 0.494) 18.039 18.634 ( -5.977 18.750 -10.027) 22.087 18.945 ( -2.520 -3.716 9.448) 10.461 19.732 ( 5.147 -22.363 -13.736) 26.745 20.315 ( -2.258 6.963 2.819) 7.844 20.499 ( -5.003 3.202 11.066) 12.560 20.650 ( -3.090 5.826 4.975) 8.261 21.839 ( 5.117 -12.609 -13.378) 19.083 ======================= Grid point 209 (91/199) ======================= q-point: (-0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.198 ( 8.666 15.028 9.347) 19.706 2.702 ( 7.325 12.429 3.395) 14.821 3.175 ( -4.764 34.056 13.218) 36.840 3.800 ( 6.150 35.618 1.290) 36.168 4.463 ( 12.156 23.755 -2.373) 26.790 4.905 ( 2.531 10.992 -19.770) 22.762 5.690 ( 8.903 24.941 0.585) 26.489 5.965 ( 19.184 48.140 3.769) 51.959 6.268 ( 0.402 0.805 5.540) 5.613 6.617 ( -4.127 13.077 0.073) 13.713 6.740 ( 11.045 13.216 -2.460) 17.398 6.982 ( 10.038 0.268 -5.504) 11.452 7.364 ( 0.849 -2.401 9.562) 9.896 7.580 ( 1.415 -7.822 -1.420) 8.075 7.664 ( 1.237 -8.107 -4.023) 9.134 7.775 ( -4.825 2.359 5.144) 7.437 8.109 ( 2.223 -1.651 -11.896) 12.214 8.288 ( 6.315 -0.152 -0.543) 6.340 8.417 ( -0.448 -11.444 3.545) 11.989 8.638 ( -2.770 -10.088 -0.805) 10.492 8.782 ( -0.275 -12.580 2.796) 12.890 8.963 ( 2.528 -12.221 -5.731) 13.733 9.145 ( -6.811 -13.880 1.948) 15.584 9.199 ( -2.147 -3.540 -0.980) 4.254 9.383 ( 3.146 -6.088 -3.351) 7.628 9.449 ( 3.508 -7.154 -2.078) 8.234 9.614 ( 0.395 -0.677 4.116) 4.190 9.666 ( -4.031 -7.514 2.142) 8.792 9.923 ( -3.996 -6.208 0.564) 7.404 9.946 ( -8.325 1.778 5.202) 9.976 10.196 ( -5.520 -12.025 3.633) 13.721 10.292 ( -2.739 -8.024 -0.144) 8.479 10.578 ( -0.721 -18.045 -1.862) 18.155 10.628 ( -7.620 -0.659 -6.268) 9.888 10.926 ( -3.042 10.886 -1.143) 11.361 11.338 ( 1.338 0.635 6.770) 6.930 11.432 ( -0.417 0.844 -3.754) 3.871 11.517 ( -3.494 -4.520 0.066) 5.714 11.620 ( 0.646 1.554 -0.742) 1.839 11.791 ( -5.345 0.308 -1.953) 5.699 12.130 ( -5.843 -9.158 -3.314) 11.358 12.232 ( -2.299 -6.636 -4.334) 8.253 12.279 ( -6.159 -7.193 -2.399) 9.769 12.550 ( -0.401 -4.038 3.627) 5.443 12.637 ( -10.512 -14.983 3.366) 18.609 12.838 ( 2.464 -4.116 1.640) 5.070 12.884 ( 0.386 1.301 2.158) 2.549 13.032 ( -2.030 -2.832 6.348) 7.241 13.203 ( -4.426 -3.286 -1.950) 5.847 13.361 ( 2.979 -2.441 -2.175) 4.423 13.447 ( -3.538 -11.916 1.819) 12.562 13.585 ( -8.704 -5.171 3.087) 10.585 13.704 ( 12.123 -10.234 -3.917) 16.342 14.033 ( 9.633 -5.473 0.157) 11.081 14.498 ( 6.275 8.942 5.914) 12.422 14.680 ( -10.942 -0.855 -2.843) 11.338 15.375 ( -6.875 5.382 6.382) 10.815 15.575 ( -16.092 6.109 -15.445) 23.127 15.697 ( 12.624 6.204 4.099) 14.651 16.203 ( 9.187 -0.577 8.999) 12.873 16.506 ( 10.337 10.579 -18.813) 23.931 16.815 ( -6.950 4.667 1.225) 8.461 17.262 ( -11.782 -1.192 8.795) 14.751 17.503 ( 3.917 3.735 3.239) 6.307 18.155 ( -5.758 16.392 -0.182) 17.374 18.437 ( 13.988 22.450 -7.674) 27.542 19.028 ( 1.542 -3.360 10.480) 11.113 19.935 ( 0.981 -16.918 -16.847) 23.896 20.270 ( 4.072 7.293 0.973) 8.410 20.432 ( -3.360 2.772 8.405) 9.467 20.599 ( -1.831 0.061 9.896) 10.064 21.986 ( 3.917 -9.939 -12.646) 16.554 ======================= Grid point 210 (92/199) ======================= q-point: (-0.17 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.271 ( 13.966 16.961 -8.339) 23.500 2.748 ( 11.184 13.371 5.899) 18.402 2.969 ( 12.238 23.351 25.547) 36.711 3.671 ( 15.584 30.975 2.494) 34.764 4.414 ( 8.053 24.708 0.294) 25.989 4.836 ( 14.368 15.981 -18.694) 28.483 5.592 ( 10.281 30.013 -2.639) 31.835 5.847 ( 21.184 48.319 3.091) 52.849 6.309 ( 11.571 7.803 1.569) 14.045 6.547 ( 2.345 -1.485 -2.960) 4.058 6.800 ( 14.888 15.142 -0.085) 21.235 7.227 ( 8.239 -5.525 0.941) 9.965 7.413 ( -0.382 -3.353 7.922) 8.611 7.606 ( -3.977 -2.325 -5.214) 6.958 7.680 ( 0.496 3.868 1.041) 4.036 7.801 ( 2.521 -9.226 -4.659) 10.639 8.165 ( 4.894 -1.523 -9.537) 10.827 8.414 ( 2.303 -5.675 -1.802) 6.384 8.484 ( -0.329 -6.670 5.079) 8.390 8.657 ( -4.255 -7.418 -1.627) 8.705 8.853 ( -4.189 -5.672 3.533) 7.887 9.119 ( 1.174 -12.141 -4.581) 13.030 9.139 ( -6.811 -4.787 6.546) 10.590 9.181 ( -5.320 -13.685 0.278) 14.685 9.450 ( 2.050 -3.694 -3.245) 5.327 9.567 ( -4.548 2.106 1.451) 5.217 9.635 ( -1.760 -8.289 1.465) 8.600 9.637 ( -14.197 8.645 2.717) 16.842 9.736 ( 1.808 -10.510 -0.390) 10.672 9.940 ( -3.308 -10.698 -2.343) 11.441 10.202 ( -2.759 -1.226 7.707) 8.277 10.302 ( -8.507 -6.564 1.629) 10.868 10.495 ( -6.669 -7.738 -2.548) 10.529 10.665 ( -6.666 -13.398 -3.131) 15.289 10.830 ( -1.647 -0.193 -5.490) 5.735 11.347 ( 0.941 5.490 4.051) 6.888 11.374 ( -2.389 3.552 -3.380) 5.454 11.482 ( -6.503 -3.956 -2.333) 7.961 11.581 ( -2.182 -0.538 -3.691) 4.322 11.742 ( -0.251 0.017 4.257) 4.264 12.065 ( -11.912 -16.708 -0.457) 20.524 12.219 ( -4.981 -4.730 -1.822) 7.107 12.319 ( -0.260 -7.001 -1.290) 7.124 12.535 ( -9.144 -4.762 -0.300) 10.314 12.604 ( -8.059 -11.649 4.934) 15.000 12.844 ( -3.774 -1.416 1.262) 4.224 12.912 ( 3.685 -0.825 -0.324) 3.790 12.986 ( -6.927 -3.424 4.079) 8.737 13.201 ( -1.218 -5.900 -2.684) 6.595 13.390 ( -3.388 -3.104 -1.743) 4.914 13.494 ( -6.471 -2.579 3.535) 7.811 13.534 ( -0.749 -10.169 4.406) 11.108 13.961 ( 5.235 -7.403 -2.853) 9.505 14.208 ( 5.803 -1.588 -2.422) 6.485 14.504 ( -7.292 -0.647 -2.471) 7.726 14.575 ( 7.794 3.985 4.336) 9.768 15.054 ( -14.664 2.172 -4.355) 15.451 15.420 ( -1.150 2.583 -4.176) 5.043 15.943 ( 16.321 5.123 11.907) 20.842 16.346 ( 3.290 4.037 13.566) 14.531 16.504 ( 6.359 13.954 -5.782) 16.389 16.727 ( 4.730 -2.489 -5.095) 7.384 17.060 ( -15.144 -3.566 -8.561) 17.758 17.537 ( 8.140 5.661 -1.557) 10.036 17.971 ( 0.240 9.828 -4.222) 10.699 18.452 ( 13.900 24.705 1.363) 28.380 19.088 ( -1.041 -1.588 9.952) 10.131 19.971 ( -6.025 -9.609 -16.498) 20.020 20.293 ( 6.990 8.953 0.648) 11.377 20.376 ( -2.660 2.712 4.937) 6.230 20.657 ( 1.323 -5.598 13.668) 14.829 22.063 ( -0.160 -6.577 -13.109) 14.667 ======================= Grid point 211 (93/199) ======================= q-point: (-0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.225 ( 3.643 14.489 -2.825) 15.205 2.919 ( 15.140 5.604 13.141) 20.816 3.241 ( 29.610 15.371 15.321) 36.712 3.746 ( 26.219 24.886 2.650) 36.246 4.287 ( 11.623 29.919 -4.408) 32.398 4.921 ( 10.655 5.388 -19.586) 22.939 5.490 ( 12.326 22.757 2.300) 25.983 5.830 ( 24.541 34.895 -2.035) 42.709 6.466 ( 13.991 11.205 4.860) 18.572 6.683 ( 18.938 11.604 -5.249) 22.822 6.922 ( 11.170 4.162 1.041) 11.966 7.260 ( -7.044 -3.840 4.781) 9.340 7.428 ( -9.494 -5.291 5.148) 12.027 7.523 ( 1.041 3.159 -8.670) 9.286 7.702 ( 6.031 4.447 -0.850) 7.541 7.891 ( 0.288 -5.361 -6.394) 8.349 8.137 ( -3.010 6.795 -2.121) 7.728 8.424 ( -7.328 -6.667 -5.942) 11.552 8.571 ( 0.515 -3.983 7.237) 8.276 8.602 ( -7.936 3.589 -2.077) 8.954 8.807 ( -4.365 -9.043 0.896) 10.081 9.096 ( -4.036 -6.261 2.984) 8.024 9.155 ( -7.956 -7.397 4.129) 11.622 9.220 ( -5.208 -2.415 1.632) 5.968 9.389 ( -3.414 -4.551 1.330) 5.843 9.437 ( -5.403 -1.666 -4.346) 7.131 9.549 ( 5.570 4.552 -1.086) 7.275 9.704 ( -3.583 -9.810 0.779) 10.473 9.787 ( -3.239 -2.407 -1.265) 4.229 10.022 ( -2.008 0.085 4.980) 5.370 10.096 ( -7.209 -7.552 3.048) 10.876 10.312 ( -5.905 -14.546 3.077) 15.998 10.510 ( -2.752 -8.486 -2.531) 9.273 10.615 ( -10.608 -10.129 -4.586) 15.367 10.805 ( -3.092 -4.011 -4.123) 6.530 11.280 ( 1.772 6.546 -7.244) 9.923 11.321 ( 0.369 3.814 6.644) 7.670 11.399 ( -6.032 -3.735 -2.596) 7.554 11.560 ( -1.034 -1.807 -3.004) 3.655 11.780 ( 2.472 0.555 5.700) 6.238 12.084 ( -9.892 -15.342 -1.679) 18.332 12.127 ( -6.955 -4.579 -0.433) 8.338 12.346 ( -4.997 -7.530 1.856) 9.225 12.410 ( -8.795 -5.272 0.478) 10.265 12.578 ( -6.162 -2.570 6.533) 9.341 12.790 ( -5.826 -1.272 -2.111) 6.326 12.936 ( -5.616 -4.951 1.541) 7.643 13.002 ( 2.499 -7.153 0.191) 7.579 13.205 ( -3.862 -5.389 -3.396) 7.450 13.341 ( -5.033 -3.589 -0.122) 6.182 13.420 ( -7.092 -3.652 1.987) 8.221 13.611 ( -2.376 -7.574 4.340) 9.047 13.981 ( -3.200 -2.554 -1.340) 4.308 14.182 ( -5.132 4.597 -2.155) 7.219 14.471 ( 2.356 -1.558 -3.941) 4.848 14.673 ( 4.733 -0.272 3.696) 6.011 15.033 ( 6.890 -10.340 -8.180) 14.876 15.389 ( 1.532 3.218 -0.585) 3.612 16.008 ( -1.640 16.011 11.242) 19.632 16.366 ( -9.741 8.467 15.284) 20.005 16.519 ( 18.625 1.011 9.706) 21.027 16.812 ( -0.347 2.955 -18.944) 19.176 16.999 ( 7.638 -13.150 -11.655) 19.160 17.690 ( 16.084 2.055 -8.335) 18.231 17.928 ( 4.663 5.085 0.394) 6.910 18.416 ( 9.837 25.789 6.282) 28.308 19.087 ( -4.389 -1.865 9.837) 10.933 19.821 ( -15.259 -6.540 -15.756) 22.888 20.291 ( -0.246 5.154 2.811) 5.876 20.364 ( 7.007 7.330 1.321) 10.226 20.809 ( 3.994 -6.343 15.528) 17.242 22.013 ( -5.607 -1.678 -14.876) 15.986 ======================= Grid point 217 (94/199) ======================= q-point: (-0.58 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.921 ( 1.482 -0.000 -1.154) 1.879 3.091 ( -20.803 0.000 8.386) 22.429 4.344 ( -1.560 0.000 0.041) 1.561 4.671 ( -6.953 0.000 4.877) 8.493 4.870 ( 2.215 -0.000 -0.769) 2.345 5.179 ( 0.256 -0.000 -8.285) 8.289 6.332 ( -9.653 0.000 2.553) 9.985 6.554 ( -3.935 0.000 2.312) 4.564 6.744 ( -5.845 0.000 -7.761) 9.716 6.764 ( -1.489 0.000 1.610) 2.193 7.037 ( -12.922 0.000 -4.773) 13.775 7.214 ( 3.258 -0.000 2.975) 4.412 7.252 ( 2.507 -0.000 -0.235) 2.518 7.440 ( 17.201 -0.000 0.308) 17.203 7.555 ( 2.158 -0.000 4.557) 5.042 7.566 ( 3.716 -0.000 1.809) 4.133 7.919 ( 4.007 -0.000 -5.585) 6.874 8.058 ( -15.222 0.000 -3.640) 15.651 8.269 ( -0.769 0.000 -2.924) 3.023 8.548 ( 13.274 -0.000 2.446) 13.497 8.609 ( -7.876 0.000 2.829) 8.369 8.836 ( 2.571 -0.000 5.652) 6.209 8.848 ( -14.824 0.000 -9.685) 17.708 9.013 ( -4.190 0.000 0.325) 4.203 9.114 ( 0.756 -0.000 -2.277) 2.399 9.312 ( 2.016 -0.000 10.709) 10.897 9.328 ( -0.127 0.000 -8.162) 8.163 9.742 ( -5.000 0.000 -0.335) 5.011 9.875 ( -11.805 0.000 9.268) 15.009 9.903 ( -0.378 0.000 -1.130) 1.191 10.063 ( -8.092 0.000 3.681) 8.890 10.224 ( 13.647 -0.000 6.958) 15.318 10.525 ( -11.639 0.000 -2.576) 11.921 10.663 ( 2.524 -0.000 -8.399) 8.770 11.165 ( 9.123 -0.000 1.642) 9.269 11.185 ( 17.882 -0.000 -0.519) 17.889 11.381 ( 3.612 -0.000 0.654) 3.671 11.400 ( 4.088 -0.000 0.018) 4.088 11.535 ( 4.655 -0.000 1.827) 5.001 11.536 ( 7.987 -0.000 -1.459) 8.119 11.622 ( 1.644 -0.000 -3.326) 3.710 11.903 ( 5.477 -0.000 -0.183) 5.480 12.205 ( -0.495 0.000 7.982) 7.997 12.222 ( 3.313 -0.000 -2.195) 3.974 12.390 ( 6.682 -0.000 -4.327) 7.960 12.450 ( -3.213 0.000 -5.276) 6.178 12.787 ( 1.461 -0.000 -1.069) 1.811 13.019 ( -6.486 0.000 4.105) 7.676 13.063 ( -2.117 0.000 2.413) 3.210 13.196 ( 3.062 -0.000 1.176) 3.280 13.328 ( 0.961 -0.000 -0.269) 0.998 13.440 ( -4.566 0.000 -4.673) 6.533 13.793 ( -9.057 0.000 6.269) 11.016 14.064 ( -10.111 0.000 0.369) 10.117 14.428 ( 11.015 -0.000 1.632) 11.135 14.633 ( 5.652 -0.000 -8.849) 10.501 15.521 ( 1.744 -0.000 -4.456) 4.786 15.842 ( 8.062 -0.000 8.098) 11.427 15.976 ( 7.950 -0.000 1.181) 8.038 16.150 ( -0.999 0.000 -3.547) 3.685 16.487 ( 7.641 -0.000 -11.737) 14.005 16.598 ( 5.418 -0.000 30.434) 30.912 17.216 ( -13.089 0.000 -14.518) 19.547 18.023 ( 7.227 -0.000 -5.314) 8.970 18.160 ( 10.003 -0.000 -0.189) 10.005 18.205 ( 12.197 -0.000 -3.226) 12.617 19.218 ( -14.427 0.000 -1.683) 14.524 19.851 ( -15.431 0.000 10.949) 18.921 20.633 ( -6.453 0.000 12.984) 14.499 20.705 ( -9.517 0.000 8.239) 12.587 21.159 ( 1.592 -0.000 -11.687) 11.795 21.173 ( 6.983 -0.000 -12.398) 14.229 ======================= Grid point 219 (95/199) ======================= q-point: (-0.50 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.737 ( -14.942 8.087 9.611) 19.520 2.948 ( -2.712 -1.137 0.910) 3.078 4.234 ( -1.449 17.757 3.322) 18.123 4.630 ( -2.880 -7.047 -0.325) 7.620 4.854 ( -0.921 6.142 0.203) 6.214 5.139 ( -0.225 2.492 -8.573) 8.931 6.175 ( -9.007 1.450 4.421) 10.138 6.409 ( -6.352 11.238 -0.268) 12.912 6.538 ( -4.443 8.575 -4.166) 10.518 6.776 ( -8.866 -3.393 -1.498) 9.611 6.905 ( -0.657 -9.565 1.142) 9.655 7.273 ( 1.336 -2.194 2.236) 3.406 7.304 ( 4.225 0.959 -0.060) 4.333 7.506 ( -1.571 2.085 -5.532) 6.117 7.597 ( 0.978 -2.626 -2.033) 3.462 7.765 ( -0.736 -3.076 -0.556) 3.211 7.907 ( 15.738 2.075 2.772) 16.114 8.065 ( 2.663 -7.998 -5.210) 9.910 8.307 ( 5.478 2.664 1.130) 6.195 8.443 ( -13.947 8.188 -2.348) 16.343 8.529 ( -8.373 0.478 -0.715) 8.417 8.767 ( 10.098 5.534 0.644) 11.533 8.978 ( 4.941 -5.571 4.863) 8.894 9.028 ( 1.582 -11.061 -1.198) 11.238 9.121 ( 1.282 0.083 3.633) 3.854 9.317 ( 2.600 -0.255 -7.593) 8.030 9.386 ( -1.214 -4.990 8.223) 9.695 9.666 ( -3.400 2.390 -1.793) 4.527 9.730 ( -8.166 -1.544 7.706) 11.334 9.906 ( -10.375 -0.188 4.681) 11.384 9.954 ( 2.052 -6.173 -1.036) 6.587 10.229 ( -8.546 6.669 0.541) 10.854 10.379 ( -3.275 -1.997 -1.360) 4.070 10.740 ( 8.956 3.587 -6.188) 11.461 11.201 ( -0.013 0.435 4.475) 4.496 11.337 ( 6.212 2.010 -0.373) 6.540 11.414 ( -1.526 0.115 -2.176) 2.660 11.427 ( 0.314 -0.012 -1.294) 1.331 11.608 ( 1.559 0.950 4.103) 4.491 11.802 ( 13.354 -5.569 -1.381) 14.535 11.840 ( 18.812 -6.708 -3.880) 20.345 11.968 ( 3.350 -0.101 -0.764) 3.437 12.174 ( -1.075 2.205 -0.948) 2.630 12.291 ( -1.177 -8.408 0.537) 8.507 12.392 ( -1.915 -1.960 -4.694) 5.435 12.497 ( 5.057 -0.164 1.745) 5.352 12.814 ( 2.215 0.492 1.540) 2.743 12.931 ( -6.458 -2.287 4.298) 8.088 13.042 ( -3.781 -5.277 3.153) 7.217 13.250 ( 1.057 -0.988 0.637) 1.581 13.339 ( -1.143 0.373 -5.463) 5.594 13.363 ( -0.462 -2.282 -2.161) 3.176 13.694 ( -6.534 -1.233 6.016) 8.967 13.893 ( -8.945 -0.862 -0.917) 9.033 14.619 ( 8.600 -1.404 1.868) 8.912 14.687 ( 5.429 4.346 -3.325) 7.708 15.509 ( 2.711 6.773 -1.339) 7.417 15.857 ( 3.236 9.793 0.582) 10.330 16.094 ( 0.359 0.878 -2.610) 2.777 16.265 ( 3.766 -18.843 1.969) 19.316 16.544 ( -12.168 3.104 -4.672) 13.399 16.602 ( 5.078 -0.838 -4.170) 6.625 17.170 ( 9.337 4.025 13.433) 16.847 18.022 ( 3.556 14.636 -2.516) 15.270 18.299 ( 13.692 5.299 -2.678) 14.924 18.538 ( 12.308 -17.225 -6.682) 22.200 19.010 ( -10.560 -3.156 1.363) 11.106 19.552 ( -19.467 3.645 5.439) 20.539 20.534 ( -8.453 1.939 9.526) 12.882 20.578 ( -8.745 -0.461 11.667) 14.588 21.042 ( 2.760 15.553 -8.972) 18.166 21.365 ( 5.652 -15.625 -12.194) 20.610 ======================= Grid point 220 (96/199) ======================= q-point: (-0.42 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.502 ( -6.296 8.704 10.736) 15.188 2.912 ( 0.804 5.505 1.604) 5.790 4.025 ( -0.614 24.266 6.026) 25.010 4.665 ( 1.308 4.012 -2.643) 4.980 4.719 ( -1.177 12.043 -0.112) 12.101 5.094 ( 2.230 3.956 -10.661) 11.588 6.048 ( -2.043 6.618 3.408) 7.720 6.207 ( -0.767 13.065 -1.907) 13.225 6.496 ( 5.003 -0.131 0.842) 5.075 6.681 ( -3.081 1.160 -1.835) 3.769 7.006 ( -0.600 -9.279 -0.395) 9.307 7.298 ( -0.549 0.467 1.784) 1.924 7.352 ( 3.350 2.908 1.484) 4.677 7.443 ( 0.617 6.579 -6.040) 8.952 7.542 ( -2.188 4.290 1.772) 5.131 7.867 ( 3.897 -10.088 -0.646) 10.834 8.039 ( -6.955 4.757 0.494) 8.441 8.177 ( 11.165 1.181 2.119) 11.426 8.247 ( -0.367 -8.023 -7.806) 11.200 8.358 ( 1.236 3.301 1.412) 3.797 8.431 ( -5.825 -5.385 1.269) 8.034 8.808 ( 4.075 6.498 -2.318) 8.012 9.009 ( -4.342 -0.905 -3.998) 5.971 9.136 ( 0.048 -10.948 6.751) 12.862 9.250 ( 2.028 3.760 2.194) 4.802 9.339 ( 3.453 -2.728 -3.658) 5.723 9.449 ( -0.795 -10.444 5.065) 11.635 9.577 ( -2.172 1.877 0.543) 2.921 9.728 ( -3.794 -10.104 3.734) 11.420 9.813 ( -1.415 -4.792 4.120) 6.476 10.062 ( -4.642 0.235 1.037) 4.762 10.084 ( 4.518 -6.529 -0.568) 7.961 10.381 ( 0.943 -0.429 -0.151) 1.047 10.742 ( -1.245 3.668 -9.547) 10.303 11.233 ( -0.048 0.734 5.907) 5.953 11.329 ( -0.938 5.611 0.500) 5.711 11.419 ( 2.319 1.005 1.781) 3.092 11.442 ( 0.924 -2.707 -1.819) 3.389 11.633 ( 1.513 1.195 3.495) 3.992 11.908 ( -1.329 0.414 -3.810) 4.056 12.001 ( -0.385 -3.807 -7.080) 8.048 12.086 ( 1.337 -5.132 -5.277) 7.481 12.189 ( -4.841 -8.727 0.272) 9.984 12.304 ( -3.867 -11.935 -1.193) 12.603 12.502 ( 8.602 -5.367 3.896) 10.862 12.537 ( 1.098 1.374 3.042) 3.514 12.852 ( 0.953 0.913 5.250) 5.414 12.937 ( 1.815 -8.600 0.941) 8.840 13.054 ( -3.101 -5.220 3.957) 7.247 13.223 ( -2.913 -3.418 -3.480) 5.682 13.358 ( 3.975 -1.626 -4.450) 6.184 13.378 ( -1.815 -2.330 -1.391) 3.265 13.629 ( -4.672 -1.223 5.318) 7.184 13.820 ( 0.245 -1.536 -1.196) 1.962 14.703 ( 4.072 8.429 1.545) 9.488 14.718 ( -0.031 -2.262 1.444) 2.684 15.496 ( 4.256 7.617 3.254) 9.313 15.812 ( 1.322 7.876 -0.097) 7.987 16.098 ( 3.091 1.540 0.212) 3.460 16.155 ( -22.448 3.320 -16.337) 27.961 16.441 ( -0.531 -13.853 -6.672) 15.385 16.740 ( 5.560 -5.715 -3.618) 8.756 17.338 ( 8.487 7.433 20.954) 23.798 17.858 ( -3.611 18.715 2.125) 19.178 18.453 ( 10.785 6.876 -0.252) 12.793 18.812 ( 9.570 -2.106 -7.764) 12.502 18.929 ( -5.843 -1.185 3.244) 6.788 19.309 ( -9.785 -14.888 -3.111) 18.085 20.416 ( -4.364 3.431 5.575) 7.867 20.486 ( -7.544 -0.678 12.947) 15.000 20.919 ( 4.017 16.859 -5.484) 18.178 21.571 ( 5.409 -15.237 -11.042) 19.579 ======================= Grid point 221 (97/199) ======================= q-point: (-0.33 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.446 ( 7.394 10.790 7.313) 14.986 2.898 ( 4.726 7.674 2.946) 9.482 3.776 ( -1.855 29.089 8.405) 30.336 4.447 ( 2.173 29.299 -0.504) 29.383 4.744 ( 5.422 3.938 -2.014) 6.997 5.069 ( 5.310 7.202 -13.102) 15.866 6.019 ( 7.604 10.543 0.967) 13.035 6.180 ( 6.708 3.178 0.876) 7.474 6.579 ( 0.504 5.906 -2.932) 6.613 6.701 ( 11.478 2.107 4.371) 12.462 7.048 ( 5.546 6.489 -1.305) 8.635 7.208 ( -3.256 15.840 -1.567) 16.247 7.367 ( 2.067 4.411 7.309) 8.783 7.408 ( 1.294 -3.163 -0.936) 3.543 7.512 ( -1.421 -5.886 -4.213) 7.377 7.854 ( -6.077 1.012 0.757) 6.207 8.046 ( 2.162 -7.324 1.671) 7.817 8.257 ( 5.153 0.061 -0.552) 5.183 8.292 ( -5.029 -3.443 -3.448) 7.002 8.440 ( 9.588 -5.882 -1.345) 11.329 8.507 ( 1.848 -11.781 2.191) 12.124 8.807 ( -1.065 -5.287 -5.534) 7.727 8.932 ( -5.302 -3.253 -0.627) 6.252 9.169 ( -2.494 -1.789 3.991) 5.035 9.279 ( 1.825 -3.886 -0.455) 4.317 9.358 ( -1.882 -2.941 -5.376) 6.410 9.514 ( -1.832 -6.369 3.320) 7.412 9.629 ( 4.745 -0.670 3.733) 6.075 9.769 ( -4.313 -10.755 2.308) 11.815 9.941 ( 4.501 -6.559 4.489) 9.134 10.023 ( -1.715 2.319 3.743) 4.725 10.164 ( -5.886 -8.583 -2.301) 10.659 10.407 ( 3.724 1.007 0.370) 3.875 10.640 ( -3.313 1.696 -8.797) 9.552 11.123 ( -7.015 8.492 2.490) 11.293 11.326 ( -0.263 -1.895 2.741) 3.343 11.437 ( 1.569 1.728 0.339) 2.358 11.464 ( -1.391 -1.677 0.862) 2.343 11.662 ( 1.941 1.102 2.766) 3.554 11.819 ( -4.486 2.213 -4.339) 6.622 11.939 ( -14.766 -10.218 -4.198) 18.441 12.077 ( -5.948 -7.754 -5.686) 11.306 12.159 ( -2.556 -7.541 -1.989) 8.207 12.337 ( -9.461 -14.044 0.954) 16.961 12.507 ( -2.043 0.022 3.473) 4.029 12.740 ( 6.790 -6.431 1.581) 9.485 12.888 ( 1.743 -0.282 5.456) 5.734 12.998 ( -4.440 -0.604 1.520) 4.731 13.103 ( 2.280 -8.145 0.653) 8.483 13.253 ( -0.970 -7.454 -0.893) 7.570 13.341 ( -1.353 -0.332 -2.431) 2.802 13.457 ( 1.759 -6.966 -1.844) 7.417 13.612 ( 3.695 -0.136 2.271) 4.339 13.933 ( 9.043 -4.613 0.065) 10.152 14.642 ( -8.607 -0.036 -0.723) 8.637 14.695 ( 2.635 8.355 4.411) 9.809 15.493 ( -2.678 7.145 7.768) 10.888 15.682 ( -20.477 4.619 -17.607) 27.398 15.803 ( 7.656 4.975 2.877) 9.573 16.193 ( 7.677 -0.672 3.061) 8.292 16.505 ( -2.100 -10.763 -10.075) 14.891 16.820 ( 0.880 -3.408 -10.781) 11.341 17.366 ( -4.267 13.136 21.065) 25.189 17.643 ( -1.588 10.845 4.455) 11.832 18.389 ( -11.820 7.707 2.369) 14.308 18.795 ( 12.488 14.579 -12.791) 23.068 19.037 ( 10.821 3.628 9.020) 14.548 19.441 ( -5.189 -31.004 -9.206) 32.755 20.372 ( 0.639 2.814 4.962) 5.739 20.425 ( -3.293 1.414 10.148) 10.762 20.828 ( 5.694 16.351 -2.356) 17.473 21.759 ( 4.030 -13.584 -9.717) 17.181 ======================= Grid point 222 (98/199) ======================= q-point: (-0.25 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.544 ( 13.692 11.821 -0.766) 18.105 2.949 ( 9.215 7.985 0.153) 12.194 3.497 ( 1.775 29.792 16.342) 34.026 4.264 ( 10.267 29.573 1.009) 31.321 4.766 ( 6.003 10.902 -0.074) 12.446 5.054 ( 7.022 8.687 -14.675) 18.443 6.076 ( 9.704 13.914 2.829) 17.198 6.280 ( 3.184 2.083 2.197) 4.394 6.554 ( 14.819 15.285 -4.550) 21.770 6.683 ( -2.405 15.208 -1.923) 15.516 7.093 ( 8.070 11.335 2.489) 14.135 7.143 ( 6.421 -0.217 0.273) 6.430 7.390 ( -0.081 3.030 10.290) 10.727 7.474 ( -1.347 -11.720 -4.979) 12.805 7.603 ( 6.466 -7.827 -6.359) 11.979 7.803 ( 2.918 3.585 0.552) 4.655 8.117 ( 0.877 -3.761 -4.120) 5.647 8.276 ( -2.654 -9.300 -1.826) 9.842 8.353 ( 1.342 -5.626 1.555) 5.989 8.564 ( 0.978 -0.663 0.441) 1.261 8.682 ( 4.378 -10.163 1.026) 11.113 8.872 ( -4.592 -15.067 1.524) 15.824 8.924 ( 1.193 -4.461 2.239) 5.132 9.143 ( -2.454 0.902 2.541) 3.645 9.339 ( 2.548 -6.318 -6.879) 9.681 9.413 ( 0.287 -9.850 1.044) 9.910 9.519 ( -5.899 -3.957 0.665) 7.134 9.682 ( 3.169 4.771 -0.846) 5.790 9.788 ( -4.427 -9.587 0.998) 10.607 9.881 ( -6.472 10.047 3.969) 12.593 10.056 ( 0.188 -3.229 3.674) 4.895 10.161 ( -2.778 -11.670 0.419) 12.003 10.465 ( -0.113 -3.285 -0.957) 3.423 10.532 ( -3.195 6.014 -4.597) 8.216 10.917 ( -7.764 6.752 -0.725) 10.315 11.341 ( -2.169 -3.537 0.838) 4.233 11.404 ( -4.757 -1.934 -2.563) 5.739 11.472 ( 2.191 2.793 3.310) 4.853 11.645 ( -2.548 4.629 -4.452) 6.910 11.742 ( -13.919 -11.320 2.469) 18.110 11.770 ( -2.654 -2.072 0.303) 3.380 12.038 ( -9.234 -13.182 -2.419) 16.275 12.207 ( 0.141 -6.356 -2.206) 6.729 12.287 ( -12.361 -13.873 -1.015) 18.609 12.491 ( -2.845 -2.871 1.964) 4.494 12.830 ( -0.675 -1.891 2.886) 3.516 12.892 ( -0.511 -0.882 -3.346) 3.498 12.951 ( -6.372 -1.640 5.273) 8.432 13.129 ( -0.966 -1.478 -0.754) 1.920 13.340 ( -1.817 -2.050 -2.945) 4.022 13.351 ( 2.315 -9.155 4.501) 10.461 13.456 ( -3.597 -1.951 1.623) 4.402 13.817 ( 11.079 -6.433 -1.700) 12.924 14.151 ( 9.989 -4.361 -0.186) 10.901 14.462 ( -11.256 -2.545 -2.278) 11.763 14.693 ( 4.791 7.886 3.199) 9.766 15.144 ( -21.349 5.966 -3.951) 22.517 15.486 ( -1.403 4.322 -2.949) 5.417 16.007 ( 15.575 1.854 10.793) 19.040 16.353 ( 6.631 -1.235 9.316) 11.501 16.544 ( -2.483 -14.275 -12.173) 18.924 16.784 ( 4.350 7.162 -21.606) 23.174 17.106 ( -15.546 13.136 21.610) 29.685 17.629 ( 4.091 4.065 2.563) 6.311 18.121 ( -9.251 5.187 -2.196) 10.831 18.836 ( 11.100 15.179 -8.956) 20.828 19.176 ( 9.756 10.210 9.014) 16.753 19.578 ( -10.500 -29.182 -9.899) 32.555 20.364 ( -4.126 0.160 13.110) 13.745 20.442 ( 7.746 6.177 0.507) 9.921 20.789 ( 7.443 13.452 0.113) 15.374 21.889 ( 0.275 -11.293 -9.224) 14.584 ======================= Grid point 223 (99/199) ======================= q-point: (-0.17 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.546 ( 2.736 17.352 -7.905) 19.263 3.022 ( 8.618 5.366 7.026) 12.346 3.542 ( 24.058 16.700 16.420) 33.575 4.234 ( 17.061 24.969 2.365) 30.334 4.740 ( 7.305 16.664 -0.389) 18.199 5.034 ( 4.008 6.254 -16.561) 18.151 5.983 ( 1.737 24.254 5.089) 24.843 6.246 ( 2.581 9.588 -2.446) 10.226 6.597 ( 7.625 5.156 0.332) 9.211 6.834 ( 26.629 6.819 -6.077) 28.152 7.114 ( 1.116 3.514 1.556) 4.001 7.166 ( -3.067 0.435 3.218) 4.466 7.359 ( -4.855 -0.768 5.159) 7.125 7.537 ( -0.126 -6.162 -4.014) 7.355 7.755 ( 7.977 0.619 -7.407) 10.903 7.874 ( 6.155 4.826 1.564) 7.976 8.148 ( -1.542 -9.684 -4.510) 10.793 8.279 ( -7.329 -2.666 0.693) 7.829 8.468 ( 4.499 -11.369 0.445) 12.235 8.556 ( -0.172 -0.287 -2.291) 2.316 8.755 ( -0.909 2.256 0.973) 2.620 8.942 ( -5.421 -15.117 0.268) 16.062 8.995 ( -2.260 -3.421 12.749) 13.392 9.121 ( 0.239 -0.260 0.733) 0.814 9.314 ( -12.514 -3.837 -0.811) 13.114 9.423 ( -7.209 -3.536 -1.275) 8.130 9.516 ( 6.316 -4.327 -5.695) 9.542 9.704 ( 5.057 3.707 1.127) 6.371 9.780 ( -6.100 -4.043 0.296) 7.324 9.856 ( 8.350 1.641 2.642) 8.910 10.070 ( -2.062 -6.669 1.704) 7.186 10.196 ( -8.275 -2.060 4.420) 9.604 10.379 ( -3.333 0.627 -1.769) 3.825 10.498 ( 0.375 -0.866 -3.959) 4.070 10.772 ( -5.360 -0.114 -2.997) 6.142 11.307 ( -4.057 -2.429 0.962) 4.826 11.328 ( -5.959 -2.061 -4.823) 7.938 11.477 ( 2.828 7.408 1.356) 8.045 11.539 ( -2.277 1.650 -2.392) 3.692 11.671 ( -11.119 -21.494 0.108) 24.200 11.826 ( 4.083 1.515 5.192) 6.777 12.003 ( -9.535 -11.726 -2.218) 15.275 12.196 ( -11.834 -12.469 1.561) 17.262 12.258 ( -3.167 -8.057 -1.740) 8.830 12.479 ( -1.977 -3.690 0.646) 4.235 12.791 ( -4.290 2.778 2.733) 5.796 12.834 ( -7.562 -3.252 1.892) 8.447 12.941 ( 2.430 -3.102 -2.441) 4.635 13.133 ( -1.698 -1.975 -1.834) 3.186 13.289 ( -4.548 -1.435 -0.087) 4.769 13.408 ( -4.684 0.024 1.725) 4.992 13.481 ( 1.872 -6.280 4.748) 8.092 13.933 ( -2.017 -2.557 -0.160) 3.260 14.260 ( -0.433 2.860 -4.077) 4.999 14.407 ( 1.328 -5.633 -3.046) 6.540 14.668 ( -2.128 0.455 -1.903) 2.891 14.926 ( 1.974 -0.501 1.581) 2.579 15.451 ( 2.392 3.409 -0.750) 4.231 16.210 ( 3.494 4.805 11.430) 12.881 16.446 ( -0.661 -3.949 2.381) 4.658 16.643 ( 6.477 0.601 8.533) 10.730 16.709 ( -10.249 5.104 2.132) 11.646 16.896 ( 9.850 -0.466 -16.426) 19.158 17.714 ( 10.051 0.946 -2.695) 10.449 17.999 ( -1.856 1.120 -1.002) 2.388 18.804 ( 4.716 14.067 -4.422) 15.481 19.201 ( 4.206 13.765 6.154) 15.654 19.566 ( -16.556 -20.499 -9.779) 28.105 20.325 ( -4.655 0.346 12.229) 13.090 20.519 ( 8.647 8.179 0.892) 11.935 20.830 ( 9.305 7.724 3.254) 12.523 21.917 ( -4.589 -8.080 -10.160) 13.768 ======================= Grid point 224 (100/199) ======================= q-point: (-0.08 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.363 ( -2.049 12.633 1.811) 12.926 3.189 ( 10.329 1.374 6.942) 12.521 3.896 ( 26.171 12.967 11.222) 31.289 4.380 ( 23.687 15.573 1.280) 28.377 4.694 ( 7.365 17.741 -4.048) 19.631 4.964 ( 1.570 5.237 -17.296) 18.140 5.844 ( 3.930 14.922 5.251) 16.300 6.218 ( 7.961 11.365 -5.398) 14.889 6.660 ( -2.953 -2.271 5.892) 6.971 7.031 ( -2.102 -1.906 2.159) 3.566 7.113 ( 3.075 12.701 -2.666) 13.338 7.216 ( 14.248 2.699 -4.782) 15.269 7.291 ( -6.435 -2.978 5.892) 9.219 7.585 ( 4.718 -3.954 -4.017) 7.350 7.791 ( -2.275 -0.977 -10.538) 10.825 7.892 ( 9.491 7.932 3.247) 12.788 8.130 ( -8.302 3.319 -1.171) 9.018 8.246 ( 3.261 -6.315 0.802) 7.152 8.506 ( -2.337 8.788 -0.253) 9.097 8.665 ( 4.630 -3.308 -0.088) 5.691 8.703 ( 0.295 -1.857 -1.473) 2.389 8.923 ( -11.749 -5.520 2.031) 13.139 8.976 ( -4.853 -5.386 10.424) 12.697 9.161 ( 1.944 -7.090 2.172) 7.666 9.238 ( -1.464 -5.686 -3.758) 6.971 9.375 ( 1.521 -0.720 -4.090) 4.423 9.622 ( -3.428 -5.476 -5.028) 8.186 9.697 ( -0.039 1.063 0.634) 1.238 9.728 ( 2.117 5.175 -0.499) 5.614 9.901 ( -10.112 -2.038 7.754) 12.905 9.971 ( -10.289 2.137 6.016) 12.109 10.207 ( 5.064 -4.566 0.236) 6.823 10.328 ( -5.793 -3.930 0.951) 7.065 10.498 ( 0.457 0.279 -9.764) 9.779 10.688 ( -6.274 -3.292 0.395) 7.096 11.251 ( -2.658 -1.057 -3.662) 4.647 11.310 ( 0.576 -1.901 0.576) 2.068 11.477 ( 3.058 4.341 0.994) 5.402 11.505 ( -1.400 -2.553 -2.777) 4.023 11.744 ( -4.269 -14.458 -3.231) 15.418 11.889 ( 1.998 -4.840 5.407) 7.526 11.939 ( -6.058 -7.700 -0.752) 9.826 12.172 ( -6.273 -9.623 6.304) 13.104 12.238 ( -5.845 -5.216 0.178) 7.836 12.482 ( -4.509 -2.648 4.421) 6.847 12.723 ( -2.493 -2.707 -1.167) 3.861 12.746 ( -7.838 0.344 -0.738) 7.880 12.946 ( -4.193 -2.318 0.848) 4.866 13.130 ( 0.709 -3.479 -4.567) 5.785 13.230 ( -5.234 -1.763 -1.568) 5.741 13.294 ( -6.283 1.173 1.693) 6.612 13.561 ( -0.088 -3.222 5.415) 6.302 13.936 ( 1.192 -3.529 -0.170) 3.729 14.116 ( -6.678 4.054 -2.010) 8.067 14.496 ( 4.246 -2.574 -3.159) 5.885 14.691 ( 0.625 -3.880 -0.926) 4.038 15.088 ( 10.868 -6.419 -4.857) 13.524 15.496 ( 7.243 4.024 1.403) 8.404 16.122 ( -4.862 12.983 8.447) 16.235 16.312 ( -13.079 11.778 13.730) 22.323 16.472 ( -11.095 -11.658 -7.998) 17.971 16.935 ( 11.011 -4.038 13.160) 17.628 17.130 ( 20.290 -0.776 -22.928) 30.626 17.936 ( 17.267 -2.946 -7.613) 19.100 18.026 ( 4.384 -1.445 4.482) 6.434 18.721 ( 2.019 12.646 2.419) 13.032 19.103 ( -2.855 11.131 4.418) 12.312 19.370 ( -20.878 -10.764 -8.357) 24.932 20.279 ( -4.148 0.350 8.311) 9.295 20.569 ( 6.544 7.722 1.011) 10.172 20.955 ( 8.908 2.256 6.474) 11.241 21.837 ( -7.390 -3.330 -11.837) 14.347 ======================= Grid point 231 (101/199) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.589 ( -7.030 0.000 9.694) 11.975 2.962 ( 1.549 0.000 0.930) 1.807 4.365 ( 2.797 0.000 2.617) 3.830 4.536 ( -0.971 0.000 0.649) 1.168 4.876 ( 0.038 0.000 -0.215) 0.218 5.126 ( 0.289 0.000 -8.120) 8.125 6.113 ( -0.984 0.000 5.577) 5.664 6.395 ( -0.695 0.000 0.058) 0.698 6.569 ( 2.991 0.000 -3.595) 4.676 6.671 ( 0.208 0.000 -5.453) 5.457 6.819 ( -2.682 0.000 3.376) 4.312 7.263 ( -1.619 0.000 2.889) 3.312 7.344 ( 1.466 0.000 0.117) 1.471 7.460 ( -2.816 0.000 -8.750) 9.192 7.637 ( 6.612 0.000 -0.730) 6.652 7.757 ( 1.894 0.000 -1.633) 2.500 7.990 ( -10.342 0.000 -4.426) 11.249 8.123 ( 8.366 0.000 -6.707) 10.722 8.364 ( -8.030 0.000 6.243) 10.171 8.394 ( -1.211 0.000 2.100) 2.425 8.470 ( 11.451 0.000 -0.458) 11.460 8.894 ( -1.600 -0.000 3.688) 4.020 8.909 ( -0.010 0.000 -0.425) 0.425 9.131 ( 4.035 0.000 9.181) 10.029 9.176 ( 4.587 0.000 2.845) 5.398 9.343 ( -4.467 0.000 4.865) 6.605 9.351 ( 3.440 -0.000 -6.581) 7.425 9.593 ( -7.920 0.000 4.766) 9.244 9.653 ( -1.086 0.000 -2.100) 2.364 9.765 ( -1.334 0.000 3.827) 4.052 9.941 ( 0.611 0.000 -1.004) 1.175 10.144 ( -3.296 0.000 -1.301) 3.544 10.365 ( 4.115 0.000 1.425) 4.354 10.786 ( -3.232 0.000 -8.594) 9.181 11.235 ( 1.444 0.000 5.470) 5.657 11.393 ( -1.707 0.000 -1.502) 2.274 11.409 ( 0.847 0.000 -1.720) 1.917 11.446 ( 3.807 0.000 0.737) 3.878 11.645 ( 0.830 0.000 5.194) 5.260 11.886 ( 0.614 0.000 -4.595) 4.636 11.997 ( -1.981 -0.000 -3.106) 3.685 12.015 ( 4.534 0.000 -6.952) 8.299 12.100 ( -9.933 0.000 1.807) 10.096 12.163 ( -3.549 0.000 -0.451) 3.577 12.445 ( 7.599 0.000 3.264) 8.270 12.575 ( 4.387 0.000 -1.357) 4.592 12.832 ( -1.411 0.000 3.647) 3.910 12.882 ( 1.281 0.000 4.247) 4.436 12.972 ( -0.990 -0.000 4.789) 4.890 13.203 ( -3.458 0.000 -3.794) 5.133 13.341 ( -1.317 0.000 -1.854) 2.274 13.356 ( 3.194 0.000 -4.813) 5.777 13.621 ( -3.346 0.000 5.190) 6.175 13.806 ( -0.369 0.000 -1.259) 1.312 14.694 ( 0.148 0.000 2.096) 2.101 14.791 ( 4.778 0.000 0.060) 4.779 15.590 ( 3.809 0.000 0.508) 3.842 15.952 ( 1.206 -0.000 -1.971) 2.310 16.101 ( -1.176 0.000 -2.787) 3.025 16.186 ( -20.968 0.000 -15.723) 26.209 16.200 ( -0.698 -0.000 6.317) 6.356 16.703 ( 5.647 0.000 -3.087) 6.436 17.420 ( 8.631 0.000 19.215) 21.065 18.132 ( 0.658 0.000 -8.802) 8.827 18.551 ( 4.759 -0.000 -5.687) 7.415 18.613 ( 14.234 0.000 2.125) 14.392 18.902 ( 1.906 0.000 7.139) 7.389 19.232 ( -19.812 0.000 -2.209) 19.935 20.447 ( -6.300 -0.000 8.877) 10.886 20.483 ( -5.117 0.000 8.221) 9.683 21.199 ( 5.146 0.000 -7.860) 9.395 21.308 ( 5.035 0.000 -8.997) 10.310 ======================= Grid point 233 (102/199) ======================= q-point: (-0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.596 ( 7.301 4.421 5.461) 10.132 2.988 ( 2.339 1.995 3.014) 4.305 4.279 ( 1.802 22.827 5.028) 23.443 4.651 ( 3.525 -11.801 -0.339) 12.321 4.835 ( 0.667 10.064 -0.439) 10.096 5.127 ( 3.048 -0.355 -8.907) 9.421 6.162 ( 7.075 4.234 3.866) 9.107 6.352 ( 2.065 11.433 -1.482) 11.712 6.612 ( 6.238 4.391 -3.465) 8.378 6.760 ( 11.997 0.539 -0.383) 12.016 6.890 ( 1.392 -13.523 2.003) 13.741 7.258 ( -0.848 -1.434 2.845) 3.297 7.356 ( -1.499 -2.573 -3.161) 4.343 7.398 ( -4.778 -4.205 -4.791) 7.967 7.675 ( 6.595 14.035 -2.216) 15.665 7.791 ( -12.397 -5.837 0.106) 13.703 7.881 ( 5.645 -6.537 2.232) 8.921 8.167 ( -12.415 -5.818 -1.402) 13.783 8.272 ( 6.005 -6.009 -6.215) 10.526 8.394 ( 2.688 6.736 4.037) 8.300 8.580 ( 6.991 6.427 -0.456) 9.507 8.779 ( -7.138 6.594 0.968) 9.765 8.963 ( -1.839 -2.915 -0.250) 3.456 9.117 ( 0.894 0.990 7.575) 7.692 9.261 ( -2.199 1.093 3.535) 4.304 9.297 ( -1.435 -4.340 -0.569) 4.607 9.404 ( 3.150 -4.435 -4.661) 7.163 9.580 ( 3.951 -4.759 4.977) 7.939 9.615 ( -2.905 -1.461 1.595) 3.622 9.906 ( 11.410 -0.996 3.372) 11.940 9.955 ( -1.581 -3.023 0.888) 3.525 10.144 ( 0.451 1.689 -1.184) 2.112 10.460 ( 6.417 2.430 2.399) 7.269 10.679 ( -1.789 1.629 -8.942) 9.264 11.227 ( -4.211 1.841 3.610) 5.844 11.330 ( -3.288 2.765 0.059) 4.297 11.423 ( -0.334 -1.421 -1.538) 2.121 11.490 ( 1.984 1.657 1.006) 2.774 11.653 ( -4.026 -1.125 4.994) 6.512 11.770 ( -18.008 -5.997 -3.731) 19.343 11.866 ( -3.287 2.391 -3.099) 5.111 11.947 ( -9.362 -6.098 -2.736) 11.503 12.016 ( -4.049 -4.043 -3.017) 6.469 12.155 ( -2.823 -5.059 -1.140) 5.904 12.542 ( -0.323 1.469 2.462) 2.886 12.640 ( 5.134 -1.709 -0.887) 5.483 12.887 ( 3.065 -1.399 4.812) 5.875 12.945 ( 4.382 -4.099 3.287) 6.842 12.983 ( -3.600 -1.745 2.762) 4.862 13.166 ( 0.396 -2.007 -2.997) 3.628 13.317 ( -1.367 -1.737 -2.356) 3.231 13.384 ( 1.122 -0.923 -3.608) 3.889 13.634 ( 4.409 1.247 4.396) 6.349 13.868 ( 6.901 -1.983 -1.119) 7.267 14.624 ( -9.561 -0.666 0.909) 9.627 14.842 ( 4.061 4.760 1.533) 6.442 15.641 ( 1.780 6.938 5.869) 9.260 15.740 ( -22.443 1.279 -16.800) 28.063 15.898 ( 0.940 5.734 1.253) 5.944 16.128 ( 0.090 -9.446 -3.532) 10.085 16.271 ( 0.427 -6.111 3.804) 7.211 16.764 ( 1.759 -1.811 -3.039) 3.951 17.547 ( 3.765 4.016 13.797) 14.855 17.965 ( -5.461 19.144 -3.791) 20.265 18.472 ( -11.850 1.704 -0.376) 11.977 18.846 ( -4.455 -21.766 7.732) 23.524 19.007 ( 2.546 2.344 -19.517) 19.822 19.111 ( 17.239 2.598 10.301) 20.250 20.399 ( -1.699 0.654 6.543) 6.791 20.461 ( 0.722 1.179 4.903) 5.094 21.150 ( 5.426 16.666 -4.597) 18.120 21.477 ( 4.130 -15.520 -7.234) 17.614 ======================= Grid point 234 (103/199) ======================= q-point: (-0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.735 ( 13.524 8.291 0.937) 15.891 3.042 ( 5.978 1.597 2.151) 6.551 4.055 ( -0.925 27.902 7.899) 29.014 4.724 ( 3.288 15.488 -0.831) 15.854 4.814 ( 4.796 -4.301 0.881) 6.503 5.157 ( 3.740 1.649 -9.855) 10.669 6.204 ( 2.553 7.886 1.929) 8.510 6.380 ( 12.262 4.045 0.721) 12.932 6.669 ( 6.789 2.385 -4.364) 8.415 6.933 ( 6.363 7.657 3.669) 10.610 7.065 ( 1.569 -12.504 0.372) 12.608 7.241 ( -3.628 6.405 2.377) 7.735 7.292 ( -4.819 -1.211 -0.191) 4.973 7.355 ( -3.184 -8.118 -6.583) 10.926 7.661 ( 9.324 10.769 -5.260) 15.185 7.731 ( -2.150 -11.185 2.374) 11.634 7.954 ( -2.910 -7.693 6.899) 10.735 8.158 ( 0.521 -3.125 -1.037) 3.334 8.336 ( -4.682 1.437 -4.895) 6.925 8.444 ( 6.333 -12.434 -1.333) 14.018 8.623 ( -0.961 -3.154 0.683) 3.367 8.754 ( 15.168 7.064 3.123) 17.021 8.914 ( -0.481 3.141 -0.876) 3.296 9.164 ( 1.065 0.086 3.927) 4.070 9.234 ( -2.061 -2.146 -0.170) 2.980 9.316 ( 1.635 -2.159 -0.560) 2.765 9.472 ( -0.133 -2.382 -3.050) 3.873 9.588 ( -4.155 -8.430 1.902) 9.589 9.741 ( 4.894 0.593 0.689) 4.978 9.956 ( -3.265 -6.566 0.236) 7.337 10.042 ( -1.337 6.474 4.566) 8.034 10.098 ( 8.283 3.605 5.058) 10.353 10.500 ( 1.333 5.294 -1.190) 5.587 10.665 ( 5.266 7.211 -6.360) 10.962 11.054 ( -11.933 7.137 1.584) 13.995 11.261 ( -5.420 -4.273 0.807) 6.949 11.381 ( -6.732 -0.425 -2.170) 7.086 11.479 ( -11.810 -7.908 1.319) 14.274 11.514 ( -4.075 -0.958 -0.681) 4.241 11.612 ( -10.808 -12.807 0.124) 16.759 11.801 ( -3.202 4.423 -2.043) 5.830 11.879 ( -0.817 -1.187 1.873) 2.364 12.023 ( -2.340 -9.669 -4.834) 11.060 12.129 ( -6.307 -6.122 -0.632) 8.812 12.481 ( -2.680 2.524 0.365) 3.700 12.730 ( -0.320 -7.223 -0.919) 7.289 12.900 ( -4.673 0.380 -1.927) 5.069 12.921 ( -1.940 -0.513 4.859) 5.257 13.101 ( 4.273 -3.729 2.484) 6.192 13.207 ( 2.137 -4.101 2.110) 5.083 13.310 ( -0.810 -1.329 -2.596) 3.026 13.402 ( -0.582 -3.284 -1.624) 3.709 13.768 ( 11.348 1.366 2.153) 11.631 14.055 ( 10.773 -5.159 -0.059) 11.944 14.425 ( -13.991 -1.308 -0.556) 14.063 14.853 ( 4.374 7.860 -0.695) 9.022 15.246 ( -24.136 4.194 -6.906) 25.453 15.591 ( -2.495 7.048 1.116) 7.560 16.005 ( 8.677 -3.392 6.969) 11.635 16.230 ( 0.268 -12.919 -0.799) 12.946 16.350 ( 4.185 -1.275 2.609) 5.094 16.783 ( 0.464 -3.151 -8.536) 9.110 17.505 ( -4.926 21.113 11.078) 24.346 17.712 ( -1.308 7.589 1.750) 7.898 18.188 ( -15.421 2.738 -1.946) 15.782 18.931 ( -11.240 -27.922 -11.689) 32.290 19.085 ( 7.973 2.494 -4.622) 9.547 19.378 ( 16.102 8.583 10.503) 21.054 20.399 ( 0.365 2.864 7.051) 7.620 20.519 ( 7.123 1.867 0.628) 7.391 21.070 ( 4.973 15.361 -1.857) 16.252 21.644 ( 0.770 -14.041 -6.247) 15.387 ======================= Grid point 235 (104/199) ======================= q-point: (-0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.826 ( 7.290 11.485 -3.389) 14.020 3.119 ( 3.420 3.909 -0.660) 5.236 3.890 ( 10.719 20.025 12.703) 26.024 4.647 ( 6.400 16.354 0.874) 17.584 4.905 ( 3.545 1.088 1.342) 3.943 5.141 ( 1.470 4.359 -11.552) 12.434 6.188 ( 1.343 3.493 3.393) 5.052 6.493 ( 4.341 12.964 3.585) 14.134 6.765 ( -2.905 9.901 -4.668) 11.325 6.847 ( 14.271 -1.658 -3.776) 14.855 7.113 ( -4.818 -0.433 3.404) 5.915 7.192 ( 0.082 -3.048 4.200) 5.190 7.277 ( -4.758 -10.146 -3.537) 11.751 7.349 ( -3.194 -4.369 -3.740) 6.579 7.747 ( 2.332 -8.133 -3.350) 9.100 7.905 ( 5.361 -6.281 2.879) 8.746 7.997 ( 3.500 2.967 -2.194) 5.086 8.166 ( -0.221 -7.841 0.071) 7.845 8.282 ( -3.262 -5.530 -1.668) 6.633 8.629 ( 6.915 0.543 0.644) 6.967 8.697 ( 4.983 -4.462 1.283) 6.811 8.893 ( 5.748 10.004 2.178) 11.742 8.983 ( 8.966 -0.259 3.607) 9.668 9.156 ( -0.500 2.763 4.799) 5.560 9.243 ( -6.317 -6.780 -3.983) 10.086 9.295 ( -8.562 -2.095 4.670) 9.975 9.460 ( 3.698 -2.577 -7.945) 9.134 9.650 ( 0.002 -7.944 0.533) 7.962 9.766 ( 4.446 3.104 1.823) 5.720 9.926 ( 0.025 -0.999 -3.598) 3.734 10.092 ( 5.478 2.689 5.415) 8.159 10.150 ( 2.545 10.147 4.893) 11.549 10.449 ( -0.173 2.127 -1.849) 2.824 10.615 ( 1.768 11.932 -2.964) 12.421 10.783 ( -13.353 0.999 -1.000) 13.427 11.208 ( -13.082 -13.475 -2.087) 18.896 11.254 ( -6.086 -4.288 -1.154) 7.533 11.369 ( -7.281 -4.465 -0.842) 8.582 11.516 ( -0.534 -0.361 3.720) 3.776 11.597 ( -10.327 -18.572 -0.612) 21.259 11.681 ( -0.796 7.346 -1.699) 7.581 11.923 ( 2.066 2.290 1.025) 3.250 12.001 ( -6.479 -7.025 -4.688) 10.644 12.118 ( -3.183 -8.144 1.945) 8.958 12.446 ( -0.429 -0.537 -0.766) 1.029 12.749 ( -5.783 -6.424 0.308) 8.649 12.841 ( -2.800 0.466 0.838) 2.960 12.881 ( -1.376 -1.120 -0.623) 1.881 13.138 ( 1.337 2.395 0.268) 2.756 13.279 ( -2.790 -0.331 -0.751) 2.908 13.349 ( 4.202 -6.130 4.204) 8.538 13.411 ( -0.854 -1.587 0.153) 1.809 13.906 ( 1.617 0.915 2.269) 2.932 14.269 ( 8.489 -3.102 -1.138) 9.109 14.278 ( -3.365 -5.649 -3.120) 7.278 14.722 ( -12.507 4.740 -11.185) 17.436 14.976 ( 0.594 4.583 8.527) 9.699 15.522 ( 1.169 4.098 0.561) 4.298 16.138 ( -4.917 -13.479 -0.707) 14.365 16.363 ( 1.068 -0.291 8.764) 8.834 16.503 ( 13.039 -4.500 8.169) 16.032 16.836 ( 7.385 -5.132 -16.136) 18.473 17.135 ( -11.580 26.587 10.950) 30.998 17.736 ( 5.665 1.314 0.390) 5.829 17.983 ( -6.713 -1.594 -2.741) 7.424 18.932 ( -7.926 -14.447 -19.111) 25.234 19.126 ( -5.330 -6.789 1.168) 8.710 19.516 ( 8.867 13.315 11.233) 19.548 20.377 ( -0.858 5.621 6.819) 8.879 20.643 ( 9.809 4.086 0.205) 10.628 21.025 ( 5.809 11.355 -0.156) 12.756 21.721 ( -4.268 -12.004 -6.369) 14.244 ======================= Grid point 236 (105/199) ======================= q-point: (-0.17 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.658 ( -6.747 17.284 -5.702) 19.410 3.171 ( 4.949 -2.539 6.671) 8.685 4.105 ( 22.471 9.161 8.948) 25.864 4.639 ( 7.267 8.857 0.625) 11.474 4.900 ( -0.969 5.807 -2.659) 6.460 5.077 ( 2.135 5.339 -9.543) 11.141 6.152 ( 0.467 13.995 3.947) 14.548 6.375 ( 1.408 7.866 0.408) 8.001 6.662 ( -2.957 4.263 -0.863) 5.259 6.974 ( -7.813 -4.077 1.945) 9.025 7.169 ( 1.451 -6.465 5.861) 8.846 7.228 ( -6.900 -2.851 -7.802) 10.799 7.247 ( 8.837 -0.490 -0.305) 8.856 7.406 ( 5.694 -10.380 -4.123) 12.537 7.788 ( -9.470 -5.659 -1.386) 11.119 7.934 ( -3.190 -9.695 -2.669) 10.550 8.066 ( 12.424 8.106 -3.381) 15.215 8.257 ( 1.004 1.314 6.220) 6.436 8.386 ( 6.713 -15.100 -5.028) 17.273 8.713 ( 4.570 6.012 2.209) 7.869 8.789 ( -3.228 -2.307 1.571) 4.267 8.846 ( 2.343 8.282 -0.373) 8.615 9.022 ( -2.721 4.867 7.446) 9.303 9.075 ( -3.477 0.030 3.108) 4.664 9.193 ( 1.791 0.174 -0.899) 2.011 9.302 ( 2.706 -6.225 -2.114) 7.109 9.483 ( -6.015 -6.282 -5.495) 10.288 9.683 ( -3.258 -2.176 2.022) 4.409 9.830 ( 3.484 5.201 1.126) 6.361 9.990 ( 1.109 6.866 0.585) 6.980 10.059 ( 1.108 3.020 2.593) 4.132 10.148 ( 4.811 3.537 1.851) 6.252 10.373 ( -3.715 7.431 1.426) 8.430 10.562 ( 3.359 6.690 -7.765) 10.786 10.625 ( -7.530 -3.486 0.516) 8.314 11.194 ( -2.176 -13.372 -3.184) 13.917 11.212 ( -4.401 -8.567 0.072) 9.631 11.323 ( -5.961 -8.606 0.728) 10.494 11.517 ( -0.774 -2.141 3.484) 4.162 11.577 ( 0.169 2.494 -1.193) 2.769 11.694 ( -3.166 -14.994 -1.232) 15.374 11.833 ( -6.000 -1.600 -2.963) 6.880 12.053 ( 3.563 -2.340 0.518) 4.293 12.136 ( -4.277 -5.867 4.169) 8.373 12.445 ( -0.069 0.111 -1.564) 1.570 12.657 ( -9.034 -2.473 0.964) 9.416 12.814 ( 1.256 2.260 3.328) 4.215 12.924 ( 0.833 -4.157 -2.684) 5.017 13.097 ( -2.463 3.299 -2.393) 4.761 13.224 ( -3.069 1.177 0.137) 3.290 13.361 ( -2.632 4.061 1.221) 4.991 13.483 ( 2.307 -4.769 4.531) 6.971 13.873 ( -2.043 -2.394 1.526) 3.498 14.203 ( -7.769 4.734 -4.699) 10.239 14.425 ( 6.549 -5.150 -2.456) 8.686 14.601 ( 1.067 -4.884 -4.086) 6.456 15.046 ( 7.320 1.916 4.621) 8.866 15.568 ( 8.537 3.261 0.127) 9.140 16.131 ( -9.731 -12.583 -2.250) 16.065 16.324 ( -5.175 1.874 5.102) 7.505 16.686 ( -12.309 21.597 15.570) 29.332 16.827 ( 7.325 -5.306 11.351) 14.514 17.070 ( 19.385 -5.282 -23.422) 30.859 17.880 ( 12.226 -2.262 -2.054) 12.602 17.977 ( 2.667 -3.384 1.958) 4.733 18.843 ( -7.784 -6.888 -16.135) 19.193 19.039 ( -13.135 -7.275 -0.890) 15.042 19.479 ( -0.469 16.315 11.880) 20.188 20.311 ( -3.174 4.709 6.783) 8.847 20.724 ( 6.066 7.767 0.245) 9.858 21.051 ( 7.187 6.751 0.835) 9.896 21.708 ( -6.555 -9.757 -7.237) 13.804 ======================= Grid point 237 (106/199) ======================= q-point: (-0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.404 ( -5.886 7.540 4.275) 10.477 3.309 ( 3.329 -4.611 2.511) 6.216 4.334 ( 8.183 6.464 3.438) 10.980 4.728 ( 5.787 -1.679 -4.669) 7.623 4.800 ( 3.389 7.863 -2.186) 8.837 5.072 ( 4.501 4.820 -3.817) 7.620 5.999 ( -1.471 14.334 3.479) 14.823 6.427 ( 8.748 2.934 -3.267) 9.788 6.536 ( -7.541 2.070 4.520) 9.033 6.911 ( -6.533 -7.475 0.275) 9.931 7.080 ( -7.685 1.421 -7.180) 10.613 7.204 ( -1.992 -4.113 8.274) 9.452 7.328 ( -2.148 -2.353 0.352) 3.205 7.620 ( -2.327 -0.911 -6.485) 6.950 7.725 ( 12.165 -7.142 -0.891) 14.134 7.932 ( -1.226 0.665 -6.766) 6.908 8.240 ( 6.600 -7.715 1.119) 10.215 8.317 ( 9.326 9.190 1.420) 13.170 8.578 ( 0.328 -10.567 -5.652) 11.988 8.591 ( -7.129 1.509 1.398) 7.420 8.701 ( -4.432 1.943 -1.214) 4.989 8.823 ( -1.874 6.143 5.590) 8.514 8.984 ( 2.691 4.708 7.708) 9.424 9.200 ( 7.969 -7.840 -2.022) 11.360 9.241 ( 7.745 2.667 -2.771) 8.647 9.359 ( -13.856 -8.321 -1.355) 16.219 9.439 ( 6.978 -3.130 -0.727) 7.682 9.618 ( -5.733 -0.406 4.481) 7.288 9.764 ( -4.441 5.753 -2.969) 7.851 9.851 ( -3.364 8.004 1.186) 8.763 9.961 ( -3.163 12.510 6.034) 14.245 10.221 ( -3.191 -3.068 -2.574) 5.121 10.285 ( -1.010 4.437 0.513) 4.579 10.473 ( -1.938 3.531 -11.203) 11.905 10.632 ( 3.508 -2.658 7.320) 8.541 11.218 ( 1.117 -0.938 -2.272) 2.699 11.305 ( -3.481 -4.386 -0.575) 5.629 11.320 ( -0.519 -8.043 1.042) 8.127 11.567 ( 1.505 0.593 -1.515) 2.216 11.690 ( 10.813 -11.321 2.587) 15.867 11.773 ( -1.066 -9.497 0.796) 9.590 11.826 ( -0.390 -9.102 0.091) 9.111 12.089 ( -2.770 -3.074 -2.876) 5.039 12.136 ( -1.141 -0.858 8.147) 8.271 12.429 ( -1.395 1.074 2.065) 2.714 12.549 ( -7.968 -3.737 -1.873) 8.998 12.776 ( -2.612 11.753 0.349) 12.045 12.890 ( -1.352 1.000 2.842) 3.303 13.078 ( -0.624 -5.314 -5.742) 7.849 13.159 ( -1.830 2.157 -1.627) 3.263 13.275 ( -0.693 6.024 0.465) 6.082 13.551 ( -0.212 -2.608 5.560) 6.145 13.924 ( 1.673 -4.949 -0.634) 5.262 14.055 ( -3.255 2.216 -0.017) 3.937 14.539 ( 4.267 -1.470 -2.927) 5.379 14.666 ( 1.802 -2.748 -2.813) 4.326 15.195 ( 8.232 -4.501 -1.300) 9.472 15.730 ( 15.523 5.957 0.789) 16.646 16.053 ( -10.237 -7.497 -0.899) 12.721 16.223 ( -7.772 -0.410 2.164) 8.078 16.290 ( -12.739 21.265 15.019) 28.984 16.956 ( -2.663 -4.857 -0.020) 5.539 17.392 ( 17.760 -8.293 -22.149) 29.577 18.087 ( 5.132 -4.050 4.559) 7.970 18.212 ( 21.602 -3.407 3.405) 22.133 18.767 ( -4.777 -10.373 -6.903) 13.344 18.846 ( -13.500 -1.056 -1.080) 13.584 19.269 ( -7.879 18.675 10.058) 22.627 20.234 ( -4.571 1.481 5.387) 7.218 20.704 ( 0.817 6.729 0.019) 6.779 21.108 ( 3.486 1.796 0.234) 3.928 21.674 ( -2.498 -4.047 -7.260) 8.679 ======================= Grid point 245 (107/199) ======================= q-point: ( 0.58 -0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.830 ( 15.906 -0.000 -0.958) 15.934 3.040 ( 1.745 -0.000 5.200) 5.485 4.506 ( 0.690 -0.000 6.163) 6.201 4.557 ( -0.215 0.000 -0.559) 0.599 4.906 ( 2.457 -0.000 0.779) 2.577 5.158 ( 4.394 -0.000 -9.124) 10.127 6.349 ( 10.366 -0.000 4.324) 11.231 6.404 ( -0.917 0.000 -2.299) 2.475 6.733 ( 2.967 -0.000 -6.284) 6.949 6.838 ( 6.254 -0.000 -2.101) 6.597 7.009 ( 9.386 -0.000 6.532) 11.435 7.220 ( -6.382 0.000 -8.990) 11.025 7.309 ( 6.706 -0.000 1.985) 6.994 7.345 ( -1.249 0.000 2.673) 2.950 7.564 ( -10.074 0.000 4.068) 10.864 7.799 ( -19.190 0.000 1.476) 19.246 7.948 ( 9.153 -0.000 5.988) 10.937 8.056 ( 21.274 -0.000 -6.762) 22.323 8.299 ( 2.041 -0.000 -4.703) 5.127 8.360 ( -18.354 0.000 -4.295) 18.850 8.583 ( 11.936 -0.000 2.043) 12.109 8.829 ( -1.529 0.000 0.459) 1.596 9.002 ( 7.542 -0.000 -2.271) 7.876 9.132 ( 0.401 -0.000 6.596) 6.608 9.269 ( -1.112 0.000 9.509) 9.573 9.278 ( 0.789 -0.000 -2.312) 2.443 9.421 ( 4.342 -0.000 -8.808) 9.820 9.514 ( -5.450 0.000 0.130) 5.451 9.740 ( 8.624 -0.000 2.446) 8.965 9.898 ( -2.784 0.000 1.518) 3.171 10.119 ( -0.362 0.000 4.595) 4.609 10.129 ( 10.941 -0.000 5.414) 12.207 10.578 ( 3.394 -0.000 -0.607) 3.448 10.750 ( 9.883 -0.000 -6.240) 11.688 11.132 ( -9.856 0.000 0.692) 9.880 11.235 ( -19.153 0.000 1.827) 19.240 11.372 ( -10.207 0.000 -0.893) 10.246 11.377 ( -9.158 0.000 -2.567) 9.511 11.436 ( -11.322 0.000 0.811) 11.351 11.531 ( -1.410 0.000 -0.846) 1.644 11.828 ( -1.805 0.000 -1.984) 2.683 11.895 ( 3.583 -0.000 4.694) 5.905 11.926 ( -2.576 0.000 -5.053) 5.672 12.053 ( -7.065 0.000 -1.671) 7.260 12.541 ( -1.959 0.000 0.133) 1.964 12.629 ( -2.258 0.000 -3.142) 3.869 12.896 ( -5.483 0.000 -1.759) 5.758 12.925 ( -1.251 0.000 4.578) 4.746 13.034 ( 8.201 -0.000 4.528) 9.367 13.185 ( 2.472 -0.000 0.873) 2.621 13.291 ( -0.032 0.000 -1.967) 1.967 13.368 ( -0.684 0.000 -3.264) 3.335 13.803 ( 11.994 -0.000 4.582) 12.839 13.991 ( 9.559 -0.000 -1.360) 9.656 14.412 ( -14.712 0.000 0.076) 14.712 14.939 ( 5.084 -0.000 -3.100) 5.954 15.289 ( -24.980 0.000 -9.900) 26.871 15.725 ( -2.937 0.000 4.617) 5.472 15.873 ( -5.695 0.000 1.723) 5.950 16.122 ( 10.287 -0.000 9.086) 13.725 16.343 ( 6.875 -0.000 -0.841) 6.927 16.744 ( -1.434 0.000 -3.657) 3.929 17.649 ( 3.366 -0.000 7.339) 8.074 17.966 ( -6.009 0.000 -5.848) 8.385 18.280 ( -13.281 0.000 -2.211) 13.464 18.435 ( -20.248 0.000 5.149) 20.892 19.150 ( 9.918 -0.000 -13.631) 16.858 19.463 ( 17.127 -0.000 10.941) 20.324 20.438 ( 4.010 -0.000 5.459) 6.774 20.529 ( 5.324 -0.000 0.552) 5.352 21.358 ( 4.502 -0.000 -3.530) 5.721 21.369 ( 0.113 -0.000 -4.137) 4.139 ======================= Grid point 247 (108/199) ======================= q-point: (-0.33 0.58 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.006 ( 7.606 8.023 0.339) 11.060 3.125 ( 5.126 -3.607 -1.222) 6.386 4.297 ( -1.634 21.680 5.262) 22.369 4.666 ( -5.739 -14.232 -0.720) 15.363 4.959 ( 6.809 5.294 3.910) 9.470 5.190 ( 1.987 0.830 -8.579) 8.845 6.328 ( 2.347 10.263 0.446) 10.538 6.559 ( 7.371 -4.975 2.850) 9.338 6.763 ( 2.909 -1.527 -3.883) 5.087 6.901 ( -3.898 -4.847 -4.390) 7.613 7.081 ( 0.868 2.695 2.798) 3.980 7.144 ( -3.889 1.360 -1.719) 4.464 7.226 ( -6.583 3.373 -1.123) 7.481 7.350 ( 0.073 2.704 4.101) 4.913 7.510 ( -8.821 -13.455 0.699) 16.104 7.760 ( 12.047 -5.397 0.987) 13.238 8.021 ( -8.663 1.411 0.527) 8.793 8.142 ( 1.062 -5.650 5.672) 8.076 8.258 ( 5.877 8.526 -5.686) 11.813 8.516 ( 18.061 -7.654 -4.389) 20.101 8.718 ( 3.818 1.195 3.673) 5.431 8.923 ( 10.907 -2.218 -4.781) 12.114 9.074 ( 5.772 2.635 -0.685) 6.382 9.153 ( -2.506 1.450 3.835) 4.805 9.243 ( 0.371 4.780 6.157) 7.804 9.296 ( -5.345 -0.578 5.418) 7.633 9.410 ( 0.902 -2.738 -7.774) 8.291 9.523 ( 3.884 -4.095 -5.011) 7.547 9.811 ( 4.569 1.405 2.079) 5.213 9.862 ( -2.317 -2.227 -0.850) 3.324 10.239 ( 11.434 7.578 7.398) 15.585 10.304 ( 8.778 2.329 7.238) 11.613 10.510 ( -4.927 5.056 -6.155) 9.367 10.797 ( -21.413 1.721 3.290) 21.733 10.834 ( -1.586 5.223 -2.045) 5.829 10.949 ( -14.876 -9.063 -2.189) 17.556 11.137 ( -13.555 -5.146 -3.508) 14.918 11.354 ( -0.956 -4.062 -2.228) 4.730 11.379 ( -0.754 1.684 -0.303) 1.870 11.523 ( -0.136 -0.161 3.062) 3.069 11.796 ( -3.296 3.201 -1.733) 4.910 11.886 ( -1.453 -4.407 -5.954) 7.548 11.926 ( -5.757 -3.400 -3.804) 7.692 11.997 ( 3.293 -1.317 8.953) 9.630 12.473 ( -1.686 3.360 -2.254) 4.384 12.610 ( -3.943 -6.758 -1.773) 8.023 12.821 ( -2.541 -0.809 -3.600) 4.480 12.896 ( -2.794 0.844 3.798) 4.790 13.186 ( 5.944 0.578 4.114) 7.252 13.237 ( 3.439 -1.876 2.795) 4.812 13.289 ( 0.402 0.310 -1.779) 1.850 13.360 ( -0.445 -3.191 -2.688) 4.196 13.984 ( 6.771 6.273 4.020) 10.068 14.140 ( -0.652 -6.907 2.423) 7.349 14.235 ( 2.789 -1.447 -3.828) 4.952 14.802 ( -19.257 2.588 -16.493) 25.487 15.068 ( 4.605 3.775 7.667) 9.708 15.613 ( -3.695 5.533 4.326) 7.936 15.859 ( -6.752 -12.388 2.502) 14.328 16.379 ( 10.888 0.736 15.609) 19.046 16.458 ( 8.860 -0.619 -3.031) 9.384 16.732 ( 2.080 -4.094 -7.781) 9.035 17.660 ( -4.349 22.355 4.334) 23.183 17.771 ( 0.383 6.096 0.905) 6.175 17.972 ( -10.795 1.654 -4.274) 11.728 18.371 ( -15.956 -32.099 -2.254) 35.917 19.202 ( 2.627 3.729 -10.258) 11.227 19.684 ( 7.881 4.145 8.558) 12.350 20.523 ( 6.560 8.298 4.464) 11.481 20.655 ( 9.232 -2.931 -0.064) 9.686 21.242 ( 0.129 11.287 -1.661) 11.409 21.482 ( -2.875 -12.315 -3.678) 13.170 ======================= Grid point 248 (109/199) ======================= q-point: (-0.25 0.58 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.969 ( -3.691 13.288 -6.710) 15.336 3.120 ( -4.429 -1.963 3.861) 6.195 4.255 ( 12.599 7.155 6.024) 15.691 4.623 ( -11.169 -9.121 -2.992) 14.728 5.023 ( 4.496 7.088 3.182) 8.976 5.149 ( -1.079 2.095 -6.387) 6.808 6.323 ( 6.963 7.425 2.016) 10.377 6.591 ( -5.317 8.656 2.489) 10.459 6.755 ( -4.029 4.011 -2.344) 6.149 6.840 ( -5.699 -10.070 -2.450) 11.827 7.014 ( -4.570 -3.664 -3.857) 7.013 7.106 ( -1.247 -6.132 -1.260) 6.383 7.237 ( 1.522 0.281 5.926) 6.125 7.358 ( 3.818 0.933 3.180) 5.056 7.546 ( -1.126 -12.909 -4.381) 13.678 7.853 ( -3.886 -2.141 0.597) 4.477 8.098 ( 11.861 -10.322 -3.529) 16.115 8.217 ( -0.749 1.297 1.713) 2.276 8.286 ( 7.576 3.623 3.706) 9.179 8.756 ( 9.647 -0.520 -4.908) 10.837 8.772 ( 2.545 0.829 2.958) 3.989 8.996 ( -9.152 3.124 3.255) 10.203 9.026 ( -7.725 -1.279 -0.227) 7.833 9.167 ( 3.154 3.776 2.849) 5.686 9.202 ( 2.008 0.287 0.578) 2.109 9.256 ( 4.660 5.406 3.720) 8.049 9.442 ( 0.402 2.007 -7.246) 7.529 9.610 ( 1.081 -4.542 -1.564) 4.924 9.896 ( 3.691 -2.828 -5.963) 7.562 9.938 ( 9.547 -1.403 4.572) 10.678 10.227 ( -7.544 7.541 -1.365) 10.754 10.304 ( 3.460 9.276 3.396) 10.466 10.514 ( -0.575 5.613 2.994) 6.388 10.560 ( -2.230 -2.882 0.606) 3.694 10.737 ( -0.527 2.962 3.943) 4.960 10.839 ( -8.744 -11.420 -3.020) 14.697 10.999 ( -8.327 -8.650 -4.626) 12.868 11.323 ( -0.287 3.288 -1.560) 3.651 11.420 ( 1.792 -5.290 -0.595) 5.617 11.536 ( -0.026 0.066 4.736) 4.736 11.648 ( -7.280 -0.129 -3.944) 8.281 11.862 ( -2.023 3.945 -0.615) 4.476 11.939 ( -0.280 -9.325 -6.516) 11.379 12.086 ( 2.994 0.056 8.447) 8.963 12.453 ( 1.519 -0.093 -4.013) 4.291 12.585 ( -5.385 -4.333 -0.274) 6.917 12.812 ( 0.217 -3.024 -1.281) 3.292 12.864 ( -0.393 0.490 1.720) 1.831 13.205 ( 0.017 6.124 -2.274) 6.533 13.255 ( 0.901 1.861 2.307) 3.098 13.383 ( 2.914 -5.620 3.349) 7.161 13.401 ( 3.268 -0.655 -0.003) 3.334 13.876 ( -7.027 2.629 3.284) 8.190 14.267 ( 4.210 0.139 -1.347) 4.422 14.342 ( 1.630 -0.868 -5.055) 5.382 14.514 ( -3.359 -4.372 -4.439) 7.078 15.141 ( 6.397 7.227 6.384) 11.571 15.605 ( 5.790 -0.240 1.109) 5.900 15.866 ( -7.631 -11.986 3.162) 14.557 16.399 ( -2.916 5.107 2.963) 6.585 16.678 ( 7.962 -7.368 0.911) 10.886 16.901 ( 11.305 -6.046 -1.656) 12.926 17.228 ( -11.908 27.160 1.820) 29.712 17.855 ( 8.043 -0.619 0.955) 8.123 17.924 ( 4.896 -1.748 -1.378) 5.378 18.392 ( -16.779 -30.167 -5.403) 34.940 19.117 ( -3.406 5.961 -7.303) 10.023 19.703 ( -1.856 6.617 8.337) 10.805 20.491 ( 1.185 13.220 1.411) 13.348 20.833 ( 8.599 2.685 0.876) 9.051 21.175 ( 2.363 5.575 -0.113) 6.056 21.491 ( -7.166 -11.848 -4.071) 14.432 ======================= Grid point 249 (110/199) ======================= q-point: (-0.17 -0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.616 ( -14.423 13.874 -3.619) 20.337 3.158 ( -1.888 -9.812 4.727) 11.053 4.418 ( -4.711 1.679 0.548) 5.031 4.560 ( 3.009 -14.078 -1.883) 14.519 4.935 ( -4.810 5.936 -3.886) 8.572 5.146 ( 3.795 3.752 0.729) 5.386 6.322 ( -9.057 16.336 2.468) 18.841 6.411 ( 3.820 0.590 3.256) 5.054 6.664 ( -0.766 6.152 -4.010) 7.383 6.770 ( -7.918 -6.269 -3.540) 10.702 7.005 ( -6.364 -12.174 2.084) 13.894 7.094 ( -3.323 -1.463 -3.250) 4.873 7.294 ( 2.640 -0.836 3.751) 4.663 7.485 ( 0.095 -9.942 2.965) 10.375 7.631 ( 5.703 -2.249 0.101) 6.131 7.922 ( 7.511 -7.130 -3.542) 10.946 8.169 ( 0.045 3.692 -4.076) 5.500 8.355 ( 3.984 -10.452 -5.537) 12.481 8.403 ( 8.451 0.502 8.396) 11.923 8.732 ( -6.686 2.710 -1.609) 7.392 8.750 ( -7.726 13.333 2.308) 15.581 8.886 ( 0.947 -0.841 2.155) 2.500 8.946 ( 1.385 -5.797 1.325) 6.106 9.113 ( -7.967 -1.577 -1.735) 8.305 9.244 ( -3.909 -2.596 -0.285) 4.702 9.337 ( 10.859 2.478 0.450) 11.147 9.437 ( 8.115 4.744 0.272) 9.404 9.619 ( -1.034 0.818 0.773) 1.529 9.886 ( -3.334 5.496 -2.935) 7.066 10.027 ( -7.579 5.739 -1.803) 9.676 10.094 ( -0.202 -4.195 0.857) 4.286 10.247 ( -2.206 6.326 1.702) 6.913 10.338 ( -6.968 3.906 1.778) 8.183 10.541 ( -1.856 2.935 -8.679) 9.347 10.711 ( 4.247 11.602 4.834) 13.267 11.012 ( 6.932 -17.568 -1.251) 18.928 11.092 ( 6.560 -11.625 3.192) 13.725 11.302 ( 1.976 2.731 -2.063) 3.952 11.508 ( 4.491 -3.676 2.656) 6.383 11.570 ( -0.520 -6.850 -1.754) 7.090 11.617 ( 4.766 -1.662 1.371) 5.230 11.793 ( -1.796 2.692 1.639) 3.628 11.991 ( -0.696 -6.703 -3.903) 7.788 12.139 ( 1.188 0.613 5.451) 5.612 12.443 ( -1.665 -0.423 -6.640) 6.859 12.530 ( -2.452 1.916 2.428) 3.947 12.875 ( 2.019 -3.287 4.068) 5.606 12.883 ( 1.622 -1.996 -4.444) 5.135 13.104 ( -2.380 7.872 -1.028) 8.288 13.236 ( 0.691 6.990 1.098) 7.109 13.424 ( 3.020 7.187 0.099) 7.796 13.476 ( 0.819 -5.096 4.135) 6.613 13.834 ( 0.521 -3.528 0.520) 3.604 14.113 ( -6.480 4.170 -0.683) 7.736 14.489 ( 7.685 -3.923 -3.319) 9.245 14.610 ( 5.182 -3.010 -2.431) 6.466 15.182 ( 3.413 3.255 5.778) 7.458 15.788 ( 6.816 -6.924 -1.155) 9.785 15.868 ( 2.375 -2.514 3.179) 4.698 16.276 ( -6.105 5.080 1.196) 8.032 16.751 ( -13.042 25.693 13.844) 31.966 16.828 ( 0.216 -8.248 -3.879) 9.117 17.173 ( 9.275 -12.880 -19.391) 25.058 18.007 ( 5.729 -3.917 2.374) 7.335 18.167 ( 19.951 -1.370 7.834) 21.477 18.369 ( -14.175 -24.566 -4.325) 28.690 18.965 ( -3.619 6.748 -5.752) 9.577 19.558 ( -9.182 9.987 9.261) 16.426 20.346 ( -3.895 11.101 1.118) 11.818 20.846 ( -0.531 6.948 -0.946) 7.032 21.147 ( -3.511 1.936 -2.731) 4.851 21.536 ( 2.640 -9.824 -2.071) 10.381 ======================= Grid point 250 (111/199) ======================= q-point: (-0.08 -0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.340 ( -8.432 1.219 6.811) 10.908 3.209 ( -6.265 -10.729 -1.526) 12.517 4.213 ( -18.130 -7.226 -3.493) 19.827 4.749 ( -0.749 -10.993 -0.611) 11.035 4.811 ( -4.143 0.624 -0.912) 4.288 5.172 ( 3.502 3.873 -0.859) 5.292 5.988 ( -15.244 9.156 -0.070) 17.782 6.432 ( -4.879 -5.078 7.723) 10.452 6.597 ( -1.615 4.710 -4.193) 6.509 6.779 ( 6.633 -3.118 -4.903) 8.818 7.005 ( 0.117 1.289 -5.538) 5.687 7.106 ( -0.524 -9.191 7.668) 11.981 7.302 ( -2.680 -0.083 -0.536) 2.735 7.572 ( 5.723 -6.164 3.130) 8.975 7.843 ( 8.058 -8.405 3.172) 12.068 8.058 ( 2.332 11.362 -8.824) 14.574 8.121 ( -2.964 -12.711 -2.910) 13.373 8.411 ( -3.985 -8.410 -4.263) 10.236 8.521 ( -0.794 3.295 1.347) 3.647 8.565 ( 0.894 4.563 2.501) 5.280 8.618 ( -5.920 3.036 2.139) 6.988 8.764 ( -9.819 7.048 -1.588) 12.190 8.943 ( -5.814 -5.001 5.329) 9.339 9.178 ( 7.914 -12.189 -1.075) 14.573 9.220 ( 0.934 1.447 -2.621) 3.136 9.500 ( 4.277 2.032 -1.430) 4.946 9.578 ( 4.132 7.518 -1.009) 8.638 9.594 ( 8.683 -2.390 6.342) 11.015 9.732 ( -3.120 7.303 -1.622) 8.105 9.854 ( -4.320 4.790 -0.715) 6.490 9.998 ( -6.058 7.501 1.776) 9.804 10.108 ( -5.551 2.513 -0.393) 6.106 10.338 ( 1.589 1.276 -2.301) 3.074 10.441 ( 0.559 1.322 -8.137) 8.263 10.757 ( 6.828 5.068 7.837) 11.564 11.184 ( 2.109 -6.345 -2.530) 7.149 11.275 ( 3.278 1.822 -2.027) 4.263 11.374 ( 8.767 -2.566 5.390) 10.606 11.580 ( 0.994 -1.180 1.044) 1.863 11.723 ( 2.966 -6.989 1.555) 7.749 11.796 ( 4.933 -5.892 0.639) 7.711 11.819 ( 12.235 -6.094 2.762) 13.945 12.037 ( 2.893 -2.754 -1.709) 4.345 12.140 ( -2.257 0.604 3.941) 4.581 12.399 ( -2.679 -1.711 -5.690) 6.518 12.486 ( 2.027 6.625 2.751) 7.454 12.866 ( -2.039 9.460 3.119) 10.168 12.915 ( 2.456 0.587 -3.343) 4.190 13.027 ( 0.662 2.136 -1.852) 2.904 13.183 ( 0.769 4.988 -0.197) 5.051 13.382 ( 3.370 11.055 -0.567) 11.571 13.535 ( -0.006 -2.912 5.011) 5.796 13.900 ( 1.566 -4.139 -0.855) 4.507 14.040 ( -1.048 0.295 1.520) 1.869 14.599 ( 4.724 0.793 -3.179) 5.749 14.686 ( 2.955 -0.248 -2.313) 3.760 15.248 ( 3.132 -4.021 0.408) 5.114 15.790 ( -9.736 -10.153 4.264) 14.698 16.081 ( 2.577 5.665 2.766) 6.810 16.165 ( 10.935 7.151 -2.897) 13.383 16.362 ( -7.753 21.715 12.164) 26.069 16.793 ( -9.420 -4.478 -8.701) 13.583 17.377 ( 4.606 -16.801 -21.317) 27.530 18.100 ( -0.871 -6.608 -0.318) 6.672 18.368 ( -9.844 -14.997 9.819) 20.451 18.537 ( 9.555 -8.021 6.524) 14.078 18.967 ( 19.165 7.760 -2.260) 20.800 19.273 ( -13.523 13.624 7.640) 20.661 20.188 ( -5.810 4.723 0.905) 7.542 20.715 ( -6.292 5.421 -1.517) 8.443 21.039 ( -8.634 -4.986 -3.523) 10.574 21.698 ( 9.513 -1.233 -2.820) 9.998 ======================= Grid point 259 (112/199) ======================= q-point: (-0.33 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.067 ( -4.317 0.000 7.395) 8.563 3.141 ( -3.290 0.000 -9.935) 10.465 4.391 ( -9.647 0.000 -4.995) 10.864 4.439 ( -0.201 0.000 4.905) 4.909 5.110 ( 6.273 -0.000 6.184) 8.809 5.158 ( -3.939 0.000 -7.125) 8.141 6.450 ( 5.321 -0.000 -2.176) 5.749 6.593 ( 0.165 -0.000 7.073) 7.075 6.686 ( -7.043 0.000 -5.404) 8.878 6.836 ( -2.575 0.000 -0.399) 2.606 7.042 ( -11.153 0.000 -2.617) 11.456 7.061 ( 0.044 -0.000 -5.817) 5.817 7.252 ( 5.962 -0.000 9.183) 10.948 7.299 ( -8.718 0.000 4.460) 9.793 7.441 ( 7.957 -0.000 -3.231) 8.588 7.838 ( -6.082 0.000 -1.785) 6.339 7.980 ( 14.896 -0.000 -2.274) 15.069 8.207 ( 1.855 -0.000 12.006) 12.148 8.351 ( 4.139 -0.000 -2.798) 4.996 8.746 ( 8.345 -0.000 -4.630) 9.543 8.780 ( 3.092 -0.000 1.778) 3.567 8.996 ( -9.375 0.000 -1.354) 9.473 9.000 ( -0.395 0.000 0.922) 1.003 9.218 ( -0.927 0.000 0.022) 0.927 9.222 ( 1.357 -0.000 6.556) 6.695 9.348 ( 2.184 -0.000 6.320) 6.687 9.468 ( 10.523 -0.000 -6.367) 12.299 9.582 ( 7.011 -0.000 -9.947) 12.170 9.803 ( -2.860 0.000 -4.218) 5.096 9.954 ( 6.899 -0.000 5.958) 9.116 10.294 ( -14.287 0.000 -5.378) 15.266 10.420 ( -4.471 0.000 3.938) 5.958 10.523 ( 6.927 -0.000 2.116) 7.243 10.574 ( 4.717 -0.000 1.737) 5.026 10.583 ( -6.029 0.000 0.119) 6.031 10.789 ( -15.090 0.000 8.269) 17.207 11.036 ( 0.593 -0.000 -9.322) 9.341 11.342 ( 1.537 -0.000 -1.783) 2.354 11.403 ( 1.884 -0.000 -0.593) 1.975 11.538 ( -0.074 0.000 6.294) 6.294 11.647 ( -11.517 0.000 -5.336) 12.694 11.798 ( 1.213 -0.000 -4.807) 4.957 11.922 ( 1.180 -0.000 -0.862) 1.461 12.088 ( 3.607 -0.000 7.014) 7.887 12.445 ( -1.677 0.000 -6.114) 6.340 12.538 ( 0.227 -0.000 0.631) 0.671 12.781 ( -0.584 0.000 -3.840) 3.884 12.874 ( -1.525 0.000 4.106) 4.381 13.282 ( 2.448 -0.000 3.265) 4.081 13.293 ( -0.839 0.000 -1.662) 1.862 13.307 ( 3.375 -0.000 0.916) 3.497 13.364 ( 7.540 -0.000 0.212) 7.543 13.915 ( -10.181 0.000 2.524) 10.489 14.247 ( 11.669 -0.000 2.363) 11.906 14.366 ( 10.474 -0.000 -3.241) 10.964 14.455 ( -17.367 0.000 -7.598) 18.956 15.246 ( 10.004 -0.000 2.375) 10.282 15.562 ( -6.757 0.000 8.999) 11.254 15.756 ( 1.391 -0.000 2.511) 2.870 16.501 ( -2.535 0.000 7.698) 8.105 16.550 ( 6.594 -0.000 -12.302) 13.958 16.831 ( 11.617 -0.000 1.505) 11.714 17.773 ( -14.087 0.000 1.815) 14.203 17.819 ( -14.408 0.000 0.954) 14.439 17.849 ( 4.927 -0.000 2.420) 5.489 17.910 ( 6.249 -0.000 -3.211) 7.025 19.178 ( -3.620 0.000 -9.314) 9.992 19.759 ( -2.759 0.000 6.038) 6.639 20.689 ( 2.769 -0.000 -5.537) 6.191 20.819 ( 12.824 -0.000 7.849) 15.036 21.246 ( -4.427 0.000 -1.122) 4.567 21.339 ( -5.337 0.000 -2.861) 6.055 ======================= Grid point 260 (113/199) ======================= q-point: (-0.25 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.870 ( -18.042 9.943 -7.482) 21.917 2.998 ( -8.269 -5.452 6.466) 11.829 4.226 ( -15.755 -11.919 -6.282) 20.730 4.485 ( 4.500 0.958 1.406) 4.811 5.014 ( -9.042 2.145 -4.744) 10.433 5.207 ( 4.263 2.027 5.034) 6.901 6.462 ( -2.891 5.645 0.352) 6.352 6.499 ( -11.105 0.887 -1.873) 11.296 6.633 ( -5.392 -10.028 3.621) 11.947 6.788 ( 3.890 8.470 -2.597) 9.676 6.888 ( -6.136 0.830 -2.489) 6.673 7.071 ( 1.911 -0.429 -3.145) 3.705 7.216 ( -5.367 -7.587 2.142) 9.537 7.374 ( 4.030 -1.349 9.014) 9.966 7.599 ( 10.563 -1.179 -1.629) 10.753 7.807 ( -0.296 -2.853 -1.019) 3.044 8.192 ( 6.981 -3.836 -5.574) 9.722 8.241 ( 1.048 0.964 2.791) 3.134 8.430 ( 6.138 1.405 8.068) 10.235 8.757 ( -5.922 -0.201 -2.716) 6.518 8.827 ( 0.415 -1.619 2.498) 3.006 8.865 ( -3.923 -2.315 0.964) 4.656 8.935 ( -4.899 2.326 -0.066) 5.424 9.193 ( -2.025 4.629 -0.674) 5.098 9.220 ( 0.101 3.300 1.921) 3.819 9.388 ( 4.150 2.745 2.736) 5.679 9.552 ( 3.009 7.521 -3.404) 8.787 9.643 ( 8.530 0.974 -3.303) 9.199 9.834 ( -1.482 -13.780 -10.500) 17.387 9.990 ( -2.851 -0.031 2.552) 3.827 10.038 ( -10.968 -2.083 -4.601) 12.075 10.346 ( -6.549 6.003 5.143) 10.266 10.432 ( -13.363 -0.210 6.611) 14.910 10.594 ( -1.406 2.194 -7.930) 8.347 10.766 ( 14.419 -2.972 0.612) 14.735 10.843 ( 14.948 -6.275 5.419) 17.093 11.015 ( 6.647 6.822 -0.639) 9.546 11.371 ( 2.674 2.360 -1.914) 4.048 11.437 ( 3.085 -1.669 0.088) 3.508 11.514 ( -0.901 0.009 -2.062) 2.250 11.577 ( 0.736 -2.927 5.777) 6.518 11.825 ( -1.023 -2.300 -3.027) 3.937 11.909 ( 0.642 0.876 -1.746) 2.056 12.142 ( 0.178 -0.474 4.825) 4.851 12.423 ( 0.175 -0.628 -8.805) 8.829 12.581 ( 4.652 1.837 2.088) 5.420 12.779 ( 0.487 -2.909 -3.919) 4.905 12.881 ( 0.791 -0.128 4.553) 4.623 13.222 ( -1.246 5.089 -1.722) 5.515 13.360 ( 1.162 -5.343 2.303) 5.933 13.381 ( 6.011 4.414 2.998) 8.038 13.496 ( 7.029 0.734 0.074) 7.068 13.814 ( -1.813 0.735 2.091) 2.863 14.188 ( -9.981 2.007 -3.383) 10.728 14.436 ( 10.254 0.067 0.462) 10.264 14.546 ( 8.602 -3.447 -1.817) 9.444 15.304 ( 0.623 8.599 6.849) 11.010 15.557 ( -5.275 -11.954 7.607) 15.120 15.901 ( 17.368 1.478 -1.322) 17.481 16.399 ( -4.482 7.257 0.028) 8.530 16.647 ( 2.343 -9.570 -13.910) 17.046 16.978 ( 3.408 -5.420 -6.797) 9.337 17.272 ( -14.848 28.121 7.166) 32.598 17.810 ( -15.704 -26.076 3.728) 30.667 17.988 ( 7.245 -3.659 2.088) 8.381 18.171 ( 21.205 -0.104 5.318) 21.862 19.058 ( -4.578 2.574 -8.025) 9.590 19.661 ( -9.572 2.043 6.363) 11.674 20.604 ( -3.310 12.338 -4.574) 13.568 20.916 ( -3.800 -0.673 -0.152) 3.862 21.182 ( -9.322 2.144 -2.895) 9.994 21.345 ( 9.531 -8.096 2.242) 12.705 ======================= Grid point 261 (114/199) ======================= q-point: (-0.17 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.446 ( -17.157 8.841 -0.791) 19.317 2.959 ( -8.900 -13.299 2.563) 16.206 4.001 ( -24.081 -13.874 -3.541) 28.016 4.542 ( -4.247 -8.060 -3.442) 9.739 4.819 ( -11.135 0.378 -0.952) 11.182 5.244 ( 2.198 3.267 0.988) 4.059 6.185 ( -17.064 10.156 -3.246) 20.121 6.343 ( -9.986 -2.818 2.977) 10.794 6.592 ( -8.966 -7.899 2.052) 12.124 6.757 ( -4.069 2.027 -2.520) 5.198 6.932 ( 12.875 -2.054 -2.027) 13.194 7.098 ( 3.323 2.252 -2.452) 4.704 7.228 ( -3.690 -6.106 3.768) 8.068 7.485 ( 3.950 -2.962 6.981) 8.550 7.750 ( 4.220 -1.391 1.374) 4.650 7.863 ( -0.779 -11.918 -4.150) 12.644 8.200 ( -1.372 4.076 -1.302) 4.493 8.261 ( -2.483 -5.451 -1.257) 6.120 8.556 ( 2.087 1.398 3.596) 4.387 8.593 ( -6.970 1.282 0.534) 7.107 8.795 ( -0.311 5.927 5.673) 8.210 8.858 ( -3.087 -3.162 -0.060) 4.419 8.980 ( 7.259 -6.785 -0.825) 9.970 9.014 ( -0.734 18.085 -6.268) 19.155 9.213 ( -0.460 -1.133 -0.643) 1.382 9.476 ( 5.752 -1.381 0.225) 5.920 9.588 ( 3.833 1.266 4.100) 5.754 9.734 ( 2.744 5.415 -3.809) 7.166 9.805 ( 1.979 -0.111 -4.830) 5.221 9.909 ( -8.562 0.850 0.600) 8.625 9.983 ( -2.025 -8.202 -0.313) 8.454 10.243 ( -7.876 2.523 0.352) 8.277 10.270 ( 0.822 1.800 3.158) 3.727 10.480 ( -1.923 2.085 -10.583) 10.956 10.936 ( 7.264 8.844 7.826) 13.864 11.099 ( 10.721 -0.206 -2.217) 10.949 11.240 ( 14.251 -4.963 3.372) 15.463 11.385 ( 4.751 3.598 -0.468) 5.978 11.520 ( 2.193 -5.183 0.877) 5.696 11.634 ( 10.179 -1.168 2.025) 10.444 11.684 ( 6.418 -5.104 2.614) 8.607 11.785 ( 0.449 -0.043 1.528) 1.593 11.967 ( 5.005 -3.489 -3.710) 7.141 12.129 ( -4.285 -1.677 3.578) 5.829 12.399 ( 1.980 2.069 -8.582) 9.048 12.627 ( 4.942 7.209 1.893) 8.943 12.836 ( 2.586 -5.616 -5.811) 8.485 12.914 ( 0.416 -0.133 4.385) 4.407 13.163 ( 1.343 5.926 0.615) 6.108 13.372 ( 2.043 10.226 2.060) 10.630 13.454 ( 2.193 -2.583 4.067) 5.294 13.575 ( 6.722 5.985 -1.003) 9.056 13.835 ( 2.635 -1.292 0.040) 2.935 14.065 ( -3.110 1.375 1.603) 3.760 14.595 ( 8.579 -0.523 -2.250) 8.885 14.683 ( 6.177 -0.142 -2.307) 6.595 15.241 ( -2.284 3.378 6.404) 7.592 15.580 ( -8.012 -11.423 7.615) 15.896 16.199 ( 2.593 7.078 -3.424) 8.280 16.288 ( 18.238 5.184 -2.972) 19.192 16.674 ( -6.045 -7.641 -11.888) 15.371 16.808 ( -11.950 22.834 3.741) 26.042 17.064 ( 0.218 -12.303 -11.208) 16.644 17.815 ( -13.135 -22.956 6.252) 27.177 18.155 ( 5.607 -5.216 4.100) 8.686 18.471 ( 4.704 -0.890 9.364) 10.517 19.074 ( 18.682 3.392 -3.368) 19.284 19.447 ( -14.602 4.897 6.789) 16.831 20.366 ( -7.672 12.786 -3.443) 15.303 20.812 ( -7.991 0.838 -2.440) 8.397 20.948 ( -14.995 -1.971 -4.882) 15.893 21.630 ( 14.195 -4.871 0.995) 15.040 ======================= Grid point 262 (115/199) ======================= q-point: (-0.08 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.216 ( -7.591 -3.049 9.722) 12.706 2.940 ( -9.807 -12.760 -3.793) 16.534 3.702 ( -27.463 -15.406 0.827) 31.500 4.422 ( -22.424 -15.863 -4.289) 27.800 4.640 ( -14.292 -5.879 2.247) 15.617 5.227 ( -0.086 2.091 -5.641) 6.017 5.748 ( -21.829 7.498 -3.159) 23.296 6.290 ( -4.712 -8.193 5.751) 11.064 6.477 ( -11.443 -3.171 -5.047) 12.903 6.726 ( -9.149 -16.246 2.570) 18.821 7.121 ( 3.403 0.483 1.961) 3.957 7.157 ( 5.475 -2.780 -4.118) 7.393 7.238 ( 5.220 5.073 4.497) 8.556 7.587 ( -1.237 -10.059 1.186) 10.204 7.765 ( -6.321 -6.078 -5.255) 10.223 7.876 ( -6.518 -7.754 0.165) 10.131 8.150 ( 0.705 2.861 2.054) 3.592 8.290 ( 0.353 -6.302 1.962) 6.609 8.449 ( -0.986 2.813 3.763) 4.801 8.609 ( 2.946 2.778 -4.486) 6.043 8.794 ( 1.643 3.599 7.148) 8.170 8.811 ( -0.926 3.679 -2.108) 4.340 8.865 ( 7.769 17.964 -9.217) 21.633 9.202 ( 2.750 -3.537 0.098) 4.481 9.236 ( 6.351 -7.148 -1.395) 9.664 9.491 ( -4.593 2.436 -1.352) 5.372 9.618 ( 0.684 1.590 1.211) 2.113 9.684 ( -0.247 5.609 0.960) 5.696 9.832 ( 2.042 -2.193 1.126) 3.202 9.876 ( 0.427 3.118 -0.953) 3.288 10.070 ( 8.204 11.732 4.309) 14.950 10.101 ( 6.265 -1.562 -2.422) 6.896 10.343 ( 3.683 -2.063 -1.626) 4.524 10.515 ( 8.682 0.780 -5.157) 10.129 10.979 ( 7.468 9.769 6.998) 14.148 11.226 ( 6.433 0.934 -2.488) 6.960 11.334 ( 0.708 2.890 -0.649) 3.045 11.499 ( 0.642 2.125 1.867) 2.901 11.595 ( 3.443 -2.827 0.757) 4.519 11.677 ( -1.442 -4.831 0.936) 5.128 11.886 ( 10.356 -4.120 1.132) 11.203 11.961 ( 7.319 -2.643 5.265) 9.395 12.104 ( 2.067 -2.519 1.555) 3.611 12.142 ( 12.953 -3.759 -1.971) 13.631 12.431 ( 6.647 1.949 -3.520) 7.769 12.631 ( 4.669 8.414 1.612) 9.757 12.889 ( -1.054 1.158 -0.627) 1.686 12.918 ( 2.672 -0.768 -3.286) 4.304 13.166 ( 5.807 8.009 2.231) 10.141 13.279 ( 0.815 12.017 0.745) 12.067 13.515 ( 1.648 -0.482 4.403) 4.726 13.590 ( 4.954 10.685 -0.748) 11.802 13.902 ( 2.923 -2.776 -0.526) 4.065 14.028 ( -1.486 1.491 1.434) 2.547 14.681 ( 2.848 2.991 -3.714) 5.554 14.747 ( 4.345 2.844 -1.106) 5.309 15.225 ( -1.081 -4.426 0.225) 4.562 15.574 ( -7.285 -9.796 7.868) 14.524 16.015 ( -8.160 5.834 -2.935) 10.451 16.363 ( -11.294 21.388 6.769) 25.117 16.513 ( -10.449 -3.745 -9.615) 14.686 16.755 ( 27.127 9.145 -2.725) 28.756 17.160 ( -2.347 -18.670 -16.126) 24.782 17.872 ( -8.034 -21.808 6.955) 24.260 18.188 ( -9.439 0.488 4.860) 10.628 18.509 ( -2.132 -10.662 6.135) 12.485 19.134 ( -15.528 9.177 5.353) 18.815 19.536 ( 34.809 5.047 4.156) 35.418 20.133 ( -6.960 6.822 -3.138) 10.239 20.597 ( -12.154 3.853 -3.194) 13.144 20.772 ( -12.425 -9.941 -2.183) 16.061 21.881 ( 13.077 -0.243 -3.203) 13.466 ======================= Grid point 272 (116/199) ======================= q-point: (-0.25 -0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.579 ( -19.708 0.000 -4.466) 20.208 2.796 ( -12.133 0.000 4.981) 13.115 3.828 ( -22.771 0.000 -4.854) 23.283 4.468 ( -7.918 0.000 -4.050) 8.893 4.824 ( -13.814 0.000 -0.511) 13.823 5.278 ( 1.532 -0.000 1.575) 2.198 6.287 ( -10.669 0.000 -6.382) 12.432 6.371 ( -11.539 0.000 5.572) 12.814 6.441 ( -13.535 0.000 -0.125) 13.536 6.783 ( -11.160 0.000 2.615) 11.462 6.939 ( 8.783 -0.000 -3.589) 9.488 7.103 ( 2.037 -0.000 -4.472) 4.914 7.165 ( 6.002 -0.000 5.263) 7.983 7.451 ( 1.711 -0.000 8.015) 8.196 7.738 ( -4.705 0.000 -4.081) 6.229 7.749 ( 6.517 -0.000 -0.209) 6.520 8.209 ( -0.340 0.000 -0.200) 0.394 8.239 ( -2.117 0.000 0.485) 2.172 8.580 ( -12.337 0.000 1.159) 12.391 8.598 ( 8.902 -0.000 5.627) 10.531 8.810 ( -3.131 0.000 3.745) 4.881 8.866 ( 4.723 -0.000 -1.761) 5.041 8.902 ( 2.141 -0.000 0.205) 2.151 9.175 ( -0.869 0.000 -1.566) 1.790 9.323 ( 3.831 -0.000 -1.478) 4.106 9.488 ( 5.185 -0.000 1.192) 5.321 9.552 ( -0.432 0.000 -7.968) 7.980 9.707 ( 2.274 -0.000 -1.203) 2.573 9.813 ( 4.733 -0.000 -3.881) 6.121 9.881 ( -3.202 0.000 -0.355) 3.221 9.916 ( -5.301 0.000 1.102) 5.414 10.235 ( -2.664 0.000 -0.194) 2.672 10.335 ( -5.509 0.000 6.637) 8.625 10.502 ( -2.629 0.000 -11.385) 11.685 11.015 ( 10.886 -0.000 8.525) 13.827 11.126 ( 17.153 -0.000 1.733) 17.241 11.186 ( 9.387 -0.000 -1.912) 9.580 11.442 ( 4.657 -0.000 -0.417) 4.676 11.449 ( -0.255 0.000 1.110) 1.139 11.624 ( 6.492 -0.000 5.960) 8.813 11.628 ( 14.972 -0.000 -0.126) 14.973 11.785 ( -3.559 0.000 -1.013) 3.700 11.935 ( 4.122 -0.000 -2.732) 4.945 12.104 ( -4.420 0.000 2.095) 4.891 12.431 ( 3.444 -0.000 -10.383) 10.939 12.709 ( 5.734 -0.000 1.411) 5.905 12.773 ( 3.955 -0.000 -2.935) 4.925 12.907 ( 0.720 -0.000 4.411) 4.470 13.245 ( 0.515 -0.000 -1.119) 1.232 13.350 ( 1.160 -0.000 4.613) 4.757 13.523 ( 6.444 -0.000 2.480) 6.905 13.627 ( 7.729 -0.000 -0.745) 7.765 13.855 ( 4.418 -0.000 2.467) 5.060 14.057 ( -5.260 0.000 -1.251) 5.406 14.600 ( 8.392 -0.000 0.842) 8.434 14.678 ( 9.725 -0.000 -2.981) 10.171 15.349 ( -4.635 0.000 5.906) 7.508 15.393 ( -7.735 0.000 11.376) 13.757 16.290 ( 26.153 -0.000 -8.746) 27.577 16.369 ( -6.072 0.000 5.061) 7.905 16.539 ( 0.273 -0.000 -21.937) 21.939 16.890 ( -4.362 0.000 -20.979) 21.428 17.330 ( -11.812 0.000 13.723) 18.106 17.334 ( -14.454 0.000 12.787) 19.299 18.111 ( 7.248 -0.000 2.929) 7.817 18.466 ( 3.675 -0.000 9.249) 9.952 19.105 ( 17.682 -0.000 -3.569) 18.039 19.489 ( -14.182 0.000 5.651) 15.267 20.564 ( -7.415 0.000 -8.709) 11.437 20.725 ( -13.208 0.000 -0.405) 13.214 20.974 ( -14.626 0.000 -4.243) 15.229 21.569 ( 16.605 -0.000 2.869) 16.851 ======================= Grid point 273 (117/199) ======================= q-point: (-0.17 -0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.257 ( -12.905 5.352 0.991) 14.005 2.686 ( -8.660 -10.959 0.862) 13.994 3.440 ( -28.747 -9.259 1.587) 30.243 4.188 ( -26.899 -6.911 -7.796) 28.846 4.562 ( -19.480 -2.153 4.446) 20.096 5.256 ( -3.264 0.814 -6.488) 7.309 5.942 ( -24.162 10.470 -3.379) 26.549 6.204 ( -8.568 -1.359 1.320) 8.775 6.344 ( -7.018 -10.041 -0.439) 12.259 6.474 ( -27.492 -6.630 6.267) 28.966 7.087 ( 2.646 -1.123 -0.999) 3.043 7.125 ( 4.785 -1.905 -2.575) 5.758 7.306 ( 9.008 0.320 1.960) 9.225 7.468 ( -3.439 -1.297 3.124) 4.823 7.685 ( -0.542 -2.787 -4.281) 5.137 7.748 ( -6.858 -3.312 -1.835) 7.834 8.184 ( -4.741 0.304 4.482) 6.531 8.237 ( 3.416 -0.084 2.813) 4.426 8.484 ( 2.877 0.479 3.255) 4.370 8.635 ( -3.000 0.795 -9.092) 9.607 8.788 ( -0.923 0.072 9.996) 10.039 8.926 ( 6.948 5.658 -1.860) 9.151 9.073 ( 11.344 -5.008 1.761) 12.525 9.175 ( 0.456 -1.197 -0.009) 1.281 9.279 ( 6.757 16.093 -7.590) 19.033 9.528 ( 1.663 3.237 -3.404) 4.983 9.621 ( 1.774 -1.536 0.808) 2.482 9.716 ( -5.341 -0.749 -0.534) 5.419 9.788 ( 5.106 -5.574 -2.606) 7.996 9.926 ( -2.312 0.583 -1.176) 2.658 9.990 ( 12.452 -4.243 2.496) 13.390 10.238 ( 6.968 4.590 -2.952) 8.851 10.325 ( 4.664 0.535 4.336) 6.391 10.542 ( 10.510 1.219 -5.244) 11.809 11.139 ( 5.866 5.519 7.815) 11.222 11.289 ( 9.353 5.035 -1.765) 10.768 11.366 ( 4.246 -0.869 0.217) 4.339 11.472 ( 4.570 -3.045 0.082) 5.493 11.531 ( 2.684 -3.634 4.763) 6.564 11.654 ( -8.951 1.150 0.486) 9.037 11.835 ( 14.652 -0.184 -0.814) 14.676 11.926 ( 12.374 -1.469 3.154) 12.853 12.056 ( 4.949 -2.237 0.199) 5.434 12.061 ( 7.511 -2.641 -2.097) 8.233 12.468 ( 5.360 1.607 -6.002) 8.206 12.741 ( 1.912 1.118 -2.710) 3.500 12.879 ( 5.802 2.639 0.067) 6.375 12.935 ( 2.316 -0.658 1.606) 2.894 13.251 ( 3.453 3.026 0.129) 4.593 13.406 ( 0.753 -2.085 5.719) 6.133 13.591 ( 4.654 7.018 2.797) 8.873 13.729 ( 6.350 3.133 -1.099) 7.166 13.904 ( 3.558 4.804 0.319) 5.987 14.037 ( 0.064 -3.069 1.719) 3.519 14.715 ( 5.332 0.607 -2.523) 5.930 14.814 ( 8.904 3.477 -2.987) 10.014 15.216 ( -6.927 4.008 6.320) 10.197 15.371 ( -7.720 -10.714 8.829) 15.885 16.179 ( -7.918 10.864 -4.739) 14.254 16.392 ( -9.474 -8.742 -12.958) 18.278 16.697 ( -2.837 6.499 -20.843) 22.016 16.841 ( 22.271 -3.257 -9.725) 24.519 16.998 ( -5.778 13.467 14.221) 20.420 17.419 ( -10.050 -24.255 14.435) 29.962 18.207 ( -0.166 0.883 4.857) 4.940 18.370 ( -11.902 -3.828 3.948) 13.111 19.240 ( -15.516 2.435 4.704) 16.395 19.588 ( 34.744 1.075 7.021) 35.462 20.319 ( -9.209 10.842 -7.436) 16.051 20.569 ( -12.682 -10.306 -3.068) 16.627 20.684 ( -16.145 3.114 -4.721) 17.107 21.849 ( 15.026 -1.790 -0.739) 15.151 ======================= Grid point 274 (118/199) ======================= q-point: (-0.08 -0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.110 ( -5.301 -3.464 10.712) 12.443 2.671 ( -7.020 -10.089 -5.088) 13.303 3.075 ( -31.058 -15.503 9.129) 35.893 3.728 ( -37.550 -17.205 -5.908) 41.724 4.261 ( -24.158 -7.685 5.404) 25.920 5.073 ( -19.362 -4.423 -14.680) 24.697 5.462 ( -15.642 7.938 -2.298) 17.691 5.736 ( -54.110 -14.262 5.717) 56.249 6.307 ( -3.675 -12.371 0.752) 12.927 6.367 ( -9.627 -10.118 -0.452) 13.974 7.110 ( 1.827 -4.159 -0.797) 4.612 7.208 ( 3.461 3.249 -1.292) 4.919 7.335 ( -12.172 -2.818 1.037) 12.537 7.505 ( 11.805 -5.768 -7.123) 14.945 7.707 ( 3.657 2.640 -1.362) 4.712 7.772 ( 2.630 -9.139 2.301) 9.784 8.148 ( -1.755 -4.754 6.098) 7.929 8.310 ( 2.850 -1.272 0.416) 3.148 8.509 ( 0.325 6.582 -2.893) 7.198 8.669 ( 10.065 -2.414 1.309) 10.433 8.810 ( 1.478 1.871 8.650) 8.972 8.961 ( 5.632 7.270 -4.945) 10.442 9.164 ( 1.067 7.845 -2.228) 8.225 9.243 ( 10.428 8.620 -2.779) 13.812 9.310 ( 6.225 -1.047 -1.578) 6.506 9.470 ( 0.031 3.570 0.606) 3.621 9.645 ( 0.394 2.109 1.753) 2.771 9.707 ( 3.092 -2.494 0.536) 4.008 9.840 ( -4.096 1.326 -3.280) 5.412 9.959 ( 12.220 2.059 -2.209) 12.587 10.237 ( 11.903 2.267 0.092) 12.117 10.391 ( 12.380 0.263 -2.316) 12.597 10.471 ( 14.870 3.808 4.226) 15.921 10.733 ( 16.190 5.620 -1.930) 17.246 11.196 ( 3.841 6.927 6.340) 10.146 11.288 ( -12.441 5.025 1.173) 13.469 11.371 ( 7.291 4.658 -3.697) 9.409 11.431 ( -4.061 -0.526 2.124) 4.613 11.625 ( 0.603 -2.364 -2.339) 3.380 11.658 ( 6.457 -3.305 2.675) 7.731 11.995 ( 4.121 -0.562 5.221) 6.675 12.088 ( 11.961 -3.235 -0.392) 12.397 12.229 ( 10.524 0.710 -1.406) 10.642 12.335 ( 14.984 -4.528 -1.236) 15.702 12.572 ( 9.372 -1.040 1.211) 9.507 12.754 ( 2.728 2.759 -1.481) 4.153 12.902 ( 2.295 2.143 -1.536) 3.496 12.993 ( 4.336 3.853 -0.713) 5.845 13.325 ( 7.902 1.041 -0.634) 7.996 13.389 ( -2.236 8.465 6.125) 10.685 13.592 ( 3.972 6.679 2.842) 8.275 13.759 ( 3.960 7.535 -1.286) 8.609 13.938 ( 3.581 -0.632 -0.470) 3.666 14.050 ( 0.699 4.153 1.323) 4.414 14.696 ( -3.401 4.124 -5.734) 7.839 14.876 ( 3.409 7.773 2.281) 8.789 15.133 ( -2.988 -6.267 -1.964) 7.216 15.403 ( -4.267 -11.081 7.631) 14.115 15.927 ( -8.540 7.792 -7.702) 13.891 16.191 ( -15.577 -0.094 -5.495) 16.518 16.436 ( -9.097 15.872 4.537) 18.848 16.872 ( -7.316 -14.451 -8.896) 18.480 17.283 ( 23.544 0.764 -9.750) 25.495 17.555 ( -3.771 -19.820 12.702) 23.841 18.003 ( -16.947 4.008 1.383) 17.469 18.309 ( -12.732 -10.485 7.168) 17.984 19.016 ( -6.503 4.515 4.603) 9.157 20.065 ( -2.915 4.172 3.280) 6.055 20.186 ( 29.596 6.219 -2.207) 30.323 20.385 ( -13.406 1.749 -4.269) 14.178 20.464 ( -11.264 -10.845 -0.395) 15.641 22.078 ( 12.180 -0.333 -5.798) 13.493 ======================= Grid point 285 (119/199) ======================= q-point: (-0.17 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.121 ( -7.895 0.000 0.187) 7.898 2.520 ( -5.052 0.000 0.280) 5.060 2.912 ( -31.298 0.000 11.634) 33.390 3.554 ( -39.735 0.000 -8.327) 40.598 4.183 ( -26.303 0.000 8.552) 27.658 5.034 ( -23.644 0.000 -17.314) 29.305 5.582 ( -19.679 0.000 -1.998) 19.781 5.603 ( -59.504 0.000 9.285) 60.224 6.107 ( -11.544 0.000 0.534) 11.556 6.295 ( 0.140 -0.000 -2.055) 2.060 7.099 ( 0.758 -0.000 -2.394) 2.512 7.143 ( 0.933 -0.000 -0.324) 0.988 7.342 ( -2.412 0.000 -6.558) 6.988 7.483 ( 1.335 -0.000 0.900) 1.609 7.645 ( 0.977 -0.000 1.716) 1.975 7.751 ( 8.731 -0.000 -0.817) 8.769 8.102 ( -4.648 0.000 5.966) 7.563 8.304 ( 1.665 -0.000 -2.429) 2.945 8.579 ( 1.632 -0.000 -2.846) 3.281 8.643 ( 11.766 -0.000 3.762) 12.353 8.830 ( 1.471 -0.000 8.963) 9.083 9.026 ( 1.846 -0.000 -5.576) 5.873 9.201 ( 4.281 -0.000 1.723) 4.615 9.254 ( 8.755 -0.000 2.677) 9.155 9.440 ( 7.498 -0.000 -3.243) 8.169 9.538 ( -3.523 0.000 0.880) 3.631 9.645 ( 6.216 -0.000 -1.396) 6.371 9.711 ( -0.387 0.000 -0.493) 0.627 9.808 ( -0.046 0.000 -6.258) 6.258 9.944 ( 14.827 -0.000 -7.483) 16.609 10.281 ( 19.659 -0.000 6.726) 20.778 10.365 ( 6.360 -0.000 -8.777) 10.839 10.529 ( 15.207 -0.000 8.436) 17.390 10.795 ( 19.063 -0.000 -1.754) 19.143 11.277 ( 4.258 -0.000 8.563) 9.563 11.343 ( -16.607 0.000 -3.232) 16.918 11.400 ( 1.377 -0.000 3.881) 4.118 11.482 ( 2.330 -0.000 -2.217) 3.217 11.573 ( 10.003 -0.000 -4.106) 10.813 11.597 ( 2.793 -0.000 7.575) 8.074 11.991 ( 1.219 -0.000 8.660) 8.745 12.064 ( 13.536 -0.000 -7.863) 15.654 12.252 ( 13.460 -0.000 0.187) 13.462 12.259 ( 15.865 -0.000 -3.142) 16.173 12.563 ( 7.016 -0.000 0.534) 7.037 12.759 ( 1.682 -0.000 -2.339) 2.881 12.950 ( 2.937 -0.000 -3.414) 4.503 13.026 ( 5.715 -0.000 1.357) 5.874 13.335 ( 5.920 -0.000 -1.702) 6.160 13.434 ( 0.462 -0.000 8.213) 8.226 13.697 ( 3.412 -0.000 3.106) 4.614 13.824 ( 3.614 -0.000 -0.892) 3.722 13.996 ( 0.716 -0.000 0.663) 0.976 14.044 ( 4.808 -0.000 1.230) 4.963 14.746 ( -1.576 0.000 -6.093) 6.294 14.984 ( 9.064 -0.000 -4.119) 9.956 15.139 ( -11.614 0.000 9.545) 15.033 15.191 ( -3.927 0.000 4.857) 6.246 16.081 ( -10.368 0.000 -21.919) 24.248 16.131 ( -11.492 0.000 9.066) 14.638 16.521 ( -5.784 0.000 -24.881) 25.544 16.950 ( -16.279 0.000 17.366) 23.803 17.048 ( -3.226 0.000 7.493) 8.157 17.426 ( 25.377 -0.000 -4.380) 25.752 18.069 ( -19.410 0.000 0.436) 19.415 18.180 ( -9.895 0.000 8.393) 12.975 19.060 ( -7.549 0.000 4.658) 8.871 20.146 ( 12.752 -0.000 16.147) 20.575 20.262 ( 8.404 -0.000 -12.306) 14.902 20.279 ( -12.403 0.000 -0.625) 12.419 20.435 ( -9.263 0.000 -8.694) 12.704 22.066 ( 12.694 -0.000 -4.672) 13.527 ======================= Grid point 286 (120/199) ======================= q-point: (-0.08 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.979 ( -12.493 -5.287 5.170) 14.517 2.432 ( -24.486 -13.217 15.541) 31.871 2.525 ( -13.372 -0.878 2.897) 13.711 2.931 ( -36.077 -10.844 -3.483) 37.833 3.774 ( -28.186 -4.166 5.969) 29.111 4.410 ( -43.289 -9.353 -15.570) 46.945 4.547 ( -74.450 -10.176 13.172) 76.288 5.376 ( -2.097 4.388 -11.958) 12.909 5.965 ( -13.076 -11.320 -2.326) 17.451 6.238 ( -7.386 -2.752 -2.146) 8.169 7.066 ( -8.152 2.230 -6.569) 10.704 7.155 ( -3.153 -7.600 0.704) 8.259 7.305 ( 4.994 2.541 1.687) 5.851 7.536 ( 4.662 -5.636 -1.276) 7.425 7.729 ( 3.929 -5.003 0.090) 6.362 7.929 ( 13.297 3.223 1.539) 13.769 8.121 ( 2.467 -4.379 -0.344) 5.038 8.306 ( 1.991 -1.289 -7.137) 7.521 8.620 ( 2.887 4.516 7.521) 9.236 8.824 ( 6.685 -0.253 2.420) 7.114 8.899 ( 4.577 0.748 7.316) 8.662 9.005 ( -1.420 -0.615 -2.121) 2.626 9.236 ( 0.593 7.550 -2.659) 8.026 9.345 ( 3.759 -4.343 1.009) 5.832 9.531 ( 5.102 3.625 0.430) 6.274 9.552 ( 9.876 6.849 -1.171) 12.075 9.683 ( 1.036 1.129 1.978) 2.502 9.801 ( 1.329 0.074 -3.730) 3.960 9.836 ( 13.405 0.855 0.229) 13.434 10.169 ( 9.414 1.904 -8.641) 12.920 10.412 ( 6.672 5.308 -8.455) 12.007 10.623 ( 12.348 -2.114 5.609) 13.726 10.705 ( -3.286 -0.586 3.255) 4.662 11.056 ( 2.720 6.722 -0.463) 7.266 11.102 ( 19.468 5.160 0.164) 20.141 11.332 ( 1.113 0.711 5.381) 5.540 11.456 ( 3.537 0.959 4.816) 6.052 11.523 ( 6.239 5.675 -3.949) 9.313 11.655 ( 3.197 2.231 3.665) 5.351 11.753 ( 8.865 -3.734 -0.844) 9.657 12.086 ( 4.820 -2.453 10.029) 11.395 12.244 ( 9.576 0.584 -8.801) 13.020 12.386 ( 6.333 2.841 -0.382) 6.951 12.516 ( 12.577 -4.984 -3.581) 13.995 12.732 ( 10.101 -0.782 3.629) 10.761 12.793 ( 2.213 -0.956 1.154) 2.672 12.991 ( 6.112 3.275 -5.063) 8.585 13.086 ( 2.674 2.261 -1.043) 3.654 13.405 ( -1.956 4.713 4.859) 7.047 13.457 ( 4.096 -1.438 3.456) 5.549 13.752 ( 6.867 6.463 1.914) 9.623 13.863 ( 4.052 2.652 -0.930) 4.931 14.015 ( 5.161 1.867 0.117) 5.489 14.118 ( 3.123 1.170 0.644) 3.397 14.605 ( -9.701 3.462 -7.660) 12.837 14.904 ( -13.186 6.026 5.796) 15.614 15.088 ( 6.143 -0.944 -3.902) 7.338 15.267 ( -0.876 -11.919 4.179) 12.661 15.818 ( -9.535 6.331 -14.400) 18.394 15.950 ( -12.734 -0.036 3.776) 13.282 16.401 ( -6.148 1.921 -5.991) 8.797 16.644 ( -12.237 3.968 7.097) 14.692 17.108 ( -10.219 -21.414 9.843) 25.688 17.663 ( -11.778 4.094 -9.251) 15.526 17.776 ( -5.512 -6.352 -5.995) 10.328 18.015 ( -5.494 0.189 3.639) 6.592 19.045 ( 3.137 1.518 10.563) 11.123 20.033 ( -5.182 4.638 -2.623) 7.433 20.117 ( -12.610 -2.339 -1.669) 12.933 20.224 ( -6.149 -5.659 -3.383) 9.016 20.765 ( 28.089 2.953 4.378) 28.581 22.225 ( 8.354 -0.537 -11.083) 13.889 ======================= Grid point 298 (121/199) ======================= q-point: (-0.08 -0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.496 ( -37.913 0.000 -2.307) 37.984 1.951 ( -32.229 0.000 45.582) 55.825 2.411 ( -5.732 0.000 -5.259) 7.779 2.454 ( -15.370 0.000 1.442) 15.438 3.228 ( -80.241 0.000 19.872) 82.665 3.341 ( -25.973 0.000 4.604) 26.378 3.521 ( -45.753 0.000 -20.138) 49.989 5.374 ( 4.575 -0.000 -20.650) 21.150 5.712 ( -9.740 0.000 -1.542) 9.861 6.059 ( -10.550 0.000 -1.332) 10.634 6.926 ( -14.841 0.000 5.620) 15.869 6.966 ( -4.954 0.000 -10.726) 11.815 7.437 ( 7.207 -0.000 3.728) 8.114 7.639 ( 9.988 -0.000 -2.899) 10.400 7.787 ( 5.469 -0.000 1.935) 5.801 8.087 ( -3.269 0.000 -4.952) 5.934 8.197 ( 15.211 -0.000 0.666) 15.225 8.331 ( 3.203 -0.000 -3.848) 5.007 8.682 ( -0.802 0.000 7.409) 7.452 8.866 ( -1.070 0.000 -2.060) 2.321 8.970 ( -1.911 0.000 4.885) 5.245 8.995 ( 3.323 -0.000 4.177) 5.338 9.255 ( -3.566 0.000 2.424) 4.312 9.339 ( -0.167 0.000 -10.912) 10.913 9.649 ( 6.417 -0.000 1.913) 6.696 9.699 ( 0.757 -0.000 0.390) 0.852 9.744 ( 8.296 -0.000 -2.514) 8.668 9.880 ( 8.058 -0.000 -2.454) 8.423 10.031 ( -9.367 0.000 8.825) 12.869 10.224 ( -10.363 0.000 -2.767) 10.726 10.234 ( 1.235 -0.000 -3.983) 4.170 10.605 ( 12.660 -0.000 -19.326) 23.104 10.987 ( 17.123 -0.000 7.152) 18.557 11.294 ( -1.657 0.000 -3.462) 3.838 11.364 ( 18.797 -0.000 -1.696) 18.873 11.465 ( 12.467 -0.000 2.352) 12.687 11.551 ( 8.746 -0.000 2.954) 9.231 11.643 ( 5.626 -0.000 -3.584) 6.670 11.781 ( 7.312 -0.000 11.904) 13.970 11.892 ( 10.447 -0.000 -1.073) 10.502 12.124 ( -1.859 0.000 7.989) 8.203 12.313 ( -0.797 0.000 -5.534) 5.591 12.504 ( 7.744 -0.000 -3.472) 8.486 12.660 ( 9.139 -0.000 -5.594) 10.715 12.850 ( 4.145 -0.000 9.353) 10.231 12.864 ( 3.655 -0.000 1.837) 4.091 13.114 ( 7.592 -0.000 -7.140) 10.422 13.118 ( 1.126 -0.000 -3.413) 3.594 13.405 ( -4.138 0.000 9.161) 10.052 13.492 ( 2.658 -0.000 3.027) 4.029 13.948 ( 9.483 -0.000 2.110) 9.715 13.979 ( 9.908 -0.000 -0.967) 9.955 14.143 ( 10.105 -0.000 -0.099) 10.106 14.175 ( 3.546 -0.000 0.497) 3.581 14.412 ( -11.508 0.000 -8.511) 14.314 14.694 ( -15.550 0.000 3.169) 15.870 15.178 ( 0.381 -0.000 0.128) 0.402 15.193 ( 2.400 -0.000 0.896) 2.562 15.647 ( -10.385 0.000 -10.366) 14.673 15.756 ( -11.678 0.000 -0.261) 11.680 16.281 ( -8.966 0.000 0.152) 8.967 16.524 ( -7.017 0.000 8.318) 10.882 16.869 ( -7.619 0.000 8.523) 11.432 17.349 ( -21.528 0.000 -2.805) 21.710 17.378 ( -25.454 0.000 -3.127) 25.645 18.130 ( 8.295 -0.000 -25.491) 26.807 19.181 ( 6.030 -0.000 17.718) 18.716 19.919 ( -8.640 0.000 -0.764) 8.673 19.933 ( -7.754 0.000 -0.405) 7.764 20.179 ( 3.951 -0.000 -7.055) 8.086 21.184 ( 18.459 -0.000 4.890) 19.096 22.246 ( -1.089 0.000 -21.566) 21.594 ======================= Grid point 299 (122/199) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( 17.839 -0.000 33.321) 37.796 1.585 ( -28.471 0.000 33.326) 43.831 2.180 ( 4.038 -0.000 -7.540) 8.553 2.187 ( -1.487 0.000 -12.700) 12.787 2.297 ( 18.808 -0.000 -17.540) 25.718 2.302 ( -13.393 0.000 -14.442) 19.696 3.183 ( -7.307 0.000 68.729) 69.116 4.498 ( 5.720 -0.000 -54.650) 54.948 5.701 ( 3.710 -0.000 4.314) 5.690 5.776 ( -2.473 0.000 -2.553) 3.554 6.635 ( -8.627 0.000 3.691) 9.383 6.718 ( 7.932 -0.000 -3.709) 8.756 7.442 ( -14.767 0.000 1.980) 14.899 7.568 ( 7.826 -0.000 -9.070) 11.980 7.837 ( -8.738 0.000 2.902) 9.208 7.924 ( 8.151 -0.000 -4.840) 9.480 8.204 ( 0.054 -0.000 6.843) 6.843 8.325 ( 0.748 -0.000 -4.479) 4.541 8.616 ( -5.621 0.000 0.507) 5.644 8.620 ( 10.786 -0.000 0.907) 10.824 8.841 ( 1.332 -0.000 2.210) 2.580 8.900 ( -3.005 0.000 -2.886) 4.166 9.118 ( 3.240 -0.000 5.095) 6.038 9.190 ( -2.494 0.000 -1.072) 2.714 9.655 ( -0.150 0.000 5.147) 5.149 9.741 ( -1.674 0.000 -2.577) 3.073 9.794 ( -2.537 0.000 5.025) 5.629 9.844 ( -7.554 0.000 -1.777) 7.760 9.924 ( 2.764 -0.000 1.774) 3.285 10.103 ( 4.914 -0.000 -13.036) 13.931 10.598 ( 4.330 -0.000 6.907) 8.152 10.724 ( 3.362 -0.000 8.630) 9.262 10.815 ( 2.584 -0.000 -2.936) 3.911 11.105 ( -7.914 0.000 -16.386) 18.197 11.647 ( -1.159 0.000 10.721) 10.783 11.803 ( -0.172 0.000 -2.476) 2.482 11.822 ( -3.041 0.000 0.654) 3.111 11.845 ( 4.098 -0.000 -2.199) 4.651 12.071 ( -4.148 0.000 0.554) 4.185 12.072 ( -2.155 0.000 1.401) 2.570 12.232 ( -4.833 0.000 10.868) 11.894 12.404 ( 7.397 -0.000 0.415) 7.409 12.584 ( 6.271 -0.000 -2.021) 6.589 12.678 ( -1.141 0.000 -6.449) 6.549 12.895 ( -0.020 0.000 2.373) 2.373 12.947 ( -2.010 0.000 -2.293) 3.049 13.276 ( 1.797 -0.000 8.357) 8.548 13.412 ( -16.037 0.000 1.168) 16.079 13.461 ( 5.123 -0.000 -0.508) 5.148 13.536 ( 8.110 -0.000 -2.229) 8.410 14.058 ( 10.850 -0.000 -1.580) 10.964 14.069 ( -10.757 0.000 -2.241) 10.988 14.338 ( -2.262 0.000 0.883) 2.428 14.346 ( 1.843 -0.000 0.221) 1.856 14.384 ( -2.393 0.000 0.867) 2.545 14.413 ( 5.414 -0.000 -1.560) 5.634 15.179 ( 4.476 -0.000 -0.788) 4.545 15.225 ( -9.195 0.000 -4.704) 10.328 15.310 ( 0.117 -0.000 2.607) 2.610 15.361 ( 6.723 -0.000 -1.897) 6.986 16.412 ( 1.007 -0.000 20.381) 20.406 16.666 ( -5.864 0.000 -1.654) 6.092 16.687 ( 6.099 -0.000 0.421) 6.114 16.849 ( -6.916 0.000 2.005) 7.201 16.871 ( 2.186 -0.000 0.662) 2.284 16.938 ( 1.959 -0.000 -23.809) 23.890 19.663 ( -3.292 0.000 18.546) 18.836 19.783 ( 0.068 -0.000 0.641) 0.645 19.795 ( 0.199 -0.000 -0.450) 0.492 20.020 ( 2.975 -0.000 -14.994) 15.286 21.544 ( -2.672 0.000 3.702) 4.565 21.614 ( 3.457 -0.000 -2.833) 4.470 ======================= Grid point 300 (123/199) ======================= q-point: ( 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.553 ( 25.069 21.646 23.575) 40.655 2.171 ( -0.637 -30.812 -23.726) 38.894 2.240 ( 10.234 -21.095 8.013) 24.778 2.350 ( 14.903 -11.982 3.376) 19.418 2.463 ( 27.621 -22.474 17.418) 39.641 2.937 ( 51.748 -8.390 -19.469) 55.922 3.384 ( 5.554 -9.791 60.444) 61.483 4.441 ( 7.455 -0.277 -51.901) 52.435 5.786 ( 3.950 -2.197 -2.113) 4.990 5.851 ( 7.822 -7.502 1.172) 10.901 6.578 ( -0.978 -1.978 2.522) 3.351 6.930 ( 16.016 -1.661 -3.094) 16.397 7.355 ( -3.231 -5.528 6.155) 8.882 7.636 ( -5.293 -6.200 -5.479) 9.822 7.905 ( 14.515 6.069 4.767) 16.439 8.039 ( -1.305 2.301 -5.135) 5.776 8.210 ( -3.153 0.496 4.866) 5.819 8.417 ( 1.226 -15.583 -2.143) 15.778 8.517 ( -4.732 -3.814 -2.159) 6.450 8.838 ( 5.214 -0.399 -2.047) 5.615 8.893 ( 9.293 -2.043 -4.017) 10.328 8.941 ( 5.037 -5.695 1.892) 7.835 9.173 ( 1.630 -0.135 -0.573) 1.733 9.245 ( 10.383 -1.509 0.653) 10.512 9.579 ( -8.662 6.114 3.484) 11.160 9.648 ( -5.318 0.695 -0.678) 5.406 9.752 ( -5.824 -2.211 3.594) 7.192 9.779 ( -2.960 -0.346 2.795) 4.086 10.010 ( 7.396 0.900 4.721) 8.820 10.231 ( 13.796 -3.180 -13.158) 19.328 10.585 ( -6.365 7.759 -0.493) 10.048 10.670 ( -1.540 -0.870 -0.798) 1.941 10.857 ( -12.323 5.211 -16.975) 21.614 10.940 ( 6.741 3.061 11.492) 13.670 11.510 ( -12.835 8.527 9.731) 18.225 11.625 ( -12.399 6.772 -2.915) 14.426 11.702 ( -9.788 1.526 0.528) 9.921 11.800 ( -10.458 1.591 -1.480) 10.681 11.935 ( -7.577 7.197 6.857) 12.499 12.017 ( -3.614 -0.389 2.623) 4.482 12.221 ( -2.051 0.505 3.193) 3.829 12.474 ( 3.453 3.699 -2.736) 5.753 12.620 ( -0.009 1.520 -3.169) 3.515 12.685 ( 2.191 -3.126 -6.039) 7.145 12.891 ( -0.763 2.442 4.240) 4.952 12.928 ( -1.703 -2.616 0.175) 3.127 13.131 ( -11.421 4.888 1.397) 12.501 13.308 ( -5.635 -3.010 3.097) 7.099 13.454 ( 0.393 9.911 -0.255) 9.922 13.614 ( -1.198 -3.346 2.492) 4.341 13.992 ( 3.624 -0.642 -3.238) 4.902 14.126 ( -6.881 6.405 0.274) 9.405 14.248 ( -5.660 0.088 -2.817) 6.323 14.298 ( -3.888 0.233 0.045) 3.895 14.329 ( -2.060 4.763 -2.717) 5.857 14.439 ( 8.023 6.382 0.483) 10.263 15.146 ( 0.572 0.851 -1.495) 1.812 15.267 ( 3.835 0.977 -0.556) 3.996 15.410 ( 5.709 -10.687 4.590) 12.957 15.535 ( 9.783 -7.920 -9.055) 15.506 16.549 ( 4.366 -3.122 20.574) 21.262 16.642 ( 1.060 -1.716 1.245) 2.370 16.758 ( 10.082 4.793 -6.100) 12.721 16.903 ( 8.446 -6.593 -0.128) 10.715 17.107 ( 18.237 -9.053 -7.975) 21.866 17.123 ( 12.576 -14.431 -9.228) 21.249 19.672 ( -2.265 1.180 15.562) 15.770 19.835 ( 4.108 -1.830 -0.073) 4.497 19.849 ( 4.566 -3.856 -0.049) 5.976 20.009 ( -0.140 -1.091 -13.747) 13.791 21.477 ( -4.627 2.495 6.220) 8.144 21.674 ( 2.284 -2.349 -9.199) 9.765 ======================= Grid point 301 (124/199) ======================= q-point: ( 0.17 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.871 ( 22.495 11.057 7.862) 26.270 2.448 ( 5.236 -27.022 -9.080) 28.984 2.753 ( 30.684 -13.145 10.883) 35.110 2.800 ( 20.379 -28.427 -8.570) 36.012 3.227 ( 19.365 -14.659 39.468) 46.342 3.846 ( 45.922 -8.521 -19.975) 50.799 4.081 ( 35.203 -37.595 23.821) 56.746 4.514 ( 20.673 -4.986 -35.863) 41.694 5.925 ( 9.481 -5.681 -3.230) 11.515 6.089 ( 8.357 -11.785 -0.302) 14.450 6.659 ( 7.418 -3.234 1.389) 8.211 7.204 ( 12.107 -4.122 -3.092) 13.158 7.414 ( 1.556 -6.489 7.812) 10.274 7.565 ( -5.953 -3.146 -3.403) 7.544 7.839 ( -11.185 6.151 -1.538) 12.857 8.022 ( -2.478 0.084 0.932) 2.649 8.066 ( -6.777 6.009 0.302) 9.062 8.382 ( -14.050 -16.642 -0.086) 21.780 8.635 ( 4.187 5.523 3.107) 7.595 8.869 ( 0.810 -0.065 1.904) 2.071 9.010 ( 3.581 -2.805 -4.748) 6.576 9.108 ( 5.917 -4.181 0.859) 7.295 9.230 ( 2.812 -4.111 -0.146) 4.983 9.346 ( -8.885 11.789 2.119) 14.914 9.414 ( -0.082 -1.596 -0.627) 1.717 9.554 ( 1.305 5.231 1.022) 5.488 9.668 ( -6.946 -0.802 4.584) 8.360 9.750 ( -1.597 -3.372 -0.938) 3.847 10.076 ( -2.569 1.075 4.993) 5.717 10.280 ( -11.370 10.492 -7.961) 17.399 10.490 ( -5.119 9.402 -13.192) 16.989 10.575 ( 5.099 -5.435 -7.975) 10.915 10.728 ( 11.004 4.840 10.335) 15.853 11.001 ( 2.348 6.829 4.154) 8.331 11.172 ( -17.801 12.228 7.885) 22.991 11.273 ( -18.183 9.235 -4.899) 20.974 11.538 ( -12.380 2.808 5.134) 13.693 11.561 ( -8.293 0.945 0.224) 8.349 11.736 ( -8.851 8.736 1.352) 12.510 11.941 ( -4.019 2.869 1.398) 5.132 12.168 ( -6.258 -3.047 0.832) 7.010 12.461 ( -0.997 2.409 -0.316) 2.627 12.560 ( -1.850 6.782 -4.917) 8.579 12.707 ( -0.995 -1.977 -5.582) 6.005 12.801 ( -8.522 3.592 5.286) 10.652 12.869 ( -8.330 -0.480 4.752) 9.602 13.012 ( -0.977 -1.061 -2.797) 3.147 13.167 ( -7.199 2.955 -1.976) 8.029 13.401 ( 1.068 6.146 3.130) 6.979 13.573 ( -6.529 0.472 3.137) 7.259 13.878 ( -8.194 12.595 0.274) 15.029 14.045 ( 1.280 9.334 0.096) 9.422 14.101 ( -7.175 6.614 -6.072) 11.493 14.157 ( -5.686 -1.576 -0.644) 5.936 14.302 ( 2.629 -1.832 -4.342) 5.396 14.607 ( 11.368 0.623 4.366) 12.193 15.138 ( 2.561 8.481 -3.596) 9.562 15.293 ( 1.837 -0.826 0.242) 2.028 15.661 ( 4.453 -16.429 6.720) 18.300 15.783 ( 9.184 -16.485 -11.168) 21.928 16.641 ( 0.621 -0.381 13.075) 13.096 16.705 ( 6.430 6.596 -3.174) 9.743 16.930 ( 9.370 -1.122 -4.024) 10.259 17.128 ( 17.042 -1.113 -4.047) 17.552 17.489 ( 14.836 -18.473 -3.440) 23.941 17.569 ( 21.772 -14.633 4.858) 26.678 19.628 ( -5.137 4.879 14.160) 15.833 19.858 ( -4.994 2.513 -11.146) 12.469 20.002 ( 7.721 -5.595 0.520) 9.549 20.009 ( 4.023 -6.136 -4.157) 8.433 21.409 ( -2.922 4.514 13.902) 14.906 21.648 ( -4.388 -4.340 -16.561) 17.674 ======================= Grid point 302 (125/199) ======================= q-point: ( 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.134 ( 13.934 -0.205 6.293) 15.291 2.764 ( 6.031 -23.086 -5.483) 24.483 3.443 ( 24.806 -29.275 -1.077) 38.386 3.498 ( 36.896 -13.106 6.036) 39.617 3.726 ( 17.802 -7.090 36.526) 41.247 4.218 ( 10.880 -5.090 -37.452) 39.331 5.079 ( 33.932 -29.696 0.176) 45.091 5.214 ( 44.937 -16.614 -1.610) 47.937 6.210 ( 16.679 -12.185 -2.246) 20.777 6.348 ( 9.026 -15.534 -0.320) 17.969 6.882 ( 14.365 -3.431 -1.336) 14.829 7.315 ( 0.668 -0.376 -2.590) 2.701 7.437 ( -12.919 -4.726 7.897) 15.862 7.505 ( -7.576 -0.923 -3.913) 8.577 7.710 ( 6.167 -1.577 7.251) 9.648 7.818 ( -8.378 4.699 -5.214) 10.930 8.041 ( -3.180 -6.139 0.174) 6.916 8.329 ( -10.444 -13.013 2.940) 16.943 8.552 ( -3.070 10.302 2.001) 10.934 8.807 ( -5.860 4.802 -0.165) 7.578 9.041 ( -5.602 9.189 2.066) 10.958 9.115 ( -0.858 -0.283 -3.042) 3.173 9.136 ( -2.185 2.923 -3.969) 5.391 9.296 ( -2.494 -0.284 -5.273) 5.840 9.353 ( -3.504 -1.792 4.046) 5.644 9.515 ( -3.990 0.316 3.580) 5.370 9.581 ( -2.153 6.956 0.264) 7.286 9.781 ( -0.066 1.102 -2.681) 2.900 9.934 ( -9.453 4.951 -0.540) 10.685 10.005 ( -8.322 -0.865 1.368) 8.478 10.234 ( -5.333 6.352 -7.484) 11.171 10.657 ( -3.662 11.887 6.291) 13.939 10.773 ( -12.878 15.749 3.417) 20.629 10.806 ( -4.288 5.737 4.085) 8.246 10.853 ( -15.791 7.624 -5.366) 18.338 11.087 ( 14.647 0.866 0.890) 14.700 11.381 ( -5.724 -0.772 2.599) 6.334 11.468 ( -5.977 2.789 3.498) 7.466 11.542 ( -3.001 3.377 -3.243) 5.561 11.882 ( -1.583 0.214 2.163) 2.689 12.049 ( -11.900 -2.299 -0.350) 12.125 12.358 ( -6.687 6.017 0.362) 9.003 12.436 ( -2.131 5.301 -2.815) 6.369 12.633 ( -5.904 4.482 1.972) 7.670 12.675 ( -5.854 -1.812 0.673) 6.165 12.731 ( -10.056 -0.580 3.971) 10.827 12.994 ( -4.582 -0.798 -6.362) 7.881 13.050 ( -2.124 1.850 0.324) 2.835 13.345 ( -0.956 9.557 1.593) 9.736 13.430 ( -7.600 5.470 0.721) 9.391 13.634 ( -5.919 13.394 0.699) 14.661 13.837 ( -6.489 10.117 -0.388) 12.025 13.999 ( 0.200 6.606 -1.714) 6.828 14.106 ( -4.418 -2.903 -0.924) 5.366 14.387 ( 6.139 -0.167 -3.260) 6.953 14.784 ( 6.170 -1.431 7.094) 9.510 15.041 ( 0.464 9.357 -7.767) 12.169 15.378 ( 6.037 -0.853 3.256) 6.912 15.876 ( 1.120 -14.708 5.663) 15.800 16.047 ( 2.638 -22.489 -10.555) 24.982 16.636 ( -2.561 5.702 -5.208) 8.136 16.727 ( 9.341 9.673 4.514) 14.185 17.023 ( 0.232 -5.613 -0.890) 5.688 17.476 ( 26.049 4.453 -1.009) 26.446 17.862 ( 12.524 -11.661 0.628) 17.124 18.106 ( 20.272 -18.356 6.906) 28.206 19.496 ( -8.165 8.421 15.031) 19.066 19.608 ( -14.288 4.336 -14.717) 20.965 20.161 ( 6.150 -6.358 -1.184) 8.924 20.200 ( 8.641 -6.416 -0.436) 10.772 21.371 ( -1.934 5.239 16.997) 17.891 21.537 ( -7.675 -5.946 -18.764) 21.127 ======================= Grid point 303 (126/199) ======================= q-point: ( 0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.385 ( 11.617 -2.609 9.754) 15.392 3.034 ( 3.191 -19.817 -6.648) 21.145 4.036 ( 13.366 -16.402 -0.418) 21.162 4.185 ( 28.261 -9.550 4.915) 30.233 4.213 ( 21.793 -10.499 16.346) 29.195 4.365 ( 15.250 -11.672 -20.082) 27.787 5.647 ( 13.740 -10.727 -6.900) 18.747 5.930 ( 23.162 -10.459 5.214) 25.943 6.612 ( 8.990 -18.159 -3.361) 20.539 6.718 ( 10.310 -16.434 1.054) 19.429 7.078 ( 3.738 6.878 -0.612) 7.852 7.254 ( -3.668 -1.508 3.131) 5.053 7.366 ( 10.932 -3.753 -5.386) 12.752 7.466 ( -0.388 -4.333 5.368) 6.910 7.651 ( -4.389 3.616 -8.189) 9.970 7.893 ( 6.036 -7.435 10.249) 14.027 8.038 ( -8.516 -6.706 0.092) 10.840 8.277 ( -6.751 -5.755 5.825) 10.612 8.427 ( -1.220 7.004 -2.472) 7.527 8.633 ( -8.674 1.005 0.089) 8.733 8.853 ( -2.261 7.544 -0.727) 7.910 8.988 ( -10.829 4.103 -3.448) 12.083 9.095 ( -4.989 0.659 -10.959) 12.059 9.204 ( 2.581 7.081 -1.804) 7.750 9.330 ( 1.475 2.660 -0.061) 3.043 9.426 ( -1.933 5.951 4.248) 7.563 9.521 ( -2.995 -2.164 -3.149) 4.855 9.735 ( -0.461 1.792 0.984) 2.096 9.782 ( -1.838 4.280 2.808) 5.439 9.980 ( -7.393 -3.871 2.877) 8.828 10.134 ( -2.941 -0.235 -2.557) 3.904 10.329 ( -15.632 8.887 3.046) 18.238 10.434 ( -11.525 10.433 -2.481) 15.743 10.495 ( -9.440 9.740 0.212) 13.566 10.855 ( 3.133 5.223 8.293) 10.290 11.232 ( 0.899 2.718 -0.892) 2.998 11.292 ( -0.592 1.227 -1.914) 2.349 11.438 ( 2.437 -1.405 1.104) 3.021 11.519 ( -0.149 1.060 -0.953) 1.434 11.827 ( -5.767 2.950 0.241) 6.482 11.919 ( -4.402 -6.446 2.861) 8.314 12.198 ( -3.796 9.140 -1.929) 10.083 12.348 ( -5.072 1.576 2.175) 5.739 12.461 ( -8.013 8.249 2.553) 11.780 12.584 ( -10.310 -3.559 2.029) 11.094 12.622 ( -5.188 -3.942 2.697) 7.052 12.829 ( -8.814 3.552 -5.089) 10.779 13.047 ( 0.530 -0.341 -2.386) 2.468 13.145 ( -3.021 22.286 -2.934) 22.681 13.261 ( -6.969 3.417 0.445) 7.774 13.441 ( -4.666 10.546 2.784) 11.864 13.711 ( -1.867 3.112 1.967) 4.128 13.977 ( 2.867 3.028 -0.719) 4.231 14.047 ( -4.246 -1.178 -1.495) 4.653 14.466 ( 5.257 2.121 -1.785) 5.943 14.786 ( -4.604 4.074 1.895) 6.433 15.061 ( 9.652 1.620 -2.887) 10.204 15.513 ( 7.679 -1.446 4.428) 8.981 16.011 ( -1.010 -10.409 3.523) 11.035 16.189 ( -7.653 -19.162 -2.897) 20.836 16.492 ( -5.205 5.869 -3.687) 8.668 16.816 ( 8.790 5.768 -5.711) 11.964 17.069 ( 2.112 -3.265 -2.241) 4.489 17.869 ( 26.924 5.609 0.808) 27.514 18.118 ( 7.138 -6.853 1.717) 10.043 18.586 ( 15.395 -14.275 7.081) 22.157 19.258 ( -14.736 6.924 -6.404) 17.496 19.311 ( -10.587 7.111 9.044) 15.635 20.294 ( 3.050 -4.289 1.562) 5.489 20.388 ( 6.447 -7.116 -4.122) 10.450 21.344 ( -1.070 3.898 12.657) 13.287 21.419 ( -6.337 -5.032 -15.357) 17.358 ======================= Grid point 304 (127/199) ======================= q-point: ( 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.611 ( 10.372 1.808 14.134) 17.625 3.174 ( -3.071 -13.406 -11.118) 17.685 4.203 ( 2.870 -4.647 -10.403) 11.750 4.584 ( 12.731 -6.075 10.393) 17.521 4.698 ( 18.945 -7.565 1.910) 20.489 4.800 ( 14.701 -14.189 -1.975) 20.526 5.845 ( 7.449 -4.518 -3.891) 9.542 6.276 ( 10.320 -4.701 3.762) 11.948 6.698 ( -10.235 -3.281 5.803) 12.214 6.864 ( -0.692 -10.727 -4.870) 11.801 7.013 ( -0.708 -1.598 -5.716) 5.977 7.205 ( -7.083 13.946 2.028) 15.772 7.407 ( 1.107 -6.365 3.395) 7.298 7.604 ( 2.642 4.148 1.539) 5.153 7.839 ( 5.339 -0.723 -0.818) 5.449 7.880 ( 0.099 1.584 -2.373) 2.855 7.998 ( 3.121 -9.334 -0.052) 9.842 8.338 ( -0.839 -3.517 -1.707) 3.998 8.457 ( 6.376 -8.282 1.947) 10.632 8.567 ( 1.477 -6.191 -0.094) 6.366 8.716 ( -7.186 9.270 -5.071) 12.779 8.820 ( 1.356 2.084 -1.444) 2.875 9.053 ( -0.181 -2.122 -2.692) 3.433 9.139 ( -0.788 3.491 -0.039) 3.579 9.352 ( 7.004 8.626 -0.511) 11.123 9.464 ( 7.063 2.079 3.015) 7.956 9.469 ( -5.738 -5.750 -4.300) 9.191 9.654 ( -9.768 7.403 2.395) 12.488 9.755 ( -0.072 5.403 0.840) 5.469 9.840 ( -6.787 -6.871 5.026) 10.887 9.990 ( -8.444 5.763 2.334) 10.486 10.147 ( -6.612 -1.752 -6.187) 9.223 10.244 ( -4.390 5.455 -0.075) 7.002 10.341 ( -1.691 0.385 -0.069) 1.735 10.870 ( 2.674 4.522 6.788) 8.583 11.164 ( -2.440 -0.225 -1.405) 2.824 11.293 ( -4.349 -0.124 -1.974) 4.777 11.465 ( 3.038 0.853 2.763) 4.194 11.531 ( 3.911 1.406 -0.514) 4.188 11.799 ( 2.044 -0.607 2.633) 3.388 11.925 ( -3.006 -4.089 2.441) 5.632 12.051 ( -1.381 9.098 -2.602) 9.563 12.216 ( -4.822 10.436 0.785) 11.523 12.270 ( -10.276 -2.044 2.640) 10.805 12.477 ( -9.557 -2.223 -3.771) 10.512 12.538 ( -6.907 -1.491 5.448) 8.923 12.698 ( -1.110 1.944 -1.210) 2.544 12.909 ( -2.085 11.470 -2.533) 11.930 13.053 ( 0.820 0.971 -4.017) 4.213 13.129 ( -3.790 5.263 0.831) 6.539 13.302 ( -2.742 5.755 1.613) 6.576 13.684 ( -1.159 0.456 2.656) 2.934 13.973 ( -1.405 0.945 -1.043) 1.988 14.033 ( 2.262 -0.104 0.141) 2.269 14.506 ( 2.682 2.404 -1.774) 4.015 14.686 ( -2.457 2.623 -0.638) 3.650 15.204 ( 8.486 1.326 -1.436) 8.708 15.703 ( 11.322 -3.741 5.090) 12.965 16.042 ( -2.917 -1.602 -3.143) 4.578 16.190 ( -11.199 -15.429 10.032) 21.543 16.339 ( -8.050 2.987 2.611) 8.975 16.808 ( -2.991 0.150 -13.644) 13.969 17.171 ( 10.515 2.727 -9.098) 14.170 18.231 ( 2.726 -3.919 1.789) 5.099 18.271 ( 23.840 3.842 1.612) 24.201 18.877 ( -3.451 -8.060 5.965) 10.604 18.984 ( 2.178 13.427 -0.254) 13.605 19.119 ( -11.845 -3.086 5.932) 13.602 20.344 ( -0.883 -0.487 5.352) 5.446 20.509 ( 2.512 -6.300 -8.528) 10.896 21.309 ( -2.870 6.906 9.909) 12.414 21.375 ( 0.464 -7.749 -12.426) 14.651 ======================= Grid point 305 (128/199) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.762 ( 8.021 9.098 18.635) 22.235 3.115 ( -10.241 -5.914 -13.523) 17.965 4.200 ( -3.551 1.783 -3.369) 5.209 4.783 ( 3.407 -1.862 2.012) 4.373 4.914 ( 2.196 1.807 1.151) 3.068 5.006 ( 1.782 -4.434 -3.933) 6.188 5.945 ( -3.309 0.531 2.111) 3.960 6.416 ( 4.231 -2.092 -2.995) 5.590 6.618 ( 1.021 -3.075 4.601) 5.627 6.881 ( -1.074 -0.460 -1.559) 1.948 6.931 ( -6.170 15.329 2.949) 16.785 7.105 ( 2.891 -11.820 -6.907) 13.992 7.477 ( -1.360 6.519 5.921) 8.910 7.581 ( 5.378 -5.995 -1.867) 8.267 7.776 ( 0.722 1.752 -1.094) 2.188 7.895 ( 1.784 -2.434 -2.440) 3.881 8.167 ( -1.398 -1.619 -4.958) 5.400 8.384 ( 5.114 2.062 0.986) 5.601 8.422 ( -7.531 -1.874 -2.345) 8.107 8.643 ( 1.283 2.589 0.404) 2.918 8.716 ( -8.670 0.423 2.716) 9.095 8.758 ( 1.586 3.173 0.592) 3.597 9.031 ( 1.695 -4.177 -2.351) 5.084 9.258 ( -5.344 -0.468 6.563) 8.477 9.319 ( -3.049 -0.827 0.595) 3.214 9.391 ( 8.562 10.790 -0.896) 13.803 9.431 ( -4.478 -8.215 -3.386) 9.950 9.650 ( 5.314 -1.881 1.831) 5.927 9.720 ( -0.375 0.139 1.443) 1.497 9.822 ( 0.165 0.292 2.494) 2.516 9.920 ( 1.926 2.774 -0.778) 3.466 10.015 ( -2.736 -1.027 -5.403) 6.143 10.203 ( -2.238 -3.527 1.503) 4.440 10.348 ( 2.690 0.616 -2.513) 3.733 10.897 ( 2.088 2.063 3.752) 4.764 11.173 ( 1.695 -2.571 -1.083) 3.264 11.208 ( -2.062 1.002 -2.084) 3.098 11.515 ( 0.679 0.546 3.337) 3.449 11.582 ( 3.230 1.438 -2.433) 4.292 11.843 ( -0.144 -0.557 2.706) 2.766 11.930 ( 0.784 -0.229 2.879) 2.993 12.002 ( 3.559 3.978 -1.005) 5.431 12.099 ( 0.661 2.933 0.859) 3.127 12.183 ( -2.604 -2.626 2.074) 4.240 12.301 ( -8.592 -2.752 -1.817) 9.203 12.512 ( 0.974 1.376 3.327) 3.729 12.726 ( 3.017 -3.540 1.418) 4.863 12.824 ( -0.583 2.834 -4.730) 5.545 13.010 ( -2.579 0.865 0.629) 2.792 13.093 ( 1.748 -0.736 -2.028) 2.777 13.261 ( 0.693 -0.218 0.134) 0.739 13.670 ( -0.826 0.446 2.924) 3.071 13.951 ( 0.143 0.982 -0.226) 1.018 14.058 ( -0.135 -0.082 0.493) 0.518 14.511 ( 0.806 -0.075 -2.354) 2.490 14.657 ( 0.353 0.099 -0.945) 1.014 15.278 ( 3.118 2.574 -2.545) 4.777 15.927 ( -0.884 0.299 -0.160) 0.946 16.023 ( 7.103 -3.871 1.477) 8.223 16.120 ( -5.619 -1.323 3.510) 6.755 16.263 ( -5.355 -9.117 9.650) 14.315 16.673 ( -8.369 0.241 -5.970) 10.283 17.242 ( 7.533 8.454 -13.698) 17.772 18.243 ( -0.462 2.417 3.272) 4.094 18.562 ( -4.769 -2.424 -2.796) 6.036 18.768 ( 10.201 2.062 3.493) 10.977 19.000 ( 0.796 2.402 2.654) 3.667 19.083 ( -1.563 -4.747 3.378) 6.032 20.320 ( -1.887 4.021 9.136) 10.159 20.538 ( -1.178 -2.963 -9.223) 9.758 21.206 ( -4.242 7.606 7.210) 11.306 21.466 ( 4.780 -7.998 -9.774) 13.504 ======================= Grid point 306 (129/199) ======================= q-point: (-0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.813 ( 5.323 15.621 21.530) 27.127 2.895 ( -13.996 0.173 -12.263) 18.609 4.005 ( -13.551 9.424 5.541) 17.410 4.708 ( -13.125 9.866 -2.063) 16.548 4.744 ( -11.777 10.441 0.194) 15.741 4.958 ( -6.008 -0.458 -14.308) 15.525 5.747 ( -12.022 6.473 3.995) 14.226 6.387 ( -7.162 2.232 -5.792) 9.478 6.697 ( -1.981 13.948 9.957) 17.251 6.816 ( 7.311 2.019 -4.680) 8.912 6.962 ( 9.538 -7.093 -1.126) 11.939 7.236 ( 2.456 -9.242 -0.519) 9.577 7.396 ( -1.877 10.613 4.399) 11.641 7.676 ( -9.403 -0.390 -4.884) 10.603 7.844 ( -0.526 -0.267 0.913) 1.087 7.872 ( -3.229 3.510 -4.307) 6.426 8.069 ( 7.481 1.436 -5.579) 9.442 8.320 ( -4.752 -1.256 -0.374) 4.929 8.456 ( 3.760 1.533 0.890) 4.157 8.500 ( -0.969 -4.523 5.568) 7.239 8.678 ( -2.216 6.019 -0.770) 6.460 8.764 ( 2.337 0.049 2.869) 3.701 9.011 ( -9.606 3.230 6.229) 11.896 9.122 ( 1.948 -3.542 -2.804) 4.920 9.349 ( -7.980 -11.355 0.038) 13.879 9.418 ( 7.047 8.952 0.109) 11.393 9.502 ( -2.832 -7.141 0.115) 7.683 9.647 ( 2.753 -1.993 1.000) 3.543 9.788 ( -2.374 -2.143 -1.301) 3.453 9.934 ( 4.744 3.757 0.213) 6.056 9.975 ( 18.291 -2.837 0.500) 18.517 10.059 ( 3.423 -0.933 1.052) 3.700 10.255 ( 1.303 -8.663 -0.421) 8.771 10.409 ( 6.951 0.228 -5.214) 8.692 10.940 ( 2.831 -2.955 0.954) 4.202 11.172 ( 1.402 0.386 -2.665) 3.036 11.269 ( 4.167 -1.257 0.301) 4.363 11.486 ( -4.744 -0.707 0.513) 4.824 11.575 ( -0.652 1.512 -4.160) 4.474 11.817 ( -1.612 2.293 1.787) 3.323 11.951 ( 2.204 0.915 0.410) 2.421 12.040 ( 1.693 -3.896 -2.583) 4.972 12.211 ( 6.541 -9.028 2.883) 11.516 12.250 ( 7.989 3.274 5.158) 10.057 12.335 ( 7.935 -3.223 5.804) 10.346 12.572 ( 5.641 -0.224 0.972) 5.728 12.781 ( 1.699 1.854 -7.487) 7.898 12.854 ( 2.745 -9.402 2.943) 10.227 12.997 ( -0.754 -3.305 1.023) 3.541 13.159 ( 3.476 -4.585 -1.284) 5.895 13.333 ( 4.226 -7.005 -1.209) 8.270 13.667 ( -0.393 0.554 3.819) 3.879 13.956 ( 1.896 1.260 0.333) 2.301 14.029 ( -3.393 -0.252 0.499) 3.439 14.524 ( -0.628 -2.919 -3.455) 4.566 14.686 ( 2.408 -2.634 -0.524) 3.607 15.246 ( -2.087 3.386 -4.468) 5.982 15.817 ( -8.602 0.789 -3.589) 9.354 15.909 ( -7.674 2.926 5.428) 9.845 16.259 ( -1.093 -3.391 7.046) 7.896 16.413 ( 5.530 -2.224 -4.195) 7.288 16.577 ( 3.925 -7.275 6.053) 10.246 17.180 ( 2.373 12.715 -11.091) 17.038 18.187 ( -5.935 3.607 4.520) 8.287 18.315 ( -15.566 2.315 -1.461) 15.805 18.902 ( 6.359 15.542 3.013) 17.060 18.972 ( -14.535 -16.398 2.090) 22.012 19.275 ( 19.979 -7.147 -7.647) 22.554 20.285 ( 1.229 7.318 11.290) 13.510 20.475 ( -4.492 1.152 -6.225) 7.763 21.067 ( -5.273 10.000 10.908) 15.710 21.611 ( 6.816 -8.543 -13.122) 17.077 ======================= Grid point 307 (130/199) ======================= q-point: (-0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.606 ( -14.480 2.516 -10.841) 18.263 2.769 ( 2.544 20.582 19.114) 28.204 3.653 ( -18.446 13.407 19.156) 29.782 4.147 ( -27.390 26.848 1.797) 38.396 4.351 ( -26.431 7.586 -6.599) 28.279 4.776 ( -7.293 2.919 -25.460) 26.644 5.485 ( -13.599 10.713 6.768) 18.588 6.049 ( -29.368 13.723 -5.155) 32.823 6.500 ( -10.069 12.493 5.919) 17.102 6.727 ( -9.371 16.099 0.583) 18.637 7.074 ( -9.941 -3.862 -0.192) 10.667 7.213 ( -1.263 -0.093 1.821) 2.218 7.396 ( 7.866 -2.544 1.278) 8.365 7.545 ( 0.400 9.140 -3.470) 9.785 7.587 ( 1.896 0.845 -4.557) 5.008 8.018 ( 6.862 8.967 1.681) 11.415 8.149 ( -4.409 3.374 -12.542) 13.716 8.325 ( 7.627 1.666 3.161) 8.423 8.453 ( -0.693 -8.170 -5.171) 9.694 8.619 ( 8.773 -1.587 0.125) 8.916 8.780 ( 8.668 -9.256 8.700) 15.379 8.857 ( 9.790 -1.800 1.796) 10.115 8.969 ( 1.422 -2.265 5.502) 6.118 9.159 ( -1.081 -4.167 0.574) 4.343 9.328 ( -3.188 -5.457 0.102) 6.320 9.458 ( 3.603 0.914 1.036) 3.859 9.524 ( 2.422 -4.890 -3.911) 6.714 9.733 ( -1.021 -5.293 2.368) 5.887 9.779 ( 1.074 -1.793 1.347) 2.487 9.999 ( 5.165 5.037 2.223) 7.549 10.132 ( 4.719 -2.352 -2.664) 5.908 10.345 ( 17.912 -6.695 0.797) 19.139 10.400 ( 9.864 -8.542 0.558) 13.060 10.558 ( 10.480 -6.234 -4.134) 12.876 11.032 ( -3.236 -8.109 -6.314) 10.775 11.228 ( 4.328 -2.904 -0.675) 5.255 11.253 ( -4.015 -1.964 1.595) 4.745 11.455 ( 0.629 0.962 -0.438) 1.230 11.530 ( -1.297 0.661 -2.698) 3.066 11.812 ( 2.627 -0.017 2.708) 3.772 11.988 ( 6.084 4.002 -3.553) 8.103 12.145 ( 3.654 -8.051 1.180) 8.920 12.364 ( 8.142 5.891 6.331) 11.878 12.415 ( 6.394 -6.027 2.192) 9.056 12.565 ( 13.651 -1.597 2.977) 14.063 12.678 ( 5.815 -1.365 -1.760) 6.227 12.807 ( 4.028 -1.213 -3.894) 5.733 12.967 ( 0.486 -3.310 5.109) 6.107 13.111 ( 2.689 -18.608 -0.384) 18.805 13.280 ( 7.392 -2.630 -0.955) 7.904 13.509 ( 5.787 -11.111 -2.854) 12.849 13.671 ( -0.484 -1.503 5.302) 5.532 13.967 ( -2.515 -1.622 0.458) 3.028 14.006 ( 3.016 0.821 1.456) 3.448 14.500 ( -4.331 -2.782 -4.817) 7.050 14.793 ( 4.743 -6.345 1.110) 7.999 15.127 ( -5.143 4.590 -7.479) 10.171 15.640 ( -8.914 0.432 -7.951) 11.952 15.793 ( -6.450 5.159 13.456) 15.789 16.240 ( -1.527 7.950 3.671) 8.889 16.363 ( -7.030 -7.247 7.233) 12.420 16.857 ( 6.550 -4.243 -8.327) 11.413 17.082 ( 8.612 9.754 -6.674) 14.624 17.926 ( -23.381 -4.011 -2.410) 23.844 18.094 ( -6.257 11.891 4.151) 14.063 18.644 ( -17.229 11.074 1.695) 20.551 19.053 ( 6.702 -3.886 8.588) 11.566 19.613 ( 10.842 -12.860 -15.074) 22.587 20.290 ( 2.207 6.341 5.123) 8.446 20.339 ( -6.457 4.242 -2.427) 8.098 20.952 ( 0.833 11.206 19.323) 22.353 21.757 ( 6.569 -7.248 -17.364) 19.929 ======================= Grid point 308 (131/199) ======================= q-point: (-0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.325 ( -14.103 -0.871 -11.100) 17.969 2.599 ( -2.420 26.176 11.052) 28.517 3.270 ( -21.209 21.179 21.927) 37.137 3.430 ( -25.954 22.087 20.796) 39.924 3.732 ( -34.558 7.785 -11.720) 37.313 4.473 ( -12.697 14.227 -27.334) 33.328 5.058 ( -44.012 16.046 1.930) 46.886 5.122 ( -35.086 19.618 3.699) 40.368 6.194 ( -16.126 10.730 -0.990) 19.395 6.361 ( -8.552 17.152 -1.062) 19.195 6.906 ( -10.764 -0.470 -3.434) 11.308 7.258 ( -0.272 -1.576 2.201) 2.721 7.450 ( 5.281 9.693 2.444) 11.306 7.588 ( 12.999 7.246 -5.103) 15.733 7.749 ( 6.026 -9.777 0.406) 11.492 7.904 ( -6.973 2.508 -7.036) 10.219 8.044 ( 5.682 8.393 -3.753) 10.808 8.382 ( 7.040 10.355 -1.290) 12.588 8.618 ( 4.632 -13.080 -0.946) 13.908 8.775 ( 5.255 -3.378 -0.405) 6.260 8.999 ( 2.349 -2.375 6.372) 7.195 9.028 ( 6.263 -6.120 6.589) 10.959 9.090 ( 1.593 1.376 0.405) 2.144 9.217 ( 8.425 -8.546 -1.929) 12.154 9.414 ( 7.495 -2.627 -0.447) 7.955 9.548 ( 4.578 -4.217 2.139) 6.581 9.623 ( 5.816 -3.354 -4.928) 8.329 9.730 ( -3.114 -0.753 1.530) 3.550 9.874 ( 6.516 -4.000 3.780) 8.529 10.034 ( 2.439 -1.294 0.044) 2.761 10.211 ( 4.577 -1.882 -4.760) 6.866 10.691 ( 15.280 -9.796 7.100) 19.490 10.763 ( 15.994 -14.213 -0.973) 21.419 10.821 ( -17.048 2.350 -2.136) 17.342 10.886 ( 17.535 -12.560 -3.143) 21.797 11.233 ( -6.816 -5.260 -10.190) 13.340 11.382 ( 6.574 -3.694 1.678) 7.725 11.482 ( 3.369 -2.119 1.654) 4.310 11.544 ( 6.126 -2.520 -2.396) 7.044 11.877 ( 3.172 0.676 3.124) 4.503 12.085 ( 9.583 1.540 -4.100) 10.536 12.300 ( 5.209 -7.417 3.543) 9.731 12.428 ( 4.394 6.027 4.297) 8.608 12.539 ( 5.013 -0.353 0.131) 5.027 12.777 ( 4.564 -4.985 -2.876) 7.345 12.808 ( 13.009 0.089 0.768) 13.032 12.884 ( 3.139 -1.311 0.505) 3.439 13.015 ( 1.860 -1.441 2.682) 3.568 13.317 ( -2.350 -17.278 3.370) 17.759 13.452 ( 10.909 -1.745 -1.395) 11.135 13.672 ( 5.594 -6.435 -1.436) 8.647 13.766 ( 4.258 -8.969 5.316) 11.262 13.985 ( 0.110 -7.324 0.535) 7.344 14.067 ( 4.842 1.760 1.542) 5.378 14.405 ( -7.376 -0.697 -5.054) 8.969 14.890 ( -7.941 -3.344 3.362) 9.249 15.008 ( 4.943 1.002 -9.605) 10.848 15.476 ( -8.598 -1.029 -6.668) 10.929 15.659 ( -6.943 8.167 13.285) 17.070 16.100 ( -2.110 15.207 0.020) 15.353 16.381 ( -5.876 -10.662 11.482) 16.735 16.755 ( -7.814 5.208 0.100) 9.391 17.229 ( 11.611 4.117 -17.303) 21.241 17.549 ( -23.429 -1.676 -4.043) 23.834 17.853 ( -10.529 10.359 1.756) 14.875 18.184 ( -22.219 15.727 -0.434) 27.226 19.282 ( 10.690 -4.449 15.652) 19.469 19.788 ( 4.543 -7.943 -12.022) 15.108 20.148 ( -8.308 5.468 -0.221) 9.948 20.221 ( -5.533 6.056 -2.953) 8.718 21.065 ( 13.599 4.757 20.152) 24.772 21.840 ( 3.171 -4.041 -21.075) 21.692 ======================= Grid point 309 (132/199) ======================= q-point: (-0.17 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.090 ( -12.996 0.318 -10.063) 16.439 2.223 ( -11.528 32.692 8.649) 35.728 2.661 ( -19.351 20.629 4.847) 28.697 3.038 ( -33.338 8.334 -15.065) 37.521 3.094 ( -22.256 8.595 46.878) 52.599 3.812 ( -31.969 33.118 -9.686) 47.039 3.880 ( -60.363 18.966 18.074) 65.803 4.724 ( -6.199 4.743 -33.129) 34.036 5.860 ( -9.451 10.405 1.776) 14.168 6.107 ( -8.374 9.553 -1.683) 12.814 6.740 ( -7.075 -0.726 -5.448) 8.959 7.137 ( -10.963 7.862 2.513) 13.723 7.450 ( -1.249 -1.148 2.631) 3.131 7.649 ( 6.468 8.616 -7.582) 13.174 7.843 ( 6.340 -3.161 -1.076) 7.166 8.035 ( 10.666 -3.243 -2.781) 11.489 8.084 ( 6.121 0.588 -0.243) 6.154 8.400 ( 8.337 11.002 -1.583) 13.894 8.741 ( -3.788 -8.700 -1.508) 9.608 8.841 ( 0.988 0.164 1.737) 2.005 8.980 ( -7.629 0.014 -3.789) 8.518 9.071 ( -0.595 0.679 3.922) 4.025 9.120 ( -0.893 0.938 6.216) 6.349 9.450 ( 1.457 10.647 -3.562) 11.321 9.484 ( 8.572 -11.508 -6.485) 15.747 9.619 ( -4.695 -4.510 -4.864) 8.127 9.690 ( 3.666 -2.467 3.234) 5.476 9.778 ( 9.082 0.240 -3.886) 9.882 10.087 ( -1.122 -9.076 5.138) 10.489 10.146 ( 10.231 -5.426 6.455) 13.258 10.292 ( 3.853 -4.133 2.798) 6.305 10.488 ( -8.746 12.835 -2.936) 15.806 11.017 ( -7.596 -5.782 -12.063) 15.384 11.065 ( 6.201 -8.548 0.148) 10.561 11.168 ( 16.159 -11.196 -0.280) 19.660 11.310 ( 15.813 -13.398 -4.416) 21.191 11.558 ( 5.409 -3.209 2.091) 6.628 11.564 ( 10.826 -2.572 0.095) 11.128 11.771 ( 11.233 -8.700 -0.316) 14.211 11.946 ( 4.646 -1.496 1.717) 5.174 12.189 ( 4.410 0.015 -1.933) 4.815 12.400 ( -1.248 2.318 5.848) 6.413 12.484 ( 5.502 -0.505 2.545) 6.083 12.608 ( 3.832 -0.688 0.407) 3.914 12.883 ( -0.149 -4.925 2.230) 5.409 12.947 ( 6.692 -0.393 -2.892) 7.301 12.997 ( 7.856 -1.036 -3.401) 8.623 13.088 ( 7.771 1.094 4.796) 9.197 13.392 ( -4.758 -11.781 3.959) 13.308 13.597 ( 5.336 1.165 0.518) 5.487 13.884 ( 11.156 -8.707 0.224) 14.153 13.958 ( 6.243 -6.591 6.319) 11.061 14.091 ( 1.095 -10.123 -1.917) 10.361 14.154 ( 7.087 0.209 -1.130) 7.180 14.258 ( -5.780 2.314 -2.068) 6.561 14.686 ( -13.677 1.267 -1.980) 13.878 15.120 ( 4.830 -2.364 -2.187) 5.805 15.341 ( -8.355 -4.119 -4.434) 10.317 15.499 ( -5.934 9.127 9.561) 14.489 15.871 ( -4.837 19.644 -5.309) 20.915 16.413 ( -7.495 -9.788 15.153) 19.535 16.605 ( -7.329 0.077 6.589) 9.855 17.168 ( -11.068 3.306 -9.369) 14.873 17.191 ( -9.211 12.346 -5.744) 16.440 17.564 ( -11.122 18.475 -11.181) 24.291 17.655 ( -22.890 5.568 -5.891) 24.283 19.536 ( 7.630 -3.449 17.833) 19.701 19.870 ( 1.823 -3.337 -7.222) 8.161 19.967 ( -7.129 5.063 0.970) 8.797 20.051 ( -4.181 5.583 -5.549) 8.912 21.329 ( 12.179 -1.003 12.162) 17.241 21.796 ( -2.948 0.503 -21.166) 21.376 ======================= Grid point 310 (133/199) ======================= q-point: (-0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.608 ( -6.653 43.541 24.334) 50.321 2.020 ( -10.030 -17.398 -13.926) 24.438 2.327 ( -17.745 3.081 2.782) 18.224 2.362 ( -36.973 10.255 8.620) 39.325 2.525 ( -27.824 13.801 1.866) 31.114 2.911 ( -27.723 35.546 -17.648) 48.410 3.215 ( -20.220 4.228 61.686) 65.053 4.570 ( 3.516 0.070 -49.513) 49.638 5.700 ( -2.086 5.685 4.379) 7.473 5.893 ( -7.605 4.882 -1.788) 9.212 6.673 ( -0.740 -1.734 -5.487) 5.802 6.852 ( -13.868 6.113 3.171) 15.484 7.468 ( -0.667 -5.690 -1.527) 5.929 7.645 ( 6.187 11.040 -8.105) 15.028 7.958 ( -0.263 -2.546 2.888) 3.859 8.028 ( -6.774 -0.625 -3.577) 7.686 8.261 ( 1.589 -7.243 -1.266) 7.523 8.443 ( 5.607 10.582 -2.272) 12.189 8.550 ( -16.082 10.848 -9.635) 21.660 8.742 ( -10.320 4.474 3.327) 11.730 8.845 ( 0.144 3.272 1.213) 3.492 8.998 ( -5.259 2.952 -2.317) 6.460 9.085 ( -1.454 -0.212 5.996) 6.173 9.281 ( -6.397 4.676 -0.640) 7.950 9.611 ( 1.362 -3.832 -1.305) 4.271 9.693 ( 5.633 -4.336 -2.407) 7.506 9.784 ( 3.272 -3.333 -0.710) 4.724 9.891 ( 4.629 -0.135 -5.325) 7.057 9.959 ( -10.203 1.747 9.247) 13.880 10.218 ( -9.205 6.602 -12.892) 17.162 10.432 ( 11.037 -3.580 6.162) 13.138 10.513 ( 11.262 -2.926 14.642) 18.703 10.863 ( -4.722 -2.624 -12.156) 13.302 11.199 ( -1.167 -5.797 -10.500) 12.050 11.498 ( 10.991 -6.061 7.274) 14.506 11.649 ( 11.394 -9.994 -2.615) 15.380 11.701 ( 8.373 -3.339 0.373) 9.021 11.781 ( 9.746 0.119 0.227) 9.750 12.010 ( 7.104 -4.183 -1.243) 8.337 12.061 ( 3.854 -5.206 0.214) 6.481 12.241 ( 0.204 -3.758 4.731) 6.046 12.352 ( -1.640 3.899 5.556) 6.983 12.518 ( 1.011 1.216 2.066) 2.602 12.684 ( 3.451 0.296 -2.987) 4.573 12.888 ( -2.520 -3.102 2.695) 4.820 12.990 ( -1.540 -1.079 -4.649) 5.015 13.153 ( 10.232 -1.114 0.697) 10.316 13.292 ( 13.182 1.061 6.027) 14.533 13.439 ( -1.543 -8.500 0.828) 8.678 13.606 ( -3.786 2.257 2.447) 5.041 13.999 ( -3.393 0.983 -3.258) 4.806 14.153 ( 9.438 0.132 -2.346) 9.726 14.180 ( 6.841 -8.870 2.030) 11.384 14.272 ( 3.786 -5.745 2.332) 7.265 14.314 ( 8.874 1.594 -0.425) 9.026 14.450 ( -13.257 -3.549 -0.530) 13.734 15.163 ( 1.262 1.580 -2.669) 3.349 15.267 ( -5.518 -7.401 -0.507) 9.246 15.364 ( -4.336 5.276 4.849) 8.375 15.548 ( -8.920 18.035 -6.140) 21.036 16.399 ( -6.984 -3.301 18.358) 19.917 16.576 ( -1.411 -6.021 4.896) 7.888 16.898 ( -7.476 11.895 -0.791) 14.071 16.959 ( -6.353 6.158 -4.452) 9.905 17.057 ( -16.181 18.621 -4.482) 25.073 17.274 ( -19.567 3.153 -23.461) 30.712 19.661 ( -1.194 -0.669 16.939) 16.995 19.832 ( -4.222 2.315 0.641) 4.858 19.838 ( -3.429 2.596 -0.150) 4.304 20.006 ( 3.965 0.930 -13.141) 13.758 21.512 ( 4.258 -1.903 6.400) 7.919 21.651 ( -4.088 2.888 -10.845) 11.945 ======================= Grid point 312 (134/199) ======================= q-point: ( 0.08 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.006 ( 9.692 -0.000 -19.438) 21.720 2.127 ( 4.051 -0.000 6.670) 7.803 2.495 ( 29.772 -0.000 2.033) 29.841 2.744 ( 41.833 -0.000 12.048) 43.534 2.955 ( 38.512 -0.000 17.776) 42.416 3.713 ( 23.677 -0.000 47.765) 53.312 3.774 ( 51.475 -0.000 -22.307) 56.101 4.479 ( 18.668 -0.000 -38.799) 43.056 5.877 ( 9.092 -0.000 -6.813) 11.361 5.963 ( 8.835 -0.000 2.779) 9.261 6.614 ( 5.624 -0.000 1.956) 5.954 7.151 ( 10.345 -0.000 -4.819) 11.413 7.341 ( 3.591 -0.000 9.069) 9.754 7.520 ( -3.875 0.000 -3.710) 5.365 7.910 ( -12.420 0.000 -1.663) 12.531 8.008 ( -8.767 0.000 -4.369) 9.795 8.151 ( -13.133 0.000 1.595) 13.229 8.176 ( -3.853 0.000 6.029) 7.155 8.694 ( 11.970 -0.000 5.023) 12.981 8.871 ( 7.171 -0.000 0.212) 7.174 8.967 ( 4.679 -0.000 -2.056) 5.111 9.033 ( 1.494 -0.000 1.802) 2.340 9.205 ( 2.546 -0.000 -3.347) 4.206 9.397 ( 0.602 -0.000 -4.702) 4.740 9.551 ( -5.120 0.000 6.517) 8.287 9.599 ( -8.981 0.000 4.676) 10.125 9.618 ( 5.308 -0.000 -0.424) 5.325 9.692 ( -7.324 0.000 1.512) 7.478 10.104 ( -1.684 0.000 3.439) 3.829 10.387 ( -9.181 0.000 -11.469) 14.691 10.481 ( 14.691 -0.000 -10.183) 17.875 10.603 ( -14.478 0.000 -15.055) 20.887 10.774 ( 11.464 -0.000 12.039) 16.624 11.072 ( 3.205 -0.000 8.034) 8.650 11.306 ( -19.310 0.000 9.595) 21.562 11.361 ( -19.999 0.000 -4.942) 20.601 11.566 ( -16.046 0.000 3.586) 16.442 11.570 ( -7.284 0.000 1.633) 7.464 11.889 ( -7.629 0.000 0.444) 7.642 11.903 ( -8.047 0.000 3.624) 8.826 12.155 ( -6.571 0.000 1.034) 6.652 12.494 ( -2.000 0.000 -2.988) 3.596 12.626 ( 1.349 -0.000 -5.265) 5.435 12.662 ( -2.543 0.000 -4.016) 4.754 12.847 ( -5.574 0.000 3.940) 6.826 12.860 ( -8.529 0.000 6.380) 10.651 13.009 ( -6.345 0.000 -4.827) 7.972 13.165 ( -7.534 0.000 -2.156) 7.837 13.499 ( -5.803 0.000 5.499) 7.994 13.562 ( 1.244 -0.000 3.394) 3.615 14.043 ( -10.883 0.000 -0.161) 10.884 14.048 ( -6.101 0.000 -3.908) 7.245 14.117 ( 8.606 -0.000 -1.968) 8.828 14.236 ( -4.668 0.000 -1.672) 4.959 14.322 ( -0.367 0.000 -6.380) 6.391 14.630 ( 9.646 -0.000 5.106) 10.914 15.255 ( 9.500 -0.000 -1.899) 9.688 15.354 ( -0.455 0.000 5.380) 5.399 15.378 ( 0.058 -0.000 1.374) 1.375 15.585 ( 8.071 -0.000 -13.131) 15.413 16.658 ( 2.546 -0.000 19.699) 19.863 16.778 ( 11.107 -0.000 -1.914) 11.271 17.021 ( 14.168 -0.000 4.140) 14.760 17.102 ( 5.300 -0.000 -17.981) 18.745 17.146 ( 25.272 -0.000 -6.480) 26.089 17.472 ( 25.738 -0.000 5.747) 26.372 19.678 ( -4.005 0.000 14.756) 15.290 19.902 ( -7.116 0.000 -13.519) 15.278 19.927 ( 7.373 -0.000 -0.774) 7.414 19.941 ( 8.636 -0.000 -0.891) 8.682 21.454 ( -2.713 0.000 12.176) 12.474 21.595 ( -6.167 0.000 -14.946) 16.169 ======================= Grid point 313 (135/199) ======================= q-point: ( 0.17 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.150 ( 7.363 -0.594 2.160) 7.696 2.280 ( 6.340 -17.547 -4.946) 19.302 3.014 ( 30.784 -11.673 -6.600) 33.578 3.458 ( 38.893 2.909 20.425) 44.026 3.647 ( 29.980 -1.982 22.746) 37.685 4.162 ( 12.500 -0.967 -40.248) 42.156 4.537 ( 47.616 -19.480 15.307) 53.676 5.071 ( 51.024 -2.405 -6.061) 51.439 6.047 ( 11.790 -4.350 -5.290) 13.635 6.129 ( 6.227 -6.507 1.249) 9.093 6.786 ( 12.717 -4.249 -0.988) 13.444 7.218 ( -1.355 -6.303 -0.270) 6.453 7.424 ( -3.138 3.509 -0.380) 4.723 7.511 ( 1.304 -0.431 -1.695) 2.182 7.703 ( -5.531 1.254 4.933) 7.517 7.797 ( -12.976 -7.383 -1.315) 14.988 7.982 ( -8.512 1.647 -1.606) 8.817 8.158 ( -2.972 -4.195 5.060) 7.214 8.706 ( -3.276 4.210 4.975) 7.294 8.904 ( -5.958 5.023 -1.767) 7.991 9.049 ( 4.113 0.193 0.669) 4.172 9.121 ( 1.797 -4.052 -1.582) 4.706 9.221 ( -0.270 -2.218 -1.721) 2.820 9.333 ( -3.799 2.752 -1.994) 5.097 9.351 ( -6.343 9.559 3.654) 12.040 9.523 ( -5.681 -0.344 5.177) 7.693 9.602 ( -5.605 -5.603 1.287) 8.030 9.743 ( 5.230 -2.029 -1.084) 5.714 9.963 ( -12.158 3.172 0.423) 12.572 10.098 ( -13.972 3.032 -11.596) 18.409 10.329 ( -11.107 2.780 -8.298) 14.140 10.759 ( 14.175 0.824 3.201) 14.555 10.894 ( -16.759 4.315 8.546) 19.301 10.972 ( -21.490 3.004 -4.584) 22.178 11.033 ( -6.686 8.596 -1.444) 10.985 11.131 ( 11.716 1.371 6.653) 13.542 11.365 ( -7.696 -0.479 7.542) 10.786 11.481 ( -4.095 -0.365 2.144) 4.636 11.667 ( -9.104 8.631 -1.251) 12.608 11.829 ( -8.260 -6.814 0.308) 10.712 12.033 ( -7.448 1.204 0.114) 7.545 12.403 ( -7.961 0.543 -2.582) 8.387 12.558 ( -7.182 2.583 -6.046) 9.737 12.589 ( -4.579 0.449 -3.123) 5.561 12.684 ( -8.908 0.816 6.558) 11.092 12.752 ( -9.793 -1.224 1.270) 9.951 12.931 ( -2.311 -3.242 -2.207) 4.552 13.077 ( -3.859 0.722 -1.336) 4.147 13.409 ( -5.481 0.979 2.910) 6.283 13.559 ( -0.115 4.845 3.542) 6.003 13.859 ( -5.227 7.555 -1.754) 9.353 13.965 ( -7.300 -2.287 -1.123) 7.732 14.129 ( -2.380 8.666 -2.210) 9.254 14.157 ( 0.145 6.403 0.646) 6.437 14.375 ( 8.523 -1.245 -5.229) 10.076 14.778 ( 6.030 0.242 5.887) 8.431 15.203 ( -3.142 9.563 -4.403) 10.987 15.415 ( 9.330 3.599 2.277) 10.256 15.502 ( -4.038 -20.739 7.647) 22.470 15.749 ( 9.690 -8.718 -13.046) 18.441 16.701 ( -1.984 2.528 11.457) 11.900 16.893 ( -0.908 -5.394 -13.825) 14.868 17.024 ( 12.549 19.044 1.579) 22.861 17.450 ( 11.151 -22.430 5.209) 25.585 17.586 ( 29.563 2.254 -5.253) 30.110 17.947 ( 26.832 -2.878 6.476) 27.752 19.613 ( -7.565 3.399 15.898) 17.931 19.664 ( -14.542 1.524 -13.924) 20.190 20.078 ( 9.082 -2.278 -0.552) 9.380 20.122 ( 11.230 -1.962 -1.410) 11.487 21.395 ( -10.258 -2.015 -16.806) 19.792 21.465 ( -3.194 -0.515 13.480) 13.863 ======================= Grid point 314 (136/199) ======================= q-point: ( 0.25 0.08 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.330 ( 10.827 -3.413 8.549) 14.211 2.555 ( 3.103 -25.541 -6.842) 26.623 3.667 ( 31.212 -16.370 -5.542) 35.678 4.087 ( 25.145 -3.694 27.764) 37.640 4.129 ( 22.266 0.247 -6.768) 23.273 4.252 ( 15.658 -1.121 -18.309) 24.118 5.436 ( 34.032 -10.456 -3.885) 35.814 5.832 ( 34.866 -0.630 4.560) 35.168 6.298 ( 4.174 -12.874 -0.302) 13.537 6.372 ( 16.279 -16.187 0.622) 22.966 7.092 ( 13.622 -8.091 -2.505) 16.041 7.209 ( -9.018 -0.846 1.611) 9.200 7.327 ( 1.424 0.926 -4.738) 5.033 7.403 ( 1.028 0.031 -1.359) 1.704 7.713 ( -3.549 -0.579 1.067) 3.751 7.797 ( -1.045 -0.569 5.842) 5.962 7.852 ( -4.515 -10.600 0.656) 11.540 8.176 ( -2.441 -3.047 5.074) 6.402 8.600 ( -3.250 8.002 4.465) 9.722 8.698 ( -11.835 3.705 -1.085) 12.449 8.991 ( -8.514 6.866 -1.664) 11.063 9.053 ( -3.097 1.986 -4.485) 5.801 9.120 ( -4.914 4.109 -6.175) 8.897 9.278 ( -3.770 -3.004 1.226) 4.974 9.341 ( 6.184 3.452 -1.723) 7.289 9.484 ( -1.366 0.800 3.802) 4.118 9.574 ( -3.130 0.434 0.316) 3.176 9.692 ( -9.771 0.093 0.318) 9.777 9.838 ( -5.712 -4.933 0.766) 7.586 9.903 ( 1.584 1.967 -4.157) 4.864 10.154 ( -6.590 1.089 -3.689) 7.631 10.499 ( -20.661 7.421 5.919) 22.737 10.575 ( -19.122 4.259 -3.245) 19.858 10.733 ( -11.945 12.479 -4.542) 17.862 10.951 ( 7.049 4.059 10.456) 13.247 11.301 ( 1.008 4.365 2.153) 4.970 11.341 ( 1.763 2.710 1.390) 3.519 11.432 ( -0.021 1.378 1.789) 2.258 11.526 ( 0.112 -0.575 -2.407) 2.477 11.767 ( -8.075 -8.878 2.160) 12.194 11.882 ( -7.360 2.985 -0.835) 7.986 12.232 ( -11.873 -3.129 0.695) 12.298 12.381 ( -9.361 1.805 -4.968) 10.750 12.495 ( -5.237 -0.575 -1.696) 5.535 12.536 ( -13.813 -2.157 -0.008) 13.981 12.625 ( -3.871 0.687 4.528) 5.996 12.895 ( -4.230 4.575 -3.599) 7.195 13.024 ( -0.471 -1.779 -0.385) 1.880 13.315 ( -4.837 2.187 1.045) 5.411 13.494 ( -0.858 10.259 2.127) 10.513 13.698 ( -3.332 11.980 -1.184) 12.491 13.804 ( -7.672 6.810 1.060) 10.313 14.025 ( -2.374 2.517 -2.607) 4.332 14.086 ( -0.131 6.801 1.099) 6.891 14.511 ( 8.273 1.797 -2.060) 8.713 14.822 ( -3.650 0.388 3.144) 4.833 15.117 ( 4.662 4.002 -3.040) 6.855 15.530 ( 8.058 3.192 1.895) 8.872 15.665 ( -5.632 -22.357 14.491) 27.231 15.938 ( 6.651 -8.587 -13.623) 17.423 16.601 ( -6.413 5.207 -2.184) 8.545 16.827 ( -6.878 -4.851 -3.639) 9.170 17.124 ( 13.827 10.545 -0.891) 17.412 17.813 ( 5.951 -20.049 3.527) 21.208 18.019 ( 28.393 6.301 -2.637) 29.203 18.413 ( 20.855 -4.480 6.467) 22.289 19.357 ( -12.899 3.526 -10.197) 16.817 19.455 ( -12.116 6.126 16.618) 21.459 20.246 ( 8.476 -0.931 1.124) 8.601 20.312 ( 10.123 -1.079 -3.997) 10.937 21.213 ( -9.056 -9.441 -23.925) 27.268 21.456 ( -3.242 2.278 18.260) 18.685 ======================= Grid point 315 (137/199) ======================= q-point: ( 0.33 0.08 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.610 ( 14.936 -2.410 11.335) 18.904 2.802 ( 0.254 -23.585 -10.089) 25.653 4.128 ( 12.122 -3.635 -14.280) 19.080 4.426 ( 19.815 -16.399 -9.054) 27.268 4.513 ( 14.866 -1.074 17.070) 22.662 4.636 ( 19.310 -4.312 4.930) 20.390 5.832 ( 16.935 2.500 -6.745) 18.399 6.249 ( 16.692 1.979 6.269) 17.940 6.467 ( -0.734 -14.161 0.022) 14.180 6.727 ( 5.123 -7.520 -1.097) 9.165 7.047 ( -7.002 1.633 -0.763) 7.230 7.205 ( 1.424 -9.310 1.154) 9.488 7.442 ( -3.974 6.240 3.999) 8.410 7.585 ( 2.052 -3.640 -1.360) 4.395 7.657 ( 13.646 -12.910 -7.499) 20.226 7.878 ( 4.615 -3.661 -1.678) 6.125 7.939 ( -0.311 -3.722 8.200) 9.011 8.120 ( -6.770 -4.885 6.460) 10.556 8.515 ( -1.212 1.193 -0.514) 1.776 8.525 ( 1.239 7.807 2.765) 8.374 8.811 ( -4.914 3.398 -4.261) 7.338 8.915 ( -4.883 3.183 -8.264) 10.112 9.066 ( 1.726 3.929 0.278) 4.300 9.192 ( -6.499 -0.892 -1.600) 6.752 9.376 ( -7.614 -2.403 -6.187) 10.101 9.438 ( 5.180 5.537 0.222) 7.586 9.531 ( 4.254 2.465 4.630) 6.753 9.676 ( -5.409 -6.333 6.403) 10.505 9.787 ( -0.084 2.771 0.186) 2.779 9.924 ( -2.396 6.674 -2.374) 7.478 10.040 ( -1.810 -3.256 -3.602) 5.181 10.165 ( -11.635 5.829 3.984) 13.609 10.337 ( -4.782 -0.283 -1.741) 5.097 10.415 ( -10.776 11.188 -3.160) 15.852 10.989 ( 1.853 7.516 7.327) 10.658 11.184 ( -6.144 3.296 -1.171) 7.070 11.303 ( -3.828 1.580 -0.709) 4.201 11.468 ( 1.304 -0.199 1.865) 2.285 11.573 ( 5.959 1.382 -0.231) 6.122 11.780 ( -0.796 -4.353 3.217) 5.471 11.782 ( -4.903 -6.718 -0.057) 8.317 12.074 ( -15.953 -10.002 1.834) 18.918 12.178 ( -9.935 3.794 -1.636) 10.760 12.313 ( -13.219 -1.205 -3.736) 13.789 12.450 ( -2.083 -4.111 -1.103) 4.739 12.589 ( -1.328 5.795 3.545) 6.922 12.724 ( -5.671 4.473 -3.139) 7.875 13.053 ( 1.556 -0.323 -1.250) 2.021 13.212 ( -4.198 4.169 -0.328) 5.926 13.305 ( -3.675 20.090 0.248) 20.425 13.511 ( -3.350 13.958 0.477) 14.362 13.676 ( -4.540 -0.392 2.432) 5.165 13.969 ( -2.460 -0.346 -2.301) 3.386 14.054 ( 1.079 2.608 1.412) 3.156 14.581 ( 4.376 5.123 -1.744) 6.960 14.717 ( -5.977 0.683 -0.441) 6.032 15.238 ( 10.923 0.958 -2.317) 11.207 15.646 ( 6.770 -1.588 4.211) 8.129 15.813 ( -6.896 -19.129 19.718) 28.324 16.021 ( 0.451 -3.295 -9.365) 9.938 16.422 ( -7.934 4.856 -1.271) 9.388 16.743 ( -7.614 -5.924 -7.720) 12.356 17.260 ( 13.741 6.367 -7.650) 16.967 18.051 ( 1.789 -15.227 1.706) 15.426 18.368 ( 20.460 5.966 -0.985) 21.334 18.667 ( -0.318 -7.723 2.643) 8.168 19.167 ( -11.704 7.630 8.429) 16.317 19.249 ( 3.343 8.378 3.540) 9.690 20.363 ( 5.598 2.652 4.422) 7.611 20.445 ( 7.723 -0.305 -9.480) 12.231 21.160 ( -2.823 -12.968 -18.831) 23.038 21.420 ( -3.922 3.349 15.244) 16.093 ======================= Grid point 316 (138/199) ======================= q-point: ( 0.42 0.08 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.893 ( 13.258 2.581 12.276) 18.252 2.915 ( -3.806 -13.128 -11.722) 18.006 4.240 ( 5.379 2.068 -7.315) 9.313 4.740 ( 6.343 -3.139 5.088) 8.716 4.820 ( 9.140 -12.899 -3.791) 16.257 4.896 ( 6.312 -2.486 4.771) 8.293 6.026 ( 12.139 7.301 -0.575) 14.178 6.421 ( 4.518 2.895 0.916) 5.444 6.525 ( -1.600 -8.041 4.722) 9.461 6.827 ( 5.246 -3.471 -4.014) 7.462 6.951 ( -2.254 -1.600 -6.021) 6.625 7.201 ( -7.849 8.392 5.245) 12.631 7.359 ( 1.418 -8.528 -0.313) 8.651 7.707 ( -6.245 5.899 -0.180) 8.593 7.713 ( 3.114 -1.971 1.278) 3.901 7.842 ( -4.588 -6.248 2.205) 8.059 8.058 ( 6.004 -6.953 -4.692) 10.315 8.229 ( -1.403 -14.794 1.375) 14.923 8.471 ( 1.205 4.413 0.323) 4.586 8.645 ( 3.059 0.628 0.618) 3.184 8.772 ( 6.564 2.960 -0.651) 7.230 8.820 ( -2.036 1.793 -3.778) 4.652 9.028 ( -0.683 3.247 1.937) 3.843 9.146 ( -3.305 -2.803 0.938) 4.434 9.304 ( -1.044 -4.470 -4.338) 6.315 9.425 ( -10.928 -1.327 3.726) 11.621 9.472 ( -7.385 4.734 4.069) 9.669 9.671 ( 9.664 -0.112 -1.037) 9.720 9.739 ( -1.989 4.329 -2.690) 5.471 9.861 ( 2.008 3.552 1.873) 4.490 10.034 ( 1.448 5.288 -3.048) 6.273 10.105 ( 6.978 10.560 0.834) 12.685 10.188 ( -5.157 1.971 1.273) 5.666 10.341 ( 2.086 -1.986 -1.746) 3.368 10.955 ( 0.407 5.115 0.361) 5.144 11.109 ( -1.268 -4.284 0.091) 4.469 11.205 ( -4.283 0.522 -0.099) 4.315 11.515 ( 1.571 -1.202 0.932) 2.187 11.630 ( 2.279 2.872 -2.414) 4.389 11.769 ( -3.944 -7.973 0.414) 8.905 11.870 ( 2.485 -4.324 2.332) 5.506 11.912 ( -17.158 -14.240 1.756) 22.366 12.032 ( -5.341 -2.790 6.903) 9.163 12.118 ( -7.537 1.325 -7.840) 10.956 12.429 ( -3.117 11.123 -2.013) 11.725 12.490 ( 0.566 -4.875 1.447) 5.116 12.707 ( 2.855 -1.374 0.078) 3.169 13.017 ( -1.047 13.422 0.595) 13.476 13.096 ( 1.107 4.907 -4.164) 6.530 13.119 ( -4.390 5.717 1.837) 7.439 13.352 ( -1.189 9.952 0.404) 10.031 13.645 ( -2.639 -2.870 2.363) 4.559 13.943 ( -0.732 -1.296 -2.027) 2.515 14.056 ( -0.433 0.142 1.493) 1.561 14.543 ( -2.177 2.625 -2.099) 4.004 14.660 ( -0.585 0.857 -1.621) 1.924 15.362 ( 7.680 5.420 -6.556) 11.460 15.847 ( 6.319 -10.871 6.846) 14.317 15.901 ( -8.081 -12.749 18.224) 23.664 15.991 ( -0.510 0.114 -1.639) 1.720 16.257 ( -6.440 3.326 1.854) 7.481 16.643 ( -6.939 -3.119 -6.323) 9.892 17.388 ( 11.828 6.123 -15.035) 20.086 18.190 ( 1.344 -8.838 1.051) 9.002 18.489 ( -7.356 -6.058 -0.218) 9.532 18.711 ( -5.244 -6.541 8.425) 11.886 18.899 ( -3.513 5.813 -4.836) 8.337 19.362 ( 15.000 15.550 5.921) 22.403 20.421 ( 4.701 6.153 8.052) 11.171 20.521 ( 5.527 1.244 -10.392) 11.835 21.217 ( -0.246 -10.436 -10.723) 14.965 21.363 ( -3.496 1.441 8.878) 9.649 ======================= Grid point 317 (139/199) ======================= q-point: (-0.50 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.839 ( -9.965 -5.207 -12.652) 16.926 3.072 ( 9.527 10.492 16.162) 21.496 4.188 ( -4.331 9.929 2.402) 11.095 4.793 ( -3.210 1.851 -0.188) 3.710 4.910 ( -5.747 3.735 3.363) 7.635 4.930 ( -2.266 -3.271 -11.225) 11.910 5.962 ( -4.623 15.225 4.004) 16.407 6.446 ( -0.280 3.495 -3.801) 5.171 6.685 ( 11.908 -9.243 3.870) 15.563 6.903 ( 3.269 0.797 0.441) 3.393 6.971 ( -2.457 2.900 -0.445) 3.827 7.053 ( 0.519 -2.321 -0.054) 2.378 7.510 ( 1.039 -11.708 -2.145) 11.948 7.547 ( -3.318 3.966 -0.862) 5.242 7.812 ( 0.904 -6.252 -4.286) 7.634 7.852 ( 3.308 -0.871 -1.511) 3.739 8.212 ( 7.104 3.924 0.795) 8.154 8.247 ( -7.934 -7.931 0.319) 11.222 8.376 ( -13.150 -1.734 1.396) 13.337 8.555 ( 5.346 8.866 0.372) 10.360 8.779 ( -0.202 2.913 -2.886) 4.105 8.825 ( 2.013 3.510 4.643) 6.159 9.037 ( -4.586 -3.538 4.348) 7.242 9.112 ( -4.439 0.988 -0.198) 4.552 9.159 ( -8.146 -0.868 1.808) 8.390 9.353 ( -1.330 -6.041 -0.573) 6.212 9.492 ( -1.348 -3.104 0.609) 3.439 9.726 ( 6.119 2.334 -1.171) 6.653 9.779 ( 5.584 7.131 0.530) 9.073 9.943 ( 1.168 -8.789 -1.906) 9.069 9.959 ( 6.421 5.678 2.709) 8.989 10.114 ( -0.503 1.745 -1.645) 2.450 10.169 ( 4.947 8.506 3.229) 10.356 10.419 ( 7.862 0.918 -4.164) 8.944 10.921 ( -0.953 0.713 -2.305) 2.594 11.169 ( -0.053 -0.323 -1.063) 1.112 11.226 ( 7.493 -5.456 0.707) 9.296 11.504 ( -3.849 1.174 -2.004) 4.496 11.604 ( -1.424 0.675 -4.011) 4.310 11.784 ( -4.835 -11.697 1.241) 12.718 11.848 ( -6.777 -17.755 -1.104) 19.037 11.865 ( -5.963 -2.831 2.023) 6.904 12.040 ( 1.184 -1.516 -5.390) 5.723 12.154 ( 7.572 -7.540 9.326) 14.183 12.357 ( 3.678 4.201 2.755) 6.226 12.564 ( 3.518 -2.404 -0.019) 4.261 12.793 ( 5.223 -1.681 -0.887) 5.558 12.908 ( 2.910 10.515 -1.213) 10.978 13.006 ( -3.158 4.148 2.067) 5.608 13.107 ( 3.855 0.159 -2.379) 4.533 13.300 ( 2.066 2.764 -0.134) 3.454 13.643 ( -2.324 -3.036 2.802) 4.740 13.957 ( 1.864 -1.082 -1.766) 2.786 14.032 ( -2.663 0.506 0.841) 2.839 14.493 ( -2.051 -1.148 -2.477) 3.415 14.642 ( -0.671 -0.800 -1.745) 2.034 15.350 ( 1.774 7.234 -8.984) 11.670 15.821 ( -10.732 -2.817 -0.639) 11.114 15.883 ( -7.809 -3.756 12.285) 15.033 16.189 ( -3.267 -2.177 9.043) 9.858 16.267 ( 17.094 -11.252 1.564) 20.524 16.547 ( -4.135 1.888 5.088) 6.823 17.415 ( 6.543 10.566 -15.938) 20.210 18.213 ( -14.620 -0.182 5.811) 15.734 18.328 ( -5.230 -2.501 -8.169) 10.017 18.625 ( -13.315 -18.844 2.972) 23.264 19.015 ( 13.362 0.233 -5.291) 14.374 19.409 ( 8.460 18.202 4.253) 20.517 20.459 ( 5.637 9.647 10.465) 15.309 20.535 ( 2.410 4.941 -6.312) 8.370 21.201 ( -4.948 3.036 7.526) 9.504 21.406 ( 2.830 -11.550 -10.444) 15.826 ======================= Grid point 318 (140/199) ======================= q-point: (-0.42 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.627 ( -13.658 0.578 -10.089) 16.990 3.104 ( 2.974 14.008 14.591) 20.444 3.943 ( -11.768 16.835 15.643) 25.819 4.541 ( -17.541 12.098 -5.803) 22.085 4.611 ( -18.642 18.630 4.527) 26.741 4.820 ( -4.127 2.003 -22.745) 23.203 5.756 ( -3.536 16.557 6.067) 17.985 6.302 ( -8.049 11.189 -6.302) 15.156 6.766 ( -16.625 13.805 9.152) 23.468 6.906 ( 2.867 2.716 -1.775) 4.330 6.999 ( -1.472 -4.422 -3.240) 5.676 7.169 ( 5.330 -13.432 4.871) 15.249 7.272 ( -15.632 4.754 1.505) 16.408 7.591 ( 1.616 -4.199 -5.712) 7.271 7.734 ( 0.862 8.554 -4.968) 9.930 8.089 ( 11.545 -7.778 -1.962) 14.058 8.172 ( 2.450 -4.906 -5.281) 7.613 8.198 ( -0.962 3.832 2.399) 4.622 8.455 ( -3.278 -7.559 -0.083) 8.240 8.582 ( 7.730 4.075 5.487) 10.318 8.755 ( 5.362 5.723 -0.798) 7.883 8.868 ( 6.882 0.480 1.582) 7.078 8.955 ( -1.710 1.611 5.974) 6.420 9.054 ( -2.395 -7.475 2.599) 8.268 9.178 ( 0.152 -3.853 0.037) 3.856 9.346 ( -4.091 -8.469 -1.550) 9.532 9.516 ( -0.058 -2.537 0.067) 2.539 9.727 ( 2.508 8.144 1.702) 8.690 9.798 ( 0.888 3.230 -2.447) 4.148 10.013 ( 4.840 -4.410 3.933) 7.638 10.093 ( -2.062 -0.187 2.953) 3.607 10.180 ( 4.808 -13.564 0.354) 14.395 10.249 ( 12.821 -3.315 -2.220) 13.428 10.507 ( 4.581 1.771 -5.970) 7.730 10.911 ( 0.351 -3.508 -4.912) 6.046 11.191 ( 2.246 -1.307 -0.705) 2.693 11.302 ( -2.630 5.263 -0.462) 5.902 11.477 ( 4.696 0.694 1.069) 4.865 11.540 ( -2.171 0.311 -4.030) 4.588 11.799 ( -0.957 -1.907 -1.172) 2.434 11.899 ( 1.987 -14.292 1.809) 14.543 12.015 ( 2.249 -10.152 -1.349) 10.486 12.130 ( 4.418 -15.794 -0.661) 16.414 12.403 ( 7.979 -11.036 7.411) 15.505 12.436 ( 5.643 0.815 4.371) 7.184 12.639 ( 2.252 -2.553 -0.818) 3.501 12.864 ( 5.397 5.469 -5.874) 9.672 12.913 ( 4.989 -0.410 0.603) 5.042 12.966 ( -0.486 -0.336 2.495) 2.564 13.233 ( 10.803 -1.390 -1.076) 10.946 13.363 ( 5.163 -3.527 -0.251) 6.258 13.631 ( -3.796 -3.306 3.511) 6.138 13.972 ( -2.579 1.919 -0.419) 3.242 14.018 ( 4.960 -0.058 -0.259) 4.968 14.463 ( -2.784 -1.558 -3.827) 4.982 14.665 ( 0.394 -5.975 0.108) 5.989 15.248 ( -1.385 7.690 -11.563) 13.956 15.655 ( -9.274 0.165 -3.865) 10.049 15.822 ( -7.364 -1.062 15.224) 16.944 16.186 ( -5.884 -6.195 9.947) 13.112 16.435 ( 0.898 8.768 11.722) 14.666 16.718 ( 16.235 -10.403 -4.816) 19.875 17.324 ( 2.279 13.196 -12.876) 18.577 17.865 ( -23.338 -2.233 -3.684) 23.732 18.236 ( -7.988 3.064 -2.568) 8.932 18.651 ( -4.946 -9.858 5.786) 12.455 19.159 ( 6.516 8.454 0.564) 10.689 19.411 ( 6.969 -1.298 -6.459) 9.590 20.453 ( -1.464 7.369 -1.676) 7.697 20.475 ( 2.584 12.112 6.131) 13.820 21.119 ( -2.279 5.873 16.922) 18.057 21.556 ( 5.078 -13.342 -17.708) 22.746 ======================= Grid point 319 (141/199) ======================= q-point: (-0.33 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.330 ( -16.469 2.474 -9.269) 19.060 2.987 ( -4.410 15.073 6.888) 17.149 3.620 ( -13.891 19.244 33.544) 41.092 4.006 ( -23.236 21.347 -9.227) 32.875 4.038 ( -21.372 31.111 6.370) 38.278 4.631 ( -4.514 5.037 -32.637) 33.331 5.479 ( -15.727 26.008 5.044) 30.810 5.666 ( -36.778 34.350 1.486) 50.346 6.351 ( -14.547 6.680 3.555) 16.398 6.723 ( -12.740 13.627 -3.232) 18.933 6.877 ( -9.797 1.974 1.402) 10.091 7.197 ( 2.456 -3.620 2.462) 5.020 7.498 ( 8.424 -14.761 3.697) 17.393 7.639 ( 6.849 2.847 -6.208) 9.672 7.697 ( 3.323 7.307 -1.883) 8.245 7.971 ( -14.810 3.172 -5.670) 16.172 8.163 ( -0.600 1.721 -4.308) 4.678 8.394 ( 11.727 -5.737 -2.343) 13.264 8.490 ( 3.954 -3.800 -1.980) 5.831 8.785 ( 8.571 3.490 1.592) 9.390 8.838 ( 10.500 -7.302 1.801) 12.916 8.930 ( -2.612 -5.201 6.125) 8.450 9.102 ( 1.336 -3.987 2.267) 4.777 9.208 ( 18.835 7.747 3.440) 20.655 9.231 ( 5.350 -13.747 1.728) 14.853 9.431 ( 1.198 -9.936 -0.360) 10.014 9.555 ( 2.916 -4.858 -3.050) 6.435 9.727 ( 3.341 0.127 2.588) 4.228 9.762 ( -2.514 -1.137 -0.895) 2.900 9.994 ( -9.474 -3.254 5.060) 11.223 10.167 ( 3.381 -4.950 -1.333) 6.141 10.442 ( 9.705 -13.722 4.225) 17.330 10.525 ( 7.823 -8.789 -4.712) 12.675 10.613 ( 11.570 -14.439 -3.476) 18.826 10.901 ( -1.015 3.909 -5.053) 6.468 11.214 ( -2.429 4.400 -5.877) 7.733 11.290 ( 6.331 -4.942 3.330) 8.695 11.459 ( -0.308 -0.675 -1.457) 1.635 11.553 ( 2.877 2.750 -1.249) 4.171 11.869 ( 3.611 -1.634 3.002) 4.972 12.080 ( 1.576 -4.933 -3.079) 6.025 12.117 ( 9.357 -10.340 -0.393) 13.951 12.405 ( 6.410 -13.833 -1.144) 15.289 12.504 ( 1.583 -0.294 3.997) 4.309 12.677 ( 0.560 -6.845 4.245) 8.074 12.681 ( 7.136 -10.821 2.061) 13.125 12.898 ( 5.883 3.323 -3.364) 7.547 12.998 ( 1.588 -2.535 0.137) 2.995 13.032 ( 5.194 -5.085 2.026) 7.545 13.428 ( 9.798 -1.810 -2.063) 10.175 13.532 ( 7.798 -7.880 -0.697) 11.108 13.633 ( -0.437 -4.837 4.893) 6.894 13.929 ( -0.026 1.187 -0.761) 1.410 14.105 ( 5.679 1.528 1.326) 6.028 14.395 ( -4.943 -0.262 -4.351) 6.590 14.762 ( 1.184 -8.773 3.081) 9.374 15.102 ( -2.265 7.510 -14.528) 16.510 15.494 ( -7.529 2.036 -3.136) 8.407 15.742 ( -7.907 1.413 15.592) 17.539 16.171 ( -7.026 -7.225 9.810) 14.065 16.404 ( 3.590 14.977 17.680) 23.447 16.910 ( 2.117 5.152 -16.792) 17.691 17.258 ( 5.443 -1.359 -11.773) 13.041 17.516 ( -16.767 1.015 -6.222) 17.913 17.992 ( -15.577 5.828 1.214) 16.676 18.531 ( -10.101 15.219 3.546) 18.607 19.216 ( 7.382 -0.229 12.014) 14.103 19.593 ( 7.758 -11.774 -12.975) 19.162 20.300 ( -5.503 9.832 0.519) 11.279 20.369 ( -4.277 9.963 -0.468) 10.852 21.155 ( 5.143 3.900 21.958) 22.887 21.696 ( 4.111 -10.989 -21.757) 24.719 ======================= Grid point 320 (142/199) ======================= q-point: (-0.25 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.011 ( -14.566 1.344 -11.648) 18.699 2.724 ( -9.848 15.985 2.813) 18.984 3.314 ( -20.041 16.293 31.979) 41.107 3.374 ( -18.852 31.234 3.723) 36.672 3.414 ( -13.601 36.830 7.360) 39.945 4.323 ( -25.398 25.643 -14.629) 38.944 4.435 ( -34.556 30.994 -11.683) 47.867 5.054 ( -15.577 32.800 -0.847) 36.321 6.068 ( -9.819 10.142 -0.298) 14.119 6.384 ( -7.901 18.352 -1.978) 20.079 6.701 ( -9.823 -2.936 -0.892) 10.291 7.247 ( -3.700 1.780 1.650) 4.425 7.447 ( -13.024 0.175 2.808) 13.324 7.746 ( 0.695 -1.808 -4.907) 5.276 7.801 ( 8.835 0.729 0.708) 8.894 7.868 ( 9.567 -6.771 -6.090) 13.209 8.120 ( -3.111 -0.877 -6.153) 6.951 8.522 ( -0.453 -5.155 -0.355) 5.187 8.644 ( 9.051 -0.531 -2.779) 9.483 8.855 ( 1.684 1.819 5.855) 6.358 8.942 ( -0.390 -3.156 2.672) 4.154 9.037 ( 2.548 -4.018 2.851) 5.547 9.196 ( 6.832 3.053 -0.279) 7.488 9.291 ( 2.625 -5.133 -2.971) 6.486 9.497 ( 0.542 -6.318 -2.970) 7.002 9.540 ( 5.126 -5.117 0.825) 7.290 9.676 ( 1.232 3.273 -0.706) 3.568 9.774 ( 7.947 -0.742 -2.354) 8.322 9.848 ( 2.249 -15.421 8.762) 17.879 10.006 ( 6.326 -7.878 6.421) 11.971 10.235 ( 1.749 -3.065 -0.894) 3.641 10.631 ( 2.012 -5.091 -3.864) 6.701 10.811 ( 6.850 -10.987 2.332) 13.156 10.921 ( 10.863 -9.419 1.927) 14.507 10.990 ( 7.189 -10.908 -7.116) 14.876 11.021 ( -4.729 -1.796 -12.583) 13.562 11.472 ( 6.488 -5.305 4.363) 9.448 11.524 ( 6.071 -2.403 0.483) 6.548 11.640 ( 9.119 -3.728 -3.331) 10.400 11.914 ( 0.825 -1.289 1.291) 2.002 12.151 ( 0.781 -5.133 0.650) 5.233 12.367 ( 7.656 -4.025 0.215) 8.652 12.489 ( 1.749 -3.391 -3.749) 5.350 12.587 ( 2.668 -1.298 3.866) 4.873 12.739 ( 0.883 -7.218 1.848) 7.503 12.913 ( 4.505 -6.720 4.694) 9.353 12.977 ( 5.080 -0.670 0.645) 5.165 13.060 ( 3.609 -5.518 -4.006) 7.716 13.179 ( 4.529 -5.494 4.957) 8.676 13.580 ( 5.434 -4.445 -0.602) 7.046 13.693 ( 4.380 -8.101 0.901) 9.253 13.792 ( 6.950 -10.904 2.832) 13.237 13.957 ( 2.879 -2.178 -2.173) 4.213 14.176 ( 3.839 1.704 3.504) 5.470 14.286 ( -6.148 0.856 -3.380) 7.068 14.794 ( -3.154 6.737 0.866) 7.489 15.017 ( 0.665 -6.374 -11.637) 13.285 15.355 ( -3.898 4.859 -1.520) 6.412 15.626 ( -7.825 3.877 12.223) 15.022 16.134 ( -6.272 0.676 5.865) 8.614 16.347 ( -0.616 12.208 13.863) 18.482 16.722 ( -6.406 8.101 -3.031) 10.763 17.246 ( -7.553 3.658 -8.918) 12.246 17.369 ( 7.119 3.812 -19.962) 21.533 17.638 ( -19.691 6.304 2.247) 20.797 18.106 ( -15.866 26.365 -0.498) 30.775 19.436 ( 7.108 -6.753 17.826) 20.345 19.773 ( 6.553 -7.699 -11.638) 15.416 20.111 ( -5.829 9.755 1.755) 11.499 20.178 ( -6.160 8.166 -2.812) 10.608 21.306 ( 5.936 -1.490 17.286) 18.337 21.752 ( 0.705 -5.746 -23.100) 23.815 ======================= Grid point 321 (143/199) ======================= q-point: (-0.17 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.830 ( 1.655 0.771 -15.259) 15.368 2.423 ( -11.878 12.900 5.407) 18.350 2.681 ( -36.870 34.565 12.643) 52.096 2.820 ( -4.997 45.076 11.666) 46.829 2.887 ( -20.405 25.862 1.800) 32.992 3.457 ( -16.700 28.208 47.879) 58.026 3.772 ( -20.361 45.268 -20.594) 53.739 4.629 ( -1.922 10.002 -35.006) 36.458 5.878 ( -0.884 11.413 1.299) 11.520 6.077 ( -9.015 14.264 -0.651) 16.887 6.642 ( 0.039 -1.829 -1.757) 2.537 6.974 ( -17.286 5.132 -0.455) 18.037 7.404 ( -0.185 -1.890 5.918) 6.215 7.776 ( 5.793 1.205 -5.071) 7.793 7.914 ( 3.200 -2.148 -4.487) 5.915 7.988 ( -11.740 -1.637 -7.385) 13.965 8.096 ( 5.744 -9.869 0.553) 11.433 8.494 ( -12.188 -9.960 -1.968) 15.863 8.705 ( 5.730 8.848 3.628) 11.148 8.852 ( -0.553 3.727 2.620) 4.589 8.993 ( 4.320 3.455 0.062) 5.532 9.063 ( 0.575 2.128 -0.797) 2.344 9.145 ( -2.658 8.794 3.140) 9.709 9.460 ( -4.032 5.465 -7.595) 10.188 9.467 ( 7.705 -5.607 0.039) 9.529 9.624 ( 5.626 -1.977 -2.684) 6.540 9.676 ( -1.097 -6.662 2.768) 7.297 9.891 ( 5.202 -1.052 -5.843) 7.893 9.977 ( -3.237 -0.831 9.617) 10.181 10.257 ( 5.970 -7.194 7.335) 11.882 10.374 ( 8.308 -4.323 0.319) 9.371 10.549 ( -2.305 14.889 -4.730) 15.791 10.761 ( -5.721 -8.293 -14.887) 17.975 10.993 ( -0.468 -13.512 -5.051) 14.433 11.282 ( 9.006 -16.019 5.190) 19.096 11.361 ( 10.018 -18.808 -3.498) 21.595 11.618 ( 5.862 -5.312 3.355) 8.593 11.717 ( 8.532 -5.474 0.291) 10.141 11.857 ( 9.722 -8.257 -2.044) 12.918 11.964 ( 0.590 -5.303 1.178) 5.464 12.194 ( -0.219 -2.479 3.031) 3.922 12.363 ( -3.726 -0.992 -1.653) 4.195 12.579 ( 0.400 3.048 5.505) 6.306 12.665 ( 5.918 -3.687 -3.723) 7.904 12.809 ( 0.152 -3.977 3.295) 5.167 12.969 ( -1.066 -0.625 -2.173) 2.500 13.084 ( 3.492 -6.322 5.914) 9.334 13.227 ( 6.241 -10.278 -4.590) 12.871 13.321 ( 8.873 0.437 5.460) 10.427 13.620 ( -4.813 -1.351 1.975) 5.375 13.918 ( 7.419 -15.848 -0.195) 17.499 14.007 ( 1.263 -5.013 -2.336) 5.673 14.049 ( 9.095 -9.833 3.181) 13.767 14.187 ( -5.058 -2.835 2.763) 6.423 14.212 ( -1.342 -1.455 0.031) 1.980 14.605 ( -3.681 13.821 -7.214) 16.019 15.099 ( 1.565 -7.404 -1.072) 7.643 15.286 ( 3.386 8.090 -1.787) 8.950 15.491 ( -6.357 5.479 7.827) 11.476 15.881 ( -13.349 13.768 -8.643) 21.035 16.320 ( -0.658 -1.088 16.500) 16.549 16.625 ( 1.840 8.498 9.911) 13.185 17.092 ( 0.607 11.535 -6.753) 13.380 17.209 ( -11.985 15.239 2.095) 19.500 17.349 ( -4.407 3.678 -26.461) 27.077 17.541 ( -19.177 28.075 -3.168) 34.147 19.619 ( 1.038 -4.564 16.932) 17.567 19.859 ( 1.319 -0.250 -5.954) 6.103 19.952 ( -3.391 8.132 1.862) 9.006 20.044 ( 0.085 3.723 -7.659) 8.517 21.445 ( 1.473 -4.904 10.712) 11.873 21.703 ( -0.611 0.904 -18.444) 18.477 ======================= Grid point 322 (144/199) ======================= q-point: (-0.08 0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.602 ( -41.361 20.255 23.733) 51.809 2.010 ( 23.320 0.943 -10.532) 25.605 2.310 ( 11.605 26.265 14.887) 32.344 2.459 ( 4.068 38.771 13.581) 41.282 2.518 ( 5.118 23.001 -12.527) 26.686 2.915 ( -14.048 48.231 -19.345) 53.832 3.302 ( -2.549 15.633 59.899) 61.958 4.496 ( 5.134 1.171 -50.339) 50.614 5.807 ( 2.778 10.434 2.998) 11.206 5.860 ( -1.885 8.404 -1.787) 8.796 6.688 ( -8.470 3.982 1.296) 9.449 6.725 ( 7.608 0.233 -1.850) 7.833 7.455 ( 0.603 1.988 8.506) 8.756 7.687 ( -5.203 3.836 -10.793) 12.581 7.879 ( -7.109 -0.952 -0.676) 7.204 7.952 ( 8.552 1.045 -6.209) 10.620 8.235 ( 0.289 -2.164 5.548) 5.962 8.374 ( -1.898 -4.335 -7.079) 8.515 8.711 ( 1.027 10.331 4.338) 11.252 8.780 ( 1.941 8.889 -0.902) 9.143 8.936 ( -5.541 9.256 -1.033) 10.838 8.992 ( 5.933 14.872 -6.314) 17.212 9.124 ( 3.902 2.882 6.933) 8.461 9.246 ( -4.372 7.340 -3.196) 9.121 9.632 ( 0.274 -3.042 3.785) 4.863 9.725 ( 1.647 -2.105 -3.259) 4.215 9.747 ( 0.871 -4.083 3.062) 5.177 9.846 ( -6.259 0.159 -5.647) 8.431 9.919 ( -2.282 2.302 8.650) 9.238 10.168 ( 2.285 6.381 -14.009) 15.563 10.513 ( 2.311 -8.721 9.004) 12.747 10.690 ( 6.984 -2.877 5.355) 9.259 10.757 ( 0.969 -5.893 -4.450) 7.448 11.005 ( -7.716 -9.865 -13.972) 18.763 11.502 ( -2.154 -13.454 8.153) 15.878 11.621 ( 0.946 -15.199 -2.672) 15.461 11.779 ( 2.714 -6.397 2.546) 7.401 11.815 ( -1.838 -3.943 -1.207) 4.514 11.996 ( -6.283 -7.326 3.620) 10.308 12.022 ( 0.459 -5.392 -0.120) 5.413 12.219 ( -0.124 0.264 5.869) 5.876 12.370 ( 4.193 -3.878 -5.693) 8.064 12.578 ( 1.807 0.951 5.448) 5.818 12.714 ( 0.525 0.211 -6.218) 6.244 12.857 ( 0.906 -1.261 3.613) 3.932 12.948 ( 0.118 -0.281 -4.682) 4.692 13.193 ( -2.512 -6.977 9.582) 12.116 13.369 ( 1.240 -8.521 -3.440) 9.273 13.463 ( -12.083 2.303 2.602) 12.573 13.511 ( 11.131 -1.536 -0.730) 11.260 14.058 ( -0.681 2.124 5.756) 6.173 14.123 ( -6.313 -7.095 -0.475) 9.509 14.185 ( 5.643 -14.006 -0.891) 15.126 14.217 ( 1.348 -6.000 -2.628) 6.687 14.296 ( 5.226 -6.698 3.256) 9.098 14.422 ( -4.010 4.358 -7.737) 9.744 15.198 ( 4.149 1.971 1.196) 4.746 15.244 ( -0.082 6.068 -4.099) 7.324 15.384 ( -0.019 5.733 6.237) 8.472 15.557 ( -2.392 12.098 -8.616) 15.044 16.420 ( 5.235 0.818 19.214) 19.931 16.626 ( 2.236 3.358 3.482) 5.329 16.901 ( -9.744 12.326 -3.461) 16.089 16.984 ( -7.187 14.591 2.601) 16.471 17.026 ( 1.685 16.995 -4.819) 17.745 17.172 ( 6.579 17.685 -22.328) 29.234 19.663 ( -3.090 -0.743 15.656) 15.975 19.827 ( 0.330 3.423 -0.568) 3.486 19.858 ( 0.141 6.432 1.222) 6.549 20.033 ( 2.900 1.091 -13.182) 13.541 21.499 ( -3.515 -4.680 6.355) 8.639 21.661 ( 4.048 3.602 -9.737) 11.143 ======================= Grid point 325 (145/199) ======================= q-point: ( 0.17 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.231 ( 6.266 -0.000 -5.594) 8.400 2.326 ( 8.365 -0.000 6.606) 10.659 3.504 ( 35.530 -0.000 -5.911) 36.019 4.053 ( 26.375 -0.000 29.691) 39.714 4.129 ( 13.630 -0.000 -22.416) 26.234 4.265 ( 20.741 -0.000 -8.455) 22.398 5.320 ( 48.483 -0.000 3.609) 48.617 5.840 ( 39.994 -0.000 1.813) 40.036 6.169 ( 2.771 -0.000 2.173) 3.522 6.204 ( 12.115 -0.000 -2.704) 12.413 6.997 ( 13.438 -0.000 -2.872) 13.742 7.154 ( -1.860 0.000 -1.271) 2.253 7.349 ( -3.710 0.000 -6.368) 7.370 7.482 ( -5.978 0.000 1.507) 6.165 7.615 ( 0.526 -0.000 0.342) 0.627 7.751 ( 4.241 -0.000 12.010) 12.737 7.827 ( -10.171 0.000 -3.159) 10.650 8.150 ( 0.871 -0.000 4.233) 4.322 8.680 ( -3.507 0.000 5.988) 6.939 8.735 ( -13.303 0.000 -1.499) 13.387 9.057 ( -2.298 0.000 -1.127) 2.559 9.058 ( -7.548 0.000 -10.775) 13.155 9.205 ( -1.949 0.000 3.356) 3.881 9.286 ( -7.522 0.000 4.774) 8.909 9.382 ( 6.513 -0.000 -4.507) 7.920 9.436 ( -6.878 0.000 3.539) 7.736 9.513 ( 0.559 -0.000 5.967) 5.993 9.716 ( -8.208 0.000 -5.197) 9.715 9.827 ( -4.483 0.000 -1.878) 4.860 9.913 ( -1.990 0.000 -9.543) 9.749 10.161 ( -8.494 0.000 -1.048) 8.559 10.580 ( -22.427 0.000 8.800) 24.092 10.607 ( -20.877 0.000 -6.053) 21.737 10.867 ( -13.520 0.000 -6.187) 14.869 10.992 ( 8.412 -0.000 10.848) 13.727 11.360 ( 7.184 -0.000 3.579) 8.026 11.374 ( 4.185 -0.000 6.645) 7.853 11.436 ( 0.466 -0.000 1.713) 1.776 11.570 ( -10.136 0.000 -4.300) 11.010 11.616 ( -8.063 0.000 2.389) 8.410 11.921 ( -7.934 0.000 -2.389) 8.286 12.186 ( -16.140 0.000 0.012) 16.140 12.389 ( -9.018 0.000 -5.024) 10.323 12.507 ( -11.084 0.000 1.551) 11.192 12.513 ( -11.151 0.000 -8.706) 14.147 12.621 ( -1.480 0.000 5.000) 5.215 12.938 ( 3.625 -0.000 -0.338) 3.640 13.011 ( -5.165 0.000 -0.578) 5.198 13.336 ( -4.121 0.000 0.867) 4.212 13.579 ( -1.865 0.000 2.587) 3.189 13.826 ( -4.346 0.000 -2.048) 4.804 13.830 ( -6.777 0.000 2.334) 7.167 14.149 ( -3.186 0.000 -1.288) 3.437 14.150 ( -2.078 0.000 -1.631) 2.642 14.520 ( 10.510 -0.000 -2.429) 10.787 14.823 ( -2.117 0.000 2.605) 3.357 15.268 ( -4.845 0.000 3.568) 6.017 15.294 ( 0.900 -0.000 9.885) 9.925 15.588 ( 8.131 -0.000 -1.209) 8.220 15.841 ( 10.057 -0.000 -11.919) 15.595 16.673 ( -7.481 0.000 10.935) 13.250 16.744 ( -6.596 0.000 -16.279) 17.564 17.389 ( 10.651 -0.000 4.523) 11.571 17.445 ( 8.457 -0.000 1.391) 8.571 18.099 ( 29.953 -0.000 -2.747) 30.079 18.368 ( 20.916 -0.000 4.769) 21.453 19.391 ( -12.022 0.000 -9.796) 15.507 19.516 ( -12.803 0.000 17.669) 21.820 20.241 ( 11.145 -0.000 1.092) 11.199 20.312 ( 12.789 -0.000 -3.231) 13.190 21.106 ( -11.797 0.000 -25.891) 28.452 21.475 ( -3.481 0.000 18.394) 18.721 ======================= Grid point 326 (146/199) ======================= q-point: ( 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.395 ( 6.739 -13.651 -3.945) 15.727 2.555 ( 15.333 -2.790 5.675) 16.586 4.067 ( 27.234 -2.296 -7.531) 28.349 4.201 ( 10.391 -5.957 -24.461) 27.236 4.524 ( 18.905 1.029 22.713) 29.569 4.583 ( 14.940 -1.385 3.242) 15.350 5.914 ( 22.993 4.377 -3.876) 23.725 6.267 ( 8.657 -0.212 1.281) 8.754 6.351 ( 21.814 1.140 1.770) 21.916 6.501 ( 15.107 -12.300 2.378) 19.626 7.038 ( -6.399 0.592 0.702) 6.464 7.107 ( -4.920 -4.059 -2.871) 6.995 7.400 ( 4.609 -6.204 1.477) 7.869 7.467 ( 4.301 -2.401 1.668) 5.201 7.612 ( -9.150 1.569 -5.436) 10.758 7.793 ( 12.664 -2.872 -4.660) 13.796 7.863 ( 2.779 -2.303 12.327) 12.845 8.130 ( -6.305 1.583 5.631) 8.601 8.557 ( -3.365 1.847 -1.011) 3.969 8.646 ( -0.446 3.291 6.684) 7.463 8.875 ( -6.885 1.938 -11.034) 13.150 8.968 ( -6.676 3.812 -0.721) 7.722 9.110 ( -10.515 -4.968 3.104) 12.037 9.178 ( 1.094 7.366 2.071) 7.729 9.385 ( -6.945 1.667 -9.082) 11.554 9.460 ( -2.286 -9.581 1.306) 9.936 9.549 ( 6.483 3.212 1.934) 7.489 9.611 ( -0.221 0.330 0.718) 0.821 9.816 ( 4.707 2.406 -1.638) 5.534 9.940 ( 4.002 -3.018 -3.943) 6.377 10.036 ( -6.558 1.469 0.299) 6.727 10.261 ( -14.261 3.242 1.228) 14.676 10.307 ( -12.551 -1.921 0.552) 12.709 10.602 ( -11.315 5.819 -5.750) 13.962 11.115 ( 4.379 4.624 9.079) 11.090 11.306 ( -6.188 7.552 0.238) 9.766 11.353 ( -5.734 3.262 -1.018) 6.675 11.469 ( -2.140 0.848 1.721) 2.874 11.528 ( 3.540 -4.778 2.976) 6.649 11.602 ( 0.184 -9.167 2.965) 9.636 11.750 ( -9.970 -0.691 -3.303) 10.526 11.929 ( -17.031 -4.096 1.429) 17.575 12.240 ( -8.576 3.033 -1.634) 9.242 12.299 ( -8.951 -0.855 -3.793) 9.759 12.361 ( -7.712 -3.806 -6.325) 10.676 12.633 ( 1.369 0.783 2.867) 3.272 12.867 ( -7.075 6.489 -1.097) 9.662 13.018 ( 2.729 -2.560 -0.634) 3.795 13.269 ( -3.522 1.799 0.306) 3.967 13.525 ( -3.682 2.457 1.674) 4.732 13.696 ( -6.363 4.400 1.852) 7.955 13.726 ( -7.131 3.244 -0.799) 7.875 14.023 ( -3.273 7.214 -2.959) 8.456 14.115 ( -2.350 1.000 1.074) 2.770 14.667 ( 8.042 2.657 -2.725) 8.897 14.734 ( -7.048 1.844 -0.271) 7.291 15.224 ( 2.865 -1.391 6.861) 7.564 15.460 ( 0.155 -12.730 18.262) 22.262 15.679 ( 4.996 1.733 -1.975) 5.645 15.967 ( 7.044 -1.951 -12.517) 14.495 16.511 ( -9.287 4.331 -0.583) 10.263 16.624 ( -7.944 -5.560 -5.409) 11.103 17.427 ( 9.159 11.727 -0.733) 14.898 17.713 ( 4.374 -17.767 2.197) 18.429 18.484 ( 10.576 5.556 -2.457) 12.196 18.576 ( 8.591 -3.590 0.188) 9.313 19.282 ( -16.352 3.711 10.196) 19.624 19.350 ( 9.880 2.177 2.413) 10.401 20.426 ( 10.866 2.427 3.759) 11.751 20.486 ( 10.799 3.693 -6.396) 13.083 20.924 ( -5.256 -9.423 -22.136) 24.625 21.450 ( -5.251 0.381 15.062) 15.955 ======================= Grid point 327 (147/199) ======================= q-point: ( 0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.626 ( 4.864 -13.848 -6.184) 15.927 2.895 ( 18.593 -2.706 6.214) 19.790 4.252 ( 10.216 -1.619 -14.882) 18.123 4.552 ( 12.613 -8.728 -5.326) 16.237 4.726 ( 7.257 -1.708 4.176) 8.545 4.868 ( 10.696 -0.111 12.892) 16.752 6.156 ( 16.457 3.234 -3.016) 17.041 6.401 ( 5.417 0.484 1.444) 5.627 6.544 ( 5.647 9.189 3.814) 11.440 6.776 ( 9.368 -5.428 -2.706) 11.161 6.925 ( -6.666 -2.202 -2.641) 7.500 7.110 ( -2.601 -7.779 -0.351) 8.210 7.392 ( -6.247 4.078 3.618) 8.291 7.563 ( -1.331 -10.752 -5.106) 11.977 7.634 ( 4.896 -9.552 4.735) 11.732 7.879 ( -5.192 5.243 4.811) 8.808 7.965 ( 2.796 -3.733 -1.182) 4.811 8.016 ( -2.689 -3.672 3.107) 5.511 8.562 ( 2.658 4.661 0.874) 5.437 8.688 ( 7.208 1.622 3.328) 8.103 8.786 ( -1.631 0.385 0.032) 1.676 8.840 ( -1.142 1.230 -4.964) 5.240 9.053 ( -2.181 -4.021 4.044) 6.106 9.136 ( -4.683 1.621 -2.768) 5.676 9.240 ( -1.115 1.698 -2.468) 3.196 9.480 ( -4.156 -3.059 3.851) 6.439 9.517 ( -10.095 5.403 2.766) 11.779 9.621 ( 2.879 -1.453 -5.116) 6.048 9.826 ( -4.213 5.301 -5.087) 8.469 9.960 ( 5.863 4.436 1.650) 7.535 10.058 ( 6.362 -3.117 -2.652) 7.564 10.179 ( 5.686 1.082 -0.778) 5.840 10.262 ( 2.116 -3.903 1.034) 4.559 10.385 ( -2.100 9.812 -1.276) 10.115 11.059 ( -6.233 2.738 -0.231) 6.812 11.109 ( -7.779 7.867 -1.149) 11.123 11.249 ( -2.142 3.961 4.355) 6.265 11.456 ( -2.528 -5.874 -1.424) 6.551 11.561 ( -13.171 -9.505 -0.551) 16.252 11.625 ( -3.817 -6.773 0.541) 7.793 11.721 ( -5.259 -2.644 1.884) 6.180 11.791 ( 5.113 -4.454 2.937) 7.390 12.036 ( -9.906 3.093 3.393) 10.918 12.164 ( -4.606 2.703 -9.564) 10.954 12.352 ( -0.428 -8.489 -1.697) 8.667 12.624 ( -4.841 7.514 0.202) 8.941 12.699 ( -0.362 1.732 -0.041) 1.769 13.062 ( 0.247 -1.267 -1.340) 1.861 13.187 ( -2.966 3.258 -0.298) 4.416 13.389 ( -5.641 12.404 2.053) 13.780 13.548 ( -5.202 7.586 -0.612) 9.219 13.588 ( -4.962 -1.113 1.540) 5.313 13.932 ( -1.535 1.354 -2.798) 3.467 14.079 ( -0.935 1.602 2.247) 2.913 14.577 ( -7.739 1.857 -1.365) 8.075 14.717 ( 2.874 4.237 -4.604) 6.886 15.401 ( 9.255 -6.187 4.307) 11.937 15.590 ( -3.748 -7.474 16.315) 18.333 15.746 ( 2.105 -5.271 7.171) 9.145 16.011 ( 2.036 1.522 -8.396) 8.772 16.321 ( -8.242 3.200 -2.231) 9.118 16.562 ( -3.613 -4.977 -3.429) 7.041 17.490 ( 9.600 5.725 -7.049) 13.215 17.932 ( 2.244 -16.132 2.682) 16.507 18.370 ( -11.558 -3.820 -3.623) 12.701 18.696 ( -11.876 1.685 14.540) 18.849 19.046 ( 3.888 7.701 -12.452) 15.148 19.591 ( 18.235 7.949 5.889) 20.746 20.543 ( 7.922 6.930 -0.932) 10.566 20.582 ( 8.959 4.398 -2.414) 10.268 20.967 ( 0.786 -13.755 -11.592) 18.006 21.386 ( -6.633 0.114 10.503) 12.423 ======================= Grid point 328 (148/199) ======================= q-point: (-0.58 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.734 ( -0.715 -4.950 -7.335) 8.878 3.190 ( 12.842 1.909 5.741) 14.196 4.370 ( 6.757 7.219 -1.342) 9.979 4.689 ( -1.559 -10.496 -0.232) 10.614 4.866 ( 4.559 -1.993 -5.204) 7.200 4.976 ( 0.899 3.343 5.260) 6.297 6.289 ( 0.396 18.126 3.947) 18.555 6.456 ( 9.485 -5.370 -2.594) 11.204 6.569 ( 3.545 0.711 3.182) 4.817 6.859 ( -0.275 -3.913 -7.765) 8.700 6.921 ( 4.244 0.190 0.126) 4.250 7.141 ( -3.432 -2.876 5.422) 7.032 7.326 ( 1.511 -2.498 0.195) 2.926 7.530 ( -13.085 -6.390 -2.101) 14.713 7.704 ( 4.442 -4.976 -4.287) 7.929 7.853 ( 0.836 1.481 5.496) 5.753 8.033 ( -6.637 -10.470 2.523) 12.651 8.078 ( 5.476 -8.661 -2.108) 10.462 8.518 ( -1.193 8.284 0.169) 8.371 8.734 ( -2.092 4.008 -2.078) 4.976 8.783 ( 2.219 -0.146 4.267) 4.811 8.863 ( 2.951 1.970 0.831) 3.644 9.013 ( -5.613 1.245 -1.746) 6.009 9.118 ( 3.681 -0.255 2.816) 4.642 9.200 ( -8.458 1.651 2.004) 8.847 9.319 ( -1.664 3.135 -2.037) 4.093 9.426 ( -4.842 -1.274 4.709) 6.873 9.691 ( 0.354 -9.998 -6.007) 11.669 9.736 ( 4.567 1.744 -2.019) 5.289 10.022 ( 5.615 8.756 3.381) 10.937 10.139 ( -2.873 3.006 2.432) 4.817 10.144 ( 3.272 6.906 -1.465) 7.781 10.309 ( -0.206 2.869 0.062) 2.877 10.484 ( 15.535 7.458 -1.986) 17.347 10.955 ( -3.315 -0.740 -2.709) 4.345 11.035 ( 1.402 -10.480 -1.854) 10.735 11.196 ( -1.347 2.644 2.460) 3.855 11.359 ( -13.233 -12.891 -3.584) 18.818 11.528 ( 0.416 -3.261 -0.371) 3.308 11.601 ( -7.721 -6.354 -2.600) 10.331 11.689 ( -1.451 -1.447 2.573) 3.289 11.860 ( -4.658 -0.553 0.188) 4.695 12.015 ( 3.676 -2.760 -1.382) 4.800 12.075 ( 3.226 0.510 0.730) 3.346 12.438 ( -2.221 -0.446 6.261) 6.659 12.472 ( 1.837 -1.480 -6.903) 7.295 12.749 ( 2.972 -2.106 1.229) 3.844 13.033 ( -3.054 0.824 -1.546) 3.520 13.128 ( -0.825 4.025 -2.522) 4.820 13.200 ( 0.848 12.565 2.929) 12.930 13.408 ( -2.928 6.309 0.489) 6.972 13.562 ( -3.583 -4.679 1.897) 6.191 13.928 ( 1.688 -1.402 -1.534) 2.678 14.062 ( 0.514 2.681 0.566) 2.787 14.449 ( -7.172 -2.593 -1.781) 7.831 14.680 ( -0.454 3.659 -5.173) 6.352 15.502 ( 2.951 7.835 -11.551) 14.266 15.635 ( -8.401 -12.328 22.898) 27.329 15.868 ( 0.059 -2.263 1.891) 2.949 16.055 ( 8.426 -7.685 4.044) 12.100 16.188 ( -4.476 1.046 -1.866) 4.961 16.573 ( 1.192 0.070 7.027) 7.127 17.565 ( 8.199 5.429 -12.613) 15.994 18.119 ( -0.788 -12.278 5.185) 13.351 18.235 ( -8.551 -5.909 -4.801) 11.450 18.349 ( -24.667 -6.063 3.224) 25.605 19.109 ( 11.501 8.824 -9.818) 17.508 19.748 ( 10.716 15.279 5.617) 19.489 20.596 ( 6.458 4.930 -6.095) 10.157 20.672 ( 8.059 8.392 8.258) 14.268 21.087 ( 1.639 -12.403 -8.981) 15.400 21.298 ( -7.248 -1.184 6.717) 9.952 ======================= Grid point 329 (149/199) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.658 ( -6.546 3.193 -5.894) 9.370 3.296 ( 2.949 6.199 3.694) 7.796 4.285 ( -3.481 18.333 13.427) 22.989 4.686 ( -8.086 -0.395 -1.225) 8.188 4.853 ( -2.713 4.377 -9.738) 11.016 4.871 ( -6.258 7.478 -3.990) 10.536 6.089 ( -1.270 17.665 4.221) 18.207 6.472 ( -1.126 7.323 -1.432) 7.546 6.818 ( 10.987 -8.758 2.118) 14.209 6.885 ( -2.215 -7.878 -2.034) 8.433 6.980 ( 3.567 0.878 2.246) 4.306 7.008 ( -11.254 5.392 1.783) 12.606 7.349 ( -9.767 0.392 -2.789) 10.165 7.477 ( 3.959 -6.584 -3.067) 8.272 7.845 ( 1.365 2.055 -2.342) 3.401 7.870 ( 2.342 -12.511 -2.527) 12.977 8.045 ( -1.218 -8.356 2.823) 8.904 8.175 ( -5.022 -8.909 0.781) 10.257 8.413 ( 4.770 9.136 -2.138) 10.526 8.615 ( -7.082 -3.618 1.074) 8.025 8.816 ( -0.010 3.293 5.222) 6.174 8.892 ( 5.742 3.908 -1.277) 7.062 8.994 ( 1.233 -1.095 2.928) 3.360 9.067 ( -1.477 7.631 3.428) 8.495 9.148 ( -0.917 -1.432 4.111) 4.449 9.291 ( 2.054 1.973 -6.311) 6.924 9.397 ( -4.181 -6.303 3.015) 8.143 9.775 ( 0.589 -8.676 -4.882) 9.972 9.885 ( 5.778 -5.061 0.329) 7.688 9.969 ( -0.924 12.039 3.339) 12.528 10.040 ( -2.042 2.756 6.397) 7.258 10.152 ( 2.835 7.059 -3.295) 8.290 10.223 ( -2.560 -0.412 0.426) 2.628 10.580 ( 2.569 4.529 -3.647) 6.357 10.913 ( 2.247 2.904 -5.385) 6.518 11.161 ( 1.517 -4.300 -0.748) 4.620 11.332 ( 3.164 -5.497 -0.969) 6.416 11.370 ( 8.661 -13.121 -3.787) 16.171 11.570 ( -1.453 0.726 1.281) 2.069 11.572 ( -0.852 -16.199 2.094) 16.356 11.664 ( -0.962 -4.189 -1.462) 4.539 11.800 ( -3.628 -1.661 1.306) 4.198 12.031 ( 1.971 -2.360 -6.741) 7.409 12.265 ( 8.646 -4.875 5.742) 11.467 12.421 ( 1.505 -0.919 2.055) 2.708 12.572 ( 2.263 -5.388 -1.134) 5.953 12.820 ( 1.077 -4.589 2.261) 5.228 12.977 ( 0.167 2.772 -2.752) 3.909 13.057 ( 2.048 6.979 -0.847) 7.323 13.244 ( 9.215 2.158 -0.429) 9.474 13.351 ( 0.504 1.509 1.762) 2.374 13.546 ( -4.763 -5.094 2.706) 7.481 13.992 ( 2.746 -0.972 3.539) 4.583 14.048 ( 4.045 4.792 -5.550) 8.375 14.387 ( -5.182 -6.794 -1.984) 8.772 14.619 ( -2.007 0.863 -3.851) 4.428 15.390 ( -2.848 5.696 -12.151) 13.719 15.624 ( -7.073 -1.953 13.290) 15.181 15.826 ( -2.752 2.654 4.607) 5.987 16.124 ( -3.419 -0.780 0.762) 3.589 16.410 ( 14.954 -14.923 1.977) 21.219 16.637 ( 5.017 5.300 18.346) 19.744 17.540 ( 0.077 9.196 -14.462) 17.138 17.839 ( -22.305 -0.568 -3.575) 22.597 18.192 ( -8.387 -7.595 -1.663) 11.436 18.404 ( 6.047 -14.709 0.738) 15.921 19.176 ( 6.882 2.467 -6.226) 9.603 19.683 ( 0.932 19.826 3.675) 20.185 20.598 ( 1.589 7.206 -2.805) 7.894 20.711 ( 3.908 11.683 7.294) 14.317 21.163 ( -2.487 -2.132 9.426) 9.979 21.284 ( 1.266 -13.261 -12.320) 18.145 ======================= Grid point 330 (150/199) ======================= q-point: (-0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.438 ( -10.446 8.872 -4.676) 14.481 3.206 ( -5.306 8.469 -0.218) 9.997 4.018 ( -12.171 21.517 26.824) 36.477 4.399 ( -13.207 18.685 -6.160) 23.696 4.555 ( -13.333 21.053 7.716) 26.087 4.719 ( -2.843 4.600 -27.516) 28.042 5.943 ( 1.690 20.969 6.139) 21.915 6.314 ( -9.887 26.478 -6.331) 28.964 6.479 ( -26.629 11.253 5.282) 29.388 6.738 ( -13.684 -3.534 -3.711) 14.612 7.047 ( 0.608 4.880 2.023) 5.317 7.162 ( -2.162 -1.929 2.812) 4.038 7.216 ( 8.719 -9.548 5.836) 14.186 7.564 ( 2.386 -5.650 -6.429) 8.885 7.838 ( 1.058 3.219 -4.318) 5.488 7.938 ( -7.608 -6.360 2.194) 10.156 8.127 ( 0.674 -5.245 -3.515) 6.350 8.280 ( 0.125 -15.138 -0.696) 15.155 8.394 ( 5.675 2.594 -2.720) 6.807 8.717 ( 4.472 -9.707 1.515) 10.794 8.770 ( -1.400 -1.090 -0.041) 1.775 8.947 ( -1.427 0.822 3.868) 4.204 8.997 ( 7.284 2.822 -0.614) 7.835 9.047 ( 0.894 -5.787 6.332) 8.624 9.244 ( 2.322 -6.904 3.200) 7.956 9.357 ( 1.675 -7.189 -1.490) 7.530 9.427 ( 11.935 5.094 0.284) 12.980 9.753 ( -8.924 0.601 -2.311) 9.238 9.841 ( 1.358 6.454 -0.375) 6.606 9.923 ( -6.585 -2.492 1.498) 7.199 10.093 ( 2.994 -0.384 2.810) 4.124 10.178 ( 5.723 -10.742 3.057) 12.549 10.338 ( 8.040 -10.295 -3.415) 13.501 10.500 ( -3.605 0.891 -3.636) 5.197 10.978 ( 7.708 4.185 -6.744) 11.064 11.219 ( 3.292 -2.357 1.722) 4.400 11.317 ( 0.899 2.401 -1.796) 3.130 11.473 ( -4.071 3.852 -1.306) 5.755 11.622 ( 3.810 3.564 -0.518) 5.243 11.782 ( 11.601 -13.316 -3.062) 17.924 11.822 ( 0.871 -9.789 3.325) 10.375 11.928 ( 8.452 -20.414 2.345) 22.219 12.092 ( 4.148 -8.638 -2.862) 10.000 12.420 ( 0.951 -5.386 1.321) 5.627 12.506 ( 6.084 -4.610 0.635) 7.660 12.629 ( 0.065 -3.323 1.975) 3.866 12.887 ( -0.269 -5.713 3.422) 6.665 12.982 ( 5.196 3.735 -3.259) 7.181 13.069 ( 5.939 4.086 -1.771) 7.424 13.374 ( 3.193 -3.791 -0.626) 4.996 13.418 ( 4.724 -4.043 2.642) 6.755 13.549 ( 0.603 -4.167 2.204) 4.752 13.980 ( -0.866 3.414 -1.146) 3.704 14.129 ( 7.340 1.157 -0.421) 7.442 14.366 ( -4.035 -3.824 -3.705) 6.681 14.614 ( 0.662 -5.744 0.393) 5.795 15.241 ( -4.254 5.907 -11.751) 13.823 15.546 ( -3.362 4.195 4.078) 6.748 15.768 ( -4.277 2.676 10.047) 11.243 16.095 ( -1.816 -1.107 4.855) 5.300 16.683 ( 8.527 12.725 24.030) 28.497 16.818 ( 11.331 -13.077 -8.289) 19.186 17.243 ( -20.387 0.486 -16.115) 25.992 17.613 ( -1.610 7.584 -5.769) 9.663 18.073 ( -9.893 1.660 -0.234) 10.034 18.616 ( 3.919 -6.022 4.027) 8.236 19.266 ( 3.802 -2.192 -2.163) 4.893 19.499 ( -0.851 10.619 -1.600) 10.772 20.491 ( -3.732 9.786 0.007) 10.473 20.596 ( -4.433 12.924 1.693) 13.768 21.191 ( -0.213 -0.450 20.407) 20.413 21.439 ( 5.107 -15.158 -21.380) 26.701 ======================= Grid point 331 (151/199) ======================= q-point: (-0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.157 ( -7.388 12.880 -5.291) 15.763 2.974 ( -10.862 10.674 -1.855) 15.341 3.666 ( -15.981 20.326 32.385) 41.440 3.916 ( -13.103 29.105 -7.568) 32.804 4.094 ( -16.849 30.309 14.003) 37.398 4.531 ( -1.881 6.525 -35.209) 35.858 5.379 ( -28.508 55.318 -0.358) 62.232 5.738 ( -7.142 32.804 7.780) 34.462 6.233 ( -8.705 7.338 2.090) 11.575 6.576 ( -5.438 -3.034 -2.549) 6.729 6.800 ( -12.560 16.132 0.127) 20.445 7.224 ( 0.739 -2.669 2.175) 3.521 7.393 ( -8.857 -5.063 2.980) 10.628 7.588 ( -2.558 -10.946 0.157) 11.242 7.798 ( 3.923 -2.297 -2.897) 5.391 7.899 ( 3.840 5.438 -5.285) 8.500 8.107 ( -4.181 1.334 -7.905) 9.042 8.355 ( -5.482 -11.085 0.416) 12.373 8.550 ( 8.736 -7.594 -1.739) 11.705 8.750 ( -10.107 -10.545 8.079) 16.692 8.856 ( 4.217 -8.262 -2.558) 9.623 9.023 ( 7.527 0.624 -3.332) 8.255 9.129 ( 6.657 -5.594 -0.599) 8.716 9.219 ( -1.486 -7.933 2.999) 8.610 9.278 ( -0.879 -15.692 3.250) 16.049 9.501 ( 5.327 -3.602 4.560) 7.883 9.627 ( -1.616 -3.263 0.313) 3.655 9.692 ( 15.930 0.629 -0.243) 15.944 9.803 ( -3.821 2.989 -0.459) 4.872 9.910 ( 11.562 0.432 0.387) 11.577 10.151 ( 1.704 -3.985 2.205) 4.863 10.461 ( 0.988 -14.146 -3.920) 14.712 10.492 ( 6.798 -11.518 5.273) 14.377 10.618 ( 8.663 -18.691 -4.019) 20.989 10.982 ( 3.696 7.049 -6.790) 10.461 11.215 ( -5.164 12.399 -4.595) 14.196 11.364 ( 6.816 -4.880 4.679) 9.600 11.465 ( 4.039 -3.794 0.096) 5.543 11.630 ( 4.080 1.394 -4.507) 6.237 11.890 ( -0.473 -2.047 4.525) 4.989 12.005 ( 1.241 -8.737 -2.996) 9.319 12.215 ( 13.908 -12.280 -2.798) 18.763 12.346 ( -0.190 -11.636 -0.555) 11.651 12.499 ( 7.422 -7.674 1.807) 10.828 12.661 ( -1.065 -2.796 5.560) 6.314 12.686 ( 6.211 -9.978 0.877) 11.786 12.939 ( 0.209 -3.202 3.676) 4.880 13.041 ( 5.905 2.142 -1.900) 6.563 13.155 ( 7.945 0.719 -2.593) 8.388 13.432 ( -1.573 -8.525 2.364) 8.986 13.574 ( 6.914 -7.702 1.205) 10.420 13.632 ( 0.967 -4.721 0.868) 4.896 13.929 ( -3.123 -1.860 -3.807) 5.264 14.214 ( 2.751 1.265 2.467) 3.905 14.292 ( -4.342 0.735 -2.170) 4.909 14.757 ( 6.967 -8.086 3.489) 11.229 15.062 ( -4.975 8.681 -10.295) 14.356 15.479 ( 2.060 7.558 -1.518) 7.979 15.683 ( -5.746 3.675 8.915) 11.225 16.116 ( 0.695 0.131 9.287) 9.314 16.627 ( -11.786 11.823 5.719) 17.646 16.874 ( -0.289 8.991 2.864) 9.440 17.126 ( 4.783 -13.654 -17.162) 22.446 17.527 ( 4.170 11.732 -6.610) 14.097 17.828 ( -12.277 10.828 1.979) 16.489 18.540 ( -9.911 16.388 0.866) 19.172 19.314 ( 1.993 -4.326 13.385) 14.207 19.580 ( 7.865 -10.844 -12.068) 18.031 20.313 ( -5.339 10.757 0.889) 12.042 20.375 ( -6.877 12.158 -0.106) 13.969 21.265 ( -0.778 -3.034 20.306) 20.546 21.581 ( 4.050 -11.646 -23.430) 26.476 ======================= Grid point 332 (152/199) ======================= q-point: (-0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.995 ( 7.755 14.474 -5.002) 17.166 2.647 ( -16.179 11.480 0.683) 19.850 3.268 ( -17.829 28.382 21.081) 39.596 3.436 ( -9.270 31.672 -1.542) 33.037 3.489 ( -21.002 29.141 20.078) 41.151 4.309 ( -2.438 12.582 -38.294) 40.381 4.495 ( -4.477 67.151 12.629) 68.475 5.172 ( -14.362 43.149 -1.909) 45.516 6.089 ( 1.017 9.928 1.272) 10.061 6.407 ( -12.183 18.839 -1.326) 22.475 6.592 ( 2.708 -3.113 -0.679) 4.181 7.017 ( -19.227 -0.337 -3.006) 19.464 7.385 ( 2.717 -0.390 8.642) 9.068 7.705 ( 1.676 -8.276 -0.438) 8.455 7.888 ( 1.789 -3.904 -6.156) 7.506 7.929 ( -3.442 -2.537 -6.679) 7.930 7.980 ( 0.618 0.780 -3.283) 3.430 8.288 ( -12.694 -10.086 -0.252) 16.215 8.736 ( 3.746 -3.387 2.588) 5.674 8.793 ( 1.179 -10.765 5.337) 12.073 8.966 ( 1.273 -5.447 0.015) 5.594 9.096 ( 1.604 -1.083 -9.691) 9.882 9.182 ( -4.251 -6.038 6.242) 9.669 9.290 ( 5.692 -8.598 -3.179) 10.790 9.474 ( 1.819 -9.387 0.754) 9.592 9.603 ( -1.913 1.464 1.525) 2.851 9.645 ( 6.512 -2.663 4.101) 8.144 9.794 ( 4.015 -3.070 2.520) 5.647 9.931 ( 8.330 -2.994 0.756) 8.883 10.152 ( 7.779 -3.811 4.888) 9.946 10.280 ( 10.638 -4.119 -0.228) 11.410 10.513 ( -4.877 -13.626 -8.863) 16.971 10.791 ( 3.687 -14.211 4.071) 15.236 10.881 ( -4.405 2.171 -3.979) 6.321 10.985 ( 5.864 -3.077 -10.334) 12.274 11.004 ( 2.624 -7.502 -0.720) 7.980 11.512 ( 3.520 -5.449 6.147) 8.937 11.616 ( 6.717 -4.707 -0.242) 8.206 11.732 ( 7.389 -5.309 -4.840) 10.306 11.884 ( -2.738 -2.903 0.993) 4.112 12.107 ( 2.322 -6.581 1.734) 7.191 12.324 ( -4.572 -3.534 -2.373) 6.247 12.522 ( 8.434 -9.415 -3.777) 13.192 12.617 ( -1.549 0.088 3.506) 3.834 12.745 ( 6.557 -3.462 2.504) 7.826 12.881 ( 0.589 -11.931 4.413) 12.734 12.973 ( 2.273 -0.698 3.158) 3.953 13.127 ( 5.028 -1.391 -1.860) 5.538 13.299 ( 8.331 -2.365 0.739) 8.692 13.529 ( -1.173 -10.310 0.333) 10.382 13.657 ( -1.387 -8.114 2.498) 8.602 13.801 ( 7.234 -11.162 0.954) 13.335 13.896 ( -4.518 -8.505 -4.445) 10.607 14.158 ( -7.572 -3.950 -3.608) 9.272 14.265 ( 2.248 7.108 9.868) 12.367 14.818 ( -9.469 3.743 -12.321) 15.984 15.022 ( 16.215 3.660 6.987) 18.032 15.469 ( 7.527 10.130 -5.446) 13.745 15.563 ( -7.037 3.592 6.978) 10.541 16.056 ( -13.292 5.990 -5.789) 15.686 16.344 ( -4.101 1.608 9.391) 10.372 16.847 ( 2.638 12.563 12.877) 18.182 17.227 ( 4.828 -0.511 -18.794) 19.411 17.456 ( -4.216 13.361 3.734) 14.500 17.539 ( 1.910 16.286 -8.153) 18.313 18.069 ( -18.855 26.323 -3.230) 32.540 19.477 ( 1.039 -9.869 17.747) 20.333 19.771 ( 6.708 -8.953 -12.604) 16.853 20.136 ( -3.783 10.767 1.921) 11.573 20.174 ( -3.360 9.636 -2.250) 10.450 21.332 ( -3.633 -6.736 16.902) 18.554 21.654 ( 3.424 -5.966 -22.545) 23.571 ======================= Grid point 333 (153/199) ======================= q-point: (-0.17 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.046 ( -26.633 18.675 7.999) 33.498 2.158 ( 12.678 15.536 -1.534) 20.111 2.759 ( -1.189 30.180 15.033) 33.737 3.053 ( 9.231 32.337 -12.824) 35.991 3.181 ( -3.292 24.609 33.208) 41.464 3.859 ( -11.076 41.244 -23.403) 48.697 4.048 ( 15.160 61.281 24.914) 67.867 4.657 ( -0.142 21.811 -30.895) 37.818 6.058 ( 3.732 14.304 0.937) 14.812 6.075 ( -3.194 13.753 -0.759) 14.140 6.709 ( 1.771 -2.008 1.476) 3.058 6.756 ( -2.371 2.231 -3.037) 4.452 7.473 ( 5.006 0.545 10.799) 11.916 7.728 ( -8.992 0.266 -10.867) 14.108 7.805 ( -1.363 -5.174 2.462) 5.890 7.918 ( 1.881 -3.880 -9.095) 10.065 8.114 ( 2.690 -7.797 5.218) 9.760 8.224 ( -1.703 -8.502 -4.896) 9.957 8.793 ( -0.840 -1.356 5.957) 6.167 8.871 ( 0.491 1.493 2.224) 2.723 8.976 ( -3.685 -2.172 0.060) 4.278 9.132 ( 5.181 -3.052 -9.458) 11.208 9.216 ( 1.050 0.415 8.790) 8.862 9.404 ( -2.201 -0.811 -8.339) 8.663 9.533 ( -3.903 -5.756 1.988) 7.233 9.594 ( 5.950 -7.330 -3.141) 9.950 9.768 ( 4.544 4.616 6.270) 9.015 9.887 ( -2.383 -2.256 -1.934) 3.809 10.024 ( 4.354 8.652 9.230) 13.380 10.259 ( -2.149 -3.380 -0.742) 4.074 10.335 ( -7.606 -4.640 -1.172) 8.987 10.561 ( 0.664 -12.850 -14.888) 19.678 10.707 ( 3.323 5.105 4.193) 7.395 10.850 ( -1.948 -1.281 -6.621) 7.020 11.173 ( -2.026 -19.585 3.295) 19.963 11.255 ( 2.276 -21.986 -3.287) 22.347 11.634 ( 0.257 -7.457 5.742) 9.414 11.712 ( 0.059 -5.633 -2.069) 6.002 11.854 ( -7.170 -7.103 3.035) 10.539 11.895 ( 2.291 -6.700 -1.098) 7.166 12.211 ( 3.706 -2.226 2.188) 4.845 12.300 ( 0.610 -3.633 -5.483) 6.605 12.573 ( -3.243 -1.845 4.815) 6.091 12.665 ( 2.612 -4.218 -3.921) 6.324 12.843 ( -2.129 -1.344 4.080) 4.794 12.940 ( 5.418 -1.718 -4.512) 7.257 13.074 ( 0.002 -4.398 6.907) 8.189 13.198 ( -1.113 -7.324 -2.632) 7.862 13.453 ( -3.019 -4.418 3.111) 6.190 13.478 ( 0.352 -1.576 2.596) 3.058 13.844 ( -0.792 -15.960 0.307) 15.982 13.893 ( 1.877 -14.398 -3.244) 14.877 14.024 ( -2.181 -6.740 3.318) 7.823 14.096 ( -1.589 -9.351 -2.981) 9.942 14.298 ( 8.022 7.371 11.485) 15.830 14.570 ( -6.893 8.343 -13.080) 16.976 15.287 ( 15.048 6.485 4.717) 17.051 15.390 ( -5.573 7.995 -5.975) 11.432 15.475 ( -2.602 4.692 8.032) 9.659 15.730 ( -3.752 6.288 -13.943) 15.749 16.445 ( 7.701 1.353 19.867) 21.350 16.749 ( -4.599 7.212 -0.911) 8.602 17.152 ( -2.992 14.293 1.900) 14.726 17.269 ( 3.988 12.852 -8.291) 15.805 17.466 ( -16.045 26.293 -5.514) 31.292 17.519 ( 11.541 19.823 -8.032) 24.304 19.592 ( -3.327 -7.264 16.269) 18.125 19.869 ( 2.730 -1.645 -8.271) 8.864 20.009 ( -0.268 9.132 1.514) 9.260 20.081 ( 1.979 5.624 -6.372) 8.726 21.370 ( -6.035 -8.620 12.979) 16.709 21.697 ( 5.654 -0.726 -18.423) 19.284 ======================= Grid point 334 (154/199) ======================= q-point: (-0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.500 ( 1.694 14.530 13.354) 19.808 2.379 ( 14.133 7.870 7.835) 17.974 2.677 ( 11.254 21.886 1.761) 24.673 3.051 ( 6.047 23.418 40.037) 46.775 3.110 ( 18.264 51.334 -18.886) 57.666 3.264 ( 23.820 27.419 -11.430) 38.077 3.931 ( 24.604 49.986 28.742) 62.690 4.495 ( 8.166 7.562 -45.451) 46.794 5.902 ( 1.514 9.373 -0.377) 9.502 6.076 ( 9.451 15.245 -0.539) 17.945 6.615 ( -1.300 0.864 0.335) 1.597 6.972 ( 17.761 2.203 -0.216) 17.898 7.479 ( -3.413 5.582 3.410) 7.378 7.708 ( -3.572 -0.456 -3.459) 4.993 7.779 ( 5.218 -5.819 3.222) 8.454 7.979 ( 0.437 -3.555 -3.543) 5.038 8.129 ( -6.575 -7.538 -1.442) 10.106 8.450 ( 11.952 -7.709 0.918) 14.252 8.722 ( -7.322 6.495 2.417) 10.082 8.894 ( 2.486 1.261 3.640) 4.585 8.916 ( -0.237 1.357 -1.036) 1.724 9.191 ( 3.975 9.312 -9.047) 13.578 9.230 ( -3.526 7.138 -1.012) 8.025 9.300 ( 5.952 2.021 3.852) 7.372 9.473 ( -10.876 -0.914 -1.077) 10.968 9.620 ( -10.519 1.466 -1.258) 10.695 9.744 ( 1.408 -4.836 -2.361) 5.563 9.785 ( -4.853 -0.305 2.610) 5.519 10.042 ( 4.753 6.744 9.468) 12.558 10.286 ( 10.577 -0.720 -7.422) 12.942 10.369 ( -8.107 -14.127 5.510) 17.195 10.602 ( -2.182 -9.625 -8.035) 12.727 10.733 ( -8.829 -4.710 -10.228) 14.309 10.857 ( 7.039 -2.067 4.566) 8.641 11.254 ( -11.193 -16.985 6.389) 21.322 11.391 ( -8.564 -17.267 -3.598) 19.607 11.633 ( -7.677 -4.996 2.350) 9.456 11.732 ( -8.972 -4.945 -0.626) 10.264 11.771 ( -8.217 -8.559 4.603) 12.726 11.943 ( -2.771 -6.089 1.881) 6.949 12.244 ( -0.469 1.405 0.328) 1.517 12.390 ( 4.916 -4.732 -4.442) 8.142 12.568 ( -3.813 -4.511 3.130) 6.684 12.708 ( 1.326 -1.461 -4.810) 5.198 12.828 ( -1.444 -2.980 1.243) 3.538 13.001 ( 2.646 3.721 -3.769) 5.920 13.040 ( -10.378 -3.410 7.469) 13.233 13.213 ( -5.926 -11.155 -1.396) 12.708 13.360 ( -3.190 -1.575 0.925) 3.676 13.613 ( 1.590 -3.334 3.888) 5.363 13.895 ( -8.169 -13.712 0.759) 15.979 13.952 ( -3.550 -6.955 1.932) 8.044 14.135 ( 1.128 -12.512 -2.553) 12.820 14.172 ( -1.719 -6.090 -2.581) 6.834 14.377 ( 2.209 4.754 -7.708) 9.321 14.434 ( 5.375 7.505 6.741) 11.430 15.137 ( -8.910 0.594 -3.815) 9.711 15.302 ( 0.176 3.640 -3.081) 4.771 15.637 ( 16.902 8.592 11.061) 21.951 15.706 ( 9.180 10.209 -11.090) 17.649 16.612 ( 3.842 3.286 11.876) 12.907 16.682 ( 7.658 -1.157 2.197) 8.051 16.863 ( -13.404 17.886 -4.238) 22.749 17.070 ( 3.230 10.575 -0.473) 11.067 17.326 ( 14.977 13.317 -8.139) 21.631 17.530 ( 15.181 24.566 -2.792) 29.013 19.621 ( -4.843 -4.841 14.681) 16.200 19.880 ( 1.966 1.408 -5.247) 5.777 19.965 ( 4.097 7.584 0.919) 8.669 20.051 ( 1.553 4.018 -9.204) 10.162 21.384 ( -5.425 -7.355 11.392) 14.605 21.728 ( 3.781 2.194 -15.546) 16.149 ======================= Grid point 338 (155/199) ======================= q-point: ( 0.25 0.25 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.475 ( 10.938 -0.000 -0.907) 10.976 2.855 ( 19.935 -0.000 2.189) 20.054 4.216 ( 7.508 -0.000 -20.723) 22.041 4.484 ( 21.246 -0.000 -4.763) 21.774 4.706 ( 3.510 -0.000 2.873) 4.536 4.874 ( 12.633 -0.000 17.371) 21.479 6.156 ( 10.563 -0.000 -0.853) 10.597 6.544 ( 14.671 -0.000 -3.973) 15.200 6.582 ( 12.268 -0.000 -1.026) 12.310 6.692 ( 7.736 -0.000 4.830) 9.120 6.898 ( -10.112 0.000 -1.497) 10.222 7.024 ( -1.821 0.000 -0.022) 1.821 7.403 ( -0.219 0.000 8.995) 8.998 7.459 ( -6.067 0.000 -9.204) 11.023 7.536 ( 3.822 -0.000 2.248) 4.434 7.896 ( -2.047 0.000 10.718) 10.911 7.937 ( 5.850 -0.000 -8.295) 10.150 8.025 ( -7.864 0.000 6.807) 10.401 8.622 ( 7.077 -0.000 -0.418) 7.090 8.673 ( -1.923 0.000 5.001) 5.358 8.799 ( -0.760 0.000 -6.340) 6.386 8.899 ( -6.597 0.000 5.561) 8.628 8.950 ( 0.472 -0.000 3.877) 3.905 9.173 ( -5.336 0.000 -4.088) 6.722 9.313 ( -0.449 0.000 -3.220) 3.251 9.376 ( -2.667 0.000 1.477) 3.049 9.557 ( -7.201 0.000 9.054) 11.569 9.641 ( 0.282 -0.000 -13.974) 13.977 9.928 ( 4.737 -0.000 -0.448) 4.759 9.990 ( 7.029 -0.000 -3.436) 7.824 10.057 ( 5.612 -0.000 4.104) 6.952 10.062 ( -8.111 0.000 -8.342) 11.635 10.274 ( 11.147 -0.000 2.857) 11.507 10.475 ( -5.188 0.000 -0.954) 5.275 11.132 ( -16.794 0.000 0.970) 16.822 11.205 ( -6.599 0.000 -0.691) 6.635 11.300 ( -3.268 0.000 -3.748) 4.972 11.375 ( -5.406 0.000 9.986) 11.356 11.479 ( -4.648 0.000 -0.200) 4.652 11.501 ( -3.908 0.000 -1.904) 4.347 11.690 ( -9.519 0.000 -1.708) 9.671 11.754 ( 8.771 -0.000 4.856) 10.025 12.103 ( -11.760 0.000 0.609) 11.776 12.196 ( -4.128 0.000 -10.153) 10.960 12.231 ( 1.258 -0.000 -0.594) 1.391 12.669 ( 1.065 -0.000 1.023) 1.477 12.760 ( -8.266 0.000 -1.076) 8.336 13.041 ( 1.023 -0.000 -0.765) 1.277 13.225 ( -3.164 0.000 0.485) 3.201 13.451 ( -6.054 0.000 0.906) 6.122 13.619 ( -7.287 0.000 -1.610) 7.463 13.619 ( -5.471 0.000 2.374) 5.964 14.018 ( -4.112 0.000 2.336) 4.729 14.044 ( -1.967 0.000 -4.353) 4.777 14.627 ( -7.440 0.000 -0.974) 7.503 14.761 ( 1.855 -0.000 -7.123) 7.360 15.261 ( 3.763 -0.000 18.672) 19.047 15.544 ( 5.426 -0.000 21.197) 21.881 15.709 ( -0.529 0.000 -6.401) 6.423 16.031 ( 5.344 -0.000 -13.702) 14.707 16.362 ( -9.646 0.000 -5.126) 10.924 16.496 ( -2.345 0.000 1.535) 2.803 17.637 ( 4.579 -0.000 -1.021) 4.691 17.669 ( 5.831 -0.000 1.897) 6.132 18.339 ( -12.636 0.000 -4.310) 13.350 18.716 ( -14.383 0.000 15.828) 21.387 19.131 ( 7.149 -0.000 -15.540) 17.106 19.664 ( 19.689 -0.000 4.938) 20.299 20.634 ( 10.182 -0.000 3.088) 10.640 20.679 ( 10.125 -0.000 -3.998) 10.885 20.758 ( -0.944 0.000 -12.499) 12.535 21.382 ( -7.460 0.000 9.967) 12.449 ======================= Grid point 339 (156/199) ======================= q-point: ( 0.33 0.25 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.671 ( 9.071 -1.527 0.217) 9.201 3.177 ( 15.862 -1.657 -0.887) 15.973 4.333 ( 9.342 -6.173 -11.709) 16.201 4.674 ( 4.447 6.834 0.732) 8.186 4.799 ( 6.267 -5.197 -1.705) 8.318 5.033 ( 2.675 1.970 10.099) 10.632 6.351 ( 10.023 -3.323 -0.062) 10.560 6.617 ( 7.389 11.867 -0.278) 13.982 6.656 ( -1.475 10.900 0.380) 11.005 6.776 ( -1.796 -6.597 0.010) 6.837 6.900 ( 8.995 -5.845 -2.720) 11.067 6.984 ( -4.360 -5.944 1.011) 7.441 7.374 ( -1.140 -0.127 -6.230) 6.335 7.388 ( -8.023 -1.655 5.565) 9.903 7.592 ( -1.206 -5.755 0.238) 5.885 7.860 ( -6.181 -1.562 8.707) 10.791 7.958 ( -0.639 1.852 7.616) 7.864 7.986 ( 2.915 -1.652 -9.306) 9.891 8.607 ( -3.171 0.360 4.092) 5.189 8.707 ( 0.335 -0.537 -0.736) 0.971 8.801 ( 2.761 -0.465 -0.575) 2.859 8.903 ( 2.634 1.367 6.208) 6.881 9.052 ( 2.911 0.246 3.793) 4.788 9.088 ( 0.813 0.755 -5.947) 6.050 9.249 ( -4.601 3.778 1.813) 6.224 9.332 ( -7.596 -3.909 4.083) 9.468 9.469 ( -2.450 1.266 3.421) 4.394 9.580 ( -0.702 -0.028 -11.421) 11.443 9.842 ( -0.401 9.840 -5.880) 11.470 10.081 ( 3.625 -7.415 -4.330) 9.321 10.110 ( 6.790 -0.458 -2.649) 7.302 10.182 ( 4.718 -1.219 4.232) 6.454 10.416 ( 3.581 7.562 3.027) 8.898 10.586 ( 15.351 -0.099 1.412) 15.416 10.827 ( -16.581 -4.673 0.072) 17.228 10.922 ( -19.915 -3.465 0.582) 20.223 11.256 ( 1.588 4.597 -6.542) 8.151 11.364 ( 1.666 8.367 2.381) 8.858 11.455 ( -0.033 -3.700 -1.449) 3.974 11.520 ( -1.542 -4.517 -0.107) 4.774 11.583 ( -4.124 -7.111 0.364) 8.228 11.874 ( -3.044 0.769 -3.052) 4.379 11.967 ( 2.283 -0.673 7.238) 7.620 12.119 ( -0.493 1.938 -7.699) 7.954 12.309 ( 3.426 -5.480 1.141) 6.563 12.565 ( -7.965 3.966 -0.751) 8.929 12.724 ( 1.894 -0.518 -0.372) 1.998 13.038 ( -1.032 -0.036 -1.336) 1.689 13.172 ( -1.695 1.781 0.257) 2.473 13.351 ( -6.299 -0.104 1.651) 6.513 13.485 ( -6.610 1.946 -1.070) 6.973 13.542 ( -2.605 3.193 0.958) 4.231 13.941 ( 0.285 3.729 0.998) 3.871 14.063 ( 0.735 -4.381 -1.709) 4.760 14.468 ( -8.278 4.536 -1.463) 9.552 14.715 ( -3.933 -0.932 -7.586) 8.596 15.450 ( 3.166 -5.252 23.183) 23.980 15.620 ( 0.892 4.086 -9.052) 9.971 15.735 ( 3.582 -7.450 16.933) 18.843 16.040 ( 1.731 2.321 -10.976) 11.351 16.212 ( -4.771 1.031 -7.922) 9.305 16.547 ( 4.490 -1.960 10.386) 11.483 17.661 ( 6.959 5.987 -3.914) 9.980 17.852 ( 3.947 -12.517 3.117) 13.489 18.151 ( -9.091 -2.124 -2.953) 9.792 18.320 ( -30.223 0.058 4.436) 30.547 19.270 ( 12.231 5.781 -14.354) 19.724 19.946 ( 14.233 5.025 3.302) 15.451 20.681 ( 4.421 4.113 -9.942) 11.632 20.798 ( 8.176 3.915 10.457) 13.839 20.876 ( 4.481 -8.086 -3.772) 9.985 21.271 ( -9.158 -1.278 5.369) 10.692 ======================= Grid point 340 (157/199) ======================= q-point: (-0.58 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.748 ( 2.210 5.558 -0.140) 5.983 3.354 ( 4.944 0.535 -3.294) 5.965 4.537 ( 4.623 -10.699 -3.609) 12.201 4.608 ( -0.729 13.865 10.442) 17.373 4.890 ( 3.020 0.064 -11.128) 11.530 5.000 ( -4.830 4.497 4.743) 8.127 6.376 ( -3.343 9.837 1.252) 10.465 6.604 ( 1.422 6.999 0.273) 7.148 6.685 ( 10.928 -2.395 1.035) 11.235 6.791 ( -0.357 -1.316 -0.700) 1.533 6.961 ( 0.559 -2.404 0.283) 2.485 7.092 ( -2.123 -0.414 -3.191) 3.855 7.301 ( -1.498 -8.859 2.277) 9.269 7.352 ( 0.807 0.920 -0.015) 1.224 7.629 ( -2.536 -10.779 -3.672) 11.666 7.812 ( -4.281 -5.017 6.109) 8.990 7.955 ( 0.425 -0.308 -1.412) 1.507 8.046 ( 1.283 -3.547 -0.037) 3.772 8.563 ( -11.280 -2.331 4.190) 12.257 8.616 ( -1.738 9.077 -4.120) 10.119 8.833 ( 0.044 -0.036 3.090) 3.091 8.955 ( -0.117 -1.077 3.655) 3.812 8.996 ( 1.088 3.121 -0.790) 3.398 9.114 ( -5.122 -0.654 4.983) 7.176 9.155 ( -1.769 -0.351 -0.700) 1.935 9.242 ( -6.491 -1.090 0.773) 6.627 9.497 ( 10.746 8.476 0.366) 13.691 9.573 ( -0.177 -7.058 -7.845) 10.554 9.832 ( 3.501 -0.547 -1.166) 3.730 10.114 ( -4.895 5.174 1.302) 7.241 10.183 ( 2.245 0.121 -3.217) 3.925 10.217 ( 0.529 5.403 7.418) 9.193 10.345 ( -2.003 11.807 0.694) 11.996 10.637 ( -0.814 0.499 -1.414) 1.706 10.825 ( 2.074 -22.603 1.486) 22.747 10.888 ( 2.910 -8.017 -2.087) 8.780 11.255 ( 7.484 4.860 -7.940) 11.944 11.319 ( 1.751 5.929 0.572) 6.209 11.460 ( -3.373 -1.855 -3.181) 4.993 11.530 ( 4.920 -2.826 0.036) 5.674 11.657 ( -0.496 -4.082 4.017) 5.748 11.762 ( -5.391 0.199 0.481) 5.416 12.021 ( 1.869 0.442 -9.626) 9.815 12.187 ( 7.717 -3.099 5.921) 10.209 12.415 ( -0.962 -3.162 6.511) 7.302 12.449 ( 0.196 -3.016 -6.780) 7.423 12.756 ( 0.196 -1.965 0.547) 2.049 13.015 ( 0.792 1.721 -1.806) 2.618 13.146 ( 0.270 2.308 -0.400) 2.358 13.286 ( -1.042 -0.312 1.532) 1.879 13.378 ( -3.976 0.865 0.198) 4.074 13.484 ( -2.282 0.409 0.490) 2.370 13.978 ( 4.782 0.234 3.832) 6.132 14.138 ( 6.287 -0.299 -2.939) 6.947 14.283 ( -9.280 0.927 -2.604) 9.683 14.621 ( -6.349 -2.140 -6.522) 9.350 15.437 ( -6.439 1.197 1.435) 6.705 15.649 ( 3.295 3.618 10.334) 11.434 15.913 ( 4.414 4.509 -4.000) 7.471 16.090 ( 5.522 -12.265 3.864) 13.995 16.141 ( 0.659 -1.270 -3.000) 3.324 16.711 ( 8.917 1.638 19.453) 21.462 17.684 ( -2.239 6.479 -10.084) 12.194 17.835 ( -19.658 -0.091 -3.282) 19.930 18.009 ( -4.841 -9.864 4.894) 12.029 18.136 ( 5.037 -11.563 -3.763) 13.162 19.299 ( 4.158 8.069 -9.046) 12.815 20.015 ( 2.968 13.337 2.420) 13.876 20.705 ( 4.227 3.426 -5.929) 8.047 20.890 ( 4.230 6.471 8.357) 11.385 21.001 ( 3.734 -9.096 -5.872) 11.453 21.153 ( -8.808 -3.775 5.295) 10.949 ======================= Grid point 341 (158/199) ======================= q-point: (-0.50 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.649 ( -3.047 12.258 -0.222) 12.633 3.320 ( -4.589 3.549 -4.425) 7.296 4.383 ( -12.678 13.991 18.369) 26.342 4.634 ( 0.710 6.242 -2.377) 6.717 4.829 ( -1.454 6.890 -16.985) 18.387 4.841 ( -6.766 9.298 2.426) 11.752 6.254 ( 1.861 11.709 3.075) 12.248 6.523 ( -4.794 7.095 3.635) 9.302 6.684 ( -11.571 -1.591 -2.823) 12.016 6.863 ( -9.031 16.520 -8.381) 20.609 6.948 ( 8.879 -8.019 4.518) 12.788 7.041 ( 3.890 -3.484 3.715) 6.408 7.278 ( -2.993 2.662 0.385) 4.024 7.511 ( 4.937 -1.747 -2.604) 5.849 7.692 ( -3.137 -12.729 0.002) 13.110 7.861 ( 0.774 -7.397 0.540) 7.457 7.958 ( -4.426 -5.901 -0.021) 7.376 8.060 ( 1.543 -6.259 -0.286) 6.453 8.463 ( -5.415 2.880 -3.442) 7.033 8.512 ( 3.518 -5.191 -0.330) 6.280 8.805 ( -4.836 -0.448 4.170) 6.402 8.907 ( -11.472 -6.839 3.204) 13.735 8.994 ( -4.502 1.515 6.771) 8.271 9.074 ( -0.093 -0.968 -3.235) 3.378 9.137 ( -5.475 -2.924 -1.213) 6.325 9.212 ( 9.084 0.115 3.868) 9.874 9.605 ( 6.036 2.084 -7.555) 9.892 9.666 ( 4.727 -2.982 0.518) 5.613 9.858 ( 0.359 -0.174 1.937) 1.978 9.983 ( -2.944 3.078 -3.661) 5.617 10.087 ( -2.663 4.870 6.445) 8.506 10.187 ( -1.159 2.666 6.817) 7.410 10.285 ( 3.316 7.410 -5.271) 9.679 10.547 ( -6.722 3.807 -2.280) 8.055 11.021 ( 9.901 -1.685 -4.674) 11.078 11.157 ( 7.541 -8.091 1.117) 11.116 11.295 ( 1.888 -0.830 -4.038) 4.534 11.448 ( 11.749 -14.495 -2.903) 18.883 11.532 ( 8.003 -10.450 0.873) 13.191 11.568 ( -3.679 2.138 2.576) 4.974 11.710 ( 8.182 0.016 3.765) 9.007 11.722 ( -1.489 -1.564 0.091) 2.161 12.026 ( 1.553 -0.670 -7.689) 7.873 12.347 ( 3.214 -2.705 2.708) 4.998 12.429 ( 3.380 -3.588 0.169) 4.933 12.527 ( -0.036 -7.508 -0.436) 7.520 12.788 ( 0.542 -3.833 2.586) 4.655 13.035 ( 4.063 1.808 -2.388) 5.048 13.140 ( 2.872 2.933 -0.950) 4.214 13.295 ( -3.306 -4.462 1.855) 5.855 13.358 ( 0.409 -2.567 2.171) 3.387 13.478 ( 0.649 -3.015 -1.322) 3.355 14.035 ( -3.991 1.714 2.885) 5.214 14.155 ( 2.899 0.986 -4.108) 5.124 14.277 ( 6.108 -2.914 -1.247) 6.881 14.529 ( -5.050 -4.261 -2.622) 7.109 15.326 ( -3.355 3.892 -3.658) 6.307 15.661 ( 1.125 7.030 8.645) 11.199 15.868 ( 1.273 7.624 -2.805) 8.223 16.104 ( 1.362 1.416 -1.392) 2.408 16.473 ( 11.716 -19.400 1.903) 22.743 16.904 ( 11.049 8.076 26.825) 30.114 17.257 ( -27.005 0.912 -15.240) 31.022 17.761 ( 4.202 7.627 -5.573) 10.339 18.031 ( -2.412 -5.495 1.347) 6.150 18.394 ( 8.541 -14.985 -1.327) 17.299 19.246 ( -0.229 2.863 -4.231) 5.114 19.826 ( -6.709 18.064 0.819) 19.287 20.663 ( -1.799 7.959 -1.024) 8.224 20.822 ( -4.696 9.876 1.943) 11.107 21.135 ( -2.838 -6.024 12.579) 14.233 21.155 ( 5.607 -12.719 -13.422) 19.323 ======================= Grid point 342 (159/199) ======================= q-point: (-0.42 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.453 ( -2.119 16.882 -0.261) 17.017 3.133 ( -10.623 5.911 -3.622) 12.685 4.053 ( -14.403 18.997 24.606) 34.261 4.423 ( -6.746 21.520 -5.390) 23.188 4.583 ( -10.555 20.072 5.124) 23.250 4.663 ( -1.541 8.489 -23.496) 25.030 6.186 ( -9.232 14.150 4.050) 17.374 6.235 ( -7.740 22.067 -0.238) 23.386 6.411 ( -12.879 8.046 -0.461) 15.192 6.578 ( 2.324 18.218 -1.571) 18.433 7.010 ( -10.511 3.033 2.876) 11.312 7.170 ( 4.097 -3.726 4.988) 7.453 7.281 ( 5.642 -4.588 3.715) 8.166 7.462 ( -8.527 -1.415 -6.961) 11.099 7.709 ( -3.097 -5.870 1.882) 6.898 7.931 ( 2.340 -3.716 -8.419) 9.496 8.064 ( 3.601 -11.650 3.160) 12.596 8.189 ( 0.638 -2.496 -1.629) 3.048 8.405 ( 0.110 -7.970 -2.431) 8.334 8.592 ( -11.253 -2.344 5.586) 12.780 8.731 ( -4.445 -2.772 -2.575) 5.837 8.794 ( -6.760 -20.312 0.791) 21.422 9.041 ( 5.486 -6.215 3.889) 9.157 9.060 ( -0.326 -2.223 2.261) 3.187 9.134 ( 2.656 -1.771 -5.455) 6.321 9.436 ( 10.682 -2.539 5.453) 12.259 9.579 ( -5.394 -3.332 -1.215) 6.455 9.695 ( 1.370 -0.994 -2.761) 3.239 9.902 ( -2.036 4.473 -0.164) 4.918 10.009 ( 16.022 5.987 -0.536) 17.112 10.121 ( -0.072 -4.189 4.614) 6.232 10.164 ( 2.102 -2.252 3.122) 4.386 10.322 ( 3.488 -9.839 -4.023) 11.187 10.433 ( -3.270 -0.498 -2.521) 4.159 11.124 ( 6.187 6.484 -6.673) 11.174 11.274 ( 4.246 -2.044 4.437) 6.472 11.363 ( 5.493 -3.855 -1.602) 6.899 11.455 ( -4.649 6.417 2.375) 8.272 11.650 ( -0.970 0.197 -2.271) 2.477 11.777 ( 7.154 -10.213 0.354) 12.475 11.888 ( 7.543 -5.562 -0.346) 9.378 11.939 ( 11.190 -13.441 -0.825) 17.509 12.091 ( 8.152 -10.248 -1.065) 13.139 12.383 ( 1.650 -3.593 -1.292) 4.160 12.569 ( 4.807 -5.280 -4.006) 8.187 12.589 ( 0.868 -4.874 7.008) 8.581 12.861 ( 1.728 -4.392 4.199) 6.317 13.083 ( 4.085 1.665 -1.986) 4.838 13.178 ( 4.634 1.301 -2.819) 5.578 13.282 ( -5.198 -7.055 4.104) 9.676 13.440 ( 3.722 -6.024 2.402) 7.478 13.527 ( -1.090 -7.027 -2.792) 7.639 13.890 ( -9.869 -1.392 -3.662) 10.618 14.179 ( -5.942 -4.153 -0.236) 7.253 14.355 ( 6.427 4.981 -0.364) 8.140 14.612 ( 7.620 -6.250 3.642) 10.507 15.229 ( 0.159 8.197 -3.820) 9.044 15.627 ( 1.973 7.693 3.214) 8.567 15.802 ( 0.664 8.586 -1.809) 8.799 16.141 ( 4.190 2.325 5.520) 7.310 16.750 ( -24.562 2.511 -11.831) 27.378 16.804 ( 4.648 -18.176 -8.472) 20.585 17.097 ( 13.973 11.786 22.758) 29.190 17.744 ( 6.265 10.509 -3.808) 12.814 17.989 ( -4.212 4.960 -0.045) 6.507 18.623 ( 3.382 -7.111 0.181) 7.877 19.247 ( -1.293 -5.432 0.087) 5.584 19.539 ( -6.277 10.261 -2.948) 12.384 20.515 ( -4.027 10.364 -1.330) 11.199 20.610 ( -8.081 11.631 2.564) 14.393 21.183 ( -4.656 -5.624 18.823) 20.190 21.334 ( 6.577 -13.456 -21.258) 26.005 ======================= Grid point 343 (160/199) ======================= q-point: (-0.33 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.315 ( 6.627 17.739 1.747) 19.017 2.844 ( -14.738 8.746 -1.027) 17.168 3.727 ( -10.526 21.494 27.303) 36.307 4.055 ( -2.982 31.497 -6.294) 32.258 4.105 ( -18.416 32.435 8.743) 38.309 4.483 ( -0.089 8.530 -32.582) 33.680 5.659 ( -3.075 46.467 -0.264) 46.569 5.906 ( -13.327 27.965 6.452) 31.643 6.273 ( 3.908 12.681 5.572) 14.392 6.532 ( 1.737 1.182 -0.231) 2.114 6.743 ( -9.690 11.512 -1.500) 15.122 7.063 ( -15.125 9.091 -5.686) 18.540 7.366 ( 4.154 -2.249 7.406) 8.784 7.496 ( 3.101 -11.646 2.350) 12.279 7.749 ( -3.306 -8.141 -0.261) 8.790 7.931 ( -1.366 0.073 -13.669) 13.737 8.089 ( 0.214 8.303 -1.622) 8.463 8.153 ( -7.740 -3.575 2.454) 8.872 8.501 ( -2.490 -16.985 7.079) 18.569 8.590 ( 4.658 -12.130 0.548) 13.005 8.766 ( -0.662 -13.675 -5.681) 14.823 8.896 ( -6.038 -17.144 -1.433) 18.232 9.083 ( 0.938 -3.787 1.985) 4.377 9.185 ( 3.005 -2.972 -6.054) 7.384 9.274 ( 6.250 -9.331 3.604) 11.795 9.517 ( -3.050 -4.483 2.053) 5.798 9.590 ( 1.984 -2.493 1.910) 3.715 9.789 ( 0.437 -5.748 -0.592) 5.795 9.896 ( 9.879 2.226 3.089) 10.587 10.098 ( 0.642 -2.332 5.358) 5.879 10.260 ( 13.258 2.944 -5.792) 14.764 10.319 ( -0.217 -11.359 -1.352) 11.442 10.441 ( -0.041 -12.482 3.571) 12.983 10.523 ( 3.837 -19.616 -4.151) 20.414 11.107 ( 2.996 9.606 -2.822) 10.451 11.236 ( -4.204 11.472 -3.479) 12.704 11.429 ( 2.871 -2.710 6.916) 7.964 11.529 ( 8.285 -4.829 0.538) 9.604 11.638 ( -0.772 -4.068 -3.550) 5.454 11.854 ( -3.685 -0.061 -1.211) 3.880 11.971 ( 4.949 -6.979 -0.318) 8.562 12.215 ( -1.912 -8.475 -3.539) 9.381 12.326 ( 13.335 -9.991 -2.455) 16.842 12.592 ( -2.249 -3.135 3.037) 4.910 12.603 ( 9.369 -11.616 3.684) 15.371 12.718 ( 4.866 -4.243 1.386) 6.603 12.943 ( 2.535 -2.730 4.338) 5.718 13.118 ( 1.348 -0.007 -1.142) 1.767 13.255 ( 4.790 -1.904 -1.989) 5.525 13.304 ( -2.247 -10.959 2.643) 11.495 13.537 ( -4.508 -6.890 -0.338) 8.241 13.592 ( 1.148 -11.297 0.980) 11.398 13.767 ( -3.390 -3.651 -4.586) 6.772 14.058 ( -12.496 -6.067 -0.887) 13.919 14.416 ( 6.531 8.124 6.950) 12.528 14.777 ( 1.648 -3.747 -2.190) 4.642 15.200 ( 10.810 10.573 1.698) 15.216 15.607 ( 0.794 5.620 4.506) 7.247 15.717 ( 3.197 11.316 -7.737) 14.075 16.147 ( -11.200 4.052 -2.614) 12.194 16.358 ( -7.233 0.002 0.558) 7.254 16.915 ( -3.369 -7.757 -10.234) 13.276 17.295 ( 14.814 10.578 14.212) 23.094 17.714 ( -2.104 12.552 6.588) 14.332 17.850 ( 6.788 15.097 -7.191) 18.048 18.494 ( -13.679 16.110 -4.670) 21.644 19.281 ( -2.308 -9.349 13.541) 16.616 19.555 ( 5.727 -11.774 -12.419) 18.046 20.350 ( -2.968 11.607 0.576) 11.994 20.383 ( -5.059 11.536 0.156) 12.597 21.196 ( -8.205 -7.457 20.440) 23.253 21.492 ( 6.765 -10.465 -23.031) 26.186 ======================= Grid point 344 (161/199) ======================= q-point: (-0.25 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.322 ( -0.007 13.412 10.767) 17.199 2.491 ( -4.973 15.941 -4.996) 17.430 3.417 ( -7.612 33.037 25.877) 42.650 3.572 ( -6.937 26.795 16.185) 32.063 3.762 ( 10.948 35.621 -9.242) 38.394 4.302 ( 1.436 12.306 -34.293) 36.463 5.261 ( 13.834 58.948 8.016) 61.078 5.376 ( -9.089 41.972 -2.278) 43.006 6.284 ( 7.579 9.264 4.616) 12.829 6.382 ( -6.705 17.634 -4.289) 19.347 6.670 ( 3.194 -0.303 2.873) 4.307 6.771 ( -4.596 1.294 -6.574) 8.125 7.488 ( 5.505 0.208 10.199) 11.592 7.638 ( -0.002 -9.048 -1.368) 9.151 7.720 ( -6.282 -5.498 -0.455) 8.361 7.856 ( -0.543 -1.156 -13.210) 13.272 8.014 ( -5.720 -1.150 6.795) 8.956 8.132 ( 5.319 -0.117 -4.274) 6.824 8.663 ( -1.763 -12.898 8.306) 15.443 8.797 ( 4.234 -10.634 2.493) 11.714 8.879 ( -1.009 -10.260 -7.219) 12.586 8.927 ( -2.654 -13.234 -3.070) 13.843 9.168 ( 2.503 -5.518 0.250) 6.064 9.255 ( 2.176 -8.552 -5.891) 10.610 9.420 ( 1.093 -6.527 3.661) 7.563 9.491 ( -2.888 -4.710 -2.424) 6.033 9.734 ( 3.140 -8.857 6.267) 11.295 9.794 ( -1.309 -3.764 1.005) 4.110 10.061 ( 3.452 -3.288 4.828) 6.785 10.157 ( -3.116 -5.677 2.148) 6.823 10.288 ( -4.956 -0.115 -1.363) 5.141 10.392 ( 4.111 -4.196 -9.594) 11.250 10.658 ( 0.220 -20.730 4.884) 21.298 10.750 ( -0.018 -19.753 -3.335) 20.033 10.952 ( -7.586 10.212 4.870) 13.621 11.120 ( 6.071 11.282 -10.847) 16.786 11.524 ( 1.064 -4.108 7.152) 8.316 11.622 ( -0.920 -3.731 -2.190) 4.423 11.710 ( -2.871 -7.672 3.697) 8.987 11.797 ( -1.032 -3.584 -4.272) 5.671 12.126 ( 5.656 -6.128 1.579) 8.487 12.210 ( -2.496 -5.775 -5.558) 8.395 12.521 ( -8.315 -3.802 3.033) 9.633 12.573 ( 6.421 -5.356 -1.684) 8.530 12.795 ( 1.175 -3.685 2.555) 4.636 12.845 ( 3.832 -7.689 -2.001) 8.821 13.020 ( 0.470 -1.944 6.021) 6.345 13.118 ( -1.107 -2.179 -1.999) 3.158 13.325 ( -2.991 -8.330 4.583) 9.967 13.418 ( -0.214 -5.332 -1.881) 5.658 13.575 ( 4.825 -11.178 1.507) 12.268 13.635 ( -4.722 -12.553 -2.701) 13.681 13.884 ( -3.255 -7.168 2.394) 8.228 13.933 ( 0.720 -7.030 -2.096) 7.371 14.461 ( 6.151 8.912 10.812) 15.302 14.692 ( -6.160 4.226 -9.977) 12.464 15.414 ( 19.008 5.918 7.565) 21.296 15.508 ( -6.406 6.003 0.482) 8.793 15.622 ( -10.181 9.663 -2.911) 14.335 15.830 ( -0.075 4.913 -15.656) 16.409 16.455 ( 7.224 -0.334 17.180) 18.640 16.815 ( -8.486 -1.434 -12.459) 15.143 17.420 ( 6.634 13.058 6.622) 16.074 17.498 ( -3.789 12.459 3.307) 13.436 17.911 ( 18.542 20.445 -1.512) 27.642 17.970 ( -19.552 24.842 -8.900) 32.842 19.399 ( -3.198 -11.969 16.389) 20.545 19.730 ( 4.650 -12.067 -14.759) 19.623 20.199 ( -1.609 10.511 2.410) 10.903 20.255 ( 2.277 11.535 -2.808) 12.088 21.188 ( -9.482 -9.914 19.653) 23.968 21.626 ( 7.739 -6.408 -21.462) 23.698 ======================= Grid point 345 (162/199) ======================= q-point: (-0.17 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.910 ( -9.834 23.929 1.898) 25.940 2.563 ( 13.847 10.675 7.345) 18.965 3.183 ( 11.052 30.882 11.601) 34.791 3.403 ( -0.459 17.682 37.284) 41.267 3.754 ( 31.104 30.710 -12.611) 45.493 4.042 ( 0.905 30.098 -23.638) 38.282 4.888 ( 5.200 38.552 -21.332) 44.366 5.037 ( 23.125 58.793 9.670) 63.913 6.119 ( -1.469 12.858 -1.273) 13.004 6.393 ( 13.497 16.417 0.017) 21.253 6.588 ( -4.118 -3.073 -0.353) 5.150 6.980 ( 18.993 -2.094 -0.046) 19.108 7.551 ( -2.114 2.116 1.829) 3.506 7.656 ( 0.059 -3.291 1.650) 3.682 7.700 ( -1.737 -3.577 0.059) 3.977 7.885 ( -0.091 -6.383 -1.340) 6.523 7.991 ( -2.044 -4.975 -1.407) 5.559 8.301 ( 12.126 -5.946 -1.337) 13.571 8.703 ( -5.942 -6.269 5.163) 10.063 8.860 ( -4.973 -7.242 1.663) 8.941 8.934 ( 3.277 1.013 1.903) 3.923 9.058 ( 0.976 -15.334 -5.862) 16.446 9.214 ( -0.804 -2.743 -1.266) 3.126 9.367 ( 2.398 -3.777 -6.477) 7.872 9.449 ( -2.765 -5.445 2.962) 6.787 9.591 ( 4.360 -8.136 -0.528) 9.245 9.736 ( -5.038 -5.253 1.811) 7.501 9.793 ( -11.950 10.750 -1.193) 16.118 10.030 ( -8.431 -14.030 -3.784) 16.800 10.112 ( -7.862 -10.489 5.641) 14.270 10.288 ( 1.983 3.337 4.331) 5.816 10.428 ( -0.156 -7.422 -6.372) 9.784 10.704 ( -5.204 6.564 4.005) 9.285 10.821 ( -4.670 -16.567 4.149) 17.705 10.946 ( -3.636 -15.885 -3.186) 16.604 11.097 ( 1.244 1.903 -8.023) 8.339 11.552 ( -3.787 -2.668 5.524) 7.209 11.625 ( -3.913 -5.666 -2.048) 7.184 11.641 ( -10.294 -5.888 1.440) 11.946 11.841 ( -0.853 -4.102 2.791) 5.035 12.208 ( -1.139 -5.483 -4.553) 7.218 12.296 ( 5.799 -5.556 -0.923) 8.084 12.442 ( -8.753 -8.217 3.353) 12.465 12.651 ( -1.283 -3.040 -0.317) 3.315 12.801 ( 0.007 -0.524 -2.413) 2.470 12.937 ( -5.805 -11.370 1.405) 12.843 13.016 ( -0.574 -0.873 1.174) 1.571 13.094 ( -4.278 -0.035 -1.918) 4.688 13.279 ( -7.971 -5.929 1.598) 10.062 13.499 ( 0.908 -7.545 4.638) 8.903 13.682 ( -1.595 -8.821 -0.254) 8.968 13.781 ( -9.178 -9.247 2.563) 13.279 13.866 ( 7.514 -13.566 -2.101) 15.649 14.108 ( 6.035 -2.884 0.268) 6.694 14.474 ( -2.968 4.861 -5.781) 8.115 14.578 ( 5.653 6.568 7.297) 11.329 15.186 ( -18.104 4.625 -8.454) 20.509 15.391 ( -3.657 5.707 1.521) 6.947 15.729 ( 19.012 3.648 2.245) 19.489 15.905 ( 14.191 8.839 -6.155) 17.816 16.639 ( 5.910 -1.361 21.760) 22.590 16.659 ( -3.672 -1.309 -13.570) 14.119 17.265 ( -7.915 19.488 -8.952) 22.860 17.294 ( -11.459 14.556 9.050) 20.618 17.592 ( 9.449 15.022 -9.023) 19.909 18.012 ( 18.585 24.714 2.448) 31.019 19.474 ( -6.096 -10.103 15.287) 19.311 19.822 ( -0.060 -7.887 -14.320) 16.348 20.129 ( 3.682 9.317 1.224) 10.093 20.198 ( 4.401 11.037 -3.190) 12.303 21.204 ( -7.104 -10.980 18.692) 22.813 21.728 ( 5.806 -2.527 -19.447) 20.452 ======================= Grid point 346 (163/199) ======================= q-point: (-0.08 0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.844 ( 18.688 8.441 2.478) 20.656 2.717 ( 14.582 9.236 4.004) 17.719 3.184 ( 19.473 27.544 5.153) 34.124 3.443 ( 8.100 13.868 44.600) 47.403 3.645 ( 7.256 43.648 -8.705) 45.095 4.077 ( 31.329 14.899 -23.825) 42.085 4.761 ( 26.234 24.273 -23.933) 43.014 4.974 ( 29.628 50.582 7.525) 59.101 6.084 ( 10.468 10.377 -1.626) 14.829 6.369 ( 6.375 16.179 -0.869) 17.412 6.690 ( 10.824 -0.196 0.165) 10.827 7.273 ( 11.148 1.730 -0.727) 11.305 7.520 ( 5.267 3.723 0.087) 6.451 7.601 ( -6.379 0.644 4.474) 7.818 7.705 ( -8.846 -6.107 1.905) 10.917 7.913 ( -6.673 -8.783 -2.973) 11.424 8.036 ( 5.374 0.545 -0.059) 5.402 8.500 ( 1.256 -6.054 1.121) 6.283 8.630 ( -9.029 3.167 -0.438) 9.578 8.852 ( -4.808 -3.195 6.303) 8.547 8.959 ( 1.615 -4.171 -1.466) 4.707 9.140 ( -5.766 -9.540 -3.297) 11.624 9.257 ( 3.933 -3.744 -4.638) 7.141 9.284 ( -6.944 11.636 -4.018) 14.134 9.458 ( 0.821 -4.028 2.425) 4.773 9.480 ( -5.721 3.599 3.558) 7.638 9.627 ( -8.263 -4.149 3.834) 10.010 9.773 ( 2.213 -0.601 -2.288) 3.239 10.017 ( -12.339 -16.529 -3.643) 20.946 10.095 ( -3.404 -3.465 -0.215) 4.862 10.256 ( -4.532 -7.285 -3.942) 9.442 10.574 ( -0.216 -10.348 3.279) 10.857 10.632 ( 4.040 -2.499 6.596) 8.129 10.867 ( -8.539 -13.322 4.652) 16.494 10.971 ( -2.493 -3.912 -2.730) 5.382 11.035 ( -10.105 -7.531 -7.005) 14.419 11.494 ( -8.206 -1.308 4.629) 9.512 11.531 ( -5.916 -2.569 0.479) 6.467 11.587 ( -6.801 -6.320 -1.657) 9.431 11.870 ( -0.699 -2.910 4.057) 5.041 12.206 ( -3.979 -1.488 -2.733) 5.052 12.385 ( -8.633 -10.964 -0.057) 13.955 12.408 ( 1.405 -3.363 1.086) 3.803 12.638 ( -4.467 -7.279 0.335) 8.547 12.783 ( -3.226 1.806 -2.655) 4.552 12.877 ( -8.769 -1.878 6.532) 11.095 13.032 ( -1.772 -2.545 -5.176) 6.034 13.036 ( -1.500 -5.555 1.153) 5.868 13.265 ( -2.246 -9.516 -3.156) 10.275 13.528 ( -7.115 -4.490 4.345) 9.469 13.657 ( -8.172 -7.485 2.940) 11.465 13.811 ( -3.109 -12.032 1.476) 12.514 13.989 ( -2.371 -4.954 -5.486) 7.763 14.182 ( 0.565 0.713 0.800) 1.211 14.366 ( -1.227 2.476 -7.130) 7.647 14.664 ( 8.120 6.118 9.182) 13.700 14.980 ( -4.341 -6.908 -4.263) 9.205 15.337 ( 1.527 3.180 -0.210) 3.534 15.927 ( 9.275 9.756 -13.100) 18.783 16.048 ( 16.699 10.348 8.586) 21.440 16.631 ( 0.267 -2.840 -9.283) 9.712 16.774 ( -14.212 15.054 1.681) 20.771 16.877 ( 11.739 -5.817 14.474) 19.523 17.237 ( 7.740 8.568 -6.787) 13.393 17.677 ( 15.478 8.825 -2.083) 17.938 18.056 ( 15.867 27.414 4.177) 31.949 19.495 ( -7.232 -8.942 14.321) 18.367 19.786 ( -7.112 -5.718 -14.740) 17.336 20.137 ( 6.701 8.377 0.677) 10.749 20.164 ( 5.144 10.329 -2.575) 11.822 21.276 ( -3.094 -9.431 19.372) 21.767 21.717 ( -1.176 1.991 -19.556) 19.693 ======================= Grid point 351 (164/199) ======================= q-point: (-0.67 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.817 ( 6.341 -0.000 2.973) 7.003 3.350 ( 6.272 -0.000 -4.745) 7.865 4.407 ( 6.387 -0.000 -5.217) 8.247 4.777 ( 0.511 -0.000 8.342) 8.357 4.864 ( 7.545 -0.000 -10.330) 12.792 5.041 ( -5.426 0.000 6.525) 8.486 6.442 ( 2.288 -0.000 -1.160) 2.566 6.671 ( 1.708 -0.000 -5.284) 5.553 6.714 ( -2.060 0.000 4.486) 4.936 6.857 ( -1.963 0.000 3.159) 3.719 6.903 ( 10.424 -0.000 2.363) 10.689 6.989 ( 6.113 -0.000 -6.022) 8.581 7.222 ( -6.255 0.000 -0.606) 6.284 7.426 ( 4.200 -0.000 1.309) 4.400 7.479 ( -8.240 0.000 -0.122) 8.241 7.757 ( -6.894 0.000 8.386) 10.856 7.951 ( -2.724 0.000 -7.450) 7.932 8.029 ( 5.400 -0.000 4.338) 6.926 8.531 ( -7.780 0.000 5.162) 9.336 8.698 ( -5.058 0.000 -2.993) 5.877 8.832 ( -0.033 0.000 2.550) 2.550 8.942 ( 2.177 -0.000 7.962) 8.254 9.044 ( -2.727 0.000 -9.338) 9.728 9.123 ( -2.772 0.000 -0.954) 2.931 9.123 ( -10.047 0.000 6.726) 12.091 9.244 ( -2.651 0.000 -1.314) 2.958 9.441 ( -1.607 0.000 1.915) 2.500 9.663 ( 12.830 -0.000 -3.791) 13.378 9.842 ( -1.428 0.000 -6.384) 6.542 10.123 ( -0.694 0.000 0.168) 0.714 10.228 ( 6.940 -0.000 -4.612) 8.333 10.262 ( 1.158 -0.000 6.458) 6.561 10.508 ( -0.664 0.000 2.687) 2.768 10.529 ( 0.018 -0.000 3.293) 3.293 10.649 ( -3.343 0.000 -1.785) 3.790 10.771 ( 1.906 -0.000 0.918) 2.116 11.374 ( -1.463 0.000 -10.109) 10.214 11.419 ( -0.177 0.000 -1.585) 1.595 11.430 ( -1.614 0.000 -1.246) 2.039 11.514 ( 14.166 -0.000 0.299) 14.170 11.534 ( 0.649 -0.000 3.478) 3.538 11.779 ( -6.109 0.000 1.714) 6.345 12.023 ( 2.608 -0.000 -6.692) 7.182 12.160 ( 5.663 -0.000 2.652) 6.253 12.338 ( 1.870 -0.000 1.937) 2.692 12.459 ( -5.706 0.000 -1.829) 5.992 12.739 ( 0.513 -0.000 -0.677) 0.849 13.037 ( 1.427 -0.000 -1.896) 2.373 13.173 ( 0.281 -0.000 1.889) 1.910 13.247 ( -5.090 0.000 1.581) 5.330 13.385 ( -5.565 0.000 -0.615) 5.599 13.516 ( -3.207 0.000 -2.136) 3.853 14.011 ( 4.281 -0.000 5.965) 7.342 14.058 ( 3.136 -0.000 -1.913) 3.673 14.368 ( -5.592 0.000 -4.765) 7.347 14.564 ( -9.260 0.000 -5.158) 10.600 15.463 ( -4.241 0.000 -1.355) 4.452 15.718 ( 10.951 -0.000 7.942) 13.528 15.842 ( 5.384 -0.000 22.136) 22.781 16.033 ( 0.652 -0.000 -12.931) 12.948 16.144 ( -0.615 0.000 -10.615) 10.632 16.718 ( 11.001 -0.000 19.844) 22.690 17.800 ( -29.051 0.000 -5.121) 29.498 17.807 ( 5.945 -0.000 0.805) 5.999 17.878 ( 5.027 -0.000 0.374) 5.041 18.022 ( -3.763 0.000 -3.061) 4.851 19.392 ( 3.078 -0.000 -10.748) 11.180 20.146 ( 5.675 -0.000 -0.944) 5.753 20.732 ( 4.138 -0.000 -8.165) 9.153 20.915 ( 4.314 -0.000 -0.091) 4.315 20.951 ( 2.974 -0.000 11.843) 12.210 21.111 ( -9.773 0.000 1.222) 9.850 ======================= Grid point 353 (165/199) ======================= q-point: (-0.58 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.852 ( 1.033 7.011 1.546) 7.253 3.350 ( -4.274 0.139 -4.236) 6.019 4.460 ( -3.345 -1.912 4.515) 5.935 4.781 ( 1.686 7.517 5.063) 9.219 4.921 ( -0.387 1.944 -10.315) 10.504 4.930 ( -3.489 0.974 1.565) 3.946 6.415 ( -1.024 5.067 -1.175) 5.302 6.647 ( -3.568 3.804 -2.105) 5.624 6.670 ( -5.759 1.515 2.339) 6.398 6.862 ( 1.058 -6.583 1.524) 6.839 6.957 ( 0.895 4.131 -5.881) 7.242 7.110 ( 8.197 5.644 -0.161) 9.954 7.308 ( 9.289 -11.775 4.570) 15.679 7.321 ( -6.279 1.569 0.605) 6.500 7.573 ( 7.355 -3.069 1.577) 8.124 7.700 ( -5.674 -5.424 3.964) 8.794 7.891 ( -3.843 -2.964 -1.552) 5.095 8.087 ( -0.704 5.867 -1.240) 6.038 8.369 ( -9.224 -6.077 0.971) 11.088 8.542 ( -9.029 0.268 -2.858) 9.474 8.798 ( -4.715 -0.337 6.014) 7.650 8.863 ( -11.889 4.750 -3.527) 13.280 8.993 ( -6.080 -0.095 7.349) 9.539 9.044 ( -2.841 -1.755 -4.540) 5.636 9.098 ( 6.264 -4.049 -0.714) 7.493 9.222 ( -0.121 0.118 1.234) 1.246 9.460 ( -0.161 -5.481 1.764) 5.760 9.731 ( -0.930 1.482 -7.155) 7.366 9.953 ( -0.876 4.311 -0.475) 4.425 9.995 ( 8.601 1.975 0.486) 8.839 10.180 ( -4.527 4.218 5.999) 8.618 10.259 ( -4.379 0.972 7.322) 8.587 10.448 ( 0.992 6.958 -4.658) 8.432 10.647 ( -6.068 6.503 -0.510) 8.909 10.866 ( 19.494 -9.526 0.691) 21.708 10.924 ( 18.704 -11.708 -0.302) 22.068 11.311 ( 1.734 0.995 -6.229) 6.542 11.399 ( 1.500 4.939 -1.445) 5.360 11.426 ( 1.292 -1.999 -2.713) 3.609 11.533 ( -4.056 -3.851 3.269) 6.478 11.699 ( -2.715 0.091 3.237) 4.226 11.754 ( 11.156 1.316 0.314) 11.238 12.032 ( 2.038 0.597 -9.937) 10.161 12.299 ( 7.295 -1.917 4.995) 9.047 12.378 ( -0.728 -6.004 -0.473) 6.066 12.389 ( -1.915 -0.602 -0.992) 2.239 12.751 ( 1.265 -0.512 0.450) 1.437 13.062 ( 2.695 1.041 -1.957) 3.489 13.176 ( 0.512 0.737 2.304) 2.472 13.213 ( -3.580 -3.103 2.771) 5.488 13.322 ( -1.702 -1.019 -0.438) 2.031 13.439 ( -4.361 -1.130 -4.656) 6.479 14.046 ( -5.877 -0.036 5.265) 7.890 14.134 ( 2.306 -1.569 1.734) 3.284 14.314 ( 7.925 4.625 -6.562) 11.281 14.438 ( -5.437 -4.860 -2.536) 7.721 15.394 ( -0.597 2.443 -5.589) 6.128 15.820 ( 3.754 10.505 11.623) 16.110 15.997 ( 0.975 1.778 -6.474) 6.784 16.109 ( 10.313 -7.017 1.920) 12.621 16.148 ( 4.621 -5.732 0.296) 7.369 16.993 ( 14.514 1.774 21.628) 26.107 17.278 ( -28.872 0.929 -7.828) 29.929 17.903 ( 8.404 3.898 -2.819) 9.683 17.932 ( 0.243 0.728 0.262) 0.811 18.118 ( 7.587 -12.758 -1.258) 14.897 19.325 ( -5.087 3.294 -5.542) 8.212 20.096 ( -6.546 8.470 -2.002) 10.890 20.777 ( 3.575 3.076 -6.499) 8.030 20.934 ( -0.884 0.029 -9.994) 10.033 20.983 ( -4.053 -0.472 4.719) 6.238 21.026 ( -1.825 -5.659 13.233) 14.508 ======================= Grid point 354 (166/199) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.752 ( -0.474 13.167 0.450) 13.183 3.200 ( -11.196 1.296 -1.818) 11.416 4.338 ( -9.162 9.543 13.582) 18.960 4.668 ( -5.061 7.259 -4.649) 9.996 4.838 ( -2.380 5.368 0.186) 5.875 4.869 ( 0.085 10.894 -9.290) 14.318 6.354 ( -2.257 5.043 2.893) 6.236 6.440 ( -8.941 7.951 -6.208) 13.479 6.479 ( -13.143 5.265 2.206) 14.329 6.933 ( -2.517 -1.544 -1.769) 3.442 7.025 ( 4.636 -11.580 4.139) 13.142 7.111 ( 4.966 18.104 1.765) 18.856 7.270 ( 1.255 0.173 1.107) 1.682 7.481 ( -11.549 2.555 -7.566) 14.041 7.587 ( 5.829 -9.890 1.568) 11.586 7.756 ( 2.292 -4.089 1.760) 5.007 7.923 ( 3.630 -7.261 2.326) 8.445 8.105 ( 4.751 -7.587 2.645) 9.334 8.253 ( -10.369 -3.937 -3.578) 11.654 8.516 ( -5.595 -5.612 -5.881) 9.869 8.628 ( -3.339 3.703 3.591) 6.144 8.730 ( -6.822 0.527 4.938) 8.438 8.972 ( 3.046 -1.093 5.915) 6.743 9.029 ( -0.978 -2.310 -4.109) 4.814 9.141 ( 0.927 1.831 -6.177) 6.509 9.315 ( 1.655 -10.698 5.696) 12.233 9.523 ( 2.440 -0.873 2.442) 3.561 9.672 ( -3.490 -1.440 -2.755) 4.673 9.892 ( -0.595 -3.717 -5.613) 6.759 9.987 ( -3.741 1.484 3.612) 5.408 10.184 ( -4.537 1.305 9.232) 10.369 10.268 ( 4.529 10.548 4.578) 12.358 10.347 ( 4.045 8.177 -6.741) 11.343 10.444 ( -7.037 1.305 -5.112) 8.795 11.179 ( 11.391 -0.886 -1.465) 11.519 11.257 ( 6.093 -0.262 3.353) 6.960 11.329 ( 2.624 1.768 -3.595) 4.789 11.484 ( -4.168 -3.798 2.307) 6.093 11.533 ( 13.887 -10.699 -3.297) 17.838 11.612 ( 12.164 -8.322 0.897) 14.766 11.712 ( 3.537 -2.030 3.430) 5.328 11.880 ( 6.907 0.724 0.649) 6.975 12.018 ( 1.025 0.391 -8.301) 8.373 12.343 ( -0.802 -1.452 -3.973) 4.305 12.430 ( 0.084 -7.732 0.410) 7.744 12.495 ( 6.109 -4.879 5.434) 9.522 12.803 ( 3.227 -1.196 2.942) 4.528 13.097 ( 2.388 -0.199 -1.650) 2.909 13.168 ( -6.258 -4.528 4.399) 8.889 13.205 ( 2.751 1.202 -0.572) 3.057 13.338 ( -0.883 -4.578 -0.325) 4.673 13.389 ( -3.586 -6.115 -4.134) 8.207 13.893 ( -10.042 1.389 -0.262) 10.141 14.086 ( -10.240 -4.905 -0.723) 11.377 14.445 ( 10.389 3.788 -3.449) 11.583 14.529 ( 10.169 -2.612 5.407) 11.810 15.364 ( 2.983 5.477 -3.728) 7.266 15.779 ( 0.754 8.485 5.069) 9.913 15.965 ( 2.375 7.036 -4.630) 8.751 16.201 ( 7.691 3.656 -1.530) 8.652 16.456 ( 6.862 -17.079 2.161) 18.532 16.770 ( -25.380 0.144 -15.982) 29.994 17.286 ( 14.860 7.392 28.404) 32.898 17.922 ( 5.009 7.219 0.653) 8.811 18.015 ( 5.751 -0.084 -4.101) 7.064 18.390 ( 8.823 -14.325 -1.625) 16.902 19.185 ( -7.019 -0.583 -1.642) 7.232 19.796 ( -14.719 12.587 -2.840) 19.574 20.704 ( -1.080 9.330 -5.331) 10.800 20.797 ( -8.332 7.811 5.804) 12.811 21.050 ( -1.252 -8.301 3.224) 8.992 21.098 ( 2.335 -10.344 -4.743) 11.616 ======================= Grid point 355 (167/199) ======================= q-point: (-0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.634 ( 2.794 14.892 3.068) 15.459 2.968 ( -12.712 3.986 -0.412) 13.329 4.106 ( -7.766 17.676 19.457) 27.411 4.497 ( -2.062 11.657 -9.432) 15.136 4.642 ( -7.201 22.274 2.424) 23.534 4.698 ( 0.200 14.372 -15.661) 21.257 6.105 ( -8.025 11.613 -2.283) 14.300 6.190 ( -13.711 7.088 2.315) 15.608 6.421 ( 5.605 1.394 0.687) 5.816 6.813 ( -13.577 -0.504 0.282) 13.590 6.952 ( 5.772 26.611 2.606) 27.354 7.223 ( 3.713 -1.015 4.008) 5.557 7.318 ( -2.366 -1.522 -5.731) 6.384 7.339 ( 3.422 -1.195 1.587) 3.957 7.652 ( -1.961 -0.406 4.157) 4.614 7.863 ( 2.022 -8.896 -5.913) 10.872 8.076 ( 5.926 -4.684 2.858) 8.076 8.147 ( -5.667 -7.706 -1.776) 9.729 8.300 ( 0.284 -10.312 -1.973) 10.503 8.361 ( -7.829 0.808 4.813) 9.226 8.590 ( -6.560 -1.628 -1.664) 6.961 8.658 ( 1.787 -2.872 -2.264) 4.070 9.023 ( -0.928 -2.524 0.234) 2.699 9.145 ( 2.505 -2.721 -6.990) 7.908 9.157 ( 9.454 -2.164 3.060) 10.170 9.422 ( -2.115 -7.135 4.291) 8.590 9.554 ( 0.873 -1.405 -0.801) 1.838 9.659 ( -2.190 -5.913 1.489) 6.479 9.910 ( 1.670 -4.112 0.926) 4.533 10.058 ( -7.428 -0.055 3.366) 8.155 10.067 ( 2.739 -9.249 3.158) 10.149 10.201 ( -1.360 -7.443 2.832) 8.079 10.368 ( -1.360 -1.053 -5.847) 6.094 10.431 ( 8.887 8.962 -5.353) 13.710 11.271 ( 4.570 6.697 -2.291) 8.425 11.326 ( 1.637 0.164 3.572) 3.933 11.393 ( 2.654 -3.251 -0.107) 4.199 11.449 ( 0.271 -2.631 4.116) 4.892 11.634 ( -0.664 3.569 -0.056) 3.631 11.849 ( 8.483 -5.841 -2.293) 10.551 11.876 ( -3.719 1.576 -3.181) 5.141 12.007 ( 9.615 -11.429 -3.170) 15.268 12.156 ( 10.365 -8.122 -0.993) 13.205 12.402 ( 4.261 -8.895 -2.548) 10.187 12.498 ( 0.762 -5.918 3.614) 6.976 12.639 ( 3.179 -4.500 3.562) 6.561 12.889 ( 3.826 -2.141 4.309) 6.147 13.112 ( -1.775 -2.598 -0.751) 3.235 13.140 ( -3.867 -4.393 3.935) 7.052 13.227 ( 0.800 -1.517 -4.452) 4.771 13.350 ( -4.409 -10.616 -1.244) 11.562 13.429 ( -0.084 -5.977 -0.067) 5.978 13.747 ( -3.701 0.755 -2.210) 4.377 13.943 ( -12.221 -5.629 0.015) 13.455 14.558 ( 8.849 6.319 2.472) 11.151 14.720 ( 6.110 -2.145 2.847) 7.074 15.375 ( 7.653 7.594 0.825) 10.813 15.732 ( 0.601 7.348 4.172) 8.471 15.919 ( 3.941 8.813 -8.426) 12.814 16.227 ( -12.910 4.609 -6.276) 15.077 16.351 ( -4.137 -0.658 -3.048) 5.180 16.693 ( 1.240 -12.880 -7.421) 14.916 17.504 ( 11.935 9.649 22.526) 27.257 17.913 ( -2.157 7.646 6.622) 10.343 18.087 ( 13.056 9.686 -5.714) 17.231 18.597 ( 1.718 -5.144 -5.208) 7.519 19.133 ( -4.565 -7.078 3.087) 8.970 19.453 ( -10.634 3.220 -5.743) 12.507 20.572 ( -3.985 11.206 2.204) 12.096 20.594 ( -3.317 10.481 -1.578) 11.106 21.051 ( -9.999 -7.630 19.532) 23.231 21.274 ( 8.479 -12.013 -20.937) 25.585 ======================= Grid point 356 (168/199) ======================= q-point: (-0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.565 ( -2.629 11.551 11.724) 16.667 2.747 ( -0.506 10.849 -4.841) 11.890 3.884 ( -4.758 20.563 24.977) 32.700 4.208 ( -7.742 32.190 3.464) 33.289 4.379 ( 8.350 24.564 -7.653) 27.049 4.522 ( 3.764 14.546 -25.320) 29.442 5.922 ( -6.977 14.723 3.378) 16.638 5.981 ( 7.471 13.186 -2.508) 15.361 6.527 ( 3.063 11.097 3.541) 12.045 6.570 ( -1.090 3.003 -0.532) 3.239 6.852 ( 6.967 20.954 5.169) 22.679 6.992 ( -8.869 22.001 -7.179) 24.784 7.429 ( 5.149 -5.915 3.603) 8.630 7.451 ( 1.068 -9.357 0.229) 9.421 7.628 ( -3.176 -1.418 6.537) 7.405 7.858 ( -3.094 0.359 -12.777) 13.151 8.066 ( -4.220 4.366 7.311) 9.504 8.189 ( 3.889 3.597 -4.056) 6.672 8.348 ( 1.578 -16.711 5.890) 17.789 8.473 ( -0.152 -20.245 -4.681) 20.780 8.621 ( 1.914 -11.384 0.566) 11.557 8.713 ( 0.110 -8.513 -6.600) 10.773 9.045 ( -1.454 -4.991 2.618) 5.821 9.158 ( 0.233 -3.378 -6.759) 7.560 9.317 ( 4.170 -3.157 5.266) 7.422 9.410 ( -4.486 -3.610 -2.022) 6.103 9.626 ( 4.073 -3.793 3.708) 6.688 9.678 ( -3.690 -6.597 -0.903) 7.612 9.987 ( -2.480 -5.097 5.615) 7.978 10.059 ( 1.781 -6.924 1.290) 7.265 10.213 ( -1.504 -11.194 7.346) 13.473 10.319 ( -2.271 -13.426 -0.089) 13.617 10.345 ( 0.708 -2.065 -2.972) 3.688 10.451 ( 3.405 -0.891 -10.291) 10.876 11.192 ( -5.106 10.640 4.783) 12.734 11.312 ( 3.970 6.807 -6.069) 9.946 11.457 ( 1.131 -3.640 6.404) 7.452 11.538 ( -2.241 -5.920 -0.435) 6.345 11.631 ( 3.956 1.501 3.377) 5.413 11.761 ( -4.239 0.158 -7.510) 8.625 12.006 ( 4.958 -5.855 1.420) 7.802 12.091 ( -3.329 -6.519 -5.582) 9.205 12.398 ( -8.999 -8.895 2.462) 12.891 12.453 ( 8.458 -8.204 -2.359) 12.017 12.685 ( -1.162 -7.533 2.259) 7.949 12.701 ( 4.169 -6.499 1.204) 7.815 12.986 ( 1.756 -1.725 5.430) 5.962 13.085 ( -1.768 -1.423 -3.381) 4.072 13.156 ( -2.355 -8.585 4.999) 10.209 13.279 ( 2.476 -8.048 -5.538) 10.079 13.418 ( 2.483 -7.705 1.147) 8.176 13.436 ( -4.944 -6.594 -0.288) 8.247 13.772 ( -5.352 -4.233 3.273) 7.568 13.832 ( 3.025 -3.787 -2.394) 5.406 14.622 ( 5.151 7.679 6.692) 11.414 14.739 ( -3.814 1.072 -3.745) 5.452 15.510 ( 12.119 4.755 8.530) 15.565 15.646 ( -2.577 7.600 -1.886) 8.244 15.792 ( -17.905 7.616 -4.954) 20.079 15.933 ( 6.782 5.737 -13.184) 15.898 16.444 ( 6.201 -0.405 10.131) 11.885 16.716 ( -6.003 -7.468 -13.470) 16.530 17.635 ( 7.745 9.129 14.844) 19.070 17.735 ( -7.973 11.645 5.766) 15.245 18.247 ( 19.349 13.924 0.131) 23.839 18.376 ( -15.779 16.457 -12.240) 25.877 19.184 ( -1.091 -9.215 12.453) 15.530 19.451 ( 1.864 -15.527 -12.902) 20.274 20.395 ( -3.862 9.735 4.598) 11.438 20.495 ( 4.243 13.216 -4.426) 14.569 21.007 ( -11.459 -8.777 21.693) 26.056 21.466 ( 9.275 -10.045 -20.905) 24.979 ======================= Grid point 357 (169/199) ======================= q-point: (-0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.323 ( -7.074 18.575 1.751) 19.954 2.766 ( 10.899 10.259 4.260) 15.562 3.719 ( -0.728 20.833 33.987) 39.871 3.863 ( 4.568 33.182 4.752) 33.830 4.336 ( 19.419 27.891 -8.849) 35.119 4.402 ( 7.061 13.854 -27.488) 31.581 5.677 ( 4.105 33.176 -1.319) 33.455 5.991 ( 16.994 33.377 -1.419) 37.481 6.345 ( -5.085 7.285 0.368) 8.892 6.570 ( -4.991 14.189 -3.746) 15.501 6.717 ( 12.229 11.698 0.511) 16.931 6.953 ( 16.250 4.636 3.208) 17.200 7.513 ( -3.041 -7.517 -5.031) 9.543 7.571 ( 1.001 -9.595 -3.350) 10.212 7.627 ( -0.310 0.175 12.910) 12.915 7.790 ( -2.249 -2.389 -4.721) 5.749 7.998 ( 1.393 5.383 3.935) 6.812 8.243 ( 6.376 -0.967 -3.643) 7.407 8.516 ( -2.748 -13.000 4.448) 14.012 8.651 ( -1.063 -14.566 2.431) 14.806 8.735 ( 1.852 -13.226 -8.356) 15.754 8.886 ( 7.205 -11.306 -0.514) 13.416 9.088 ( -2.981 -10.967 0.252) 11.368 9.183 ( 0.282 -5.767 -4.782) 7.497 9.347 ( -5.484 -5.656 -1.679) 8.055 9.461 ( 5.511 -6.386 3.681) 9.204 9.646 ( -3.240 -2.618 -1.048) 4.296 9.752 ( -0.895 -8.225 3.536) 8.997 9.943 ( -9.614 -2.231 0.346) 9.875 10.039 ( -8.787 4.627 5.401) 11.304 10.271 ( -1.220 -2.918 0.491) 3.201 10.282 ( -4.619 -10.689 -0.942) 11.683 10.476 ( -2.081 -13.336 -2.352) 13.701 10.539 ( -0.969 -16.186 -3.837) 16.663 10.980 ( -6.697 13.551 5.649) 16.137 11.294 ( 4.972 9.955 -5.850) 12.572 11.499 ( -4.874 -6.721 3.858) 9.155 11.535 ( -0.852 -0.609 2.741) 2.934 11.572 ( -6.984 0.009 -3.815) 7.958 11.786 ( 2.684 -1.752 2.257) 3.920 12.069 ( -5.201 -8.496 -5.655) 11.455 12.150 ( 2.028 -9.548 1.161) 9.830 12.288 ( -9.560 -7.337 1.352) 12.126 12.599 ( -0.057 -3.658 1.270) 3.873 12.661 ( -11.529 -15.240 -1.219) 19.148 12.789 ( 0.976 -2.001 -3.754) 4.364 12.985 ( -2.552 -2.243 2.999) 4.532 13.087 ( -1.727 -1.335 -0.248) 2.197 13.191 ( -4.615 -3.194 1.769) 5.885 13.362 ( 0.561 -6.454 0.103) 6.479 13.496 ( 1.018 -10.937 2.628) 11.294 13.600 ( 2.404 -10.502 -0.688) 10.796 13.691 ( 0.745 -3.445 2.428) 4.280 14.036 ( 10.265 -4.746 0.566) 11.323 14.556 ( -7.856 3.716 -4.348) 9.717 14.680 ( 2.955 4.468 5.599) 7.749 15.299 ( -19.222 6.616 -8.671) 22.101 15.521 ( -6.015 7.727 6.453) 11.728 15.807 ( 17.861 4.490 0.471) 18.422 16.039 ( 15.613 5.344 -7.830) 18.266 16.585 ( 1.311 -4.583 10.249) 11.303 16.603 ( -5.261 -3.349 -9.335) 11.227 17.516 ( -4.709 11.859 3.701) 13.285 17.621 ( -9.074 13.433 10.907) 19.539 17.913 ( -4.700 17.979 -15.855) 24.427 18.422 ( 18.028 16.696 2.568) 24.706 19.285 ( -2.367 -7.788 12.932) 15.281 19.592 ( 0.270 -15.567 -15.614) 22.050 20.307 ( 2.678 8.977 2.387) 9.667 20.442 ( 5.901 13.904 -2.798) 15.361 20.991 ( -8.924 -10.586 22.695) 26.585 21.633 ( 7.500 -7.229 -19.625) 22.218 ======================= Grid point 358 (170/199) ======================= q-point: (-0.17 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.126 ( 8.063 18.807 -3.188) 20.710 2.883 ( 12.025 8.075 6.184) 15.750 3.702 ( 5.184 14.610 39.202) 42.156 3.746 ( 16.384 30.568 5.351) 35.092 4.303 ( 9.352 22.585 -16.151) 29.298 4.392 ( 16.746 19.871 -18.688) 32.008 5.463 ( 20.006 44.077 -7.190) 48.936 5.855 ( 12.187 38.244 -2.749) 40.233 6.293 ( 11.465 10.771 -2.854) 15.987 6.527 ( 2.307 -3.215 1.356) 4.183 6.801 ( 15.051 15.811 0.073) 21.830 7.237 ( 10.074 -3.783 0.525) 10.774 7.491 ( -2.223 -5.486 -5.824) 8.304 7.612 ( -1.177 -3.789 2.901) 4.915 7.678 ( 0.803 1.528 5.947) 6.193 7.759 ( -3.743 -3.579 1.667) 5.441 8.049 ( 6.316 1.437 -1.137) 6.576 8.386 ( 3.914 -6.844 -1.497) 8.025 8.541 ( -4.989 -8.586 -0.448) 9.941 8.709 ( -4.695 -8.782 7.446) 12.434 8.904 ( -2.678 -11.183 -2.182) 11.704 8.997 ( 4.316 -0.248 -2.176) 4.840 9.124 ( -3.160 -8.892 -2.644) 9.800 9.269 ( -4.335 -10.134 1.643) 11.144 9.368 ( 3.545 -7.928 -4.671) 9.861 9.583 ( -6.366 -1.617 0.385) 6.580 9.611 ( -7.182 2.151 -2.918) 8.045 9.692 ( -8.128 -10.067 2.145) 13.115 9.774 ( -0.850 2.654 1.971) 3.414 9.900 ( -5.476 -6.436 -0.193) 8.452 10.252 ( -3.502 -1.128 -5.957) 7.002 10.354 ( -0.186 -11.360 5.556) 12.647 10.506 ( -9.605 -10.891 3.627) 14.968 10.612 ( -8.218 -15.970 -2.429) 18.124 10.819 ( -1.957 5.303 5.156) 7.651 11.231 ( 3.073 13.810 -5.009) 15.008 11.431 ( -8.530 -4.751 -1.755) 9.920 11.482 ( -5.844 -3.619 1.123) 6.965 11.532 ( -0.259 1.299 1.983) 2.384 11.841 ( 1.753 -0.679 4.912) 5.259 12.059 ( -5.779 -12.919 -2.497) 14.371 12.171 ( -10.563 -10.832 -0.122) 15.130 12.327 ( 2.903 -5.931 1.071) 6.690 12.520 ( -10.267 -5.923 -0.755) 11.877 12.663 ( -6.731 -15.761 0.741) 17.154 12.818 ( 0.786 -1.624 -4.637) 4.975 12.950 ( -4.938 -0.541 3.148) 5.881 13.018 ( -5.903 -0.912 -0.074) 5.973 13.139 ( -3.116 -2.612 -2.263) 4.654 13.424 ( -2.605 -5.751 3.215) 7.085 13.562 ( -6.900 -4.359 2.129) 8.435 13.613 ( -0.272 -8.963 2.683) 9.360 13.899 ( 6.083 -4.877 -1.644) 7.968 14.187 ( 3.908 -0.324 1.016) 4.051 14.389 ( -5.335 0.503 -6.800) 8.657 14.730 ( 1.465 -1.245 7.408) 7.654 14.960 ( -8.895 6.119 -2.717) 11.133 15.416 ( -0.277 5.401 2.560) 5.984 16.031 ( 16.948 2.906 -19.267) 25.824 16.216 ( 9.198 7.127 5.376) 12.818 16.555 ( 1.795 -5.058 -6.500) 8.429 16.744 ( 5.238 -7.658 17.252) 19.589 17.144 ( -20.572 20.992 1.815) 29.448 17.411 ( 4.099 9.171 -5.452) 11.429 17.853 ( 8.665 9.002 -2.453) 12.734 18.523 ( 13.911 19.417 2.819) 24.052 19.325 ( -5.375 -6.855 11.942) 14.782 19.627 ( -6.104 -10.765 -15.818) 20.084 20.309 ( 6.568 9.184 0.788) 11.319 20.397 ( 5.178 13.589 -1.246) 14.595 21.063 ( -3.660 -12.038 22.911) 26.139 21.707 ( 1.735 -3.148 -19.526) 19.854 ======================= Grid point 359 (171/199) ======================= q-point: (-0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.203 ( 13.768 7.565 2.122) 15.852 3.038 ( 12.421 8.035 0.930) 14.823 3.813 ( 21.972 19.481 15.304) 33.113 3.879 ( 16.603 14.618 27.018) 34.919 4.176 ( 13.085 34.241 -5.676) 37.093 4.363 ( 8.520 10.130 -32.109) 34.730 5.523 ( 25.084 25.581 0.354) 35.829 5.751 ( 17.657 28.697 -4.964) 34.058 6.469 ( 22.964 13.313 -6.097) 27.235 6.641 ( 12.984 9.609 3.413) 16.510 6.915 ( 10.673 4.599 -1.564) 11.727 7.278 ( -3.057 -3.532 -4.751) 6.663 7.453 ( -11.145 -4.198 4.777) 12.832 7.561 ( -5.321 3.611 5.358) 8.370 7.703 ( -3.189 -4.009 -3.247) 6.065 7.809 ( 9.997 6.623 4.636) 12.857 8.128 ( 4.240 2.168 0.306) 4.772 8.362 ( -9.940 -5.689 0.018) 11.453 8.529 ( -5.609 0.245 -3.942) 6.860 8.741 ( -5.253 -2.184 7.382) 9.319 8.806 ( -7.603 -10.099 -0.095) 12.642 9.056 ( 2.212 -2.928 -4.738) 5.993 9.182 ( -6.654 -1.043 -2.654) 7.239 9.244 ( -0.469 -8.291 -0.492) 8.319 9.334 ( -15.128 0.377 -5.504) 16.102 9.426 ( -5.292 -6.814 1.393) 8.739 9.525 ( 1.938 -1.016 -0.839) 2.343 9.724 ( -0.057 -8.640 1.980) 8.864 9.758 ( -3.959 -0.240 -0.823) 4.051 10.063 ( 7.342 -5.954 -0.666) 9.476 10.157 ( -5.731 2.302 0.399) 6.189 10.429 ( -7.259 -10.464 3.684) 13.258 10.449 ( -8.566 -13.642 2.855) 16.360 10.580 ( -13.021 -14.529 -0.777) 19.525 10.799 ( -1.043 -0.707 3.456) 3.679 11.164 ( 5.701 8.170 -2.326) 10.230 11.348 ( -6.099 -3.855 -2.277) 7.566 11.430 ( -2.639 -0.769 2.895) 3.992 11.523 ( 0.239 1.106 0.205) 1.150 11.874 ( -1.132 -0.991 2.497) 2.915 12.053 ( -10.259 -2.952 -0.738) 10.701 12.124 ( -3.820 -16.546 -0.166) 16.982 12.367 ( -4.018 -4.683 1.196) 6.285 12.478 ( -4.733 -8.109 4.419) 10.377 12.716 ( -6.421 -9.774 3.052) 12.086 12.743 ( -4.274 4.699 -0.856) 6.410 12.882 ( -6.110 -7.821 -4.749) 11.002 13.009 ( 0.674 -4.081 -0.091) 4.138 13.107 ( -4.630 -6.039 -4.940) 9.073 13.372 ( -8.507 -2.499 2.899) 9.328 13.485 ( -8.464 -3.528 3.165) 9.701 13.679 ( -1.067 -6.728 1.102) 6.901 13.931 ( -0.149 -0.962 -1.971) 2.198 14.151 ( -5.317 1.630 -1.437) 5.745 14.384 ( 3.995 -0.762 -3.304) 5.240 14.777 ( -2.017 -6.318 4.228) 7.865 14.920 ( 6.582 1.557 -0.284) 6.769 15.422 ( 4.459 3.186 2.992) 6.244 16.089 ( 3.503 8.455 -11.320) 14.556 16.392 ( 14.662 -0.798 -8.375) 16.904 16.556 ( -5.862 9.185 -2.420) 11.162 16.676 ( -10.239 4.378 8.454) 13.982 17.035 ( 8.404 -4.462 8.801) 12.961 17.468 ( 15.822 3.619 -6.271) 17.400 17.969 ( 12.146 3.350 2.593) 12.863 18.538 ( 11.117 21.028 3.319) 24.016 19.323 ( -7.574 -8.136 12.128) 16.451 19.501 ( -12.858 -6.282 -14.418) 20.314 20.312 ( 3.412 8.998 -0.160) 9.624 20.371 ( 6.898 11.142 -0.392) 13.110 21.214 ( -0.422 -10.704 21.715) 24.214 21.625 ( -4.580 2.320 -20.834) 21.458 ======================= Grid point 365 (172/199) ======================= q-point: (-0.58 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.894 ( 0.008 -0.000 -1.641) 1.641 3.203 ( -12.237 0.000 1.323) 12.309 4.417 ( -3.262 0.000 6.394) 7.178 4.761 ( -10.189 0.000 1.899) 10.364 4.861 ( 1.303 -0.000 0.591) 1.431 4.972 ( 2.732 -0.000 -9.069) 9.472 6.393 ( -4.608 0.000 2.591) 5.286 6.563 ( -8.658 0.000 -1.847) 8.853 6.583 ( -5.745 0.000 -5.536) 7.978 6.803 ( -2.605 0.000 0.215) 2.614 6.941 ( -1.967 0.000 -0.539) 2.040 7.258 ( 0.641 -0.000 0.222) 0.679 7.299 ( 2.733 -0.000 4.211) 5.020 7.433 ( 5.223 -0.000 -3.031) 6.039 7.609 ( 3.982 -0.000 2.034) 4.472 7.658 ( -5.622 0.000 5.672) 7.986 7.809 ( 2.694 -0.000 -3.987) 4.812 8.030 ( -8.365 0.000 1.932) 8.585 8.233 ( 5.089 -0.000 0.252) 5.095 8.501 ( -1.613 0.000 -8.493) 8.645 8.693 ( -4.360 0.000 -2.626) 5.090 8.729 ( -6.116 0.000 7.745) 9.868 8.969 ( 1.317 -0.000 6.675) 6.804 9.027 ( 2.634 -0.000 -8.219) 8.630 9.077 ( -3.616 0.000 5.630) 6.691 9.219 ( 0.070 -0.000 -0.357) 0.364 9.522 ( 4.984 -0.000 7.993) 9.420 9.658 ( -3.992 0.000 -7.026) 8.081 9.846 ( -2.570 0.000 -4.243) 4.960 10.026 ( -9.453 0.000 3.513) 10.085 10.203 ( -4.917 0.000 8.779) 10.062 10.376 ( 3.198 -0.000 5.020) 5.952 10.456 ( 8.374 -0.000 -8.293) 11.785 10.460 ( -15.437 0.000 -3.008) 15.727 11.182 ( 14.340 -0.000 -0.081) 14.340 11.210 ( 17.006 -0.000 2.622) 17.207 11.388 ( 5.443 -0.000 -1.211) 5.576 11.397 ( -4.337 0.000 -1.466) 4.578 11.464 ( 6.945 -0.000 -1.684) 7.146 11.499 ( 10.960 -0.000 -1.875) 11.120 11.698 ( 1.138 -0.000 5.800) 5.911 11.900 ( 4.574 -0.000 0.218) 4.580 12.036 ( 1.739 -0.000 -10.647) 10.788 12.293 ( -3.137 0.000 -7.114) 7.775 12.376 ( -0.200 0.000 6.049) 6.052 12.435 ( 7.746 -0.000 4.297) 8.858 12.800 ( 4.089 -0.000 2.043) 4.571 13.084 ( 0.058 -0.000 -0.627) 0.629 13.124 ( -5.760 0.000 5.072) 7.674 13.216 ( 2.260 -0.000 0.868) 2.421 13.303 ( -7.550 0.000 -7.316) 10.513 13.316 ( 1.260 -0.000 -0.614) 1.402 13.917 ( -9.360 0.000 4.329) 10.313 14.027 ( -11.719 0.000 -3.945) 12.365 14.484 ( 11.201 -0.000 -5.001) 12.267 14.505 ( 11.263 -0.000 6.304) 12.908 15.419 ( 3.845 -0.000 -5.457) 6.676 15.901 ( -1.278 0.000 -3.222) 3.467 16.036 ( 2.081 -0.000 2.763) 3.459 16.228 ( 6.257 -0.000 12.155) 13.671 16.261 ( 12.586 -0.000 -7.616) 14.711 16.769 ( -25.670 0.000 -16.727) 30.639 17.362 ( 15.661 -0.000 29.605) 33.492 17.945 ( 3.370 -0.000 -4.126) 5.328 18.135 ( 9.687 -0.000 -0.149) 9.688 18.153 ( 10.213 -0.000 -0.896) 10.252 19.188 ( -10.344 0.000 -2.220) 10.579 19.929 ( -16.962 0.000 -3.943) 17.414 20.863 ( 5.962 -0.000 -10.131) 11.755 20.865 ( -1.366 0.000 -8.173) 8.286 20.945 ( -6.516 0.000 10.034) 11.964 20.952 ( -4.489 0.000 7.593) 8.820 ======================= Grid point 367 (173/199) ======================= q-point: (-0.50 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.857 ( 0.731 7.736 -0.812) 7.813 2.995 ( -12.610 -0.885 3.936) 13.239 4.364 ( -2.124 7.982 8.549) 11.887 4.607 ( -5.505 2.124 -2.947) 6.596 4.857 ( -0.648 3.276 0.075) 3.341 4.939 ( 0.266 7.002 -7.763) 10.458 6.287 ( -8.095 5.933 4.914) 11.175 6.377 ( -8.050 10.546 -2.331) 13.471 6.445 ( 0.785 3.397 -3.520) 4.955 6.734 ( -11.219 -7.160 -1.846) 13.437 6.976 ( 0.437 -7.500 5.886) 9.544 7.280 ( 0.184 -1.034 -5.820) 5.914 7.322 ( -0.066 2.474 -1.130) 2.721 7.355 ( 0.115 1.018 -1.196) 1.575 7.585 ( 1.804 -4.961 0.881) 5.352 7.785 ( -4.994 -6.546 2.535) 8.615 7.895 ( 8.595 -3.201 -4.284) 10.123 8.030 ( 4.801 -2.447 2.282) 5.852 8.308 ( -6.684 6.989 -4.839) 10.814 8.385 ( 7.288 1.806 4.029) 8.522 8.630 ( -7.593 1.649 6.882) 10.379 8.741 ( 5.785 4.593 -4.223) 8.508 9.015 ( -0.147 2.442 1.396) 2.817 9.081 ( 5.197 -2.356 1.856) 6.000 9.134 ( 7.657 -3.681 -2.535) 8.866 9.259 ( 2.388 -5.753 4.041) 7.425 9.545 ( -2.596 0.575 1.913) 3.276 9.589 ( -4.064 -2.005 -1.074) 4.657 9.834 ( -3.309 -0.624 -1.469) 3.674 9.910 ( -3.454 -6.353 1.080) 7.311 10.083 ( -13.785 0.290 8.699) 16.303 10.206 ( -6.748 4.795 -1.970) 8.509 10.331 ( -0.293 -2.916 -3.325) 4.432 10.593 ( 5.572 5.711 -5.973) 9.967 11.324 ( 3.883 0.434 3.721) 5.396 11.330 ( 3.954 -0.055 2.217) 4.533 11.368 ( 1.243 0.245 -1.956) 2.330 11.415 ( -0.820 -0.642 -0.012) 1.041 11.679 ( 6.770 0.572 1.793) 7.027 11.762 ( 11.668 -2.468 -2.107) 12.111 11.805 ( 9.942 -6.215 1.126) 11.779 11.926 ( -0.159 0.740 -3.190) 3.278 12.053 ( 6.098 -1.642 -6.103) 8.783 12.255 ( -2.597 -5.713 -4.361) 7.642 12.416 ( 2.597 -2.004 5.520) 6.421 12.562 ( 3.454 -2.645 3.152) 5.372 12.878 ( 4.199 0.643 4.363) 6.089 13.042 ( -6.437 -1.723 5.169) 8.434 13.085 ( -1.906 -4.366 0.075) 4.765 13.177 ( -5.370 -1.519 -7.211) 9.118 13.256 ( 2.138 -0.326 -0.571) 2.237 13.342 ( -0.242 -2.852 -0.883) 2.995 13.776 ( -6.251 1.789 1.045) 6.585 13.855 ( -9.200 -3.321 -1.980) 9.979 14.644 ( 9.864 2.427 -0.833) 10.192 14.693 ( 7.245 -0.719 5.107) 8.893 15.480 ( 6.642 2.979 -1.304) 7.395 15.862 ( 0.502 4.903 -0.837) 4.999 16.036 ( 0.958 3.493 -3.053) 4.737 16.275 ( -18.652 -1.606 -11.584) 22.015 16.363 ( 2.964 3.444 3.198) 5.556 16.488 ( 5.275 -7.243 -3.289) 9.545 17.645 ( 10.287 4.581 23.156) 25.748 17.987 ( 1.864 0.621 -2.421) 3.118 18.246 ( 13.714 7.907 -0.882) 15.855 18.419 ( 9.944 -10.351 -2.273) 14.533 19.039 ( -6.210 -2.289 0.491) 6.636 19.560 ( -21.514 4.396 -4.859) 22.489 20.751 ( -9.311 7.825 11.045) 16.429 20.799 ( 3.147 9.767 -8.186) 13.127 20.913 ( -8.505 -5.845 13.044) 16.632 21.046 ( 7.882 -11.566 -16.761) 21.837 ======================= Grid point 368 (174/199) ======================= q-point: (-0.42 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.744 ( -6.790 6.842 10.596) 14.325 2.901 ( 3.552 5.227 -3.756) 7.351 4.242 ( -1.945 16.339 14.205) 21.737 4.538 ( 2.464 4.038 -10.866) 11.851 4.736 ( -3.672 15.523 2.266) 16.112 4.849 ( 4.156 11.891 -9.607) 15.842 6.119 ( -2.706 9.711 2.790) 10.460 6.165 ( 0.749 12.541 -1.907) 12.707 6.531 ( 6.859 -2.784 2.929) 7.961 6.615 ( -4.941 -1.845 -4.292) 6.800 7.059 ( -0.557 -5.363 6.026) 8.086 7.237 ( -0.932 0.217 -9.645) 9.692 7.351 ( -0.545 -1.613 2.184) 2.769 7.383 ( 3.316 1.080 -0.577) 3.535 7.650 ( -3.479 -0.041 7.602) 8.360 7.809 ( 4.499 -7.315 -5.742) 10.330 8.033 ( -4.869 -7.295 -0.208) 8.773 8.076 ( 1.883 -11.605 -5.416) 12.945 8.255 ( 10.794 11.481 4.527) 16.395 8.347 ( -7.076 6.589 -3.333) 10.227 8.543 ( -1.691 1.914 8.738) 9.103 8.722 ( 2.179 7.389 -6.738) 10.235 8.993 ( -1.706 0.400 3.167) 3.619 9.110 ( 0.438 -0.920 -6.898) 6.973 9.299 ( 4.676 0.015 3.495) 5.838 9.347 ( -3.182 -3.759 0.301) 4.934 9.537 ( -4.136 -6.620 2.796) 8.291 9.569 ( 4.362 -2.737 -0.322) 5.160 9.834 ( -3.524 -9.473 4.916) 11.240 9.893 ( -1.424 -7.194 0.873) 7.386 10.065 ( 1.036 -8.611 2.432) 9.008 10.115 ( -1.371 -1.822 0.431) 2.321 10.390 ( 4.420 2.632 2.041) 5.535 10.520 ( -3.035 4.946 -9.999) 11.561 11.328 ( -2.832 3.957 2.827) 5.628 11.379 ( 1.413 -0.335 1.043) 1.788 11.396 ( -0.174 -1.063 0.643) 1.254 11.446 ( 3.211 -2.654 -0.302) 4.177 11.707 ( 2.677 4.461 3.361) 6.194 11.804 ( -3.989 3.857 -6.022) 8.189 11.902 ( 1.522 -5.402 0.193) 5.615 11.972 ( -1.181 -5.350 -5.117) 7.497 12.219 ( -5.349 -8.568 1.901) 10.278 12.262 ( 3.052 -10.168 -2.189) 10.840 12.572 ( 7.853 -5.324 2.176) 9.734 12.585 ( -3.712 -3.686 1.024) 5.331 12.963 ( 4.712 -0.738 4.473) 6.539 13.001 ( -2.849 -4.849 3.819) 6.799 13.088 ( -3.793 -0.323 -1.254) 4.008 13.133 ( 0.284 -6.857 -3.614) 7.756 13.310 ( 3.410 -3.069 0.023) 4.588 13.342 ( -3.087 -3.890 -2.063) 5.377 13.721 ( -3.692 -1.389 3.496) 5.271 13.782 ( 1.587 -1.567 -2.397) 3.274 14.740 ( 3.255 3.981 1.523) 5.363 14.748 ( -0.484 0.604 0.898) 1.186 15.595 ( 10.021 3.729 6.404) 12.463 15.765 ( -8.939 4.259 -7.865) 12.646 15.920 ( -11.806 6.196 -0.608) 13.347 16.022 ( 4.092 2.879 -6.852) 8.484 16.427 ( 1.153 -2.608 5.478) 6.176 16.595 ( 1.747 -3.404 -8.902) 9.690 17.764 ( 3.529 4.587 16.889) 17.853 17.923 ( -4.905 7.660 1.449) 9.210 18.422 ( 13.582 4.509 -0.864) 14.337 18.548 ( -2.257 1.156 -12.841) 13.089 19.079 ( 5.649 -2.102 8.049) 10.056 19.223 ( -11.944 -6.307 -5.323) 14.518 20.565 ( -6.470 8.016 8.510) 13.362 20.745 ( 5.162 11.807 -5.751) 14.111 20.859 ( -9.479 -5.897 16.155) 19.637 21.254 ( 9.555 -11.862 -18.137) 23.685 ======================= Grid point 369 (175/199) ======================= q-point: (-0.33 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.608 ( -2.316 11.186 5.811) 12.816 2.939 ( 8.036 7.454 1.302) 11.038 4.096 ( -1.085 18.964 20.673) 28.075 4.447 ( 2.727 23.505 -2.030) 23.750 4.598 ( 6.780 9.544 -11.252) 16.237 4.790 ( 8.747 16.236 -9.469) 20.731 6.054 ( 7.318 11.663 2.262) 13.953 6.200 ( 10.446 2.906 0.682) 10.864 6.491 ( -3.575 4.002 -4.665) 7.110 6.787 ( 14.960 0.599 2.799) 15.231 7.022 ( -3.501 18.334 -2.578) 18.843 7.178 ( 4.313 6.362 2.099) 7.968 7.338 ( -3.761 -5.878 -3.303) 7.721 7.408 ( -2.741 -5.990 -4.192) 7.808 7.612 ( -1.935 -1.749 9.806) 10.147 7.815 ( -1.410 4.455 -3.717) 5.971 8.067 ( 0.081 -5.973 1.200) 6.093 8.206 ( -4.129 -6.336 -4.311) 8.705 8.264 ( 5.066 -6.403 1.198) 8.252 8.429 ( 15.020 -0.423 -0.494) 15.034 8.559 ( -0.143 -11.060 1.688) 11.189 8.672 ( 0.066 1.420 -5.029) 5.226 8.974 ( -2.692 -2.482 4.637) 5.909 9.118 ( 0.587 -1.895 -5.283) 5.643 9.253 ( -8.364 -3.902 -4.208) 10.143 9.366 ( 2.917 -3.020 5.839) 7.192 9.570 ( -2.565 -6.807 0.227) 7.278 9.674 ( 4.043 -1.144 0.796) 4.276 9.864 ( -5.707 -7.161 5.002) 10.434 10.039 ( 5.478 -5.769 3.520) 8.699 10.095 ( -2.759 -8.130 0.887) 8.631 10.168 ( -4.607 -1.002 5.776) 7.456 10.378 ( 1.869 3.080 -6.933) 7.813 10.441 ( -0.252 1.368 -5.136) 5.321 11.192 ( -7.277 8.541 3.981) 11.906 11.381 ( -4.613 -4.797 1.816) 6.898 11.389 ( 0.294 1.273 -2.998) 3.270 11.518 ( 2.271 -2.182 1.060) 3.323 11.643 ( -3.181 5.890 -3.425) 7.520 11.780 ( 2.983 0.675 1.407) 3.366 11.889 ( -10.958 -9.489 -0.496) 14.504 11.979 ( -3.799 -7.314 -2.366) 8.575 12.146 ( -7.200 -8.479 0.162) 11.125 12.359 ( -8.663 -13.347 1.305) 15.965 12.543 ( -2.860 -2.793 -0.236) 4.004 12.715 ( 1.497 -5.671 -3.259) 6.710 12.962 ( -3.598 0.135 -0.615) 3.653 13.051 ( -1.197 -1.924 3.150) 3.880 13.123 ( 3.311 -4.567 3.198) 6.485 13.231 ( 4.051 -8.105 -2.207) 9.325 13.326 ( -1.683 -4.885 0.685) 5.212 13.427 ( 2.999 -7.268 -0.361) 7.871 13.681 ( 1.087 1.605 3.598) 4.088 13.937 ( 10.589 -5.291 0.311) 11.841 14.612 ( -10.397 2.065 -2.145) 10.814 14.757 ( 0.367 3.608 0.480) 3.658 15.420 ( -17.196 5.680 -6.145) 19.124 15.672 ( -4.368 7.662 8.624) 12.335 15.891 ( 13.467 4.162 2.229) 14.271 16.103 ( 11.558 1.131 -4.916) 12.611 16.464 ( -4.592 -6.969 -0.853) 8.389 16.580 ( -0.122 0.722 -4.861) 4.916 17.727 ( -6.047 9.823 1.685) 11.657 17.795 ( -3.055 5.579 17.218) 18.356 18.218 ( -15.221 12.555 -17.160) 26.149 18.598 ( 10.497 2.094 -4.340) 11.550 19.200 ( 1.848 -8.267 0.232) 8.474 19.314 ( 8.278 -4.937 3.134) 10.135 20.461 ( 0.557 7.058 5.181) 8.773 20.703 ( 3.986 11.438 -0.850) 12.143 20.826 ( -5.940 -4.915 16.085) 17.837 21.462 ( 8.322 -10.492 -17.662) 22.165 ======================= Grid point 370 (176/199) ======================= q-point: (-0.25 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.487 ( 4.250 17.503 -3.249) 18.303 3.021 ( 8.627 6.342 5.748) 12.152 4.000 ( 2.340 16.353 28.600) 33.028 4.308 ( 10.676 26.734 3.004) 28.943 4.604 ( 10.627 12.335 -18.778) 24.853 4.767 ( 8.493 15.346 -8.130) 19.332 6.141 ( 17.681 19.292 3.353) 26.382 6.305 ( -3.714 4.941 -1.008) 6.263 6.448 ( 16.586 8.584 -4.225) 19.147 6.606 ( -7.258 20.208 -4.027) 21.846 7.071 ( 13.669 8.108 -2.462) 16.082 7.231 ( 4.132 4.155 3.665) 6.911 7.349 ( -4.240 -10.377 -4.264) 11.994 7.418 ( -1.499 -10.909 -5.444) 12.284 7.668 ( 0.745 -3.405 8.941) 9.597 7.794 ( 5.437 3.740 0.250) 6.604 8.087 ( -1.202 -1.703 1.010) 2.317 8.213 ( 0.156 -7.904 -3.802) 8.773 8.381 ( -2.496 -8.948 0.701) 9.316 8.622 ( 5.343 2.043 5.173) 7.712 8.684 ( 2.391 -7.886 -2.036) 8.488 8.850 ( 8.399 -19.175 -3.545) 21.232 8.982 ( 0.939 -2.249 4.656) 5.255 9.118 ( -2.152 -3.732 -3.065) 5.287 9.200 ( 0.715 -6.366 -6.845) 9.375 9.485 ( 0.168 -5.802 5.058) 7.699 9.536 ( -9.970 -4.154 -0.560) 10.815 9.664 ( 0.016 2.982 -0.348) 3.002 9.847 ( -2.266 -3.571 3.766) 5.663 9.970 ( -10.352 10.952 3.479) 15.467 10.132 ( -2.019 -4.787 3.933) 6.517 10.182 ( 0.710 -9.341 0.572) 9.386 10.372 ( -0.214 0.222 -8.435) 8.441 10.433 ( -0.186 -2.659 -1.720) 3.172 10.982 ( -8.300 8.793 5.933) 13.469 11.346 ( -6.176 -4.147 -1.400) 7.569 11.350 ( -3.696 -1.886 -1.317) 4.354 11.536 ( 0.640 8.178 -4.942) 9.577 11.565 ( 1.332 2.532 4.846) 5.628 11.741 ( -13.259 -14.119 1.192) 19.406 11.865 ( -0.325 -3.096 4.574) 5.532 11.965 ( -6.375 -10.223 -4.154) 12.744 12.141 ( -7.790 -14.163 -4.021) 16.657 12.320 ( -6.633 -8.123 3.604) 11.089 12.515 ( -4.928 -3.545 1.115) 6.172 12.746 ( -0.139 -5.216 -7.144) 8.846 12.922 ( -2.859 -2.810 0.431) 4.032 13.021 ( -5.456 0.261 2.723) 6.103 13.131 ( -2.472 1.266 1.039) 2.966 13.325 ( 0.878 -4.382 0.257) 4.476 13.444 ( 2.133 -8.845 4.194) 10.018 13.472 ( -3.145 -5.477 -0.314) 6.323 13.819 ( 11.224 -2.260 2.172) 11.654 14.156 ( 8.069 -3.292 0.908) 8.762 14.399 ( -10.824 0.744 -3.285) 11.336 14.695 ( -5.498 -0.969 -3.146) 6.409 15.117 ( -8.469 8.427 3.516) 12.454 15.545 ( -2.727 7.870 5.832) 10.168 16.063 ( 12.331 0.068 -14.517) 19.047 16.313 ( 3.416 2.800 -7.590) 8.782 16.459 ( 10.221 -4.365 5.171) 12.258 16.604 ( -0.847 -6.084 9.383) 11.215 17.518 ( -18.904 17.445 11.498) 28.176 17.579 ( -1.201 8.558 -8.517) 12.134 17.980 ( 0.406 3.384 -4.205) 5.413 18.703 ( 4.525 -0.808 -5.079) 6.850 19.267 ( -2.268 -5.413 -1.158) 5.982 19.470 ( 6.581 1.885 1.904) 7.105 20.470 ( 6.494 7.322 2.135) 10.017 20.644 ( 0.712 9.891 3.992) 10.690 20.869 ( -0.294 -5.567 15.391) 16.370 21.600 ( 3.485 -7.822 -17.408) 19.401 ======================= Grid point 371 (177/199) ======================= q-point: (-0.17 0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.418 ( 7.376 14.250 -3.049) 16.333 3.144 ( 9.901 3.835 4.772) 11.640 4.060 ( 10.568 11.268 29.271) 33.098 4.306 ( 16.086 23.340 4.778) 28.746 4.589 ( 8.011 13.186 -24.268) 28.757 4.694 ( 6.523 18.671 -4.965) 20.392 6.041 ( 0.175 23.295 -1.266) 23.330 6.215 ( 7.510 21.713 1.442) 23.021 6.602 ( 16.040 -2.512 -2.629) 16.447 6.698 ( 20.123 5.386 -3.045) 21.052 7.106 ( 2.418 9.208 -2.491) 9.840 7.221 ( -3.769 -3.095 -0.263) 4.884 7.324 ( -5.557 -6.691 -4.409) 9.751 7.500 ( -1.994 -9.898 -1.890) 10.272 7.703 ( 0.173 4.941 5.737) 7.573 7.944 ( 11.202 1.534 2.693) 11.623 8.084 ( -1.291 -5.454 -0.815) 5.663 8.323 ( -1.973 -1.467 2.003) 3.171 8.360 ( -3.510 -13.200 -5.259) 14.636 8.647 ( 1.155 3.083 6.162) 6.986 8.781 ( -2.176 -4.656 0.332) 5.150 8.942 ( -3.638 -10.203 1.430) 10.927 9.062 ( 2.780 2.325 -5.619) 6.687 9.160 ( 0.903 -4.606 -0.327) 4.705 9.298 ( -12.972 -4.632 -0.792) 13.797 9.380 ( -6.001 -2.993 -2.426) 7.131 9.426 ( -1.736 -3.977 -1.287) 4.527 9.704 ( 5.847 2.771 0.925) 6.536 9.812 ( -2.770 3.738 2.186) 5.141 9.918 ( 10.262 -4.231 1.751) 11.237 10.132 ( -5.284 -6.362 2.965) 8.785 10.214 ( -5.654 -4.585 -2.834) 7.812 10.346 ( -3.945 -5.802 -3.575) 7.874 10.424 ( -0.917 2.633 1.815) 3.327 10.825 ( -5.920 3.175 6.494) 9.344 11.252 ( -6.403 -1.862 -2.164) 7.010 11.310 ( -2.016 -1.221 -0.393) 2.390 11.465 ( 1.922 7.319 -0.796) 7.609 11.573 ( 0.891 3.352 3.589) 4.991 11.699 ( -11.782 -18.481 2.806) 22.096 11.906 ( -1.733 -3.470 -0.052) 3.879 11.933 ( -5.981 -11.367 -1.701) 12.957 12.132 ( -9.009 -18.616 -4.866) 21.246 12.353 ( -0.496 -5.130 7.122) 8.792 12.475 ( -4.224 -6.143 -0.233) 7.459 12.771 ( -2.128 -4.176 -7.167) 8.563 12.886 ( -6.421 4.732 5.222) 9.534 12.932 ( -0.584 -4.269 0.617) 4.353 13.071 ( -3.397 0.997 -2.968) 4.619 13.328 ( -5.544 -1.936 3.099) 6.640 13.440 ( -5.012 -1.949 0.520) 5.402 13.560 ( 1.904 -6.166 1.914) 6.731 13.939 ( 0.518 1.368 1.212) 1.899 14.175 ( -5.639 1.060 -3.453) 6.697 14.342 ( 3.853 -3.746 -1.862) 5.687 14.633 ( -3.555 -6.373 -1.304) 7.413 15.025 ( 2.849 7.088 7.634) 10.800 15.496 ( 2.719 4.783 3.954) 6.776 16.210 ( -0.749 3.456 -17.922) 18.267 16.254 ( 10.518 -7.250 -16.102) 20.554 16.580 ( -3.225 -3.569 11.002) 12.008 16.894 ( 16.696 -3.643 15.679) 23.192 17.033 ( -16.001 18.667 0.514) 24.592 17.555 ( 8.181 4.465 -6.316) 11.259 18.013 ( 5.115 0.411 3.306) 6.104 18.739 ( 0.512 -1.766 -4.515) 4.875 19.226 ( -7.579 -4.614 -0.376) 8.881 19.481 ( 0.521 9.200 0.417) 9.224 20.485 ( 1.600 8.548 1.352) 8.801 20.588 ( 3.917 9.935 3.625) 11.278 21.009 ( 2.705 -8.539 16.181) 18.495 21.611 ( -2.235 -3.724 -18.117) 18.630 ======================= Grid point 372 (178/199) ======================= q-point: (-0.08 0.42 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.450 ( 7.248 4.990 6.366) 10.860 3.258 ( 5.884 4.974 -1.132) 7.787 4.251 ( 8.457 9.369 13.865) 18.749 4.402 ( 15.395 11.889 -3.059) 19.690 4.479 ( 11.533 14.714 -6.034) 19.645 4.702 ( 16.163 18.592 -5.212) 25.181 5.873 ( 2.297 14.038 -3.438) 14.634 6.185 ( 9.647 14.213 3.237) 17.480 6.801 ( -1.448 -3.298 6.809) 7.703 6.973 ( 18.249 12.348 -9.497) 23.994 7.009 ( -3.979 1.865 -3.071) 5.361 7.196 ( -6.457 -8.848 1.877) 11.113 7.347 ( 8.589 -1.046 -2.506) 9.008 7.545 ( -0.368 -6.306 -0.897) 6.380 7.639 ( 2.827 8.350 0.407) 8.825 7.990 ( -1.806 1.544 5.579) 6.064 8.115 ( -11.281 -0.977 0.354) 11.328 8.259 ( 7.495 -2.771 -1.272) 8.092 8.469 ( 3.387 4.807 -1.579) 6.089 8.656 ( -1.685 -3.191 -1.993) 4.122 8.718 ( -2.535 2.329 2.878) 4.487 8.918 ( -13.592 -4.540 -2.271) 14.509 9.072 ( 2.033 -0.625 -6.135) 6.493 9.125 ( -3.366 -1.143 -0.389) 3.576 9.170 ( 0.408 -7.353 -0.642) 7.392 9.347 ( 3.592 -5.722 -0.938) 6.820 9.543 ( 0.550 -3.601 -2.264) 4.290 9.719 ( -2.323 3.574 1.400) 4.487 9.734 ( -0.936 2.856 2.888) 4.168 10.052 ( -10.450 -0.603 3.791) 11.133 10.076 ( -5.602 -2.777 2.217) 6.634 10.202 ( 0.316 -9.129 -0.418) 9.144 10.292 ( -4.045 0.383 -7.256) 8.316 10.380 ( -4.052 -0.969 4.491) 6.126 10.773 ( -0.788 -3.091 6.593) 7.324 11.196 ( -2.028 -1.331 -1.291) 2.748 11.309 ( 1.929 1.743 -0.623) 2.673 11.471 ( 3.818 2.611 0.799) 4.693 11.504 ( -7.321 -1.335 0.091) 7.443 11.740 ( -0.382 -8.057 2.609) 8.477 11.929 ( -2.418 -13.832 -0.343) 14.046 11.972 ( -1.431 -4.327 2.254) 5.084 12.162 ( -5.853 -14.552 -2.650) 15.907 12.374 ( -4.863 -3.887 7.487) 9.737 12.522 ( -2.748 -12.208 -1.969) 12.668 12.691 ( -7.250 -1.031 -3.364) 8.059 12.753 ( -4.013 6.260 3.545) 8.238 12.951 ( -5.481 1.279 -1.108) 5.736 13.022 ( 2.048 -3.786 -4.315) 6.095 13.215 ( -9.229 -0.581 0.274) 9.251 13.337 ( -6.478 -0.741 2.009) 6.822 13.649 ( 1.771 -3.892 2.082) 4.756 13.940 ( 1.638 -1.154 0.949) 2.217 14.064 ( -4.375 0.746 -2.760) 5.226 14.438 ( 4.155 -1.333 -1.523) 4.622 14.671 ( -1.110 -6.922 -0.643) 7.040 15.078 ( 6.963 3.322 4.043) 8.710 15.560 ( 7.594 2.962 4.127) 9.137 16.116 ( -2.258 1.399 -9.707) 10.064 16.378 ( -1.939 -3.507 -4.015) 5.673 16.539 ( -12.647 7.990 3.334) 15.327 16.728 ( 8.665 2.761 -8.942) 12.754 17.121 ( 1.733 1.220 5.400) 5.801 17.802 ( 24.791 -1.438 -0.802) 24.846 18.149 ( 7.205 -1.803 5.591) 9.296 18.760 ( 2.945 -2.248 -2.004) 4.212 19.114 ( -12.612 -6.442 1.218) 14.214 19.332 ( -5.240 12.731 2.112) 13.928 20.399 ( -2.568 6.034 3.318) 7.349 20.567 ( 3.738 10.711 -1.992) 11.518 21.187 ( 1.799 -9.336 15.646) 18.308 21.509 ( -3.763 1.821 -18.371) 18.841 ======================= Grid point 379 (179/199) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.812 ( -8.794 0.000 9.724) 13.110 2.949 ( 5.363 0.000 -3.072) 6.180 4.448 ( 3.744 -0.000 4.981) 6.231 4.532 ( -2.489 0.000 -1.905) 3.135 4.875 ( 0.461 0.000 0.660) 0.805 4.947 ( -0.342 -0.000 -6.916) 6.924 6.261 ( -2.181 -0.000 7.685) 7.988 6.379 ( 1.138 0.000 -2.391) 2.648 6.499 ( 6.512 0.000 -2.048) 6.827 6.533 ( -5.385 0.000 -5.860) 7.959 6.955 ( 0.042 0.000 9.552) 9.552 7.196 ( -2.324 -0.000 -12.302) 12.520 7.335 ( -1.879 0.000 3.066) 3.596 7.372 ( 2.193 0.000 -0.698) 2.301 7.626 ( 7.583 0.000 0.820) 7.627 7.688 ( -3.355 0.000 -4.267) 5.428 7.942 ( -9.285 0.000 0.565) 9.302 8.002 ( 7.922 0.000 -4.563) 9.142 8.421 ( -8.860 0.000 1.450) 8.977 8.450 ( 10.641 0.000 -1.281) 10.718 8.571 ( -2.014 0.000 11.844) 12.014 8.811 ( 2.009 0.000 -9.335) 9.549 9.023 ( -1.306 0.000 7.384) 7.498 9.169 ( 3.776 -0.000 -5.563) 6.724 9.260 ( 4.076 0.000 3.138) 5.144 9.274 ( -0.029 0.000 0.751) 0.752 9.469 ( -6.027 0.000 5.504) 8.161 9.560 ( 2.128 0.000 -3.754) 4.315 9.730 ( -6.004 0.000 4.929) 7.769 9.805 ( 0.498 0.000 -1.744) 1.814 9.986 ( 0.474 0.000 6.043) 6.062 10.098 ( -2.477 0.000 -3.495) 4.283 10.420 ( 7.371 0.000 4.454) 8.612 10.576 ( -5.707 0.000 -10.018) 11.529 11.353 ( -1.004 0.000 4.787) 4.891 11.372 ( -0.668 0.000 -0.309) 0.736 11.384 ( 1.020 0.000 -0.369) 1.085 11.438 ( 3.204 0.000 -2.019) 3.787 11.767 ( 2.351 0.000 6.188) 6.620 11.822 ( -1.663 -0.000 -0.589) 1.764 11.876 ( 1.715 0.000 -5.278) 5.549 11.898 ( -3.132 -0.000 -5.844) 6.630 12.128 ( -9.632 0.000 0.866) 9.671 12.144 ( 5.402 0.000 -0.879) 5.473 12.514 ( 7.908 0.000 2.818) 8.395 12.555 ( -2.050 0.000 -1.125) 2.338 12.931 ( -1.367 0.000 5.564) 5.729 13.001 ( 1.694 0.000 5.917) 6.155 13.033 ( 2.124 -0.000 -1.055) 2.371 13.091 ( -4.427 0.000 -4.760) 6.500 13.290 ( 2.819 -0.000 -1.724) 3.305 13.295 ( -2.457 0.000 -1.948) 3.136 13.709 ( -2.759 0.000 3.325) 4.320 13.768 ( 0.831 0.000 -2.336) 2.480 14.748 ( -2.176 0.000 2.560) 3.360 14.785 ( 5.518 0.000 -0.855) 5.584 15.634 ( 9.903 0.000 4.527) 10.889 15.804 ( -13.210 0.000 -11.256) 17.355 16.004 ( -4.676 -0.000 -0.366) 4.690 16.038 ( -0.803 0.000 -2.755) 2.869 16.377 ( -3.049 -0.000 9.673) 10.142 16.578 ( 6.708 0.000 -8.532) 10.854 17.810 ( 0.665 0.000 15.478) 15.492 18.005 ( 0.218 0.000 -4.626) 4.631 18.449 ( 0.156 0.000 -2.031) 2.037 18.527 ( 13.411 0.000 -7.757) 15.492 19.067 ( 11.714 0.000 7.522) 13.921 19.184 ( -22.493 0.000 -3.346) 22.740 20.689 ( -9.364 -0.000 13.246) 16.222 20.728 ( -8.280 0.000 14.274) 16.502 20.975 ( 8.431 0.000 -12.628) 15.184 21.051 ( 8.471 0.000 -14.675) 16.944 ======================= Grid point 381 (180/199) ======================= q-point: (-0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.751 ( 0.122 3.842 7.672) 8.581 3.037 ( 6.734 2.553 0.679) 7.234 4.420 ( 1.367 14.028 6.951) 15.716 4.596 ( 6.393 -2.810 -5.061) 8.624 4.834 ( 0.154 9.564 0.712) 9.591 4.939 ( 2.348 0.563 -6.457) 6.894 6.263 ( 6.235 8.934 4.968) 11.974 6.346 ( 3.618 10.973 1.083) 11.605 6.492 ( 2.039 -0.901 -6.538) 6.907 6.726 ( 13.291 -8.510 -1.351) 15.840 7.043 ( 3.571 -2.741 10.003) 10.969 7.161 ( -1.276 -6.904 -9.161) 11.542 7.310 ( -1.732 0.879 1.238) 2.303 7.389 ( -1.569 -0.006 -0.938) 1.828 7.617 ( 0.333 4.184 -2.177) 4.728 7.812 ( -7.748 -4.975 2.479) 9.536 7.863 ( 10.484 -10.548 -3.810) 15.352 8.104 ( -1.821 0.152 -4.401) 4.765 8.228 ( -3.015 -1.357 2.434) 4.106 8.459 ( -5.378 6.616 -1.100) 8.596 8.605 ( 1.260 -1.610 5.991) 6.330 8.771 ( 2.836 9.006 -4.554) 10.483 8.973 ( -4.712 1.021 2.547) 5.453 9.140 ( 1.375 5.458 -4.440) 7.169 9.200 ( -7.357 -1.431 -4.919) 8.965 9.303 ( -0.294 -6.516 0.666) 6.556 9.444 ( -0.901 -3.264 5.246) 6.244 9.646 ( 6.799 -2.229 -0.470) 7.171 9.719 ( -3.329 -4.207 7.059) 8.866 9.934 ( 6.717 -4.187 0.122) 7.916 10.061 ( 6.601 2.355 7.041) 9.934 10.164 ( 6.155 -0.856 3.173) 6.977 10.438 ( -1.884 1.820 -12.291) 12.567 10.513 ( 3.039 3.905 2.344) 5.476 11.298 ( -6.363 1.491 2.750) 7.090 11.339 ( -2.553 1.168 0.670) 2.887 11.397 ( -0.294 -0.284 -0.923) 1.010 11.468 ( 1.145 -1.823 -3.576) 4.175 11.704 ( -16.642 -4.503 -1.636) 17.318 11.730 ( -6.889 1.768 1.544) 7.278 11.833 ( -1.022 0.254 0.421) 1.134 11.882 ( -0.541 -2.002 -1.812) 2.753 11.984 ( -9.145 -6.006 0.500) 10.952 12.178 ( -3.200 -5.419 2.623) 6.818 12.528 ( -0.938 0.920 -4.187) 4.388 12.608 ( 0.071 -4.274 -1.249) 4.453 12.973 ( -4.035 0.535 -2.802) 4.941 13.010 ( 2.740 -4.307 5.035) 7.170 13.044 ( 2.410 0.214 5.174) 5.711 13.121 ( 4.472 -3.133 -1.440) 5.647 13.269 ( -1.139 -1.841 -1.808) 2.820 13.337 ( 1.660 -1.994 -0.870) 2.737 13.727 ( 4.632 2.458 4.224) 6.734 13.848 ( 7.836 -3.470 -0.702) 8.599 14.636 ( -10.834 0.574 0.265) 10.852 14.809 ( -0.906 1.545 -4.643) 4.976 15.499 ( -15.972 2.222 -4.959) 16.872 15.784 ( 2.773 3.191 6.540) 7.788 15.971 ( 3.130 3.980 4.031) 6.472 16.090 ( 8.300 -1.806 2.177) 8.769 16.351 ( -4.627 -3.921 3.577) 7.042 16.607 ( 0.956 1.218 -10.229) 10.346 17.818 ( -2.918 0.757 10.439) 10.866 17.924 ( -4.444 6.637 -1.405) 8.110 18.355 ( -11.512 1.711 -8.717) 14.541 18.579 ( -3.325 -1.742 -18.033) 18.419 18.994 ( 0.182 -6.418 5.126) 8.215 19.370 ( 19.196 3.305 12.167) 22.966 20.575 ( -2.978 4.886 9.835) 11.379 20.682 ( -7.112 -4.736 15.198) 17.435 20.991 ( 8.536 13.043 -9.942) 18.489 21.242 ( 8.300 -12.195 -14.417) 20.627 ======================= Grid point 382 (181/199) ======================= q-point: (-0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.754 ( 5.368 9.918 0.453) 11.286 3.120 ( 5.966 3.710 4.658) 8.429 4.312 ( -0.065 15.851 14.807) 21.691 4.677 ( 6.343 8.115 -5.568) 11.708 4.790 ( 8.020 8.754 -2.354) 12.104 4.940 ( 1.833 3.366 -7.649) 8.556 6.285 ( 1.924 6.076 5.500) 8.418 6.400 ( 13.041 5.364 0.659) 14.116 6.561 ( 9.381 2.481 -5.145) 10.983 6.930 ( -1.376 0.133 -1.975) 2.411 7.113 ( 0.641 -4.673 0.239) 4.723 7.173 ( -7.592 0.042 -5.485) 9.366 7.286 ( -4.500 0.693 0.331) 4.565 7.342 ( 13.095 4.913 3.494) 14.417 7.596 ( -0.325 -1.800 -0.220) 1.843 7.770 ( -1.681 -9.473 0.679) 9.645 7.977 ( -4.302 0.746 -2.856) 5.217 8.186 ( 12.510 -8.869 0.499) 15.343 8.231 ( -11.976 1.571 -4.345) 12.836 8.420 ( 6.314 -14.954 1.974) 16.352 8.669 ( 5.270 -1.578 0.813) 5.561 8.783 ( 9.798 8.464 0.173) 12.949 8.933 ( -1.534 -2.462 3.362) 4.441 9.109 ( 1.543 2.415 -6.909) 7.480 9.128 ( -0.102 -0.910 -4.907) 4.992 9.394 ( 2.039 -6.658 1.707) 7.170 9.466 ( -3.621 -1.205 3.166) 4.959 9.672 ( -6.618 -4.847 0.760) 8.238 9.759 ( 3.208 -0.970 4.649) 5.731 9.990 ( -3.130 -2.258 2.476) 4.586 10.179 ( 2.535 6.329 7.306) 9.993 10.223 ( 8.140 5.958 5.982) 11.728 10.426 ( -1.059 4.871 -8.428) 9.792 10.472 ( 5.816 6.037 -7.482) 11.236 11.119 ( -12.301 5.177 3.829) 13.885 11.273 ( -6.048 -2.139 0.412) 6.428 11.335 ( -6.663 -0.380 -2.379) 7.085 11.477 ( -15.434 -10.097 1.079) 18.475 11.527 ( 2.397 -4.950 -0.822) 5.561 11.620 ( -10.332 -9.239 0.462) 13.868 11.759 ( -3.805 3.635 -1.291) 5.418 11.906 ( -1.379 -3.174 1.829) 3.914 11.927 ( -4.053 -3.822 -3.685) 6.680 12.205 ( -1.563 -5.856 6.552) 8.925 12.467 ( -3.889 -0.295 -1.578) 4.207 12.628 ( -2.074 -6.868 -6.558) 9.720 12.871 ( -5.107 -1.784 -2.571) 5.990 13.025 ( -3.098 0.300 4.738) 5.669 13.160 ( 2.110 1.233 2.623) 3.586 13.247 ( 5.397 -5.267 -0.826) 7.586 13.282 ( 1.660 -5.354 2.064) 5.973 13.371 ( -0.900 -4.679 -1.194) 4.912 13.838 ( 10.791 3.766 3.892) 12.074 14.065 ( 10.835 -5.801 0.972) 12.329 14.415 ( -13.949 0.715 -0.065) 13.967 14.697 ( -8.162 0.739 -10.100) 13.007 15.250 ( -8.765 5.078 5.227) 11.399 15.705 ( -3.722 8.440 7.306) 11.767 16.027 ( 2.471 -3.400 -3.727) 5.618 16.307 ( -1.641 -2.766 -7.265) 7.946 16.398 ( 18.977 -2.213 13.126) 23.180 16.550 ( -2.956 0.165 -6.309) 6.969 17.722 ( -4.151 6.751 -5.177) 9.466 17.798 ( -8.760 9.427 13.601) 18.724 18.008 ( -12.720 3.237 -11.565) 17.494 18.553 ( -4.541 -14.012 -15.454) 21.350 19.128 ( 3.547 -4.240 3.466) 6.525 19.637 ( 15.082 9.103 11.388) 20.977 20.577 ( 5.072 3.771 5.215) 8.195 20.658 ( -6.153 -3.177 16.037) 17.468 20.977 ( 7.361 11.646 -6.336) 15.164 21.420 ( 4.348 -10.720 -14.467) 18.524 ======================= Grid point 383 (182/199) ======================= q-point: (-0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.706 ( 3.515 14.585 -5.424) 15.953 3.198 ( 5.176 2.054 6.118) 8.273 4.268 ( 5.021 10.304 21.037) 23.957 4.667 ( 6.020 12.009 1.068) 13.476 4.829 ( 5.496 11.109 -16.798) 20.876 4.901 ( 3.761 4.797 -2.071) 6.438 6.260 ( -0.732 4.316 2.479) 5.031 6.596 ( 11.578 5.428 4.097) 13.428 6.642 ( -5.941 14.437 -4.684) 16.299 6.772 ( 16.197 3.601 -1.624) 16.672 7.069 ( -9.306 -9.207 -6.145) 14.462 7.153 ( -4.222 -6.694 -6.256) 10.089 7.266 ( 1.958 1.255 2.653) 3.528 7.413 ( -1.765 2.042 5.586) 6.204 7.698 ( 2.848 -10.955 -0.698) 11.341 7.903 ( 1.319 4.304 -3.942) 5.983 7.952 ( 3.747 -11.822 0.949) 12.438 8.100 ( -2.735 -6.809 -3.849) 8.286 8.357 ( 3.676 1.387 5.288) 6.588 8.569 ( 0.757 -7.832 -3.913) 8.788 8.812 ( 7.205 3.559 5.259) 9.603 8.940 ( 4.077 5.926 2.139) 7.504 8.997 ( 8.754 -9.806 -1.604) 13.243 9.122 ( 2.137 -0.820 -4.157) 4.745 9.188 ( 4.871 -4.194 -4.405) 7.792 9.307 ( -8.211 0.092 -4.189) 9.218 9.437 ( -7.411 1.329 7.429) 10.577 9.670 ( -1.639 -6.382 0.020) 6.589 9.850 ( 7.586 2.089 5.420) 9.555 9.894 ( -5.062 -0.812 0.601) 5.162 10.167 ( 3.687 6.013 0.538) 7.074 10.207 ( -1.947 9.220 1.205) 9.500 10.393 ( 1.905 5.246 -9.810) 11.287 10.486 ( 5.391 5.661 1.133) 7.899 10.885 ( -11.779 1.912 7.247) 13.961 11.179 ( -9.715 -8.294 -0.969) 12.810 11.239 ( -6.469 -5.185 0.817) 8.330 11.384 ( -8.884 -8.913 2.163) 12.769 11.569 ( -9.524 -15.661 -1.815) 18.420 11.598 ( 1.444 -0.860 1.130) 2.025 11.667 ( -1.533 6.548 2.139) 7.057 11.842 ( -6.547 -4.251 -6.596) 10.220 11.939 ( -0.105 -3.885 0.389) 3.906 12.267 ( 0.249 -4.136 8.919) 9.834 12.412 ( -3.555 -1.940 -1.901) 4.474 12.647 ( -1.759 -7.614 -7.252) 10.661 12.838 ( -1.985 -4.729 -1.201) 5.268 12.958 ( -4.509 2.410 4.633) 6.899 13.129 ( -1.336 4.307 -0.377) 4.525 13.296 ( -0.996 -1.662 1.460) 2.426 13.394 ( -0.562 -3.106 -0.865) 3.273 13.436 ( 3.910 -6.752 2.616) 8.229 13.985 ( 5.091 3.789 4.853) 7.990 14.183 ( -4.637 -0.569 -4.485) 6.476 14.266 ( 0.450 -3.402 -0.067) 3.432 14.544 ( -4.875 -3.273 -4.605) 7.462 15.156 ( 0.685 6.088 8.874) 10.783 15.608 ( -0.489 6.960 6.255) 9.370 16.090 ( -1.443 -7.714 -2.381) 8.201 16.272 ( 5.101 0.414 -26.055) 26.553 16.484 ( -6.347 -4.959 0.728) 8.087 16.819 ( 19.361 -2.665 18.163) 26.681 17.410 ( -14.811 19.032 -1.375) 24.155 17.632 ( 2.377 3.968 -3.480) 5.788 17.962 ( 0.421 -5.112 3.671) 6.308 18.560 ( -6.393 -15.210 -14.338) 21.858 19.161 ( -3.372 -0.290 3.160) 4.631 19.750 ( 7.879 13.878 8.099) 17.896 20.593 ( -5.146 1.373 9.575) 10.957 20.692 ( 6.381 3.235 7.088) 10.071 20.994 ( 7.013 6.400 -1.513) 9.614 21.491 ( -1.333 -8.427 -14.822) 17.102 ======================= Grid point 384 (183/199) ======================= q-point: (-0.17 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.594 ( 0.101 10.109 -0.069) 10.109 3.284 ( 3.124 -1.145 3.672) 4.955 4.403 ( 10.274 6.074 17.295) 21.014 4.598 ( -3.107 6.848 -8.500) 11.349 4.742 ( 7.423 11.334 -5.457) 14.606 4.947 ( 8.232 7.911 -3.883) 12.060 6.171 ( 1.048 15.324 -2.416) 15.548 6.418 ( -1.227 10.069 3.069) 10.597 6.713 ( 0.872 -1.904 5.889) 6.250 6.947 ( -11.830 -11.148 -4.105) 16.765 7.070 ( -5.907 -1.413 -6.332) 8.774 7.127 ( 19.408 0.865 -6.338) 20.435 7.310 ( 2.315 -1.572 2.402) 3.688 7.400 ( -0.740 -4.911 3.261) 5.942 7.791 ( -3.717 -0.059 1.943) 4.194 7.858 ( -3.691 -8.178 -2.059) 9.205 8.060 ( 5.258 -3.503 0.867) 6.377 8.241 ( 6.103 -6.948 -5.130) 10.576 8.376 ( 1.237 1.093 2.264) 2.802 8.671 ( 4.752 -1.993 -3.653) 6.317 8.845 ( -7.791 5.318 2.260) 9.700 8.878 ( 4.374 5.253 1.033) 6.913 9.075 ( -5.229 -2.348 -2.507) 6.257 9.120 ( 1.808 4.011 -2.705) 5.165 9.177 ( -7.730 2.799 3.799) 9.056 9.247 ( 8.556 -1.536 -3.373) 9.324 9.409 ( -1.645 -8.706 0.087) 8.860 9.727 ( -0.402 -5.569 0.038) 5.584 9.847 ( -2.638 3.839 3.166) 5.632 10.038 ( 9.333 -2.696 -0.507) 9.728 10.064 ( -5.723 6.400 1.668) 8.746 10.149 ( 0.770 7.072 -2.534) 7.551 10.322 ( 1.510 3.342 -8.284) 9.060 10.478 ( -4.051 7.794 4.941) 10.078 10.754 ( -3.315 1.852 8.339) 9.163 11.154 ( -2.047 -6.018 -0.373) 6.367 11.261 ( -0.520 -11.465 3.909) 12.124 11.334 ( -9.215 -9.401 0.538) 13.175 11.563 ( 0.332 0.721 0.012) 0.794 11.605 ( -1.039 -2.025 3.741) 4.379 11.654 ( -2.255 -15.833 -2.755) 16.228 11.809 ( 0.309 -1.084 0.202) 1.145 11.985 ( -0.417 -6.560 -2.369) 6.987 12.302 ( -4.368 -3.038 6.371) 8.300 12.391 ( -0.496 -2.751 -2.006) 3.441 12.635 ( -5.477 -5.162 -3.705) 8.389 12.851 ( -2.644 0.010 -0.085) 2.646 12.925 ( 2.954 -2.214 2.283) 4.341 13.046 ( -2.588 6.374 -1.228) 6.988 13.237 ( -5.687 2.610 0.571) 6.283 13.374 ( -2.510 2.919 -0.187) 3.854 13.557 ( 3.104 -5.540 1.823) 6.607 13.932 ( -4.132 0.539 4.111) 5.854 14.092 ( -2.963 2.763 -5.073) 6.492 14.376 ( 5.813 -5.677 -1.279) 8.225 14.570 ( 1.718 -3.190 0.685) 3.687 15.172 ( 4.256 6.057 7.881) 10.813 15.619 ( 6.233 3.263 3.819) 8.005 16.075 ( -5.292 -4.909 -3.263) 7.922 16.337 ( 4.431 -1.118 -16.469) 17.091 16.449 ( -1.957 -9.352 -9.291) 13.327 16.939 ( -10.592 7.827 -4.991) 14.084 17.169 ( 2.896 7.963 18.752) 20.578 17.794 ( 21.926 0.155 -1.813) 22.001 18.075 ( 4.874 -5.509 6.363) 9.726 18.560 ( -5.812 -15.663 -10.920) 19.959 19.060 ( -8.737 1.199 3.806) 9.605 19.673 ( -0.784 18.392 4.988) 19.072 20.490 ( -7.294 2.946 8.157) 11.332 20.750 ( 3.626 7.489 2.051) 8.569 21.069 ( 4.144 -1.121 2.689) 5.065 21.476 ( -1.897 -5.171 -13.941) 14.990 ======================= Grid point 385 (184/199) ======================= q-point: (-0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.577 ( 2.492 -0.662 11.265) 11.556 3.297 ( -3.537 0.257 -4.829) 5.991 4.316 ( -6.016 6.625 -7.181) 11.474 4.690 ( 10.903 3.259 6.584) 13.147 4.802 ( 8.473 2.862 0.683) 8.970 4.992 ( 6.240 5.518 -3.885) 9.192 6.031 ( 1.389 14.818 -1.263) 14.936 6.385 ( 3.573 5.124 0.707) 6.287 6.676 ( -7.812 -1.731 6.236) 10.145 6.897 ( -7.864 -14.783 -0.120) 16.745 6.954 ( -5.573 0.248 -4.475) 7.151 7.199 ( 2.792 10.403 -7.436) 13.088 7.419 ( -2.325 -11.861 6.385) 13.670 7.529 ( 7.041 4.176 -0.611) 8.210 7.739 ( 0.035 -6.475 2.204) 6.840 7.851 ( -0.139 -1.285 -1.553) 2.020 8.253 ( 7.218 -7.678 0.047) 10.539 8.282 ( 2.083 13.414 -3.814) 14.100 8.439 ( 2.850 -11.497 -5.532) 13.073 8.587 ( -7.464 3.943 -1.853) 8.642 8.713 ( -0.684 2.151 2.556) 3.410 8.896 ( -0.572 5.214 -0.221) 5.250 9.093 ( -1.136 0.077 -0.420) 1.214 9.138 ( 5.574 -5.004 -2.693) 7.960 9.180 ( 10.538 3.518 0.019) 11.110 9.339 ( -3.275 -8.349 -0.210) 8.971 9.477 ( 3.868 -3.720 2.275) 5.829 9.693 ( -6.307 4.030 2.225) 7.808 9.730 ( -4.362 3.037 1.248) 5.460 9.911 ( -6.842 4.314 3.707) 8.897 10.041 ( -2.739 9.277 -1.827) 9.844 10.123 ( -4.667 -2.327 -4.535) 6.911 10.253 ( -3.292 5.726 -3.742) 7.591 10.341 ( -1.536 0.339 0.995) 1.861 10.803 ( 3.897 -1.919 7.863) 8.983 11.172 ( 0.549 -0.063 -1.280) 1.395 11.260 ( -6.847 -5.294 -2.340) 8.965 11.414 ( 5.532 -5.049 5.574) 9.336 11.559 ( 1.708 4.089 0.631) 4.476 11.770 ( 8.577 -13.820 3.504) 16.638 11.803 ( 2.001 -8.979 1.904) 9.394 11.850 ( 0.752 -7.219 2.167) 7.575 12.021 ( -0.917 -5.160 -2.814) 5.949 12.268 ( -4.439 -3.368 2.166) 5.978 12.386 ( -3.751 -4.779 -3.795) 7.163 12.561 ( -5.939 -0.725 1.537) 6.177 12.785 ( -1.369 6.548 0.129) 6.691 12.905 ( -4.438 7.812 -1.561) 9.120 13.024 ( 2.017 -4.519 1.373) 5.136 13.106 ( -3.341 5.163 -2.988) 6.837 13.289 ( -1.841 4.194 0.808) 4.651 13.644 ( 0.820 -3.691 2.644) 4.614 13.927 ( -0.319 -3.411 0.876) 3.536 14.048 ( 0.921 1.321 -0.599) 1.719 14.482 ( 3.365 -0.965 -1.616) 3.855 14.629 ( 1.580 -2.656 -0.539) 3.138 15.217 ( 4.219 2.871 3.575) 6.231 15.767 ( 13.125 2.568 2.418) 13.590 16.025 ( -3.929 -2.674 -1.883) 5.112 16.260 ( -9.725 -2.554 1.168) 10.122 16.453 ( -4.392 5.946 -6.627) 9.928 16.755 ( -1.196 -2.303 -13.262) 13.513 17.159 ( -0.587 1.358 3.439) 3.744 18.182 ( 6.889 -4.479 5.517) 9.897 18.278 ( 23.931 0.434 0.743) 23.947 18.666 ( 3.111 -18.422 -2.655) 18.870 18.894 ( -11.190 0.303 5.152) 12.323 19.420 ( -8.398 20.063 3.470) 22.024 20.368 ( -6.652 1.669 7.063) 9.845 20.664 ( -2.487 9.193 -5.447) 10.971 21.154 ( -1.021 -7.952 5.767) 9.876 21.470 ( 3.358 1.644 -10.936) 11.557 ======================= Grid point 393 (185/199) ======================= q-point: ( 0.58 -0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.851 ( 6.543 -0.000 2.142) 6.885 3.155 ( 4.871 -0.000 4.909) 6.916 4.534 ( 0.559 -0.000 -2.920) 2.973 4.661 ( 2.716 -0.000 8.442) 8.868 4.908 ( 3.235 -0.000 -0.484) 3.271 4.949 ( 3.447 -0.000 -8.512) 9.184 6.395 ( -0.931 0.000 1.240) 1.551 6.469 ( 10.378 -0.000 6.252) 12.116 6.592 ( 6.677 -0.000 -5.473) 8.633 6.798 ( 4.093 -0.000 -1.034) 4.221 7.037 ( -3.414 0.000 -7.628) 8.357 7.191 ( 5.403 -0.000 8.071) 9.713 7.346 ( 4.121 -0.000 2.386) 4.761 7.366 ( -1.912 0.000 -1.394) 2.366 7.658 ( -5.773 0.000 4.705) 7.448 7.697 ( -10.722 0.000 -6.002) 12.287 7.874 ( 15.843 -0.000 -8.950) 18.197 8.103 ( 7.018 -0.000 -1.782) 7.240 8.278 ( 3.518 -0.000 9.124) 9.779 8.279 ( -13.087 0.000 -3.458) 13.536 8.653 ( 7.552 -0.000 3.045) 8.143 8.864 ( -6.301 0.000 4.726) 7.877 8.899 ( 6.405 -0.000 -7.343) 9.744 9.124 ( 0.634 -0.000 -8.398) 8.422 9.228 ( 0.608 -0.000 1.137) 1.289 9.233 ( 3.400 -0.000 -8.635) 9.280 9.475 ( 1.617 -0.000 9.699) 9.833 9.598 ( -8.978 0.000 2.292) 9.266 9.761 ( 5.535 -0.000 1.836) 5.832 9.989 ( 0.381 -0.000 5.754) 5.767 10.254 ( 9.525 -0.000 6.533) 11.550 10.254 ( 4.549 -0.000 5.685) 7.281 10.526 ( -5.197 0.000 -4.505) 6.878 10.541 ( 15.310 -0.000 -11.338) 19.051 11.164 ( -11.814 0.000 1.654) 11.929 11.264 ( -25.539 0.000 -1.131) 25.565 11.330 ( -0.974 0.000 1.083) 1.457 11.365 ( -7.710 0.000 0.440) 7.723 11.462 ( -13.720 0.000 1.558) 13.808 11.500 ( 1.947 -0.000 -2.369) 3.067 11.817 ( -2.530 0.000 -5.405) 5.968 11.858 ( -1.675 0.000 5.327) 5.584 11.916 ( -0.836 0.000 -1.088) 1.372 12.128 ( -0.872 0.000 7.184) 7.237 12.513 ( -0.634 0.000 -6.435) 6.466 12.513 ( -5.554 0.000 -2.765) 6.204 12.856 ( -6.418 0.000 -2.690) 6.959 13.027 ( -2.218 0.000 4.464) 4.985 13.153 ( 8.429 -0.000 6.539) 10.668 13.194 ( 5.187 -0.000 -0.975) 5.278 13.247 ( -0.133 0.000 -1.933) 1.938 13.318 ( -1.638 0.000 -1.295) 2.089 13.916 ( 11.947 -0.000 5.902) 13.325 13.969 ( 10.266 -0.000 -1.154) 10.331 14.422 ( -14.772 0.000 1.217) 14.822 14.707 ( -8.756 0.000 -12.679) 15.408 15.300 ( -8.865 0.000 5.321) 10.339 15.814 ( -1.920 0.000 4.163) 4.584 15.972 ( -3.867 0.000 6.467) 7.535 16.270 ( -2.383 0.000 -5.101) 5.630 16.376 ( 19.793 -0.000 12.692) 23.513 16.559 ( -2.539 0.000 -10.680) 10.977 17.810 ( -1.221 0.000 7.827) 7.922 17.834 ( -7.918 0.000 -10.795) 13.387 18.194 ( -10.066 0.000 -4.794) 11.150 18.271 ( -15.623 0.000 -14.125) 21.062 19.101 ( 7.972 -0.000 5.164) 9.499 19.729 ( 15.372 -0.000 13.058) 20.170 20.620 ( 2.348 -0.000 10.966) 11.215 20.621 ( -2.030 0.000 8.503) 8.742 21.202 ( 3.914 -0.000 -11.134) 11.802 21.204 ( 7.023 -0.000 -10.598) 12.714 ======================= Grid point 395 (186/199) ======================= q-point: (-0.33 0.58 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.921 ( 4.318 6.594 -4.796) 9.227 3.224 ( 1.689 0.605 6.858) 7.089 4.446 ( -3.009 7.724 6.358) 10.447 4.697 ( -5.023 -5.343 5.227) 9.006 4.967 ( 2.693 3.233 -10.435) 11.251 4.996 ( 9.417 4.261 -1.579) 10.457 6.362 ( 1.017 5.807 2.709) 6.488 6.628 ( 6.499 1.230 1.034) 6.695 6.709 ( 8.477 -3.988 0.378) 9.376 6.823 ( -4.308 -2.508 -1.290) 5.149 6.982 ( -3.514 -1.750 -5.556) 6.803 7.151 ( -9.908 9.693 -2.436) 14.074 7.285 ( 5.346 0.060 4.706) 7.123 7.388 ( -5.707 -7.911 -2.003) 9.958 7.546 ( -7.247 -0.808 2.960) 7.870 7.747 ( 10.935 -6.045 -0.835) 12.523 7.929 ( -6.813 -2.822 -5.141) 8.990 8.132 ( 3.714 7.654 -4.995) 9.866 8.389 ( 9.038 1.428 11.171) 14.440 8.421 ( 14.388 -7.877 -3.446) 16.761 8.828 ( 1.586 -4.416 2.126) 5.152 8.857 ( 12.060 1.287 3.182) 12.539 8.974 ( 4.294 -2.232 -6.304) 7.948 9.141 ( 1.818 3.534 -5.025) 6.407 9.185 ( 3.621 2.211 -7.543) 8.654 9.289 ( -3.195 -4.269 -3.286) 6.263 9.451 ( -2.379 1.937 4.091) 5.113 9.555 ( -1.688 -5.183 7.377) 9.172 9.885 ( 9.682 1.350 4.429) 10.732 9.928 ( -8.297 3.428 5.791) 10.683 10.320 ( -0.411 7.013 -4.535) 8.361 10.363 ( -1.247 3.913 -1.098) 4.251 10.414 ( 7.943 -0.361 -0.501) 7.967 10.688 ( 5.042 11.182 -6.344) 13.809 10.861 ( -16.090 -4.339 1.367) 16.721 10.932 ( -20.773 -11.517 -0.509) 23.757 11.165 ( -10.875 -1.317 5.784) 12.388 11.344 ( -1.968 -2.765 1.758) 3.822 11.390 ( -0.309 1.404 1.028) 1.767 11.590 ( 5.589 -1.622 0.819) 5.877 11.752 ( -7.878 -0.639 -1.664) 8.077 11.781 ( -4.070 1.154 -3.303) 5.367 11.894 ( -1.195 -1.625 1.683) 2.627 12.193 ( 2.271 -2.845 9.421) 10.100 12.401 ( -4.443 0.544 -4.369) 6.255 12.516 ( -0.832 -4.817 -5.849) 7.623 12.777 ( -2.846 -1.501 -1.601) 3.594 12.989 ( -3.206 0.937 4.499) 5.603 13.216 ( 0.155 4.356 -1.535) 4.621 13.266 ( 2.493 -1.138 -0.854) 2.871 13.312 ( 1.716 -4.152 0.455) 4.516 13.331 ( 5.237 -3.913 4.030) 7.680 14.081 ( 10.093 5.582 4.083) 12.235 14.161 ( -1.254 -1.571 -3.155) 3.742 14.206 ( -3.273 -3.133 3.789) 5.906 14.503 ( -8.817 -1.025 -9.664) 13.122 15.239 ( 0.201 2.278 7.975) 8.296 15.752 ( -2.696 7.190 8.195) 11.230 15.954 ( -4.223 -6.376 6.333) 9.930 16.236 ( 0.805 -2.386 -15.741) 15.941 16.433 ( -4.374 -0.864 -15.826) 16.442 16.788 ( 17.732 -0.753 19.206) 26.151 17.657 ( -3.025 3.522 -19.335) 19.884 17.800 ( -7.659 13.101 6.977) 16.703 17.882 ( -2.384 1.820 1.903) 3.552 18.208 ( -9.977 -20.284 -8.878) 24.285 19.191 ( 0.955 1.789 6.030) 6.362 19.919 ( 5.401 3.748 12.252) 13.904 20.614 ( -1.495 1.889 5.894) 6.368 20.747 ( 9.464 1.502 7.071) 11.909 21.141 ( 2.753 7.803 -7.354) 11.070 21.315 ( -0.401 -9.149 -11.719) 14.873 ======================= Grid point 396 (187/199) ======================= q-point: (-0.25 0.58 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.811 ( -4.357 11.269 -5.979) 13.481 3.246 ( -2.148 -2.199 6.324) 7.032 4.436 ( 1.768 -4.476 8.296) 9.590 4.616 ( -10.478 -1.446 3.983) 11.302 4.907 ( 0.445 6.496 -10.339) 12.218 5.086 ( 7.556 6.489 -2.245) 10.209 6.369 ( 5.940 5.859 1.801) 8.536 6.645 ( -7.075 13.617 -2.134) 15.493 6.669 ( -4.176 -5.684 0.454) 7.068 6.827 ( -6.316 1.159 -1.222) 6.537 6.940 ( 2.110 -9.588 -0.739) 9.845 7.071 ( 0.182 -4.510 -1.374) 4.719 7.324 ( 0.677 1.534 0.557) 1.767 7.396 ( 3.326 0.805 -1.271) 3.650 7.531 ( -1.926 -11.770 4.111) 12.616 7.880 ( -2.215 -2.302 1.924) 3.729 7.960 ( 7.647 -5.681 -6.285) 11.413 8.124 ( 2.686 0.061 -5.479) 6.102 8.498 ( 6.065 7.101 8.398) 12.559 8.654 ( 11.220 -0.657 -4.569) 12.133 8.850 ( -3.922 -0.547 3.663) 5.395 8.971 ( -2.141 -2.626 -3.748) 5.052 9.050 ( -1.357 0.950 1.325) 2.121 9.128 ( 6.700 -1.722 -3.586) 7.792 9.234 ( -0.427 2.106 -1.949) 2.901 9.295 ( 5.111 2.808 -5.082) 7.735 9.348 ( -6.592 6.502 7.365) 11.831 9.592 ( 1.397 -6.861 -2.636) 7.481 9.812 ( -3.193 -3.397 0.032) 4.662 10.066 ( 8.560 2.064 5.265) 10.259 10.164 ( -8.486 2.133 -1.958) 8.966 10.344 ( 3.139 10.443 -0.156) 10.905 10.423 ( -2.573 5.513 -9.758) 11.499 10.592 ( 0.902 3.077 2.980) 4.377 10.832 ( -6.041 -12.295 1.994) 13.844 10.846 ( 2.261 -5.716 1.115) 6.247 11.036 ( -8.982 -3.291 9.798) 13.693 11.313 ( -0.914 3.544 0.505) 3.695 11.419 ( 1.664 -3.601 0.547) 4.005 11.565 ( -8.213 -2.116 -2.403) 8.815 11.672 ( 2.957 2.837 4.885) 6.376 11.804 ( 1.831 -6.363 -4.870) 8.220 11.879 ( -1.495 0.834 2.484) 3.017 12.256 ( -1.821 -1.721 5.664) 6.194 12.348 ( -1.403 -3.055 -3.472) 4.833 12.533 ( -0.708 -3.771 -4.448) 5.874 12.775 ( -0.586 -3.823 -1.192) 4.047 12.949 ( -0.689 1.766 4.260) 4.663 13.156 ( -0.852 4.825 -1.592) 5.152 13.298 ( 1.358 2.874 0.928) 3.311 13.384 ( 3.098 -2.827 -0.608) 4.238 13.460 ( 3.680 -3.337 2.641) 5.626 13.963 ( -9.297 2.159 4.350) 10.489 14.175 ( -3.481 4.170 -6.222) 8.260 14.267 ( 9.243 -2.817 -0.729) 9.690 14.512 ( 4.210 -3.866 3.250) 6.575 15.286 ( 5.298 5.060 7.821) 10.716 15.691 ( 1.338 4.500 5.893) 7.534 15.962 ( -4.872 -6.494 5.250) 9.668 16.264 ( 3.715 -7.288 -21.837) 23.318 16.329 ( -3.420 -1.404 -14.714) 15.172 16.959 ( -4.956 -1.867 0.127) 5.297 17.449 ( -6.310 18.157 11.408) 22.352 17.801 ( 20.976 0.517 -2.393) 21.118 17.972 ( 5.185 -4.433 4.922) 8.412 18.215 ( -8.882 -19.731 -8.534) 23.260 19.129 ( -6.491 4.520 6.153) 10.021 19.923 ( -3.185 6.455 9.944) 12.275 20.550 ( -4.366 5.048 5.722) 8.792 20.862 ( 5.087 5.043 1.502) 7.319 21.123 ( 1.963 4.276 -4.938) 6.821 21.328 ( -1.421 -9.400 -10.213) 13.953 ======================= Grid point 397 (188/199) ======================= q-point: (-0.17 -0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.614 ( -6.582 4.778 3.297) 8.776 3.229 ( -6.651 -6.101 1.467) 9.143 4.394 ( -15.501 -2.407 -2.542) 15.891 4.614 ( 5.208 -8.610 6.081) 11.757 4.833 ( -1.018 2.740 -3.759) 4.761 5.105 ( 3.796 6.629 -4.772) 9.007 6.347 ( -11.770 13.954 -0.125) 18.256 6.447 ( 8.638 5.003 -1.702) 10.127 6.629 ( -9.290 -10.870 -0.722) 14.317 6.716 ( -2.851 5.206 2.495) 6.439 6.956 ( -4.304 -2.994 -3.140) 6.112 7.154 ( -2.022 -12.532 3.995) 13.308 7.320 ( 0.247 1.964 -0.248) 1.995 7.569 ( 15.564 0.415 -0.360) 15.574 7.605 ( -1.911 -8.192 1.547) 8.553 7.889 ( 2.779 1.449 1.057) 3.308 8.053 ( -0.276 -5.353 -4.814) 7.204 8.206 ( 1.739 -9.781 -7.890) 12.686 8.528 ( 5.865 8.230 0.965) 10.152 8.709 ( -4.129 2.167 0.414) 4.681 8.792 ( -6.521 10.926 2.926) 13.056 8.883 ( 2.633 -4.831 -2.089) 5.885 9.027 ( -2.936 -1.065 -1.238) 3.360 9.132 ( -2.009 -1.641 7.568) 8.000 9.211 ( -4.781 -0.364 -2.043) 5.212 9.275 ( 10.882 1.114 -2.915) 11.320 9.459 ( 10.629 2.660 0.438) 10.965 9.657 ( -1.668 -2.904 0.972) 3.486 9.769 ( -5.583 -3.115 -5.924) 8.716 10.033 ( -5.245 4.087 2.931) 7.267 10.104 ( -1.935 -0.776 -1.219) 2.415 10.251 ( -0.683 10.181 -2.420) 10.487 10.338 ( -1.314 0.491 -6.066) 6.226 10.414 ( -13.613 10.479 4.259) 17.700 10.859 ( 4.700 7.194 6.351) 10.685 11.006 ( 2.064 -13.600 0.704) 13.773 11.182 ( 9.154 -9.138 4.181) 13.594 11.287 ( 3.305 -1.350 1.093) 3.734 11.536 ( 4.825 -7.827 -0.210) 9.197 11.556 ( 3.842 -5.976 1.013) 7.177 11.687 ( 2.950 4.388 3.335) 6.251 11.866 ( -0.765 -0.701 5.604) 5.699 11.896 ( 2.787 -5.587 -3.621) 7.218 12.217 ( -2.726 -1.295 -3.493) 4.616 12.345 ( -3.841 -2.605 2.216) 5.143 12.534 ( 0.206 0.105 -2.314) 2.326 12.789 ( -1.759 -3.526 -3.020) 4.965 12.978 ( 2.755 -0.397 4.007) 4.879 13.093 ( 0.030 7.211 0.327) 7.219 13.244 ( 0.350 10.204 -0.820) 10.243 13.419 ( 2.332 6.385 -0.469) 6.814 13.552 ( 1.767 -5.513 2.545) 6.324 13.870 ( -2.254 -1.575 2.804) 3.928 14.090 ( -0.793 2.974 -1.471) 3.412 14.439 ( 7.594 -2.861 -0.939) 8.170 14.605 ( 3.179 -0.336 1.718) 3.629 15.310 ( 1.432 6.588 6.986) 9.708 15.785 ( 9.452 -1.058 0.877) 9.552 15.961 ( -1.351 -3.947 3.389) 5.375 16.204 ( -8.647 -3.052 -7.131) 11.616 16.395 ( 8.142 -7.959 -25.964) 28.351 16.776 ( -11.468 1.009 -9.093) 14.671 17.254 ( -6.858 9.744 16.142) 20.064 18.093 ( 2.257 -4.937 5.087) 7.440 18.241 ( 11.988 -9.804 -2.818) 15.741 18.339 ( 19.750 -9.196 3.115) 22.008 18.951 ( -10.554 4.824 4.043) 12.288 19.742 ( -10.883 11.711 5.978) 17.068 20.418 ( -7.516 4.711 6.536) 11.019 20.830 ( -3.148 7.246 -1.825) 8.109 21.038 ( -5.787 -3.692 -5.357) 8.708 21.442 ( 7.850 -4.077 -6.253) 10.832 ======================= Grid point 398 (189/199) ======================= q-point: (-0.08 -0.42 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.592 ( -0.493 -7.665 15.487) 17.287 3.123 ( -11.839 -4.749 -7.269) 14.682 4.164 ( -13.824 -3.153 -0.174) 14.180 4.752 ( -4.726 -14.240 1.246) 15.055 4.796 ( -2.515 -0.931 -0.526) 2.733 5.065 ( -0.478 3.528 -8.383) 9.108 6.000 ( -17.425 5.785 1.242) 18.403 6.492 ( 0.901 5.726 -5.009) 7.662 6.610 ( -6.763 -15.022 2.563) 16.672 6.684 ( 5.643 3.352 2.042) 6.874 6.920 ( 1.177 1.767 -2.106) 2.990 7.257 ( -1.156 -8.279 2.906) 8.850 7.298 ( 1.475 1.690 2.190) 3.135 7.635 ( 3.673 -3.373 2.647) 5.646 7.844 ( 13.782 6.533 -6.730) 16.671 7.907 ( 1.273 2.429 -1.203) 2.994 8.029 ( -9.977 -14.240 -3.975) 17.836 8.290 ( 2.295 -7.797 -4.611) 9.345 8.500 ( -3.988 6.064 -2.237) 7.595 8.637 ( 3.867 3.138 1.859) 5.316 8.692 ( -8.611 0.802 5.167) 10.074 8.769 ( -8.617 2.410 1.253) 9.035 9.105 ( -0.481 -0.752 2.034) 2.221 9.142 ( -5.043 -1.155 0.170) 5.176 9.178 ( 7.062 -9.249 2.134) 11.831 9.478 ( 9.481 1.541 -1.260) 9.688 9.538 ( 3.555 5.651 -2.300) 7.061 9.650 ( -1.699 -1.343 0.787) 2.304 9.711 ( 4.553 2.025 -0.803) 5.048 9.888 ( -4.343 6.060 2.221) 7.779 9.998 ( -7.640 2.371 -0.914) 8.052 10.099 ( -3.499 12.261 -0.223) 12.752 10.270 ( 3.319 -0.614 -4.079) 5.294 10.332 ( 1.046 -0.636 -1.791) 2.169 10.896 ( 4.452 4.296 5.126) 8.034 11.132 ( 1.665 -5.801 -1.916) 6.332 11.228 ( 2.935 3.350 -1.967) 4.868 11.491 ( 5.057 -2.905 4.235) 7.208 11.589 ( -0.504 1.586 0.281) 1.687 11.759 ( 3.837 -8.999 1.341) 9.875 11.847 ( 9.145 -7.521 2.833) 12.175 11.931 ( 7.085 -0.630 7.929) 10.652 11.977 ( 5.470 -6.797 -3.221) 9.300 12.226 ( 3.708 -3.157 -7.893) 9.274 12.282 ( -4.980 1.600 6.443) 8.298 12.531 ( 1.571 2.526 0.548) 3.025 12.777 ( -0.440 -1.509 -5.987) 6.190 12.977 ( -2.236 12.310 5.250) 13.568 13.029 ( 1.611 4.374 0.588) 4.698 13.168 ( 2.258 7.031 -1.664) 7.569 13.365 ( 2.722 10.527 -0.845) 10.906 13.629 ( 0.904 -3.709 3.319) 5.059 13.905 ( 1.393 -3.244 1.256) 3.747 14.065 ( -0.603 1.060 0.603) 1.360 14.539 ( 3.680 1.938 -1.756) 4.515 14.650 ( 2.595 -0.271 -0.780) 2.723 15.276 ( -1.429 2.316 2.240) 3.525 15.880 ( -2.751 -4.446 3.355) 6.212 16.043 ( -10.804 -3.948 -5.616) 12.800 16.119 ( 16.955 3.024 -1.634) 17.300 16.434 ( -1.532 4.202 -10.132) 11.076 16.627 ( -4.240 -4.209 -5.102) 7.857 17.135 ( -4.209 -0.155 4.185) 5.937 18.150 ( -1.897 -7.166 3.594) 8.238 18.472 ( 0.332 -12.940 1.976) 13.094 18.716 ( -3.645 -1.534 7.682) 8.640 18.901 ( 28.208 2.765 -4.366) 28.678 19.396 ( -16.196 15.196 2.811) 22.386 20.282 ( -7.036 0.661 8.349) 10.939 20.630 ( -7.899 6.444 -7.671) 12.758 21.030 ( -4.877 -10.247 4.648) 12.264 21.569 ( 8.480 2.505 -8.845) 12.506 ======================= Grid point 407 (190/199) ======================= q-point: (-0.33 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.940 ( -4.650 0.000 -8.369) 9.574 3.221 ( -4.901 0.000 7.046) 8.583 4.343 ( -11.641 0.000 0.476) 11.651 4.613 ( -4.262 0.000 11.142) 11.929 4.973 ( -1.163 0.000 -9.645) 9.715 5.154 ( 7.172 -0.000 -2.142) 7.485 6.428 ( 2.327 -0.000 -0.028) 2.327 6.618 ( -5.038 0.000 -0.525) 5.066 6.779 ( 0.696 -0.000 9.108) 9.135 6.800 ( 0.895 -0.000 -2.247) 2.419 6.952 ( 0.375 -0.000 -4.192) 4.209 6.969 ( -11.555 0.000 -3.611) 12.106 7.276 ( -3.039 0.000 -4.408) 5.354 7.424 ( 7.053 -0.000 5.678) 9.054 7.446 ( -0.522 0.000 1.010) 1.137 7.836 ( -1.770 0.000 2.613) 3.156 7.894 ( 10.444 -0.000 -4.889) 11.531 8.157 ( 0.047 -0.000 -7.694) 7.694 8.575 ( 7.019 -0.000 11.980) 13.884 8.641 ( 9.420 -0.000 -5.198) 10.759 8.838 ( 1.273 -0.000 5.716) 5.856 8.923 ( -5.080 0.000 -4.975) 7.111 9.041 ( 4.887 -0.000 3.995) 6.312 9.127 ( -0.689 0.000 -8.296) 8.325 9.288 ( 4.056 -0.000 -1.937) 4.495 9.292 ( 11.589 -0.000 -8.815) 14.560 9.471 ( 3.007 -0.000 -1.676) 3.443 9.507 ( -6.893 0.000 9.626) 11.840 9.786 ( -8.899 0.000 0.926) 8.947 10.074 ( 4.400 -0.000 4.583) 6.353 10.178 ( -11.735 0.000 -2.164) 11.933 10.433 ( 1.428 -0.000 -8.339) 8.461 10.506 ( -3.466 0.000 2.764) 4.433 10.585 ( -4.014 0.000 -1.082) 4.158 10.622 ( 7.768 -0.000 1.691) 7.950 10.808 ( -6.342 0.000 -4.018) 7.508 11.108 ( -0.890 0.000 13.235) 13.265 11.349 ( 1.188 -0.000 2.619) 2.876 11.410 ( 1.265 -0.000 0.796) 1.495 11.556 ( -11.909 0.000 -3.134) 12.315 11.661 ( 1.809 -0.000 -6.540) 6.785 11.711 ( 0.789 -0.000 8.217) 8.255 11.916 ( 1.253 -0.000 0.442) 1.328 12.241 ( 0.958 -0.000 7.259) 7.322 12.294 ( -4.839 0.000 -7.625) 9.030 12.508 ( 3.520 -0.000 -3.050) 4.658 12.739 ( -0.978 0.000 -0.706) 1.206 12.968 ( -1.320 0.000 4.309) 4.507 13.226 ( -1.507 0.000 -3.011) 3.367 13.284 ( 4.046 -0.000 -1.708) 4.392 13.359 ( 4.949 -0.000 2.017) 5.344 13.433 ( 5.843 -0.000 4.848) 7.593 13.989 ( -9.676 0.000 4.138) 10.524 14.166 ( -3.318 0.000 -8.251) 8.893 14.327 ( 10.324 -0.000 -0.424) 10.333 14.438 ( 4.075 -0.000 5.241) 6.639 15.338 ( 7.240 -0.000 6.088) 9.460 15.774 ( -3.953 0.000 11.220) 11.896 15.859 ( -3.536 0.000 4.908) 6.049 16.187 ( 1.185 -0.000 -18.291) 18.329 16.315 ( -2.169 0.000 -20.306) 20.421 16.935 ( -4.871 0.000 1.954) 5.248 17.781 ( 18.940 -0.000 -5.450) 19.708 17.810 ( -8.923 0.000 0.912) 8.970 17.860 ( -4.347 0.000 1.752) 4.687 17.932 ( 3.992 -0.000 4.831) 6.267 19.181 ( -6.267 0.000 7.736) 9.956 19.965 ( -5.060 0.000 12.176) 13.185 20.628 ( -0.843 0.000 0.674) 1.079 20.931 ( 5.464 -0.000 1.737) 5.734 21.171 ( 2.821 -0.000 -4.561) 5.363 21.199 ( -4.222 0.000 -10.059) 10.909 ======================= Grid point 408 (191/199) ======================= q-point: (-0.25 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.730 ( -12.726 5.362 -5.204) 14.757 3.117 ( -11.309 -4.196 4.552) 12.893 4.181 ( -15.053 -10.966 2.436) 18.783 4.570 ( -4.112 0.502 6.265) 7.511 4.884 ( -4.440 1.793 -6.671) 8.212 5.207 ( 2.181 3.163 -4.883) 6.213 6.385 ( -9.719 -2.275 -3.362) 10.532 6.553 ( -3.872 2.773 3.644) 5.996 6.703 ( -1.461 8.563 -1.981) 8.910 6.783 ( -6.561 -0.510 5.986) 8.896 6.830 ( -0.233 -0.322 -3.106) 3.131 7.017 ( 2.345 -5.312 -1.910) 6.112 7.257 ( -1.552 -6.415 2.668) 7.119 7.516 ( 4.655 0.463 0.856) 4.756 7.561 ( 9.838 -1.682 -0.673) 10.004 7.829 ( -3.533 -2.954 4.509) 6.445 8.045 ( 7.980 -2.283 -7.830) 11.411 8.132 ( 1.225 2.810 -8.567) 9.099 8.649 ( 1.378 3.952 3.286) 5.321 8.707 ( -0.290 -1.640 -0.832) 1.861 8.815 ( -2.334 -0.660 -1.181) 2.698 8.885 ( -0.977 -1.764 5.820) 6.160 9.043 ( -3.526 1.873 1.210) 4.172 9.113 ( -1.368 -2.114 -3.212) 4.081 9.275 ( -5.511 10.927 0.937) 12.274 9.354 ( 5.866 4.136 1.102) 7.262 9.491 ( 7.562 -4.568 -6.340) 10.874 9.569 ( 6.135 -3.317 -4.260) 8.172 9.726 ( -1.756 0.229 3.003) 3.486 10.007 ( -6.826 -2.210 1.852) 7.410 10.049 ( -6.523 -5.359 2.694) 8.862 10.355 ( -5.317 1.409 -11.081) 12.371 10.428 ( -4.226 7.559 1.891) 8.864 10.556 ( -18.000 0.531 4.198) 18.491 10.808 ( 18.321 -1.351 1.763) 18.455 10.925 ( 19.194 -8.218 0.898) 20.899 11.092 ( 1.520 6.883 7.683) 10.427 11.364 ( 0.997 4.310 1.001) 4.536 11.439 ( 2.718 -1.893 0.090) 3.313 11.490 ( 3.569 -1.234 0.702) 3.841 11.688 ( -0.945 -9.502 -6.014) 11.285 11.763 ( 1.871 2.060 7.696) 8.184 11.928 ( 2.067 2.122 2.958) 4.186 12.208 ( -1.713 0.107 -7.824) 8.010 12.260 ( -4.037 -4.339 2.741) 6.530 12.584 ( 7.122 3.034 -1.360) 7.860 12.728 ( -1.283 -1.965 -0.986) 2.545 12.978 ( 1.057 0.050 4.072) 4.207 13.190 ( 0.849 3.873 -1.240) 4.154 13.379 ( 4.982 -1.821 -0.596) 5.338 13.447 ( 5.672 1.706 2.634) 6.482 13.519 ( 3.923 1.650 2.034) 4.717 13.887 ( -2.909 2.739 4.271) 5.849 14.100 ( -2.405 -2.724 -3.978) 5.387 14.452 ( 9.281 4.750 0.327) 10.431 14.577 ( 5.379 -3.146 4.752) 7.837 15.441 ( 2.496 5.625 6.896) 9.243 15.739 ( -2.045 -2.572 8.415) 9.034 15.871 ( 2.572 -4.334 -6.424) 8.165 16.171 ( 0.642 -0.109 -11.447) 11.466 16.266 ( 3.282 -4.354 -22.149) 22.810 16.762 ( -12.137 -1.147 -9.255) 15.306 17.518 ( -8.525 16.769 10.212) 21.404 17.870 ( -8.410 -18.534 1.240) 20.391 18.064 ( 8.389 -2.313 4.589) 9.838 18.309 ( 34.448 0.180 5.360) 34.863 19.033 ( -11.727 2.737 5.946) 13.430 19.850 ( -12.111 1.242 9.734) 15.587 20.553 ( -4.909 6.990 1.285) 8.638 20.880 ( -6.318 -1.695 -2.812) 7.121 21.038 ( -10.135 2.666 -10.091) 14.548 21.349 ( 12.418 -4.118 -1.830) 13.210 ======================= Grid point 409 (192/199) ======================= q-point: (-0.17 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 362 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.499 ( -9.943 -1.708 5.151) 11.327 2.975 ( -13.840 -9.060 -1.337) 16.596 4.024 ( -18.883 -11.228 5.982) 22.769 4.499 ( -10.817 -8.705 -0.082) 13.885 4.778 ( -6.241 -0.549 -2.350) 6.692 5.140 ( -3.450 3.598 -10.190) 11.343 6.135 ( -17.942 6.564 -1.001) 19.131 6.401 ( -9.215 -4.643 1.625) 10.446 6.620 ( -7.739 4.396 -1.804) 9.082 6.706 ( -1.878 -0.919 1.426) 2.531 6.909 ( 8.542 -2.242 -0.724) 8.861 7.092 ( 2.037 -4.087 1.113) 4.700 7.329 ( 2.690 -1.881 5.486) 6.393 7.566 ( 0.619 -2.953 0.278) 3.030 7.737 ( -3.084 -12.461 -6.110) 14.216 7.817 ( 1.686 -2.772 4.541) 5.581 8.084 ( 4.330 8.127 -8.112) 12.272 8.154 ( 3.210 -4.997 -6.997) 9.178 8.591 ( -3.434 3.382 -1.428) 5.027 8.658 ( -5.653 -0.274 4.746) 7.386 8.806 ( -2.381 0.655 -1.767) 3.036 8.851 ( -2.249 12.087 -3.758) 12.856 9.018 ( 8.076 -4.536 4.220) 10.179 9.096 ( -4.052 0.298 10.562) 11.317 9.172 ( -0.789 1.719 -1.900) 2.681 9.439 ( 4.448 -1.156 -1.032) 4.710 9.595 ( 2.394 -4.655 -5.106) 7.313 9.699 ( 9.817 2.121 -4.797) 11.130 9.722 ( 3.476 4.999 3.891) 7.226 9.963 ( -5.830 -3.201 4.303) 7.922 9.992 ( -5.712 -0.145 0.052) 5.715 10.192 ( -7.768 -2.644 -2.725) 8.646 10.316 ( 1.902 0.376 -3.979) 4.426 10.355 ( -2.670 9.113 2.233) 9.755 11.059 ( 7.146 9.289 3.808) 12.323 11.063 ( 9.097 1.377 -0.965) 9.251 11.292 ( 4.980 0.703 0.579) 5.063 11.408 ( 10.666 -3.323 2.585) 11.467 11.536 ( 6.393 -6.071 0.946) 8.867 11.645 ( 6.096 -3.539 -0.314) 7.055 11.755 ( 4.053 -1.541 -0.945) 4.438 11.803 ( 2.647 -8.067 1.784) 8.676 11.971 ( 3.958 1.987 6.141) 7.571 12.190 ( 1.490 -0.523 -9.080) 9.216 12.250 ( -0.812 -4.134 5.807) 7.174 12.642 ( 5.441 7.174 -0.523) 9.020 12.736 ( 1.204 -1.658 -3.429) 3.995 13.006 ( -0.358 -0.668 3.812) 3.887 13.179 ( 2.885 4.644 0.577) 5.497 13.408 ( 3.879 12.448 0.664) 13.056 13.540 ( 4.497 -0.835 1.582) 4.840 13.560 ( 4.442 4.307 1.731) 6.425 13.866 ( 1.374 0.681 2.735) 3.136 14.095 ( -0.406 0.376 0.743) 0.926 14.567 ( 8.084 2.097 -0.371) 8.359 14.661 ( 2.604 0.814 0.510) 2.775 15.359 ( -5.136 6.036 4.754) 9.242 15.761 ( -5.477 -7.898 9.106) 13.240 15.941 ( -1.617 -5.652 -17.671) 18.623 16.179 ( 9.389 2.424 -11.943) 15.384 16.386 ( 9.958 -6.007 -16.208) 19.948 16.563 ( -9.004 -2.140 -3.274) 9.817 17.271 ( -8.905 12.989 13.632) 20.829 17.924 ( -6.064 -16.837 3.274) 18.193 18.266 ( 8.291 -5.809 5.712) 11.624 18.729 ( -9.185 1.709 13.587) 16.489 18.970 ( 30.382 2.936 -7.564) 31.447 19.592 ( -17.743 5.272 5.205) 19.227 20.367 ( -8.429 7.952 4.934) 12.595 20.762 ( -11.541 6.455 -7.212) 15.062 20.829 ( -8.399 -10.459 -0.145) 13.415 21.570 ( 11.579 -1.706 -6.329) 13.305 ======================= Grid point 410 (193/199) ======================= q-point: (-0.08 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.516 ( -1.407 -14.399 16.197) 21.718 2.817 ( -13.727 -7.685 -8.013) 17.655 3.822 ( -19.718 -9.763 10.999) 24.598 4.356 ( -23.016 -19.983 -1.102) 30.500 4.646 ( -12.961 -3.527 -1.540) 13.521 4.972 ( -8.695 0.940 -17.456) 19.525 5.732 ( -20.368 4.863 2.053) 21.041 6.370 ( -14.203 0.132 -5.242) 15.140 6.416 ( -4.380 -12.774 5.144) 14.451 6.726 ( -2.887 -8.878 -1.184) 9.410 7.071 ( 10.866 3.041 -2.925) 11.657 7.189 ( 0.866 -8.023 2.804) 8.543 7.383 ( 0.832 3.670 8.107) 8.938 7.571 ( -6.839 -6.502 -2.062) 9.659 7.655 ( -14.386 -10.715 -4.235) 18.431 7.869 ( -0.500 -5.036 -0.336) 5.072 8.119 ( 9.443 4.052 -6.296) 12.051 8.235 ( 1.601 -5.344 -4.736) 7.317 8.508 ( -2.242 0.032 0.323) 2.265 8.612 ( 1.872 7.279 2.039) 7.787 8.655 ( 2.411 7.070 -2.249) 7.801 8.837 ( 3.858 7.008 2.001) 8.246 9.012 ( -5.388 3.117 8.706) 10.702 9.174 ( 2.413 1.286 -1.701) 3.220 9.250 ( 8.915 -6.305 3.386) 11.432 9.457 ( -2.194 0.566 -1.439) 2.684 9.608 ( -2.850 3.651 -2.296) 5.169 9.740 ( 2.655 3.176 3.964) 5.731 9.797 ( 2.017 -3.536 -4.477) 6.051 9.892 ( 0.594 4.865 1.930) 5.267 10.012 ( 8.761 -2.840 -2.503) 9.544 10.176 ( 6.906 7.394 2.788) 10.495 10.328 ( 4.703 1.750 -0.103) 5.020 10.420 ( 10.738 1.997 -3.317) 11.415 11.069 ( 6.520 10.002 0.804) 11.966 11.176 ( 5.468 1.798 -1.328) 5.907 11.314 ( 2.490 3.259 -1.358) 4.320 11.504 ( -1.622 -0.924 -1.384) 2.324 11.574 ( -5.046 2.789 -0.451) 5.783 11.740 ( 3.234 -5.823 3.049) 7.325 11.865 ( 3.768 -6.169 -3.439) 8.005 12.078 ( 11.482 -4.756 3.512) 12.915 12.119 ( 12.688 -2.030 1.852) 12.982 12.228 ( 5.023 -5.648 6.497) 9.967 12.368 ( 9.837 0.147 0.453) 9.849 12.639 ( 3.588 6.586 -0.958) 7.561 12.769 ( 3.700 0.901 -5.415) 6.620 12.994 ( -1.963 1.104 4.340) 4.890 13.193 ( 4.971 7.732 0.842) 9.230 13.301 ( 1.578 17.111 0.871) 17.205 13.548 ( 4.999 11.785 -2.378) 13.021 13.636 ( 2.369 -1.668 5.278) 6.020 13.919 ( 2.622 -1.956 1.951) 3.808 14.059 ( -2.199 3.245 0.947) 4.032 14.599 ( -0.893 4.291 -3.165) 5.406 14.722 ( 6.889 1.224 -0.900) 7.055 15.228 ( -6.656 1.522 -0.276) 6.833 15.775 ( -5.413 -7.222 9.848) 13.358 15.822 ( -8.845 -2.079 -9.956) 13.479 16.246 ( -0.987 -5.128 -17.308) 18.079 16.426 ( 0.202 0.306 -0.828) 0.906 16.697 ( 18.115 0.904 -3.198) 18.418 17.058 ( -9.324 4.460 8.263) 13.233 18.012 ( -3.546 -15.204 5.054) 16.410 18.303 ( -15.627 1.470 4.887) 16.439 18.630 ( -0.152 -10.526 4.734) 11.543 19.224 ( -16.841 9.467 2.027) 19.426 19.450 ( 28.391 8.234 -10.894) 31.504 20.221 ( -3.918 1.332 9.888) 10.719 20.494 ( -10.916 2.846 -6.419) 12.979 20.840 ( -6.263 -13.282 9.776) 17.641 21.715 ( 9.341 2.418 -11.852) 15.283 ======================= Grid point 420 (194/199) ======================= q-point: (-0.25 -0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.499 ( -14.740 0.000 -2.821) 15.008 2.865 ( -15.629 0.000 1.420) 15.693 3.881 ( -16.840 0.000 9.911) 19.540 4.425 ( -15.699 0.000 0.374) 15.703 4.775 ( -7.543 0.000 -3.384) 8.267 5.178 ( -4.915 0.000 -10.482) 11.577 6.182 ( -10.844 0.000 -3.294) 11.333 6.470 ( -13.055 0.000 2.717) 13.335 6.501 ( -14.167 0.000 5.974) 15.375 6.780 ( -7.697 0.000 -2.853) 8.209 6.892 ( 9.844 -0.000 -0.944) 9.889 7.043 ( 3.295 -0.000 -1.571) 3.650 7.286 ( 6.100 -0.000 6.525) 8.932 7.549 ( -2.117 0.000 1.406) 2.542 7.601 ( -2.386 0.000 -8.409) 8.741 7.794 ( -0.034 0.000 4.663) 4.663 8.107 ( 4.493 -0.000 -7.680) 8.898 8.167 ( 3.577 -0.000 -6.650) 7.551 8.633 ( -5.459 0.000 -1.561) 5.678 8.644 ( -6.366 0.000 4.732) 7.932 8.802 ( 3.225 -0.000 -4.203) 5.298 8.969 ( 6.872 -0.000 12.002) 13.830 9.013 ( -2.261 0.000 1.407) 2.663 9.068 ( 2.489 -0.000 -8.209) 8.578 9.293 ( -2.227 0.000 2.836) 3.606 9.421 ( -0.419 0.000 -3.637) 3.662 9.446 ( 4.001 -0.000 -0.879) 4.097 9.714 ( 7.203 -0.000 -5.743) 9.212 9.830 ( 4.991 -0.000 9.685) 10.896 9.926 ( -4.292 0.000 -0.095) 4.293 9.931 ( 0.070 -0.000 4.254) 4.254 10.174 ( -11.812 0.000 -5.861) 13.186 10.330 ( -0.819 0.000 -3.910) 3.995 10.441 ( -1.771 0.000 3.109) 3.578 11.150 ( 14.660 -0.000 -0.450) 14.667 11.169 ( 12.622 -0.000 2.199) 12.813 11.189 ( 6.203 -0.000 6.399) 8.912 11.443 ( 7.853 -0.000 0.625) 7.877 11.473 ( 1.040 -0.000 0.978) 1.428 11.611 ( 2.457 -0.000 -9.091) 9.418 11.646 ( 14.304 -0.000 1.932) 14.434 11.781 ( -4.267 0.000 2.829) 5.120 11.997 ( 3.644 -0.000 7.215) 8.083 12.174 ( -4.395 0.000 3.904) 5.879 12.210 ( 6.420 -0.000 -9.139) 11.168 12.689 ( -0.357 0.000 -1.201) 1.253 12.758 ( 9.159 -0.000 -0.382) 9.167 12.994 ( -0.856 0.000 3.464) 3.568 13.235 ( 2.056 -0.000 -0.270) 2.074 13.438 ( 4.169 -0.000 2.708) 4.971 13.576 ( 6.610 -0.000 2.377) 7.024 13.623 ( 6.478 -0.000 0.583) 6.504 13.939 ( 3.411 -0.000 5.031) 6.079 14.042 ( -0.856 0.000 -0.473) 0.978 14.631 ( 8.685 -0.000 -1.361) 8.791 14.647 ( 3.458 -0.000 3.723) 5.081 15.456 ( -5.986 0.000 3.050) 6.718 15.638 ( -8.633 0.000 11.330) 14.244 15.877 ( 2.991 -0.000 -23.470) 23.660 16.197 ( 0.893 -0.000 -24.341) 24.357 16.325 ( 17.519 -0.000 -1.762) 17.607 16.540 ( -10.223 0.000 -4.009) 10.981 17.556 ( -6.735 0.000 7.127) 9.806 17.597 ( -8.708 0.000 8.772) 12.360 18.219 ( 9.405 -0.000 6.355) 11.351 18.750 ( -10.217 0.000 16.579) 19.475 18.998 ( 30.193 -0.000 -7.954) 31.224 19.633 ( -17.384 0.000 6.389) 18.521 20.502 ( -7.141 0.000 4.049) 8.209 20.678 ( -11.858 0.000 -2.798) 12.183 20.834 ( -13.263 0.000 -8.317) 15.655 21.544 ( 13.100 -0.000 -4.899) 13.986 ======================= Grid point 421 (195/199) ======================= q-point: (-0.17 -0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.313 ( -8.875 -5.744 3.645) 11.183 2.658 ( -12.502 -6.419 -3.457) 14.472 3.662 ( -18.802 -5.444 18.793) 27.135 4.072 ( -29.258 -7.942 -2.377) 30.410 4.603 ( -13.995 -0.960 -0.112) 14.028 4.985 ( -12.580 0.339 -18.156) 22.091 5.890 ( -22.740 8.626 -1.248) 24.353 6.254 ( -6.610 -2.278 2.420) 7.398 6.344 ( -16.969 -6.344 0.743) 18.131 6.544 ( -19.000 -5.273 -0.065) 19.718 7.070 ( 9.472 -1.881 -0.997) 9.708 7.083 ( 0.828 -3.390 -1.066) 3.649 7.366 ( -4.541 -2.297 3.443) 6.144 7.490 ( -5.896 -1.274 -0.452) 6.049 7.584 ( 5.329 0.531 -2.763) 6.026 7.747 ( -6.328 -4.930 0.543) 8.040 8.134 ( 0.706 -0.992 -11.163) 11.229 8.216 ( 3.067 1.158 -2.008) 3.844 8.533 ( -1.415 1.567 0.184) 2.119 8.629 ( 3.525 -0.177 9.436) 10.074 8.819 ( 3.327 3.839 -7.803) 9.311 8.972 ( 0.821 3.557 3.046) 4.754 9.147 ( 8.362 3.737 0.585) 9.178 9.178 ( 8.986 -1.718 5.916) 10.895 9.199 ( 0.536 10.181 0.706) 10.219 9.470 ( 2.034 -0.112 0.133) 2.041 9.552 ( 4.554 -9.356 -5.249) 11.655 9.704 ( -2.997 -2.866 -1.440) 4.390 9.805 ( -3.590 1.926 0.831) 4.157 9.877 ( -5.201 -2.737 -0.477) 5.896 10.065 ( 11.062 6.130 0.213) 12.649 10.170 ( 10.701 -4.561 2.119) 11.824 10.418 ( 11.745 3.562 -4.097) 12.940 10.476 ( 8.637 2.894 5.099) 10.439 11.235 ( 5.578 6.180 -2.400) 8.664 11.268 ( 7.390 5.965 3.390) 10.084 11.365 ( 3.988 0.421 -1.048) 4.145 11.473 ( 0.322 -0.328 0.541) 0.709 11.611 ( -0.209 -2.988 -2.832) 4.122 11.646 ( -3.290 -0.457 3.249) 4.646 11.734 ( 9.741 -5.606 -6.283) 12.876 11.951 ( 17.462 -4.476 -0.672) 18.039 12.122 ( 9.805 0.641 8.382) 12.916 12.159 ( 0.352 -2.219 5.850) 6.266 12.353 ( 11.494 -0.464 -3.399) 11.995 12.685 ( 0.719 -0.360 -2.364) 2.497 12.869 ( 6.973 6.335 -0.820) 9.457 12.981 ( -1.716 -1.936 2.415) 3.539 13.264 ( 3.047 2.027 0.739) 3.733 13.518 ( 3.025 0.359 3.187) 4.408 13.660 ( 5.171 5.151 3.327) 8.021 13.717 ( 6.629 4.192 0.285) 7.848 13.947 ( 2.619 7.173 3.463) 8.385 14.092 ( 1.003 -2.977 2.711) 4.149 14.664 ( -1.029 2.029 -1.828) 2.918 14.756 ( 8.667 2.374 -2.161) 9.243 15.304 ( -8.012 6.221 1.091) 10.202 15.574 ( -8.897 -11.386 9.209) 17.135 15.813 ( -3.700 -0.004 -16.495) 16.905 16.122 ( -3.155 -5.058 -26.610) 27.269 16.431 ( -2.791 0.195 5.784) 6.425 16.668 ( 21.877 -1.333 -7.227) 23.078 17.298 ( -9.606 17.262 11.213) 22.715 17.660 ( -6.556 -19.841 7.356) 22.153 18.357 ( -2.573 3.381 8.007) 9.064 18.490 ( -14.251 -4.882 6.471) 16.395 19.335 ( -16.974 2.598 3.112) 17.451 19.554 ( 32.896 2.646 -10.833) 34.735 20.333 ( -6.926 9.425 8.421) 14.412 20.538 ( -13.239 -3.088 -4.459) 14.306 20.598 ( -9.854 -7.488 4.036) 13.018 21.725 ( 10.783 -0.396 -10.320) 14.931 ======================= Grid point 422 (196/199) ======================= q-point: (-0.08 -0.25 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.363 ( -3.015 -19.654 10.541) 22.505 2.524 ( -9.840 -5.315 -8.076) 13.795 3.452 ( -21.449 -6.856 23.470) 32.526 3.674 ( -32.819 -20.123 3.933) 38.697 4.278 ( -27.651 -0.595 -3.439) 27.870 4.690 ( -16.348 -5.917 -23.150) 28.952 5.397 ( -25.243 1.712 -1.112) 25.326 5.845 ( -45.401 -6.948 3.260) 46.045 6.304 ( -1.147 -8.303 -0.896) 8.430 6.371 ( -18.611 -18.043 0.773) 25.933 7.073 ( -9.964 -5.164 -1.428) 11.313 7.217 ( 4.525 0.838 1.940) 4.994 7.305 ( 2.868 -10.802 -3.843) 11.818 7.407 ( -0.147 3.376 -1.087) 3.550 7.696 ( 9.344 5.584 0.412) 10.893 7.821 ( 3.603 -10.706 1.676) 11.419 8.077 ( -5.769 -2.864 -14.685) 16.036 8.228 ( 1.167 -4.500 0.491) 4.675 8.596 ( 8.532 5.688 5.299) 11.543 8.744 ( 5.392 3.729 -1.656) 6.761 8.858 ( 10.761 4.360 2.731) 11.927 8.971 ( 2.037 3.265 4.905) 6.234 9.098 ( 4.642 13.215 -1.821) 14.124 9.239 ( 2.685 3.808 2.077) 5.102 9.323 ( 3.942 -1.602 1.253) 4.435 9.491 ( 4.500 3.195 1.567) 5.737 9.618 ( 0.927 3.296 -3.383) 4.813 9.736 ( 3.304 -4.849 -0.954) 5.945 9.809 ( -2.729 0.330 2.585) 3.774 9.887 ( 8.011 -7.491 -3.471) 11.504 10.169 ( 6.418 2.812 -4.385) 8.266 10.438 ( 16.925 1.935 5.650) 17.948 10.583 ( 16.944 10.610 4.025) 20.392 10.681 ( 17.228 5.444 -2.239) 18.205 11.164 ( -11.160 4.637 -8.346) 14.686 11.321 ( 5.176 7.008 0.795) 8.749 11.357 ( 3.054 6.761 1.444) 7.558 11.447 ( -2.270 0.142 -0.691) 2.377 11.519 ( -0.188 -0.613 -2.732) 2.806 11.777 ( 4.787 -4.573 3.816) 7.642 11.913 ( 9.501 -2.407 -5.679) 11.327 12.235 ( 10.215 -1.467 0.583) 10.336 12.250 ( 5.502 -2.556 8.134) 10.147 12.364 ( 12.104 -4.657 5.734) 14.180 12.565 ( 14.036 -1.335 -1.359) 14.165 12.715 ( 4.177 0.242 -2.863) 5.070 12.872 ( 2.241 4.974 -0.833) 5.519 13.000 ( 1.743 1.212 1.165) 2.422 13.317 ( 5.717 1.483 0.256) 5.911 13.494 ( 0.278 13.089 2.645) 13.357 13.674 ( 3.082 7.109 2.088) 8.025 13.760 ( 4.841 7.207 3.058) 9.204 13.964 ( 2.909 0.405 2.607) 3.927 14.085 ( -0.422 6.286 1.354) 6.444 14.559 ( -6.311 2.849 -5.964) 9.139 14.880 ( 9.251 2.399 -1.560) 9.683 15.102 ( -10.175 3.492 -1.162) 10.820 15.612 ( -6.050 -13.537 11.963) 19.052 15.661 ( -7.381 2.489 -10.748) 13.274 16.060 ( -4.470 -10.026 -15.884) 19.308 16.439 ( 0.103 0.258 6.615) 6.621 16.950 ( -2.917 2.434 3.884) 5.433 17.029 ( 7.573 8.411 -6.901) 13.256 17.771 ( -7.200 -20.248 6.898) 22.569 18.018 ( -22.386 4.592 -0.742) 22.864 18.440 ( -15.763 -8.134 3.710) 18.122 19.156 ( 1.173 4.486 8.384) 9.581 19.818 ( 9.694 8.029 -16.933) 21.098 20.244 ( -0.826 0.922 2.376) 2.679 20.298 ( -11.978 -0.259 -3.556) 12.497 20.721 ( 6.971 -11.714 20.836) 24.898 21.834 ( 7.378 1.372 -16.130) 17.791 ======================= Grid point 433 (197/199) ======================= q-point: (-0.17 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 199 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.147 ( -8.277 0.000 2.422) 8.624 2.460 ( -6.511 0.000 -5.403) 8.460 3.408 ( -18.636 0.000 32.698) 37.636 3.451 ( -37.391 0.000 -1.166) 37.410 4.285 ( -24.178 0.000 0.986) 24.199 4.614 ( -25.457 0.000 -23.066) 34.353 5.454 ( -31.393 0.000 -8.132) 32.429 5.780 ( -48.539 0.000 6.696) 48.999 6.148 ( -17.237 0.000 2.798) 17.463 6.231 ( -1.558 0.000 -3.479) 3.812 7.014 ( -7.855 0.000 -4.373) 8.991 7.138 ( 2.246 -0.000 0.118) 2.249 7.267 ( 0.991 -0.000 0.657) 1.189 7.497 ( 3.230 -0.000 0.130) 3.233 7.648 ( 1.199 -0.000 -1.475) 1.901 7.772 ( 11.431 -0.000 2.135) 11.628 8.050 ( -5.302 0.000 -15.131) 16.033 8.185 ( -2.304 0.000 0.930) 2.484 8.658 ( 10.630 -0.000 5.238) 11.851 8.763 ( 6.626 -0.000 3.996) 7.737 8.907 ( 7.397 -0.000 -2.320) 7.752 8.999 ( 0.480 -0.000 5.671) 5.691 9.227 ( 2.242 -0.000 0.538) 2.306 9.301 ( 2.069 -0.000 2.120) 2.962 9.380 ( 8.091 -0.000 -2.971) 8.619 9.516 ( 3.660 -0.000 -3.451) 5.030 9.619 ( 11.336 -0.000 2.073) 11.524 9.660 ( 1.339 -0.000 -6.623) 6.757 9.765 ( -3.017 0.000 4.540) 5.451 9.830 ( 6.476 -0.000 -3.075) 7.169 10.204 ( 5.098 -0.000 -5.370) 7.404 10.452 ( 20.155 -0.000 8.377) 21.826 10.709 ( 14.791 -0.000 8.436) 17.027 10.728 ( 21.875 -0.000 -5.012) 22.442 11.207 ( -12.372 0.000 -8.965) 15.279 11.425 ( -3.311 0.000 1.370) 3.583 11.434 ( 4.930 -0.000 2.040) 5.336 11.464 ( -3.621 0.000 -1.271) 3.838 11.500 ( 9.147 -0.000 -1.050) 9.207 11.692 ( 6.359 -0.000 -1.118) 6.457 11.896 ( 10.942 -0.000 -3.612) 11.523 12.180 ( 9.746 -0.000 3.463) 10.343 12.235 ( 9.989 -0.000 5.496) 11.402 12.334 ( 10.781 -0.000 6.714) 12.701 12.550 ( 13.361 -0.000 -1.487) 13.443 12.707 ( 3.625 -0.000 -3.019) 4.717 12.920 ( -2.534 0.000 0.522) 2.587 13.020 ( 5.513 -0.000 -1.096) 5.621 13.331 ( 4.370 -0.000 0.792) 4.441 13.579 ( 2.207 -0.000 3.675) 4.287 13.769 ( 4.040 -0.000 3.284) 5.206 13.826 ( 3.777 -0.000 1.258) 3.981 14.067 ( 1.152 -0.000 5.109) 5.237 14.093 ( 3.035 -0.000 3.026) 4.286 14.592 ( -7.113 0.000 -7.372) 10.244 14.896 ( 6.906 -0.000 -3.976) 7.969 15.277 ( -2.904 0.000 2.651) 3.932 15.328 ( -11.798 0.000 7.378) 13.915 15.706 ( -4.772 0.000 -12.544) 13.421 15.937 ( -6.376 0.000 -19.899) 20.896 16.435 ( -0.676 0.000 12.469) 12.487 16.947 ( 14.405 -0.000 -13.082) 19.459 17.288 ( -14.936 0.000 12.681) 19.593 17.427 ( -3.207 0.000 2.674) 4.176 18.074 ( -25.175 0.000 0.070) 25.175 18.355 ( -13.270 0.000 5.869) 14.510 19.200 ( 0.023 -0.000 8.159) 8.159 19.900 ( 10.476 -0.000 -18.319) 21.103 20.271 ( -11.884 0.000 0.484) 11.894 20.303 ( -12.638 0.000 -4.588) 13.445 20.584 ( 15.864 -0.000 22.997) 27.938 21.841 ( 7.542 -0.000 -15.402) 17.149 ======================= Grid point 434 (198/199) ======================= q-point: (-0.08 -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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.069 ( -13.227 -19.953 4.922) 24.440 2.358 ( -5.453 0.508 -7.332) 9.152 2.915 ( -31.000 -10.339 2.651) 32.786 3.231 ( -19.351 -3.897 43.365) 47.647 3.744 ( -37.726 8.453 -8.302) 39.543 4.097 ( -34.514 -20.467 -15.681) 43.081 4.847 ( -66.606 -5.241 13.846) 68.231 4.974 ( -18.321 -0.763 -23.413) 29.739 5.959 ( -13.900 -9.121 2.185) 16.769 6.177 ( -6.303 -4.052 -3.028) 8.081 6.870 ( -7.379 -2.523 -8.351) 11.426 7.193 ( -2.524 -5.775 1.760) 6.543 7.368 ( 7.899 -0.143 3.445) 8.619 7.515 ( 3.671 0.527 -0.842) 3.803 7.751 ( 4.602 -6.178 1.244) 7.804 7.935 ( 0.466 -0.020 -12.157) 12.165 7.955 ( 10.006 2.745 0.241) 10.378 8.226 ( 4.622 -4.764 -1.608) 6.830 8.802 ( 5.282 5.095 7.260) 10.323 8.823 ( 2.286 1.127 -4.015) 4.756 9.030 ( 4.690 0.896 4.754) 6.738 9.034 ( 2.104 -0.078 3.956) 4.482 9.185 ( -4.242 5.508 -0.466) 6.968 9.330 ( 3.147 -2.582 -1.758) 4.434 9.457 ( 8.838 8.327 -4.387) 12.911 9.596 ( 5.763 -0.426 1.592) 5.994 9.668 ( 4.353 0.589 -6.292) 7.674 9.721 ( -3.202 -1.525 0.265) 3.556 9.894 ( 15.443 0.374 5.490) 16.394 10.028 ( 13.024 -1.498 -4.259) 13.784 10.260 ( 4.722 2.070 -2.818) 5.876 10.780 ( -19.955 0.125 2.371) 20.096 10.813 ( 16.843 2.744 9.474) 19.518 11.009 ( 13.043 7.248 -2.272) 15.094 11.058 ( 20.266 4.764 -4.652) 21.332 11.310 ( -7.657 1.500 -7.432) 10.775 11.459 ( 6.022 4.497 -2.507) 7.923 11.505 ( 2.972 0.051 1.030) 3.146 11.653 ( 11.848 6.567 -0.105) 13.547 11.833 ( 6.524 -3.800 2.223) 7.871 12.060 ( 10.307 -0.616 -5.029) 11.485 12.317 ( 3.455 -3.942 8.016) 9.578 12.417 ( 8.256 4.657 4.111) 10.331 12.498 ( 6.887 -3.070 3.039) 8.130 12.781 ( 12.926 -1.022 -0.575) 12.979 12.805 ( 8.813 -1.128 -1.665) 9.040 12.900 ( 0.818 -0.021 -1.368) 1.595 13.064 ( 1.611 2.392 -0.462) 2.921 13.426 ( 6.419 0.144 0.466) 6.438 13.578 ( -0.925 5.372 3.034) 6.239 13.815 ( 5.001 6.726 2.267) 8.682 13.890 ( 4.517 0.596 4.292) 6.260 14.059 ( 3.962 6.371 3.552) 8.301 14.149 ( 1.644 2.597 1.835) 3.580 14.411 ( -10.371 0.147 -8.379) 13.334 14.912 ( -8.069 -0.542 -5.336) 9.689 15.093 ( 1.876 11.731 4.736) 12.789 15.405 ( -4.308 -16.726 8.555) 19.275 15.557 ( -6.176 4.902 -8.889) 11.882 15.831 ( -5.889 -10.560 -13.188) 17.892 16.464 ( -1.303 -0.208 14.283) 14.344 16.894 ( -14.615 16.272 10.454) 24.242 17.128 ( 1.863 -6.490 -12.008) 13.776 17.452 ( -11.010 -12.966 -1.847) 17.110 17.658 ( -20.575 -3.523 -6.601) 21.893 18.037 ( -24.116 -2.045 -1.607) 24.256 19.345 ( 10.840 1.769 15.893) 19.319 19.907 ( 1.897 4.582 -10.703) 11.797 20.090 ( -10.915 -1.128 -1.242) 11.043 20.118 ( -8.709 -4.519 -2.536) 10.134 21.000 ( 21.025 -1.722 16.126) 26.553 21.870 ( 2.083 0.014 -20.039) 20.147 ======================= Grid point 446 (199/199) ======================= q-point: (-0.08 -0.08 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.86e-04 2.86e-04 2.86e-04 2.86e-04 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.628 ( -24.986 0.000 14.032) 28.657 2.273 ( -4.561 0.000 -7.170) 8.498 2.484 ( -16.262 0.000 1.216) 16.307 3.009 ( -25.507 0.000 47.817) 54.195 3.093 ( -49.418 0.000 -19.433) 53.102 3.267 ( -32.547 0.000 -9.151) 33.809 3.749 ( -64.649 0.000 28.518) 70.660 4.697 ( -3.636 0.000 -42.040) 42.197 5.746 ( -8.364 0.000 4.631) 9.561 6.017 ( -8.956 0.000 -2.418) 9.276 6.741 ( -3.662 0.000 -9.398) 10.086 7.043 ( -13.444 0.000 5.433) 14.500 7.474 ( 4.863 -0.000 1.009) 4.967 7.534 ( 2.664 -0.000 -7.673) 8.122 7.891 ( 10.301 -0.000 6.310) 12.080 7.942 ( 5.048 -0.000 -5.339) 7.348 8.187 ( 13.877 -0.000 -1.257) 13.934 8.270 ( 4.259 -0.000 -2.969) 5.192 8.833 ( 0.082 -0.000 -1.884) 1.886 8.860 ( -4.887 0.000 7.772) 9.180 8.992 ( -17.260 0.000 -15.984) 23.524 9.044 ( -1.675 0.000 0.816) 1.863 9.102 ( -3.121 0.000 5.443) 6.274 9.318 ( -0.371 0.000 3.176) 3.197 9.636 ( 1.880 -0.000 -2.780) 3.356 9.655 ( 4.113 -0.000 -1.907) 4.534 9.700 ( 4.834 -0.000 -3.572) 6.011 9.775 ( 9.760 -0.000 -6.115) 11.518 10.198 ( 16.323 -0.000 6.461) 17.555 10.224 ( 10.157 -0.000 -5.779) 11.687 10.287 ( -30.678 0.000 8.271) 31.773 10.350 ( 4.638 -0.000 4.233) 6.280 11.062 ( -11.484 0.000 -14.326) 18.360 11.158 ( 13.113 -0.000 5.664) 14.284 11.281 ( 14.579 -0.000 -3.272) 14.942 11.452 ( 18.545 -0.000 -3.825) 18.935 11.586 ( 6.570 -0.000 0.375) 6.581 11.602 ( 9.708 -0.000 -0.896) 9.749 11.887 ( 10.588 -0.000 0.166) 10.590 11.954 ( 9.399 -0.000 2.403) 9.702 12.190 ( 6.989 -0.000 -4.325) 8.219 12.340 ( -1.330 0.000 10.520) 10.604 12.512 ( -0.553 0.000 4.046) 4.084 12.612 ( 6.735 -0.000 0.549) 6.757 12.909 ( 0.997 -0.000 1.764) 2.026 12.975 ( 11.067 -0.000 -5.027) 12.155 12.980 ( 11.390 -0.000 -2.550) 11.672 13.084 ( 1.474 -0.000 4.022) 4.284 13.537 ( 5.898 -0.000 1.469) 6.078 13.561 ( -5.458 0.000 4.250) 6.918 13.980 ( 8.937 -0.000 1.602) 9.079 14.019 ( 11.424 -0.000 2.449) 11.684 14.189 ( -6.605 0.000 -2.556) 7.082 14.197 ( 3.658 -0.000 1.581) 3.985 14.203 ( 0.948 -0.000 -1.852) 2.081 14.712 ( -14.033 0.000 -1.769) 14.144 15.203 ( -3.879 0.000 2.113) 4.417 15.278 ( 2.436 -0.000 7.616) 7.996 15.473 ( -5.902 0.000 -6.462) 8.751 15.609 ( -8.409 0.000 -10.400) 13.375 16.466 ( -4.370 0.000 17.194) 17.740 16.782 ( -16.925 0.000 13.270) 21.507 16.953 ( -7.131 0.000 -2.205) 7.464 17.193 ( -13.588 0.000 -14.517) 19.884 17.243 ( -20.214 0.000 -7.045) 21.406 17.653 ( -19.251 0.000 -14.358) 24.016 19.568 ( 7.268 -0.000 17.704) 19.137 19.909 ( -5.648 0.000 -0.735) 5.696 19.931 ( -7.983 0.000 0.240) 7.987 19.973 ( 1.878 -0.000 -11.347) 11.502 21.340 ( 14.578 -0.000 9.724) 17.523 21.780 ( -5.153 0.000 -19.380) 20.053 =================== 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 3/51840 10.0 1208.754 815.285 343.326 -0.000 -15.132 0.000 3/51840 20.0 434.434 361.372 179.293 -0.000 -30.240 0.000 3/51840 30.0 205.063 177.709 103.447 -0.000 -15.996 0.000 3/51840 40.0 120.260 108.339 64.213 -0.000 -8.207 0.000 3/51840 50.0 75.755 69.878 42.268 -0.000 -4.542 0.000 3/51840 60.0 50.328 47.123 29.152 -0.000 -2.748 0.000 3/51840 70.0 35.317 33.454 21.073 -0.000 -1.808 0.000 3/51840 80.0 26.085 24.955 15.915 -0.000 -1.277 0.000 3/51840 90.0 20.138 19.430 12.485 -0.000 -0.955 0.000 3/51840 100.0 16.131 15.675 10.115 -0.000 -0.746 0.000 3/51840 110.0 13.317 13.020 8.417 -0.000 -0.604 0.000 3/51840 120.0 11.270 11.073 7.163 -0.000 -0.503 0.000 3/51840 130.0 9.733 9.603 6.210 -0.000 -0.428 0.000 3/51840 140.0 8.547 8.462 5.469 -0.000 -0.370 0.000 3/51840 150.0 7.611 7.557 4.879 -0.000 -0.326 0.000 3/51840 160.0 6.857 6.824 4.402 -0.000 -0.290 0.000 3/51840 170.0 6.238 6.221 4.010 -0.000 -0.261 0.000 3/51840 180.0 5.723 5.717 3.682 -0.000 -0.237 0.000 3/51840 190.0 5.288 5.290 3.405 -0.000 -0.217 0.000 3/51840 200.0 4.916 4.924 3.168 -0.000 -0.200 0.000 3/51840 210.0 4.595 4.607 2.963 -0.000 -0.186 0.000 3/51840 220.0 4.315 4.330 2.784 -0.000 -0.173 0.000 3/51840 230.0 4.069 4.086 2.626 -0.000 -0.162 0.000 3/51840 240.0 3.850 3.869 2.487 -0.000 -0.153 0.000 3/51840 250.0 3.655 3.676 2.362 -0.000 -0.144 0.000 3/51840 260.0 3.480 3.501 2.250 -0.000 -0.136 0.000 3/51840 270.0 3.322 3.343 2.149 -0.000 -0.130 0.000 3/51840 280.0 3.178 3.200 2.057 -0.000 -0.123 0.000 3/51840 290.0 3.047 3.069 1.973 -0.000 -0.118 0.000 3/51840 300.0 2.927 2.949 1.896 -0.000 -0.113 0.000 3/51840 310.0 2.817 2.838 1.825 -0.000 -0.108 0.000 3/51840 320.0 2.715 2.736 1.760 -0.000 -0.104 0.000 3/51840 330.0 2.620 2.642 1.699 -0.000 -0.100 0.000 3/51840 340.0 2.532 2.554 1.643 -0.000 -0.096 0.000 3/51840 350.0 2.450 2.471 1.591 -0.000 -0.093 0.000 3/51840 360.0 2.374 2.395 1.542 -0.000 -0.090 0.000 3/51840 370.0 2.302 2.323 1.496 -0.000 -0.087 0.000 3/51840 380.0 2.235 2.255 1.452 -0.000 -0.084 0.000 3/51840 390.0 2.172 2.192 1.412 -0.000 -0.082 0.000 3/51840 400.0 2.112 2.132 1.374 -0.000 -0.079 0.000 3/51840 410.0 2.056 2.075 1.337 -0.000 -0.077 0.000 3/51840 420.0 2.003 2.022 1.303 -0.000 -0.075 0.000 3/51840 430.0 1.952 1.971 1.271 -0.000 -0.073 0.000 3/51840 440.0 1.904 1.923 1.240 -0.000 -0.071 0.000 3/51840 450.0 1.859 1.877 1.211 -0.000 -0.069 0.000 3/51840 460.0 1.816 1.833 1.183 -0.000 -0.068 0.000 3/51840 470.0 1.774 1.792 1.156 -0.000 -0.066 0.000 3/51840 480.0 1.735 1.752 1.131 -0.000 -0.064 0.000 3/51840 490.0 1.697 1.714 1.106 -0.000 -0.063 0.000 3/51840 500.0 1.661 1.678 1.083 -0.000 -0.061 0.000 3/51840 510.0 1.627 1.643 1.061 -0.000 -0.060 0.000 3/51840 520.0 1.594 1.610 1.040 -0.000 -0.059 0.000 3/51840 530.0 1.562 1.578 1.019 -0.000 -0.058 0.000 3/51840 540.0 1.532 1.548 1.000 -0.000 -0.056 0.000 3/51840 550.0 1.503 1.518 0.981 -0.000 -0.055 0.000 3/51840 560.0 1.475 1.490 0.963 -0.000 -0.054 0.000 3/51840 570.0 1.448 1.463 0.945 -0.000 -0.053 0.000 3/51840 580.0 1.422 1.436 0.928 -0.000 -0.052 0.000 3/51840 590.0 1.397 1.411 0.912 -0.000 -0.051 0.000 3/51840 600.0 1.372 1.387 0.896 -0.000 -0.050 0.000 3/51840 610.0 1.349 1.363 0.881 -0.000 -0.049 0.000 3/51840 620.0 1.327 1.340 0.867 -0.000 -0.049 0.000 3/51840 630.0 1.305 1.318 0.853 -0.000 -0.048 0.000 3/51840 640.0 1.284 1.297 0.839 -0.000 -0.047 0.000 3/51840 650.0 1.263 1.277 0.826 -0.000 -0.046 0.000 3/51840 660.0 1.243 1.257 0.813 -0.000 -0.045 0.000 3/51840 670.0 1.224 1.237 0.800 -0.000 -0.045 0.000 3/51840 680.0 1.206 1.219 0.788 -0.000 -0.044 0.000 3/51840 690.0 1.188 1.200 0.777 -0.000 -0.043 0.000 3/51840 700.0 1.170 1.183 0.765 -0.000 -0.043 0.000 3/51840 710.0 1.153 1.166 0.754 -0.000 -0.042 0.000 3/51840 720.0 1.137 1.149 0.744 -0.000 -0.041 0.000 3/51840 730.0 1.121 1.133 0.733 -0.000 -0.041 0.000 3/51840 740.0 1.106 1.117 0.723 -0.000 -0.040 0.000 3/51840 750.0 1.090 1.102 0.713 -0.000 -0.040 0.000 3/51840 760.0 1.076 1.087 0.704 -0.000 -0.039 0.000 3/51840 770.0 1.062 1.073 0.695 -0.000 -0.039 0.000 3/51840 780.0 1.048 1.059 0.686 -0.000 -0.038 0.000 3/51840 790.0 1.034 1.045 0.677 -0.000 -0.038 0.000 3/51840 800.0 1.021 1.032 0.668 -0.000 -0.037 0.000 3/51840 810.0 1.008 1.019 0.660 -0.000 -0.037 0.000 3/51840 820.0 0.995 1.006 0.652 -0.000 -0.036 0.000 3/51840 830.0 0.983 0.994 0.644 -0.000 -0.036 0.000 3/51840 840.0 0.971 0.982 0.636 -0.000 -0.035 0.000 3/51840 850.0 0.960 0.970 0.628 -0.000 -0.035 0.000 3/51840 860.0 0.948 0.959 0.621 -0.000 -0.034 0.000 3/51840 870.0 0.937 0.947 0.614 -0.000 -0.034 0.000 3/51840 880.0 0.926 0.936 0.607 -0.000 -0.034 0.000 3/51840 890.0 0.916 0.926 0.600 -0.000 -0.033 0.000 3/51840 900.0 0.906 0.915 0.593 -0.000 -0.033 0.000 3/51840 910.0 0.895 0.905 0.586 -0.000 -0.032 0.000 3/51840 920.0 0.886 0.895 0.580 -0.000 -0.032 0.000 3/51840 930.0 0.876 0.885 0.574 -0.000 -0.032 0.000 3/51840 940.0 0.866 0.876 0.568 -0.000 -0.031 0.000 3/51840 950.0 0.857 0.867 0.562 -0.000 -0.031 0.000 3/51840 960.0 0.848 0.857 0.556 -0.000 -0.031 0.000 3/51840 970.0 0.839 0.848 0.550 -0.000 -0.030 0.000 3/51840 980.0 0.831 0.840 0.544 -0.000 -0.030 0.000 3/51840 990.0 0.822 0.831 0.539 -0.000 -0.030 0.000 3/51840 1000.0 0.814 0.823 0.533 -0.000 -0.029 0.000 3/51840 Thermal conductivity related properties were written into "kappa-m12125.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 19:27:06]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|