----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-09 02:06:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 1 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) Number of symmetry operations in supercell: 18 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.194595354654289 1.844400487961578 8.906464203333323 b -3.194595354654282 1.844400487961578 8.906464203333323 c 0.000000000000003 -3.688800975923162 8.906464203333323 Atomic positions (fractional): *1 Sr 0.33348693836741 0.33348693836741 0.33348693836741 87.620 2 Sr 0.66651306163259 0.66651306163259 0.66651306163259 87.620 *3 Zr 0.74399902604850 0.48768998576564 0.11364292249502 91.224 4 Zr 0.88635707750498 0.25600097395151 0.51231001423437 91.224 5 Zr 0.51231001423437 0.88635707750498 0.25600097395150 91.224 *6 Zr 0.00000000000000 0.00000000000000 0.00000000000000 91.224 7 Zr 0.48768998576563 0.11364292249503 0.74399902604850 91.224 8 Zr 0.11364292249502 0.74399902604850 0.48768998576563 91.224 9 Zr 0.25600097395150 0.51231001423437 0.88635707750498 91.224 *10 O 0.76704177966998 0.32284109821549 0.03674473436485 15.999 *11 O 0.85064136177771 0.58573858398901 0.15377666664775 15.999 12 O 0.84622333335225 0.14935863822229 0.41426141601099 15.999 13 O 0.96325526563515 0.23295822033002 0.67715890178451 15.999 14 O 0.67715890178451 0.96325526563515 0.23295822033002 15.999 15 O 0.41426141601099 0.84622333335225 0.14935863822229 15.999 *16 O 0.76293037446505 0.76293037446505 0.76293037446505 15.999 *17 O 0.57194241530049 0.57194241530049 0.57194241530049 15.999 18 O 0.23706962553495 0.23706962553496 0.23706962553495 15.999 19 O 0.42805758469951 0.42805758469951 0.42805758469951 15.999 20 O 0.58573858398901 0.15377666664775 0.85064136177771 15.999 21 O 0.32284109821549 0.03674473436485 0.76704177966998 15.999 22 O 0.03674473436485 0.76704177966998 0.32284109821549 15.999 23 O 0.15377666664775 0.85064136177772 0.58573858398901 15.999 24 O 0.14935863822229 0.41426141601100 0.84622333335225 15.999 25 O 0.23295822033002 0.67715890178451 0.96325526563515 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.389190709308572 0.000000000000000 0.000000000000000 b -3.194595354654286 5.533201463884740 0.000000000000000 c 0.000000000000000 0.000000000000000 26.719392609999996 Atomic positions (fractional): *1 Sr 0.66666666666667 0.33333333333333 0.66682027170074 87.620 > 1 2 Sr 0.66666666666667 0.33333333333333 0.99984639496592 87.620 > 2 3 Sr 0.33333333333333 0.66666666666667 0.00015360503408 87.620 > 1 4 Sr 0.33333333333333 0.66666666666667 0.33317972829926 87.620 > 2 5 Sr 0.00000000000000 0.00000000000000 0.33348693836741 87.620 > 1 6 Sr 0.00000000000000 0.00000000000000 0.66651306163259 87.620 > 2 *7 Zr 0.96222171461211 0.66813438894136 0.78177731143638 91.224 > 3 8 Zr 0.00146772227469 0.37257934099592 0.88488935523028 91.224 > 4 9 Zr 0.62742065900408 0.62888838127878 0.88488935523028 91.224 > 5 *10 Zr 0.00000000000000 0.00000000000000 0.00000000000000 91.224 > 6 11 Zr 0.70591267432925 0.03777828538789 0.78177731143638 91.224 > 7 12 Zr 0.33186561105864 0.29408732567075 0.78177731143638 91.224 > 8 13 Zr 0.37111161872122 0.99853227772530 0.88488935523028 91.224 > 9 14 Zr 0.62888838127878 0.00146772227469 0.11511064476972 91.224 > 3 15 Zr 0.66813438894136 0.70591267432925 0.21822268856362 91.224 > 4 16 Zr 0.29408732567075 0.96222171461211 0.21822268856362 91.224 > 5 17 Zr 0.66666666666667 0.33333333333333 0.33333333333333 91.224 > 6 18 Zr 0.37257934099592 0.37111161872122 0.11511064476972 91.224 > 7 19 Zr 0.99853227772530 0.62742065900408 0.11511064476972 91.224 > 8 20 Zr 0.03777828538789 0.33186561105864 0.21822268856362 91.224 > 9 21 Zr 0.29555504794545 0.33480105560803 0.44844397810305 91.224 > 3 22 Zr 0.33480105560803 0.03924600766258 0.55155602189695 91.224 > 4 23 Zr 0.96075399233742 0.29555504794545 0.55155602189695 91.224 > 5 24 Zr 0.33333333333333 0.66666666666667 0.66666666666667 91.224 > 6 25 Zr 0.03924600766258 0.70444495205455 0.44844397810305 91.224 > 7 26 Zr 0.66519894439197 0.96075399233742 0.44844397810305 91.224 > 8 27 Zr 0.70444495205455 0.66519894439197 0.55155602189695 91.224 > 9 *28 O 0.05816590891987 0.67213113638526 0.70887587075011 15.999 > 10 *29 O 0.98725582430622 0.70960887082374 0.86338553747149 15.999 > 11 30 O 0.04294220415707 0.38901971318418 0.80328112919518 15.999 > 12 31 O 0.00546446971859 0.28063189413205 0.95779079591656 15.999 > 13 32 O 0.71936810586795 0.72483257558654 0.95779079591656 15.999 > 14 33 O 0.61098028681582 0.65392249097289 0.80328112919518 15.999 > 15 *34 O 0.00000000000000 0.00000000000000 0.76293037446505 15.999 > 16 *35 O 0.66666666666667 0.33333333333333 0.90527574863382 15.999 > 17 36 O 0.33333333333333 0.66666666666667 0.90373629220162 15.999 > 18 37 O 0.66666666666667 0.33333333333333 0.76139091803284 15.999 > 19 38 O 0.72235304651752 0.01274417569378 0.86338553747149 15.999 > 20 39 O 0.61396522746538 0.94183409108013 0.70887587075011 15.999 > 21 40 O 0.32786886361474 0.38603477253462 0.70887587075011 15.999 > 22 41 O 0.29039112917626 0.27764695348248 0.86338553747149 15.999 > 23 42 O 0.34607750902711 0.95705779584293 0.80328112919518 15.999 > 24 43 O 0.27516742441346 0.99453553028141 0.95779079591656 15.999 > 25 44 O 0.72483257558654 0.00546446971859 0.04220920408344 15.999 > 10 45 O 0.65392249097289 0.04294220415707 0.19671887080482 15.999 > 11 46 O 0.70960887082374 0.72235304651752 0.13661446252851 15.999 > 12 47 O 0.67213113638525 0.61396522746538 0.29112412924989 15.999 > 13 48 O 0.38603477253462 0.05816590891987 0.29112412924989 15.999 > 14 49 O 0.27764695348248 0.98725582430622 0.13661446252851 15.999 > 15 50 O 0.66666666666667 0.33333333333333 0.09626370779838 15.999 > 16 51 O 0.33333333333333 0.66666666666667 0.23860908196716 15.999 > 17 52 O 0.00000000000000 0.00000000000000 0.23706962553495 15.999 > 18 53 O 0.33333333333333 0.66666666666667 0.09472425136618 15.999 > 19 54 O 0.38901971318418 0.34607750902711 0.19671887080482 15.999 > 20 55 O 0.28063189413205 0.27516742441346 0.04220920408344 15.999 > 21 56 O 0.99453553028141 0.71936810586795 0.04220920408344 15.999 > 22 57 O 0.95705779584293 0.61098028681582 0.19671887080482 15.999 > 23 58 O 0.01274417569378 0.29039112917626 0.13661446252851 15.999 > 24 59 O 0.94183409108013 0.32786886361474 0.29112412924989 15.999 > 25 60 O 0.39149924225321 0.33879780305192 0.37554253741677 15.999 > 10 61 O 0.32058915763956 0.37627553749041 0.53005220413816 15.999 > 11 62 O 0.37627553749041 0.05568637985085 0.46994779586184 15.999 > 12 63 O 0.33879780305192 0.94729856079871 0.62445746258323 15.999 > 13 64 O 0.05270143920128 0.39149924225321 0.62445746258323 15.999 > 14 65 O 0.94431362014915 0.32058915763956 0.46994779586184 15.999 > 15 66 O 0.33333333333333 0.66666666666667 0.42959704113171 15.999 > 16 67 O 0.00000000000000 0.00000000000000 0.57194241530049 15.999 > 17 68 O 0.66666666666667 0.33333333333333 0.57040295886829 15.999 > 18 69 O 0.00000000000000 0.00000000000000 0.42805758469951 15.999 > 19 70 O 0.05568637985085 0.67941084236044 0.53005220413816 15.999 > 20 71 O 0.94729856079871 0.60850075774679 0.37554253741677 15.999 > 21 72 O 0.66120219694808 0.05270143920128 0.37554253741677 15.999 > 22 73 O 0.62372446250959 0.94431362014915 0.53005220413816 15.999 > 23 74 O 0.67941084236044 0.62372446250959 0.46994779586184 15.999 > 24 75 O 0.60850075774679 0.66120219694808 0.62445746258323 15.999 > 25 -------------------------------- super cell -------------------------------- Lattice vectors: a 6.389190709308572 0.000000000000000 0.000000000000000 b -3.194595354654286 5.533201463884740 0.000000000000000 c 0.000000000000000 0.000000000000000 26.719392609999996 Atomic positions (fractional): *1 Sr 0.66666666666667 0.33333333333333 0.66682027170074 87.620 > 1 2 Sr 0.66666666666667 0.33333333333333 0.99984639496592 87.620 > 2 3 Sr 0.33333333333333 0.66666666666667 0.00015360503408 87.620 > 1 4 Sr 0.33333333333333 0.66666666666667 0.33317972829926 87.620 > 2 5 Sr 0.00000000000000 0.00000000000000 0.33348693836741 87.620 > 1 6 Sr 0.00000000000000 0.00000000000000 0.66651306163259 87.620 > 2 *7 Zr 0.96222171461211 0.66813438894136 0.78177731143638 91.224 > 3 8 Zr 0.00146772227469 0.37257934099592 0.88488935523028 91.224 > 4 9 Zr 0.62742065900408 0.62888838127878 0.88488935523028 91.224 > 5 *10 Zr 0.00000000000000 0.00000000000000 0.00000000000000 91.224 > 6 11 Zr 0.70591267432925 0.03777828538789 0.78177731143638 91.224 > 7 12 Zr 0.33186561105864 0.29408732567075 0.78177731143638 91.224 > 8 13 Zr 0.37111161872122 0.99853227772530 0.88488935523028 91.224 > 9 14 Zr 0.62888838127878 0.00146772227469 0.11511064476972 91.224 > 3 15 Zr 0.66813438894136 0.70591267432925 0.21822268856362 91.224 > 4 16 Zr 0.29408732567075 0.96222171461211 0.21822268856362 91.224 > 5 17 Zr 0.66666666666667 0.33333333333333 0.33333333333333 91.224 > 6 18 Zr 0.37257934099592 0.37111161872122 0.11511064476972 91.224 > 7 19 Zr 0.99853227772530 0.62742065900408 0.11511064476972 91.224 > 8 20 Zr 0.03777828538789 0.33186561105864 0.21822268856362 91.224 > 9 21 Zr 0.29555504794545 0.33480105560803 0.44844397810305 91.224 > 3 22 Zr 0.33480105560803 0.03924600766258 0.55155602189695 91.224 > 4 23 Zr 0.96075399233742 0.29555504794545 0.55155602189695 91.224 > 5 24 Zr 0.33333333333333 0.66666666666667 0.66666666666667 91.224 > 6 25 Zr 0.03924600766258 0.70444495205455 0.44844397810305 91.224 > 7 26 Zr 0.66519894439197 0.96075399233742 0.44844397810305 91.224 > 8 27 Zr 0.70444495205455 0.66519894439197 0.55155602189695 91.224 > 9 *28 O 0.05816590891987 0.67213113638526 0.70887587075011 15.999 > 10 *29 O 0.98725582430622 0.70960887082374 0.86338553747149 15.999 > 11 30 O 0.04294220415707 0.38901971318418 0.80328112919518 15.999 > 12 31 O 0.00546446971859 0.28063189413205 0.95779079591656 15.999 > 13 32 O 0.71936810586795 0.72483257558654 0.95779079591656 15.999 > 14 33 O 0.61098028681582 0.65392249097289 0.80328112919518 15.999 > 15 *34 O 0.00000000000000 0.00000000000000 0.76293037446505 15.999 > 16 *35 O 0.66666666666667 0.33333333333333 0.90527574863382 15.999 > 17 36 O 0.33333333333333 0.66666666666667 0.90373629220162 15.999 > 18 37 O 0.66666666666667 0.33333333333333 0.76139091803284 15.999 > 19 38 O 0.72235304651752 0.01274417569378 0.86338553747149 15.999 > 20 39 O 0.61396522746538 0.94183409108013 0.70887587075011 15.999 > 21 40 O 0.32786886361474 0.38603477253462 0.70887587075011 15.999 > 22 41 O 0.29039112917626 0.27764695348248 0.86338553747149 15.999 > 23 42 O 0.34607750902711 0.95705779584293 0.80328112919518 15.999 > 24 43 O 0.27516742441346 0.99453553028141 0.95779079591656 15.999 > 25 44 O 0.72483257558654 0.00546446971859 0.04220920408344 15.999 > 10 45 O 0.65392249097289 0.04294220415707 0.19671887080482 15.999 > 11 46 O 0.70960887082374 0.72235304651752 0.13661446252851 15.999 > 12 47 O 0.67213113638525 0.61396522746538 0.29112412924989 15.999 > 13 48 O 0.38603477253462 0.05816590891987 0.29112412924989 15.999 > 14 49 O 0.27764695348248 0.98725582430622 0.13661446252851 15.999 > 15 50 O 0.66666666666667 0.33333333333333 0.09626370779838 15.999 > 16 51 O 0.33333333333333 0.66666666666667 0.23860908196716 15.999 > 17 52 O 0.00000000000000 0.00000000000000 0.23706962553495 15.999 > 18 53 O 0.33333333333333 0.66666666666667 0.09472425136618 15.999 > 19 54 O 0.38901971318418 0.34607750902711 0.19671887080482 15.999 > 20 55 O 0.28063189413205 0.27516742441346 0.04220920408344 15.999 > 21 56 O 0.99453553028141 0.71936810586795 0.04220920408344 15.999 > 22 57 O 0.95705779584293 0.61098028681582 0.19671887080482 15.999 > 23 58 O 0.01274417569378 0.29039112917626 0.13661446252851 15.999 > 24 59 O 0.94183409108013 0.32786886361474 0.29112412924989 15.999 > 25 60 O 0.39149924225321 0.33879780305192 0.37554253741677 15.999 > 10 61 O 0.32058915763956 0.37627553749041 0.53005220413816 15.999 > 11 62 O 0.37627553749041 0.05568637985085 0.46994779586184 15.999 > 12 63 O 0.33879780305192 0.94729856079871 0.62445746258323 15.999 > 13 64 O 0.05270143920128 0.39149924225321 0.62445746258323 15.999 > 14 65 O 0.94431362014915 0.32058915763956 0.46994779586184 15.999 > 15 66 O 0.33333333333333 0.66666666666667 0.42959704113171 15.999 > 16 67 O 0.00000000000000 0.00000000000000 0.57194241530049 15.999 > 17 68 O 0.66666666666667 0.33333333333333 0.57040295886829 15.999 > 18 69 O 0.00000000000000 0.00000000000000 0.42805758469951 15.999 > 19 70 O 0.05568637985085 0.67941084236044 0.53005220413816 15.999 > 20 71 O 0.94729856079871 0.60850075774679 0.37554253741677 15.999 > 21 72 O 0.66120219694808 0.05270143920128 0.37554253741677 15.999 > 22 73 O 0.62372446250959 0.94431362014915 0.53005220413816 15.999 > 23 74 O 0.67941084236044 0.62372446250959 0.46994779586184 15.999 > 24 75 O 0.60850075774679 0.66120219694808 0.62445746258323 15.999 > 25 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.8115258 0.0000004 0.0000000 -0.0000004 4.8115258 0.0000000 0.0000000 0.0000000 5.0091614 -------------------------- Born effective charges -------------------------- 1 Sr 2.3521493 0.0034881 -0.0000000 -0.0034881 2.3521493 -0.0000000 0.0000000 0.0000000 2.9066051 2 Sr 2.3521493 0.0034881 -0.0000000 -0.0034881 2.3521493 -0.0000000 0.0000000 0.0000000 2.9066051 3 Zr 4.3607770 -0.1111612 -0.4288298 -0.1220136 5.9393811 -0.1206082 -0.3458750 -0.0075707 5.2859537 4 Zr 5.4437624 0.7472755 0.3188647 0.7364231 4.8563957 -0.3110734 0.1794939 -0.2957512 5.2859537 5 Zr 5.6456977 -0.6198357 0.1099651 -0.6306881 4.6544604 0.4316816 0.1663811 0.3033219 5.2859537 6 Zr 5.8586183 -0.0532316 -0.0000000 0.0532316 5.8586183 -0.0000000 0.0000000 0.0000000 6.3832566 7 Zr 5.6456977 -0.6198357 0.1099651 -0.6306881 4.6544604 0.4316816 0.1663811 0.3033219 5.2859537 8 Zr 5.4437624 0.7472755 0.3188647 0.7364231 4.8563957 -0.3110734 0.1794939 -0.2957512 5.2859537 9 Zr 4.3607770 -0.1111612 -0.4288298 -0.1220136 5.9393811 -0.1206082 -0.3458750 -0.0075707 5.2859537 10 O -2.7121265 0.0378351 1.2178305 0.0180239 -1.6721496 0.0361398 1.2776638 0.0263423 -3.8235386 11 O -2.8927809 -0.3028689 0.1080975 -0.3028208 -2.3377407 0.0108189 -0.0390462 0.0593028 -2.3735778 12 O -2.7387721 0.3917379 -0.0634182 0.3917859 -2.4917496 0.0882057 -0.0318346 -0.0634664 -2.3735778 13 O -1.9079562 0.4462640 -0.6402133 0.4264528 -2.4763200 1.0366023 -0.6616450 1.0933181 -3.8235386 14 O -1.9563315 -0.4543824 -0.5776173 -0.4741936 -2.4279446 -1.0727421 -0.6160188 -1.1196604 -3.8235386 15 O -2.2142294 -0.0889411 -0.0446793 -0.0888930 -3.0162922 -0.0990247 0.0708808 0.0041636 -2.3735778 16 O -3.2967912 0.1730555 -0.0000000 -0.1730555 -3.2967912 -0.0000000 0.0000000 0.0000000 -1.6650496 17 O -3.0127078 -0.1958510 -0.0000000 0.1958510 -3.0127078 -0.0000000 0.0000000 0.0000000 -1.6996955 18 O -3.2967912 0.1730555 -0.0000000 -0.1730555 -3.2967912 -0.0000000 0.0000000 0.0000000 -1.6650496 19 O -3.0127078 -0.1958510 -0.0000000 0.1958510 -3.0127078 -0.0000000 0.0000000 0.0000000 -1.6996955 20 O -2.2142294 -0.0889411 -0.0446793 -0.0888930 -3.0162922 -0.0990247 0.0708808 0.0041636 -2.3735778 21 O -1.9563315 -0.4543824 -0.5776173 -0.4741936 -2.4279446 -1.0727421 -0.6160188 -1.1196604 -3.8235386 22 O -1.9079562 0.4462640 -0.6402133 0.4264528 -2.4763200 1.0366023 -0.6616450 1.0933181 -3.8235386 23 O -2.7387721 0.3917379 -0.0634182 0.3917859 -2.4917496 0.0882057 -0.0318346 -0.0634664 -2.3735778 24 O -2.8927809 -0.3028689 0.1080975 -0.3028208 -2.3377407 0.0108189 -0.0390462 0.0593028 -2.3735778 25 O -2.7121265 0.0378351 1.2178305 0.0180239 -1.6721496 0.0361398 1.2776638 0.0263423 -3.8235386 ---------------------------------------------------------------------------- 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: 225/225 Permutation basis: 11181/11181 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1432 Number of blocks in projector: 712 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 3 --- Eigsh_solver_block: 1 / 3 --- Block_size: 662 Use submatrix version of eigh solver. (1) Block: 500 / 662 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 37 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 662 / 662 (1) 146 eigenvectors found. (1) Complementary block size: 35 (1) Compute compressed projector. (1) Use standard solver. (1) 16 eigenvectors found. --- Eigsh_solver_block: 2 / 3 --- Block_size: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 238 eigenvectors found. (2) Block: 500 / 576 (2) 238 eigenvectors found. (2) Block: 576 / 576 (2) 64 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 24 eigenvectors found. (1) 564 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 3 --- Block_size: 194 Use standard eigh solver. Tree of FC basis block matrices: - (1432, 1394), data: False |-- (194, 187), data: True |-- (576, 564), data: False |-- (576, 564), data: False |-- (576, 24), data: (576, 36) @ (36, 24) |-- (76, 64), data: True |-- (250, 238), data: True |-- (250, 238), data: True |-- (662, 643), data: False |-- (662, 16), data: (662, 35) @ (35, 16) |-- (162, 146), data: True |-- (500, 481), data: False |-- (500, 18), data: (500, 37) @ (37, 18) |-- (250, 232), data: True |-- (250, 231), data: True ----- Solver_atoms: 1 -- 75 / 75 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 560 - Time: 1.290 Solver_block: 200 / 560 - Time: 1.261 Solver_block: 300 / 560 - Time: 1.264 Solver_block: 400 / 560 - Time: 1.265 Solver_block: 500 / 560 - Time: 1.263 Solver_block: 560 / 560 - Time: 0.802 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 7.235 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 225/225 Permutation basis: 11181/11181 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1432 Number of blocks in projector: 712 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 3 --- Eigsh_solver_block: 1 / 3 --- Block_size: 662 Use submatrix version of eigh solver. (1) Block: 500 / 662 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 37 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 662 / 662 (1) 146 eigenvectors found. (1) Complementary block size: 35 (1) Compute compressed projector. (1) Use standard solver. (1) 16 eigenvectors found. --- Eigsh_solver_block: 2 / 3 --- Block_size: 576 Use submatrix version of eigh solver. (1) Block: 576 / 576 (2) Block: 250 / 576 (2) 238 eigenvectors found. (2) Block: 500 / 576 (2) 238 eigenvectors found. (2) Block: 576 / 576 (2) 64 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 24 eigenvectors found. (1) 564 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 3 --- Block_size: 194 Use standard eigh solver. Tree of FC basis block matrices: - (1432, 1394), data: False |-- (194, 187), data: True |-- (576, 564), data: False |-- (576, 564), data: False |-- (576, 24), data: (576, 36) @ (36, 24) |-- (76, 64), data: True |-- (250, 238), data: True |-- (250, 238), data: True |-- (662, 643), data: False |-- (662, 16), data: (662, 35) @ (35, 16) |-- (162, 146), data: True |-- (500, 481), data: False |-- (500, 18), data: (500, 37) @ (37, 18) |-- (250, 232), data: True |-- (250, 231), 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 2026-01-09 02:06:42]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 02:06:43]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 1 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.194595354654289 1.844400487961578 8.906464203333323 b -3.194595354654282 1.844400487961578 8.906464203333323 c 0.000000000000003 -3.688800975923162 8.906464203333323 Atomic positions (fractional): 1 Sr 0.33348693836741 0.33348693836741 0.33348693836741 87.620 2 Sr 0.66651306163259 0.66651306163259 0.66651306163259 87.620 3 Zr 0.74399902604850 0.48768998576564 0.11364292249502 91.224 4 Zr 0.88635707750498 0.25600097395151 0.51231001423437 91.224 5 Zr 0.51231001423437 0.88635707750498 0.25600097395150 91.224 6 Zr 0.00000000000000 0.00000000000000 0.00000000000000 91.224 7 Zr 0.48768998576563 0.11364292249503 0.74399902604850 91.224 8 Zr 0.11364292249502 0.74399902604850 0.48768998576563 91.224 9 Zr 0.25600097395150 0.51231001423437 0.88635707750498 91.224 10 O 0.76704177966998 0.32284109821549 0.03674473436485 15.999 11 O 0.85064136177771 0.58573858398901 0.15377666664775 15.999 12 O 0.84622333335225 0.14935863822229 0.41426141601099 15.999 13 O 0.96325526563515 0.23295822033002 0.67715890178451 15.999 14 O 0.67715890178451 0.96325526563515 0.23295822033002 15.999 15 O 0.41426141601099 0.84622333335225 0.14935863822229 15.999 16 O 0.76293037446505 0.76293037446505 0.76293037446505 15.999 17 O 0.57194241530049 0.57194241530049 0.57194241530049 15.999 18 O 0.23706962553495 0.23706962553496 0.23706962553495 15.999 19 O 0.42805758469951 0.42805758469951 0.42805758469951 15.999 20 O 0.58573858398901 0.15377666664775 0.85064136177771 15.999 21 O 0.32284109821549 0.03674473436485 0.76704177966998 15.999 22 O 0.03674473436485 0.76704177966998 0.32284109821549 15.999 23 O 0.15377666664775 0.85064136177772 0.58573858398901 15.999 24 O 0.14935863822229 0.41426141601100 0.84622333335225 15.999 25 O 0.23295822033002 0.67715890178451 0.96325526563515 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 6.389190709308572 0.000000000000000 0.000000000000000 b -3.194595354654286 5.533201463884740 0.000000000000000 c 0.000000000000000 0.000000000000000 26.719392609999996 Atomic positions (fractional): 1 Sr 0.66666666666667 0.33333333333333 0.66682027170074 87.620 > 1 2 Sr 0.66666666666667 0.33333333333333 0.99984639496592 87.620 > 2 3 Sr 0.33333333333333 0.66666666666667 0.00015360503408 87.620 > 1 4 Sr 0.33333333333333 0.66666666666667 0.33317972829926 87.620 > 2 5 Sr 0.00000000000000 0.00000000000000 0.33348693836741 87.620 > 1 6 Sr 0.00000000000000 0.00000000000000 0.66651306163259 87.620 > 2 7 Zr 0.96222171461211 0.66813438894136 0.78177731143638 91.224 > 7 8 Zr 0.00146772227469 0.37257934099592 0.88488935523028 91.224 > 8 9 Zr 0.62742065900408 0.62888838127878 0.88488935523028 91.224 > 9 10 Zr 0.00000000000000 0.00000000000000 0.00000000000000 91.224 > 10 11 Zr 0.70591267432925 0.03777828538789 0.78177731143638 91.224 > 11 12 Zr 0.33186561105864 0.29408732567075 0.78177731143638 91.224 > 12 13 Zr 0.37111161872122 0.99853227772530 0.88488935523028 91.224 > 13 14 Zr 0.62888838127878 0.00146772227469 0.11511064476972 91.224 > 7 15 Zr 0.66813438894136 0.70591267432925 0.21822268856362 91.224 > 8 16 Zr 0.29408732567075 0.96222171461211 0.21822268856362 91.224 > 9 17 Zr 0.66666666666667 0.33333333333333 0.33333333333333 91.224 > 10 18 Zr 0.37257934099592 0.37111161872122 0.11511064476972 91.224 > 11 19 Zr 0.99853227772530 0.62742065900408 0.11511064476972 91.224 > 12 20 Zr 0.03777828538789 0.33186561105864 0.21822268856362 91.224 > 13 21 Zr 0.29555504794545 0.33480105560803 0.44844397810305 91.224 > 7 22 Zr 0.33480105560803 0.03924600766258 0.55155602189695 91.224 > 8 23 Zr 0.96075399233742 0.29555504794545 0.55155602189695 91.224 > 9 24 Zr 0.33333333333333 0.66666666666667 0.66666666666667 91.224 > 10 25 Zr 0.03924600766258 0.70444495205455 0.44844397810305 91.224 > 11 26 Zr 0.66519894439197 0.96075399233742 0.44844397810305 91.224 > 12 27 Zr 0.70444495205455 0.66519894439197 0.55155602189695 91.224 > 13 28 O 0.05816590891987 0.67213113638526 0.70887587075011 15.999 > 28 29 O 0.98725582430622 0.70960887082374 0.86338553747149 15.999 > 29 30 O 0.04294220415707 0.38901971318418 0.80328112919518 15.999 > 30 31 O 0.00546446971859 0.28063189413205 0.95779079591656 15.999 > 31 32 O 0.71936810586795 0.72483257558654 0.95779079591656 15.999 > 32 33 O 0.61098028681582 0.65392249097289 0.80328112919518 15.999 > 33 34 O 0.00000000000000 0.00000000000000 0.76293037446505 15.999 > 34 35 O 0.66666666666667 0.33333333333333 0.90527574863382 15.999 > 35 36 O 0.33333333333333 0.66666666666667 0.90373629220162 15.999 > 36 37 O 0.66666666666667 0.33333333333333 0.76139091803284 15.999 > 37 38 O 0.72235304651752 0.01274417569378 0.86338553747149 15.999 > 38 39 O 0.61396522746538 0.94183409108013 0.70887587075011 15.999 > 39 40 O 0.32786886361474 0.38603477253462 0.70887587075011 15.999 > 40 41 O 0.29039112917626 0.27764695348248 0.86338553747149 15.999 > 41 42 O 0.34607750902711 0.95705779584293 0.80328112919518 15.999 > 42 43 O 0.27516742441346 0.99453553028141 0.95779079591656 15.999 > 43 44 O 0.72483257558654 0.00546446971859 0.04220920408344 15.999 > 28 45 O 0.65392249097289 0.04294220415707 0.19671887080482 15.999 > 29 46 O 0.70960887082374 0.72235304651752 0.13661446252851 15.999 > 30 47 O 0.67213113638525 0.61396522746538 0.29112412924989 15.999 > 31 48 O 0.38603477253462 0.05816590891987 0.29112412924989 15.999 > 32 49 O 0.27764695348248 0.98725582430622 0.13661446252851 15.999 > 33 50 O 0.66666666666667 0.33333333333333 0.09626370779838 15.999 > 34 51 O 0.33333333333333 0.66666666666667 0.23860908196716 15.999 > 35 52 O 0.00000000000000 0.00000000000000 0.23706962553495 15.999 > 36 53 O 0.33333333333333 0.66666666666667 0.09472425136618 15.999 > 37 54 O 0.38901971318418 0.34607750902711 0.19671887080482 15.999 > 38 55 O 0.28063189413205 0.27516742441346 0.04220920408344 15.999 > 39 56 O 0.99453553028141 0.71936810586795 0.04220920408344 15.999 > 40 57 O 0.95705779584293 0.61098028681582 0.19671887080482 15.999 > 41 58 O 0.01274417569378 0.29039112917626 0.13661446252851 15.999 > 42 59 O 0.94183409108013 0.32786886361474 0.29112412924989 15.999 > 43 60 O 0.39149924225321 0.33879780305192 0.37554253741677 15.999 > 28 61 O 0.32058915763956 0.37627553749041 0.53005220413816 15.999 > 29 62 O 0.37627553749041 0.05568637985085 0.46994779586184 15.999 > 30 63 O 0.33879780305192 0.94729856079871 0.62445746258323 15.999 > 31 64 O 0.05270143920128 0.39149924225321 0.62445746258323 15.999 > 32 65 O 0.94431362014915 0.32058915763956 0.46994779586184 15.999 > 33 66 O 0.33333333333333 0.66666666666667 0.42959704113171 15.999 > 34 67 O 0.00000000000000 0.00000000000000 0.57194241530049 15.999 > 35 68 O 0.66666666666667 0.33333333333333 0.57040295886829 15.999 > 36 69 O 0.00000000000000 0.00000000000000 0.42805758469951 15.999 > 37 70 O 0.05568637985085 0.67941084236044 0.53005220413816 15.999 > 38 71 O 0.94729856079871 0.60850075774679 0.37554253741677 15.999 > 39 72 O 0.66120219694808 0.05270143920128 0.37554253741677 15.999 > 40 73 O 0.62372446250959 0.94431362014915 0.53005220413816 15.999 > 41 74 O 0.67941084236044 0.62372446250959 0.46994779586184 15.999 > 42 75 O 0.60850075774679 0.66120219694808 0.62445746258323 15.999 > 43 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.8115258 0.0000004 0.0000000 -0.0000004 4.8115258 0.0000000 0.0000000 0.0000000 5.0091614 -------------------------- Born effective charges -------------------------- 1 Sr 2.3521493 0.0034881 -0.0000000 -0.0034881 2.3521493 -0.0000000 0.0000000 0.0000000 2.9066051 2 Sr 2.3521493 0.0034881 -0.0000000 -0.0034881 2.3521493 -0.0000000 0.0000000 0.0000000 2.9066051 3 Zr 4.3607770 -0.1111612 -0.4288298 -0.1220136 5.9393811 -0.1206082 -0.3458750 -0.0075707 5.2859537 4 Zr 5.4437624 0.7472755 0.3188647 0.7364231 4.8563957 -0.3110734 0.1794939 -0.2957512 5.2859537 5 Zr 5.6456977 -0.6198357 0.1099651 -0.6306881 4.6544604 0.4316816 0.1663811 0.3033219 5.2859537 6 Zr 5.8586183 -0.0532316 -0.0000000 0.0532316 5.8586183 -0.0000000 0.0000000 0.0000000 6.3832566 7 Zr 5.6456977 -0.6198357 0.1099651 -0.6306881 4.6544604 0.4316816 0.1663811 0.3033219 5.2859537 8 Zr 5.4437624 0.7472755 0.3188647 0.7364231 4.8563957 -0.3110734 0.1794939 -0.2957512 5.2859537 9 Zr 4.3607770 -0.1111612 -0.4288298 -0.1220136 5.9393811 -0.1206082 -0.3458750 -0.0075707 5.2859537 10 O -2.7121265 0.0378351 1.2178305 0.0180239 -1.6721496 0.0361398 1.2776638 0.0263423 -3.8235386 11 O -2.8927809 -0.3028689 0.1080975 -0.3028208 -2.3377407 0.0108189 -0.0390462 0.0593028 -2.3735778 12 O -2.7387721 0.3917379 -0.0634182 0.3917859 -2.4917496 0.0882057 -0.0318346 -0.0634664 -2.3735778 13 O -1.9079562 0.4462640 -0.6402133 0.4264528 -2.4763200 1.0366023 -0.6616450 1.0933181 -3.8235386 14 O -1.9563315 -0.4543824 -0.5776173 -0.4741936 -2.4279446 -1.0727421 -0.6160188 -1.1196604 -3.8235386 15 O -2.2142294 -0.0889411 -0.0446793 -0.0888930 -3.0162922 -0.0990247 0.0708808 0.0041636 -2.3735778 16 O -3.2967912 0.1730555 -0.0000000 -0.1730555 -3.2967912 -0.0000000 0.0000000 0.0000000 -1.6650496 17 O -3.0127078 -0.1958510 -0.0000000 0.1958510 -3.0127078 -0.0000000 0.0000000 0.0000000 -1.6996955 18 O -3.2967912 0.1730555 -0.0000000 -0.1730555 -3.2967912 -0.0000000 0.0000000 0.0000000 -1.6650496 19 O -3.0127078 -0.1958510 -0.0000000 0.1958510 -3.0127078 -0.0000000 0.0000000 0.0000000 -1.6996955 20 O -2.2142294 -0.0889411 -0.0446793 -0.0888930 -3.0162922 -0.0990247 0.0708808 0.0041636 -2.3735778 21 O -1.9563315 -0.4543824 -0.5776173 -0.4741936 -2.4279446 -1.0727421 -0.6160188 -1.1196604 -3.8235386 22 O -1.9079562 0.4462640 -0.6402133 0.4264528 -2.4763200 1.0366023 -0.6616450 1.0933181 -3.8235386 23 O -2.7387721 0.3917379 -0.0634182 0.3917859 -2.4917496 0.0882057 -0.0318346 -0.0634664 -2.3735778 24 O -2.8927809 -0.3028689 0.1080975 -0.3028208 -2.3377407 0.0108189 -0.0390462 0.0593028 -2.3735778 25 O -2.7121265 0.0378351 1.2178305 0.0180239 -1.6721496 0.0361398 1.2776638 0.0263423 -3.8235386 ---------------------------------------------------------------------------- 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 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 7, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [-0.0050 0.0087 0.0000] [ 0.0050 -0.0087 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 10, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 28, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [-0.0050 0.0087 0.0000] [ 0.0050 -0.0087 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 29, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [-0.0050 0.0087 0.0000] [ 0.0050 -0.0087 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 34, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] 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 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (xxx) -0.00000000 (xxx) -0.00000000 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (zz) 0.00000000 (zz) 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 2026-01-09 02:06:56]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 02:06:56]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 1 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.194595354654289 1.844400487961578 8.906464203333323 b -3.194595354654282 1.844400487961578 8.906464203333323 c 0.000000000000003 -3.688800975923162 8.906464203333323 Atomic positions (fractional): 1 Sr 0.33348693836741 0.33348693836741 0.33348693836741 87.620 2 Sr 0.66651306163259 0.66651306163259 0.66651306163259 87.620 3 Zr 0.74399902604850 0.48768998576564 0.11364292249502 91.224 4 Zr 0.88635707750498 0.25600097395151 0.51231001423437 91.224 5 Zr 0.51231001423437 0.88635707750498 0.25600097395150 91.224 6 Zr 0.00000000000000 0.00000000000000 0.00000000000000 91.224 7 Zr 0.48768998576563 0.11364292249503 0.74399902604850 91.224 8 Zr 0.11364292249502 0.74399902604850 0.48768998576563 91.224 9 Zr 0.25600097395150 0.51231001423437 0.88635707750498 91.224 10 O 0.76704177966998 0.32284109821549 0.03674473436485 15.999 11 O 0.85064136177771 0.58573858398901 0.15377666664775 15.999 12 O 0.84622333335225 0.14935863822229 0.41426141601099 15.999 13 O 0.96325526563515 0.23295822033002 0.67715890178451 15.999 14 O 0.67715890178451 0.96325526563515 0.23295822033002 15.999 15 O 0.41426141601099 0.84622333335225 0.14935863822229 15.999 16 O 0.76293037446505 0.76293037446505 0.76293037446505 15.999 17 O 0.57194241530049 0.57194241530049 0.57194241530049 15.999 18 O 0.23706962553495 0.23706962553496 0.23706962553495 15.999 19 O 0.42805758469951 0.42805758469951 0.42805758469951 15.999 20 O 0.58573858398901 0.15377666664775 0.85064136177771 15.999 21 O 0.32284109821549 0.03674473436485 0.76704177966998 15.999 22 O 0.03674473436485 0.76704177966998 0.32284109821549 15.999 23 O 0.15377666664775 0.85064136177772 0.58573858398901 15.999 24 O 0.14935863822229 0.41426141601100 0.84622333335225 15.999 25 O 0.23295822033002 0.67715890178451 0.96325526563515 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 6.389190709308572 0.000000000000000 0.000000000000000 b -3.194595354654286 5.533201463884740 0.000000000000000 c 0.000000000000000 0.000000000000000 26.719392609999996 Atomic positions (fractional): 1 Sr 0.66666666666667 0.33333333333333 0.66682027170074 87.620 > 1 2 Sr 0.66666666666667 0.33333333333333 0.99984639496592 87.620 > 2 3 Sr 0.33333333333333 0.66666666666667 0.00015360503408 87.620 > 1 4 Sr 0.33333333333333 0.66666666666667 0.33317972829926 87.620 > 2 5 Sr 0.00000000000000 0.00000000000000 0.33348693836741 87.620 > 1 6 Sr 0.00000000000000 0.00000000000000 0.66651306163259 87.620 > 2 7 Zr 0.96222171461211 0.66813438894136 0.78177731143638 91.224 > 7 8 Zr 0.00146772227469 0.37257934099592 0.88488935523028 91.224 > 8 9 Zr 0.62742065900408 0.62888838127878 0.88488935523028 91.224 > 9 10 Zr 0.00000000000000 0.00000000000000 0.00000000000000 91.224 > 10 11 Zr 0.70591267432925 0.03777828538789 0.78177731143638 91.224 > 11 12 Zr 0.33186561105864 0.29408732567075 0.78177731143638 91.224 > 12 13 Zr 0.37111161872122 0.99853227772530 0.88488935523028 91.224 > 13 14 Zr 0.62888838127878 0.00146772227469 0.11511064476972 91.224 > 7 15 Zr 0.66813438894136 0.70591267432925 0.21822268856362 91.224 > 8 16 Zr 0.29408732567075 0.96222171461211 0.21822268856362 91.224 > 9 17 Zr 0.66666666666667 0.33333333333333 0.33333333333333 91.224 > 10 18 Zr 0.37257934099592 0.37111161872122 0.11511064476972 91.224 > 11 19 Zr 0.99853227772530 0.62742065900408 0.11511064476972 91.224 > 12 20 Zr 0.03777828538789 0.33186561105864 0.21822268856362 91.224 > 13 21 Zr 0.29555504794545 0.33480105560803 0.44844397810305 91.224 > 7 22 Zr 0.33480105560803 0.03924600766258 0.55155602189695 91.224 > 8 23 Zr 0.96075399233742 0.29555504794545 0.55155602189695 91.224 > 9 24 Zr 0.33333333333333 0.66666666666667 0.66666666666667 91.224 > 10 25 Zr 0.03924600766258 0.70444495205455 0.44844397810305 91.224 > 11 26 Zr 0.66519894439197 0.96075399233742 0.44844397810305 91.224 > 12 27 Zr 0.70444495205455 0.66519894439197 0.55155602189695 91.224 > 13 28 O 0.05816590891987 0.67213113638526 0.70887587075011 15.999 > 28 29 O 0.98725582430622 0.70960887082374 0.86338553747149 15.999 > 29 30 O 0.04294220415707 0.38901971318418 0.80328112919518 15.999 > 30 31 O 0.00546446971859 0.28063189413205 0.95779079591656 15.999 > 31 32 O 0.71936810586795 0.72483257558654 0.95779079591656 15.999 > 32 33 O 0.61098028681582 0.65392249097289 0.80328112919518 15.999 > 33 34 O 0.00000000000000 0.00000000000000 0.76293037446505 15.999 > 34 35 O 0.66666666666667 0.33333333333333 0.90527574863382 15.999 > 35 36 O 0.33333333333333 0.66666666666667 0.90373629220162 15.999 > 36 37 O 0.66666666666667 0.33333333333333 0.76139091803284 15.999 > 37 38 O 0.72235304651752 0.01274417569378 0.86338553747149 15.999 > 38 39 O 0.61396522746538 0.94183409108013 0.70887587075011 15.999 > 39 40 O 0.32786886361474 0.38603477253462 0.70887587075011 15.999 > 40 41 O 0.29039112917626 0.27764695348248 0.86338553747149 15.999 > 41 42 O 0.34607750902711 0.95705779584293 0.80328112919518 15.999 > 42 43 O 0.27516742441346 0.99453553028141 0.95779079591656 15.999 > 43 44 O 0.72483257558654 0.00546446971859 0.04220920408344 15.999 > 28 45 O 0.65392249097289 0.04294220415707 0.19671887080482 15.999 > 29 46 O 0.70960887082374 0.72235304651752 0.13661446252851 15.999 > 30 47 O 0.67213113638525 0.61396522746538 0.29112412924989 15.999 > 31 48 O 0.38603477253462 0.05816590891987 0.29112412924989 15.999 > 32 49 O 0.27764695348248 0.98725582430622 0.13661446252851 15.999 > 33 50 O 0.66666666666667 0.33333333333333 0.09626370779838 15.999 > 34 51 O 0.33333333333333 0.66666666666667 0.23860908196716 15.999 > 35 52 O 0.00000000000000 0.00000000000000 0.23706962553495 15.999 > 36 53 O 0.33333333333333 0.66666666666667 0.09472425136618 15.999 > 37 54 O 0.38901971318418 0.34607750902711 0.19671887080482 15.999 > 38 55 O 0.28063189413205 0.27516742441346 0.04220920408344 15.999 > 39 56 O 0.99453553028141 0.71936810586795 0.04220920408344 15.999 > 40 57 O 0.95705779584293 0.61098028681582 0.19671887080482 15.999 > 41 58 O 0.01274417569378 0.29039112917626 0.13661446252851 15.999 > 42 59 O 0.94183409108013 0.32786886361474 0.29112412924989 15.999 > 43 60 O 0.39149924225321 0.33879780305192 0.37554253741677 15.999 > 28 61 O 0.32058915763956 0.37627553749041 0.53005220413816 15.999 > 29 62 O 0.37627553749041 0.05568637985085 0.46994779586184 15.999 > 30 63 O 0.33879780305192 0.94729856079871 0.62445746258323 15.999 > 31 64 O 0.05270143920128 0.39149924225321 0.62445746258323 15.999 > 32 65 O 0.94431362014915 0.32058915763956 0.46994779586184 15.999 > 33 66 O 0.33333333333333 0.66666666666667 0.42959704113171 15.999 > 34 67 O 0.00000000000000 0.00000000000000 0.57194241530049 15.999 > 35 68 O 0.66666666666667 0.33333333333333 0.57040295886829 15.999 > 36 69 O 0.00000000000000 0.00000000000000 0.42805758469951 15.999 > 37 70 O 0.05568637985085 0.67941084236044 0.53005220413816 15.999 > 38 71 O 0.94729856079871 0.60850075774679 0.37554253741677 15.999 > 39 72 O 0.66120219694808 0.05270143920128 0.37554253741677 15.999 > 40 73 O 0.62372446250959 0.94431362014915 0.53005220413816 15.999 > 41 74 O 0.67941084236044 0.62372446250959 0.46994779586184 15.999 > 42 75 O 0.60850075774679 0.66120219694808 0.62445746258323 15.999 > 43 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.8115258 0.0000004 0.0000000 -0.0000004 4.8115258 0.0000000 0.0000000 0.0000000 5.0091614 -------------------------- Born effective charges -------------------------- 1 Sr 2.3521493 0.0034881 -0.0000000 -0.0034881 2.3521493 -0.0000000 0.0000000 0.0000000 2.9066051 2 Sr 2.3521493 0.0034881 -0.0000000 -0.0034881 2.3521493 -0.0000000 0.0000000 0.0000000 2.9066051 3 Zr 4.3607770 -0.1111612 -0.4288298 -0.1220136 5.9393811 -0.1206082 -0.3458750 -0.0075707 5.2859537 4 Zr 5.4437624 0.7472755 0.3188647 0.7364231 4.8563957 -0.3110734 0.1794939 -0.2957512 5.2859537 5 Zr 5.6456977 -0.6198357 0.1099651 -0.6306881 4.6544604 0.4316816 0.1663811 0.3033219 5.2859537 6 Zr 5.8586183 -0.0532316 -0.0000000 0.0532316 5.8586183 -0.0000000 0.0000000 0.0000000 6.3832566 7 Zr 5.6456977 -0.6198357 0.1099651 -0.6306881 4.6544604 0.4316816 0.1663811 0.3033219 5.2859537 8 Zr 5.4437624 0.7472755 0.3188647 0.7364231 4.8563957 -0.3110734 0.1794939 -0.2957512 5.2859537 9 Zr 4.3607770 -0.1111612 -0.4288298 -0.1220136 5.9393811 -0.1206082 -0.3458750 -0.0075707 5.2859537 10 O -2.7121265 0.0378351 1.2178305 0.0180239 -1.6721496 0.0361398 1.2776638 0.0263423 -3.8235386 11 O -2.8927809 -0.3028689 0.1080975 -0.3028208 -2.3377407 0.0108189 -0.0390462 0.0593028 -2.3735778 12 O -2.7387721 0.3917379 -0.0634182 0.3917859 -2.4917496 0.0882057 -0.0318346 -0.0634664 -2.3735778 13 O -1.9079562 0.4462640 -0.6402133 0.4264528 -2.4763200 1.0366023 -0.6616450 1.0933181 -3.8235386 14 O -1.9563315 -0.4543824 -0.5776173 -0.4741936 -2.4279446 -1.0727421 -0.6160188 -1.1196604 -3.8235386 15 O -2.2142294 -0.0889411 -0.0446793 -0.0888930 -3.0162922 -0.0990247 0.0708808 0.0041636 -2.3735778 16 O -3.2967912 0.1730555 -0.0000000 -0.1730555 -3.2967912 -0.0000000 0.0000000 0.0000000 -1.6650496 17 O -3.0127078 -0.1958510 -0.0000000 0.1958510 -3.0127078 -0.0000000 0.0000000 0.0000000 -1.6996955 18 O -3.2967912 0.1730555 -0.0000000 -0.1730555 -3.2967912 -0.0000000 0.0000000 0.0000000 -1.6650496 19 O -3.0127078 -0.1958510 -0.0000000 0.1958510 -3.0127078 -0.0000000 0.0000000 0.0000000 -1.6996955 20 O -2.2142294 -0.0889411 -0.0446793 -0.0888930 -3.0162922 -0.0990247 0.0708808 0.0041636 -2.3735778 21 O -1.9563315 -0.4543824 -0.5776173 -0.4741936 -2.4279446 -1.0727421 -0.6160188 -1.1196604 -3.8235386 22 O -1.9079562 0.4462640 -0.6402133 0.4264528 -2.4763200 1.0366023 -0.6616450 1.0933181 -3.8235386 23 O -2.7387721 0.3917379 -0.0634182 0.3917859 -2.4917496 0.0882057 -0.0318346 -0.0634664 -2.3735778 24 O -2.8927809 -0.3028689 0.1080975 -0.3028208 -2.3377407 0.0108189 -0.0390462 0.0593028 -2.3735778 25 O -2.7121265 0.0378351 1.2178305 0.0180239 -1.6721496 0.0361398 1.2776638 0.0263423 -3.8235386 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (xxx) -0.00000000 (xxx) -0.00000000 (xxx) Max drift of fc2: 0.00000000 (xx) 0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 9 9 9 ] 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: 0.61, Number of G-points: 293, Lambda: 0.14 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/125) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 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 3.121 ( 0.000 0.000 0.000) 0.000 3.121 ( 0.000 0.000 0.000) 0.000 3.787 ( 0.000 0.000 0.000) 0.000 3.787 ( 0.000 0.000 0.000) 0.000 3.931 ( 0.000 0.000 0.000) 0.000 4.032 ( 0.000 0.000 0.000) 0.000 4.421 ( 0.000 0.000 0.000) 0.000 4.421 ( 0.000 0.000 0.000) 0.000 4.628 ( 0.000 0.000 0.000) 0.000 4.628 ( 0.000 0.000 0.000) 0.000 5.522 ( 0.000 0.000 0.000) 0.000 5.570 ( 0.000 0.000 0.000) 0.000 5.588 ( 0.000 0.000 0.000) 0.000 5.588 ( 0.000 0.000 0.000) 0.000 5.639 ( 0.000 0.000 0.000) 0.000 5.639 ( 0.000 0.000 0.000) 0.000 6.283 ( 0.000 0.000 0.000) 0.000 6.396 ( 0.000 0.000 0.000) 0.000 6.519 ( 0.000 0.000 0.000) 0.000 6.519 ( 0.000 0.000 0.000) 0.000 6.721 ( 0.000 0.000 0.000) 0.000 7.464 ( 0.000 0.000 0.000) 0.000 7.464 ( 0.000 0.000 0.000) 0.000 7.512 ( 0.000 0.000 0.000) 0.000 8.200 ( 0.000 0.000 0.000) 0.000 8.272 ( 0.000 0.000 0.000) 0.000 8.338 ( 0.000 0.000 0.000) 0.000 8.338 ( 0.000 0.000 0.000) 0.000 8.439 ( 0.000 0.000 0.000) 0.000 8.439 ( 0.000 0.000 0.000) 0.000 8.890 ( 0.000 0.000 0.000) 0.000 9.106 ( 0.000 0.000 0.000) 0.000 9.106 ( 0.000 0.000 0.000) 0.000 9.217 ( 0.000 0.000 0.000) 0.000 9.217 ( 0.000 0.000 0.000) 0.000 9.247 ( 0.000 0.000 0.000) 0.000 10.256 ( 0.000 0.000 0.000) 0.000 10.256 ( 0.000 0.000 0.000) 0.000 10.386 ( 0.000 0.000 0.000) 0.000 11.143 ( 0.000 0.000 0.000) 0.000 11.143 ( 0.000 0.000 0.000) 0.000 11.315 ( 0.000 0.000 0.000) 0.000 11.329 ( 0.000 0.000 0.000) 0.000 11.329 ( 0.000 0.000 0.000) 0.000 11.464 ( 0.000 0.000 0.000) 0.000 11.565 ( 0.000 0.000 0.000) 0.000 11.565 ( 0.000 0.000 0.000) 0.000 12.358 ( 0.000 0.000 0.000) 0.000 12.932 ( 0.000 0.000 0.000) 0.000 12.932 ( 0.000 0.000 0.000) 0.000 13.380 ( 0.000 0.000 0.000) 0.000 13.666 ( 0.000 0.000 0.000) 0.000 13.724 ( 0.000 0.000 0.000) 0.000 13.757 ( 0.000 0.000 0.000) 0.000 13.757 ( 0.000 0.000 0.000) 0.000 14.944 ( 0.000 0.000 0.000) 0.000 14.950 ( 0.000 0.000 0.000) 0.000 15.851 ( 0.000 0.000 0.000) 0.000 15.851 ( 0.000 0.000 0.000) 0.000 16.264 ( 0.000 0.000 0.000) 0.000 16.264 ( 0.000 0.000 0.000) 0.000 16.819 ( 0.000 0.000 0.000) 0.000 17.335 ( 0.000 0.000 0.000) 0.000 17.335 ( 0.000 0.000 0.000) 0.000 17.499 ( 0.000 0.000 0.000) 0.000 17.499 ( 0.000 0.000 0.000) 0.000 18.595 ( 0.000 0.000 0.000) 0.000 20.731 ( 0.000 0.000 0.000) 0.000 20.731 ( 0.000 0.000 0.000) 0.000 21.076 ( 0.000 0.000 0.000) 0.000 21.076 ( 0.000 0.000 0.000) 0.000 22.981 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/125) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.606 ( 28.567 12.100 -1.384) 31.055 0.849 ( 36.736 17.920 4.541) 41.125 1.290 ( 47.630 31.819 25.796) 62.821 3.125 ( -0.499 0.176 -5.672) 5.697 3.197 ( 6.871 3.126 -1.371) 7.672 3.729 ( -3.211 -3.620 -1.530) 5.075 3.786 ( -4.205 2.364 2.634) 5.496 3.926 ( -2.923 -2.324 0.171) 3.738 3.947 ( -1.041 -2.892 -0.023) 3.074 4.302 ( -7.296 -5.692 0.408) 9.263 4.411 ( 0.620 2.726 0.518) 2.844 4.717 ( 5.985 -4.727 -3.851) 8.544 4.770 ( 2.558 9.655 3.179) 10.482 5.313 ( -7.916 -6.335 -8.904) 13.494 5.416 ( -12.437 -4.520 12.531) 18.224 5.535 ( 0.017 -1.849 -10.563) 10.723 5.557 ( 0.031 -0.905 9.278) 9.322 5.766 ( 6.884 6.324 -17.579) 19.910 5.948 ( 10.458 4.450 16.393) 19.947 6.342 ( -0.291 0.001 0.724) 0.780 6.362 ( 2.620 -0.223 -4.946) 5.601 6.444 ( -5.529 -1.139 -2.833) 6.316 6.600 ( 6.437 4.346 -3.487) 8.514 6.810 ( 5.409 2.591 10.532) 12.120 7.468 ( -5.435 -0.049 2.344) 5.919 7.500 ( 3.344 1.007 -2.450) 4.266 7.580 ( -6.156 -3.778 4.109) 8.310 7.964 ( -18.844 -8.947 0.411) 20.864 8.105 ( -4.823 -12.721 -10.675) 17.293 8.242 ( 2.171 -6.177 -1.763) 6.781 8.333 ( -12.203 8.523 2.494) 15.092 8.662 ( 10.683 -0.242 5.263) 11.911 8.698 ( 1.822 9.312 -3.714) 10.189 8.942 ( 1.462 6.607 -4.405) 8.074 9.122 ( 8.137 -5.516 5.240) 11.140 9.196 ( -2.900 -2.112 -2.040) 4.127 9.265 ( 3.334 3.188 -0.554) 4.646 9.411 ( 6.283 8.798 8.193) 13.564 9.568 ( 0.769 -1.622 -9.727) 9.891 10.195 ( -5.702 -2.127 -0.240) 6.091 10.303 ( -4.928 -3.844 -4.660) 7.796 10.962 ( -12.315 -0.690 -19.562) 23.126 11.064 ( -5.859 -6.606 8.740) 12.424 11.149 ( -3.000 -6.506 1.942) 7.423 11.279 ( -2.468 -2.484 -2.669) 4.403 11.324 ( 1.292 0.554 -5.333) 5.515 11.374 ( 0.082 0.729 4.249) 4.312 11.579 ( 2.523 -0.879 2.207) 3.466 11.849 ( 11.757 13.108 -7.591) 19.175 12.333 ( -2.525 -1.177 6.060) 6.670 12.655 ( 7.282 1.838 5.471) 9.292 12.927 ( -0.538 -0.283 2.408) 2.483 13.398 ( 1.488 -0.263 -4.094) 4.364 13.504 ( -5.957 -3.320 -0.216) 6.823 13.615 ( -4.617 -2.975 1.099) 5.601 13.671 ( -6.103 -4.878 2.170) 8.109 13.971 ( 8.152 10.305 -7.420) 15.090 14.876 ( -5.027 -2.655 0.684) 5.726 15.052 ( 4.092 7.444 -1.185) 8.576 15.373 ( 8.375 -7.522 13.003) 17.199 15.550 ( -20.723 -9.440 2.534) 22.913 15.880 ( -20.768 -6.918 8.002) 23.307 16.358 ( 6.886 -0.694 -0.992) 6.992 16.736 ( 9.676 4.783 4.150) 11.564 16.958 ( 12.897 7.467 -0.120) 14.904 17.373 ( -6.066 -2.787 -2.304) 7.062 17.623 ( 10.203 6.212 0.274) 11.949 17.663 ( 19.736 13.254 -0.040) 23.774 18.698 ( 11.474 9.636 -12.243) 19.349 20.209 ( -9.722 -10.516 22.565) 26.727 20.688 ( -4.229 -0.398 -1.735) 4.588 20.951 ( -7.663 -7.143 3.588) 11.073 21.045 ( 0.466 -5.958 -2.664) 6.543 21.257 ( -0.655 6.488 2.835) 7.111 22.885 ( -7.850 -4.503 -1.619) 9.194 ======================= Grid point 2 (3/125) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.222 ( 29.161 11.614 -2.787) 31.512 1.657 ( 33.295 16.665 3.579) 37.405 2.463 ( 39.367 27.144 23.745) 53.389 3.030 ( -4.364 -3.760 -9.787) 11.356 3.394 ( 11.236 4.744 -3.191) 12.607 3.636 ( -3.337 -7.407 1.979) 8.361 3.646 ( -10.387 4.384 -3.579) 11.829 3.870 ( -1.387 0.974 -3.090) 3.524 3.968 ( 1.162 -1.488 5.564) 5.875 4.166 ( -0.297 -3.825 4.213) 5.698 4.484 ( 2.211 4.425 -0.989) 5.045 4.710 ( 0.485 -5.634 1.056) 5.753 4.855 ( -2.732 7.054 -4.001) 8.557 5.139 ( -9.720 1.291 -0.436) 9.815 5.208 ( -5.766 -11.261 6.963) 14.441 5.455 ( -0.881 -3.688 -0.365) 3.809 5.604 ( 1.823 0.230 -0.533) 1.913 5.847 ( 3.328 5.995 -13.314) 14.976 6.183 ( 5.435 2.232 6.385) 8.677 6.264 ( -3.550 -8.508 -4.753) 10.372 6.282 ( -0.323 -2.098 3.417) 4.023 6.504 ( 5.586 4.560 -4.668) 8.590 6.757 ( 4.088 7.704 -8.938) 12.488 7.002 ( 7.220 2.328 10.381) 12.857 7.351 ( -9.246 -1.306 -5.509) 10.842 7.403 ( -10.694 -4.302 7.292) 13.640 7.483 ( -9.871 -2.897 8.712) 13.480 7.636 ( 0.647 -6.811 -6.153) 9.202 7.873 ( -0.303 -7.873 -11.110) 13.620 8.194 ( -7.196 4.362 1.807) 8.607 8.279 ( -2.710 2.693 4.290) 5.744 8.755 ( 4.232 0.114 -2.176) 4.760 8.846 ( 0.341 1.354 6.394) 6.544 8.956 ( -0.162 4.193 -8.307) 9.307 9.121 ( -1.499 -1.011 -1.485) 2.340 9.288 ( 5.888 0.779 4.037) 7.182 9.373 ( 8.363 -3.728 1.919) 9.355 9.442 ( -7.229 4.075 -0.134) 8.300 9.664 ( 6.391 5.988 -0.047) 8.758 10.017 ( -9.893 -2.083 -4.855) 11.215 10.153 ( -3.161 -7.646 2.131) 8.544 10.622 ( -13.602 -6.904 -14.660) 21.157 10.955 ( -4.047 -3.447 7.862) 9.491 11.014 ( -6.751 -3.139 4.373) 8.634 11.231 ( 0.049 -2.005 0.080) 2.008 11.345 ( 1.963 3.135 -4.750) 6.020 11.408 ( 1.758 0.042 0.978) 2.012 11.661 ( 6.208 0.145 0.543) 6.233 12.045 ( 1.961 6.287 -6.858) 9.507 12.325 ( -2.379 1.797 8.661) 9.160 12.741 ( -1.420 -1.244 -2.942) 3.495 12.992 ( 6.391 0.864 4.228) 7.712 13.301 ( -2.997 -4.232 0.905) 5.264 13.451 ( -7.645 -8.104 4.809) 12.134 13.527 ( -1.008 0.401 -0.506) 1.198 13.571 ( 2.711 2.592 -2.001) 4.252 14.161 ( 6.335 7.901 -6.326) 11.940 14.750 ( -6.098 -3.419 0.519) 7.010 15.022 ( -18.467 -10.342 5.727) 21.927 15.156 ( -6.136 8.025 -4.506) 11.062 15.348 ( -10.107 -7.369 -2.275) 12.714 15.820 ( 16.155 -3.515 7.093) 17.990 16.448 ( 3.759 1.635 -0.934) 4.204 16.979 ( 12.816 0.772 9.529) 15.989 17.165 ( -3.665 -9.417 -8.816) 13.410 17.314 ( 7.283 20.704 1.708) 22.014 17.936 ( 16.508 6.959 0.156) 17.916 18.218 ( 23.735 16.476 -0.978) 28.910 18.990 ( 11.086 13.913 -6.040) 18.787 19.974 ( -10.658 -16.732 21.786) 29.465 20.558 ( -8.838 -1.488 -3.934) 9.788 20.736 ( -9.807 -6.598 2.426) 12.066 20.947 ( -1.180 -9.549 -3.940) 10.397 21.311 ( -0.879 5.856 1.956) 6.237 22.620 ( -13.578 -7.672 -3.724) 16.034 ======================= Grid point 3 (4/125) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.806 ( 26.445 9.518 -4.873) 28.525 2.295 ( 19.429 9.777 0.031) 21.751 2.885 ( 1.338 -2.519 -4.891) 5.662 3.280 ( 6.368 7.468 4.503) 10.798 3.417 ( 2.800 5.876 9.826) 11.786 3.574 ( 1.131 -0.602 -0.080) 1.283 3.704 ( 11.262 4.114 -3.243) 12.421 3.870 ( 0.100 1.923 1.268) 2.306 3.951 ( -1.800 -0.419 3.280) 3.765 4.287 ( 7.709 4.988 2.081) 9.415 4.512 ( -2.879 -0.829 1.319) 3.273 4.670 ( -3.717 1.697 4.467) 6.054 4.814 ( -7.534 5.424 -2.578) 9.635 4.985 ( -2.562 -2.775 -7.402) 8.310 5.051 ( 0.153 -8.683 2.097) 8.934 5.468 ( 1.828 -0.986 12.134) 12.311 5.609 ( 3.197 -3.302 -8.656) 9.801 5.889 ( -1.495 7.636 -6.972) 10.448 6.107 ( -2.472 -10.818 1.003) 11.142 6.213 ( 0.342 -0.451 -2.924) 2.978 6.363 ( 5.369 -2.525 3.848) 7.072 6.586 ( 1.835 -1.080 -0.205) 2.140 6.726 ( -11.293 2.634 0.861) 11.628 6.981 ( -4.534 -4.167 -11.548) 13.088 7.141 ( -14.079 -1.648 -3.972) 14.721 7.238 ( -1.318 1.832 2.407) 3.300 7.547 ( 9.244 3.559 7.596) 12.483 7.639 ( 6.257 -6.320 3.558) 9.578 7.840 ( 1.619 3.562 -10.473) 11.180 8.173 ( -4.130 10.777 6.279) 13.139 8.268 ( -0.702 -3.055 2.171) 3.813 8.723 ( -7.136 -5.800 0.571) 9.213 8.823 ( 2.161 0.646 -1.396) 2.652 8.996 ( -0.764 -0.773 -3.553) 3.716 9.063 ( -2.005 -3.263 -3.997) 5.535 9.269 ( -4.864 2.791 3.353) 6.534 9.441 ( -2.024 7.624 2.947) 8.421 9.474 ( 6.343 -8.131 2.334) 10.574 9.814 ( 3.215 7.217 -4.470) 9.078 9.849 ( -4.407 1.649 -5.513) 7.248 10.055 ( 0.283 -10.832 3.216) 11.303 10.276 ( -12.253 -5.013 -5.462) 14.322 10.873 ( -5.025 -0.170 3.384) 6.061 10.969 ( 0.843 -1.418 5.464) 5.708 11.237 ( 1.942 -1.090 0.724) 2.342 11.419 ( -0.859 7.944 0.061) 7.991 11.448 ( 6.520 -2.180 -2.284) 7.244 11.783 ( 8.465 -1.588 -1.774) 8.794 12.035 ( -3.795 2.408 -3.272) 5.559 12.313 ( -5.078 2.000 5.909) 8.044 12.583 ( -10.189 -5.061 -3.055) 11.780 13.024 ( -3.270 -6.211 0.610) 7.046 13.237 ( -2.007 -3.769 -1.131) 4.418 13.389 ( 3.984 2.389 8.006) 9.256 13.519 ( 2.545 -0.069 -1.621) 3.018 13.701 ( 5.816 3.817 -0.823) 7.005 14.290 ( 4.474 3.527 -5.725) 8.076 14.597 ( -8.633 -3.638 4.861) 10.554 14.683 ( -9.491 -5.609 2.075) 11.218 15.084 ( -6.796 -3.046 3.151) 8.087 15.143 ( -7.730 6.668 -9.480) 13.931 16.116 ( 18.542 -6.228 1.105) 19.591 16.518 ( 0.648 5.427 -2.077) 5.847 16.930 ( -6.882 -8.876 0.268) 11.235 17.265 ( 10.678 2.363 3.931) 11.621 17.711 ( 14.350 19.150 2.110) 24.023 18.280 ( 14.572 5.307 -0.451) 15.515 18.736 ( 17.332 13.520 -3.198) 22.213 19.237 ( 2.372 11.787 -6.963) 13.894 19.768 ( -1.677 -15.561 24.572) 29.133 20.312 ( -13.052 -4.610 -2.699) 14.103 20.522 ( -8.961 -3.684 -2.535) 10.015 20.789 ( -3.752 -9.651 -2.932) 10.762 21.388 ( 2.941 5.161 3.400) 6.845 22.256 ( -15.718 -8.749 -5.663) 18.859 ======================= Grid point 4 (5/125) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.204 ( 8.824 5.110 -3.704) 10.848 2.535 ( 16.737 -3.715 -5.921) 18.138 2.821 ( -16.991 2.766 5.960) 18.217 3.320 ( 6.304 4.228 -1.598) 7.757 3.550 ( 6.356 0.302 -4.695) 7.908 3.693 ( -1.242 -3.037 11.057) 11.534 3.846 ( 2.151 2.905 2.149) 4.205 3.908 ( 0.617 0.358 -2.459) 2.561 4.053 ( 10.649 5.177 -0.540) 11.853 4.351 ( -11.973 -3.673 4.646) 13.358 4.408 ( 1.217 0.911 -1.157) 1.911 4.620 ( -3.991 1.974 1.958) 4.864 4.753 ( -5.706 13.278 -8.425) 16.728 4.827 ( -0.330 -14.455 1.728) 14.562 5.264 ( 14.559 4.000 6.360) 16.384 5.496 ( -2.756 -4.490 -6.996) 8.758 5.677 ( 9.069 8.195 6.173) 13.693 5.926 ( -1.017 7.333 -3.100) 8.026 5.956 ( -2.328 -15.326 3.258) 15.841 6.147 ( -3.041 -3.926 -1.937) 5.331 6.334 ( -8.350 -0.917 -2.658) 8.810 6.546 ( -1.440 1.295 8.824) 9.034 6.613 ( -0.200 -2.654 -4.075) 4.867 6.913 ( -5.787 -1.018 -5.407) 7.985 6.976 ( 7.653 1.336 -7.918) 11.093 7.141 ( -9.818 -1.591 3.945) 10.700 7.707 ( 2.300 0.227 10.623) 10.871 7.744 ( 3.590 0.861 -8.235) 9.024 7.953 ( 9.547 8.488 -3.935) 13.367 8.175 ( -6.321 -5.968 3.308) 9.302 8.321 ( 4.538 9.348 4.547) 11.343 8.542 ( -5.485 -6.995 -1.714) 9.052 8.824 ( -2.804 3.102 -2.117) 4.687 8.861 ( -3.507 -8.064 0.933) 8.843 9.010 ( -0.144 -0.131 -2.408) 2.416 9.299 ( 1.625 2.106 3.432) 4.342 9.412 ( -2.981 -2.679 -5.831) 7.075 9.550 ( 2.579 7.085 7.815) 10.859 9.794 ( -3.476 -5.158 -9.279) 11.170 9.849 ( 2.490 -0.254 -0.494) 2.552 9.980 ( -1.867 -1.661 2.100) 3.264 10.128 ( -1.781 0.400 0.632) 1.932 10.831 ( -1.435 0.235 1.760) 2.283 11.003 ( 1.350 -0.314 1.846) 2.308 11.265 ( 1.180 -0.292 0.549) 1.334 11.434 ( -1.080 1.720 -0.110) 2.034 11.606 ( 7.939 3.766 0.259) 8.791 11.869 ( 2.995 -4.048 -2.289) 5.531 11.965 ( -3.585 0.780 -0.672) 3.729 12.264 ( -3.129 1.270 2.211) 4.036 12.362 ( -6.649 -1.856 -1.580) 7.081 12.862 ( -4.004 -5.968 0.255) 7.192 13.210 ( -0.416 0.748 0.057) 0.857 13.510 ( 2.240 2.293 2.431) 4.023 13.565 ( 2.880 -1.232 -1.181) 3.348 13.808 ( 2.654 1.773 0.125) 3.194 14.339 ( 1.506 -0.313 -0.784) 1.726 14.488 ( -2.825 -0.552 3.360) 4.424 14.559 ( -2.786 -0.750 -1.211) 3.129 14.977 ( -2.470 -1.870 1.020) 3.262 15.070 ( -3.430 3.212 -4.132) 6.258 16.315 ( 9.652 -4.741 0.339) 10.759 16.542 ( -2.812 4.881 -2.990) 6.377 16.777 ( -2.866 -3.589 1.671) 4.887 17.410 ( 3.080 0.808 1.105) 3.371 18.149 ( 12.042 11.026 3.286) 16.655 18.507 ( 7.068 1.490 -0.431) 7.236 18.957 ( -0.857 2.495 -5.084) 5.727 19.252 ( -0.896 0.942 1.371) 1.890 19.859 ( 8.081 1.123 10.466) 13.270 20.063 ( -7.999 -5.536 -0.228) 9.731 20.339 ( -6.073 -0.874 -4.494) 7.606 20.634 ( -2.948 -4.904 -1.043) 5.816 21.564 ( 8.701 5.841 5.117) 11.662 21.884 ( -13.577 -7.610 -6.100) 16.717 ======================= Grid point 10 (6/125) ======================= q-point: ( 0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.618 ( -14.810 28.629 4.628) 32.563 0.930 ( 4.349 38.974 15.545) 42.184 1.395 ( 3.919 51.168 38.583) 64.204 3.122 ( 2.502 1.170 -6.562) 7.119 3.162 ( -2.987 6.396 -6.294) 9.457 3.746 ( 4.972 -5.772 1.099) 7.697 3.765 ( -1.580 -1.203 -0.586) 2.070 3.946 ( -2.985 -0.543 3.305) 4.486 3.971 ( -1.883 -3.229 2.973) 4.776 4.299 ( 2.687 -11.049 -0.219) 11.373 4.401 ( -0.553 2.127 -0.703) 2.307 4.612 ( -2.458 -0.183 -11.390) 11.653 4.868 ( 3.227 9.470 9.010) 13.464 5.275 ( -0.467 -8.800 -8.237) 12.063 5.430 ( -1.076 -6.559 0.690) 6.683 5.447 ( -0.343 -7.535 2.258) 7.874 5.670 ( -1.073 1.485 -1.590) 2.426 5.725 ( 2.758 7.221 -7.263) 10.606 5.978 ( -1.396 10.019 14.377) 17.579 6.312 ( -1.050 -0.556 -4.147) 4.314 6.377 ( -1.030 3.828 -5.580) 6.845 6.479 ( 3.714 -4.008 4.054) 6.804 6.519 ( -0.348 3.392 -11.047) 11.561 6.877 ( -0.732 5.720 15.768) 16.790 7.357 ( 1.556 -10.089 -9.301) 13.810 7.524 ( 1.322 3.255 1.360) 3.768 7.676 ( -0.885 -3.347 12.798) 13.258 7.970 ( -1.503 -19.630 0.982) 19.712 8.168 ( 0.241 -1.927 -3.220) 3.760 8.246 ( -9.596 -7.206 -0.450) 12.009 8.323 ( 7.719 -9.011 2.407) 12.107 8.579 ( 5.479 10.442 -8.655) 14.628 8.725 ( -1.781 6.248 -0.491) 6.515 8.931 ( 3.601 8.003 -5.569) 10.394 9.102 ( 1.165 -4.103 3.760) 5.685 9.180 ( 2.268 1.557 -11.336) 11.665 9.226 ( -3.800 -0.140 0.731) 3.873 9.353 ( 0.196 8.670 0.052) 8.673 9.640 ( -0.327 7.553 3.556) 8.355 10.211 ( 1.643 -5.399 2.661) 6.239 10.282 ( -1.285 -5.153 -5.627) 7.737 10.836 ( 3.553 -11.189 -21.698) 24.670 11.072 ( -3.349 -6.314 -2.681) 7.634 11.184 ( -5.888 -4.856 2.972) 8.191 11.243 ( -1.311 -1.642 -8.591) 8.845 11.326 ( 0.304 1.889 -1.273) 2.299 11.363 ( 1.920 0.284 2.987) 3.562 11.615 ( 2.437 1.943 6.568) 7.271 11.864 ( 3.107 18.668 -3.745) 19.292 12.354 ( 0.634 -2.884 6.496) 7.135 12.692 ( -4.044 3.254 10.669) 11.865 12.907 ( 0.547 -2.255 -0.741) 2.436 13.352 ( -1.278 1.094 -7.476) 7.663 13.494 ( -0.494 -5.318 -1.630) 5.584 13.631 ( 1.551 -6.018 2.813) 6.821 13.657 ( 2.540 -7.186 0.118) 7.623 13.970 ( 4.300 12.590 -5.034) 14.225 14.879 ( -0.097 -4.531 -2.710) 5.281 15.081 ( -1.025 10.162 0.434) 10.222 15.444 ( -8.072 -8.616 15.751) 19.685 15.574 ( 1.196 -20.341 6.828) 21.489 15.906 ( 8.866 -21.207 14.176) 27.006 16.373 ( -7.310 5.096 1.449) 9.028 16.689 ( -0.436 5.859 -2.825) 6.519 16.967 ( -4.153 13.780 1.167) 14.439 17.402 ( 6.530 -3.637 2.109) 7.766 17.624 ( 3.132 11.145 0.568) 11.591 17.653 ( -2.409 23.830 -1.649) 24.008 18.646 ( 3.877 21.229 -16.012) 26.872 20.292 ( -6.801 -20.700 28.411) 35.804 20.710 ( 3.618 -2.734 1.745) 4.860 20.917 ( -9.869 -10.394 -1.829) 14.449 21.038 ( 0.500 -2.786 -2.515) 3.786 21.310 ( 5.588 -0.321 9.341) 10.890 22.875 ( 0.056 -9.351 -2.661) 9.722 ======================= Grid point 11 (7/125) ======================= q-point: ( 0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.952 ( 16.029 25.651 -11.392) 32.322 1.508 ( 13.902 32.141 18.393) 39.555 2.351 ( 26.655 40.614 32.857) 58.648 3.071 ( -6.298 0.413 -9.141) 11.109 3.234 ( 7.992 5.132 -10.701) 14.308 3.667 ( -6.486 -4.408 4.969) 9.283 3.780 ( -5.839 -5.255 -1.786) 8.056 3.852 ( 8.363 -2.451 0.170) 8.717 3.941 ( -2.243 4.685 3.252) 6.128 4.289 ( -9.410 1.551 1.220) 9.614 4.372 ( 9.731 -5.946 1.420) 11.492 4.579 ( 2.268 -1.590 -6.945) 7.477 4.992 ( -3.124 -1.963 2.591) 4.508 5.167 ( -1.210 2.590 7.262) 7.805 5.308 ( -5.289 -8.437 -1.094) 10.018 5.379 ( 0.318 -6.552 -3.185) 7.292 5.666 ( -2.285 2.276 5.626) 6.485 5.790 ( 3.093 9.096 -18.979) 21.272 6.139 ( 3.189 2.865 10.264) 11.123 6.238 ( -4.195 -4.568 -2.390) 6.646 6.296 ( -2.231 -2.360 -4.569) 5.605 6.504 ( 0.209 8.158 -10.614) 13.388 6.671 ( 10.794 6.363 -2.108) 12.706 6.989 ( 1.277 3.178 9.988) 10.559 7.291 ( 4.660 -8.212 -7.215) 11.883 7.503 ( -4.848 -12.549 2.137) 13.621 7.591 ( -5.653 -6.236 8.982) 12.309 7.734 ( -10.453 -1.042 4.785) 11.544 7.875 ( -11.772 -3.781 -4.806) 13.266 8.180 ( 2.278 0.535 -3.722) 4.396 8.480 ( 1.253 -0.093 5.973) 6.104 8.602 ( 3.742 -0.367 -3.181) 4.925 8.855 ( 7.256 3.179 -3.732) 8.757 8.990 ( -5.629 -1.245 -4.992) 7.626 9.067 ( 7.097 2.635 6.520) 9.991 9.126 ( -3.218 -3.024 -3.828) 5.844 9.380 ( 6.469 4.500 -4.571) 9.110 9.466 ( 4.830 1.324 -0.798) 5.071 9.715 ( -2.303 9.335 11.264) 14.809 10.122 ( -6.170 -6.797 -5.740) 10.826 10.133 ( -4.235 -7.753 3.908) 9.660 10.620 ( -4.008 -13.204 -17.201) 22.052 10.927 ( -0.382 -9.406 -4.813) 10.573 11.050 ( -3.809 -3.132 3.338) 5.955 11.240 ( 0.638 -0.482 -0.211) 0.827 11.334 ( -1.367 4.237 -5.059) 6.739 11.406 ( 1.988 1.185 2.227) 3.211 11.652 ( -2.595 2.957 5.091) 6.434 12.070 ( 3.268 8.446 -2.562) 9.411 12.380 ( 0.980 -1.668 11.621) 11.781 12.735 ( 0.563 4.860 -0.580) 4.927 12.925 ( 4.245 -1.273 -0.106) 4.433 13.277 ( -3.016 -5.816 -0.882) 6.611 13.497 ( 2.604 1.489 -2.682) 4.024 13.537 ( -5.497 -6.146 2.823) 8.716 13.602 ( -2.572 -3.115 0.489) 4.069 14.130 ( 3.754 8.232 -3.270) 9.620 14.778 ( -3.530 -6.125 -1.817) 7.300 15.175 ( 6.446 -16.720 2.846) 18.144 15.208 ( -12.766 -14.387 3.103) 19.483 15.400 ( -3.562 16.542 -2.761) 17.145 15.780 ( -9.192 -9.419 17.963) 22.269 16.435 ( 4.024 9.217 -9.658) 13.943 16.767 ( 7.347 -1.252 3.097) 8.070 17.046 ( 2.507 5.612 -2.539) 6.650 17.652 ( 3.719 13.737 4.636) 14.967 17.696 ( 6.137 12.486 -0.164) 13.914 18.072 ( 15.953 22.443 -0.943) 27.551 18.969 ( 10.112 20.608 -3.360) 23.200 19.990 ( -9.645 -25.026 19.223) 32.997 20.639 ( -6.729 -6.194 -2.481) 9.476 20.768 ( 0.964 -6.075 0.592) 6.180 20.926 ( -6.865 -3.830 -4.325) 8.972 21.364 ( -0.114 -1.231 5.623) 5.758 22.684 ( -7.159 -12.672 -4.715) 15.299 ======================= Grid point 12 (8/125) ======================= q-point: ( 0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.463 ( 22.116 18.837 -15.518) 32.935 2.151 ( 17.032 22.771 14.240) 31.802 2.883 ( -6.694 -0.544 -7.787) 10.283 3.211 ( 16.943 16.445 16.646) 28.889 3.388 ( 7.836 1.611 -1.621) 8.162 3.527 ( 0.991 0.141 -2.484) 2.678 3.728 ( -1.924 6.165 -1.789) 6.701 3.950 ( -6.855 5.219 -0.371) 8.623 3.981 ( 2.438 0.361 2.539) 3.539 4.243 ( 5.065 5.570 10.321) 12.775 4.501 ( 7.967 -2.481 3.214) 8.942 4.586 ( 4.024 -2.994 -1.195) 5.156 4.844 ( -4.300 -9.293 5.474) 11.611 5.037 ( -9.828 -6.863 -3.426) 12.467 5.196 ( -9.754 0.643 -2.525) 10.096 5.395 ( 7.415 2.066 2.401) 8.064 5.611 ( -7.327 1.230 -2.938) 7.989 5.889 ( 6.262 3.903 -6.669) 9.946 6.088 ( -5.640 -3.424 -2.036) 6.905 6.180 ( 0.069 -1.899 -5.756) 6.061 6.285 ( 2.661 -2.890 7.615) 8.568 6.561 ( 1.644 4.729 -6.334) 8.074 6.832 ( 0.591 5.404 -10.426) 11.758 7.073 ( -7.460 -4.013 2.431) 8.813 7.163 ( 4.189 -3.763 -4.307) 7.090 7.308 ( -2.725 -8.547 -0.728) 9.000 7.476 ( -7.004 -6.028 7.822) 12.107 7.595 ( 1.844 3.261 6.363) 7.384 7.832 ( -0.967 5.865 -3.047) 6.680 8.217 ( 1.581 0.348 0.917) 1.860 8.444 ( -7.787 6.631 4.329) 11.106 8.704 ( 8.230 -4.086 0.782) 9.222 8.818 ( -9.320 -4.488 0.827) 10.378 8.947 ( 2.787 -0.416 -7.325) 7.848 9.014 ( -1.883 -5.101 -8.339) 9.955 9.260 ( 10.386 -4.341 8.218) 13.937 9.433 ( -3.560 1.491 5.021) 6.334 9.501 ( 0.016 3.770 -6.854) 7.823 9.800 ( -1.119 0.951 3.173) 3.497 9.956 ( -3.497 -1.824 -5.557) 6.814 9.992 ( -3.644 -5.072 4.078) 7.458 10.367 ( -6.190 -5.344 -9.294) 12.380 10.847 ( 4.773 -9.851 -5.480) 12.241 10.980 ( -4.577 -0.100 4.091) 6.140 11.246 ( -0.570 0.454 5.666) 5.713 11.362 ( 2.493 4.263 -4.809) 6.893 11.483 ( 2.558 5.380 -0.532) 5.981 11.668 ( 0.748 0.090 3.070) 3.161 12.108 ( -2.127 1.065 -1.443) 2.783 12.408 ( -1.337 -1.947 8.961) 9.267 12.688 ( -7.662 -2.918 -1.743) 8.382 13.042 ( 0.673 4.731 -0.330) 4.790 13.129 ( 0.865 -10.897 -0.627) 10.950 13.390 ( -3.801 -7.328 4.665) 9.482 13.512 ( 1.402 2.213 -1.471) 3.005 13.651 ( 4.517 5.945 -1.281) 7.575 14.230 ( 2.962 3.059 -5.084) 6.631 14.640 ( -4.009 -7.097 0.516) 8.167 14.799 ( -10.650 -14.884 3.158) 18.572 15.119 ( -2.055 -8.707 2.625) 9.323 15.443 ( -14.973 15.835 -7.874) 23.172 15.808 ( 13.708 -0.707 11.055) 17.624 16.557 ( 2.277 11.074 -7.384) 13.503 16.862 ( 4.470 -7.131 1.643) 8.575 17.169 ( 6.076 7.117 2.580) 9.707 17.854 ( -0.820 25.311 2.095) 25.411 18.038 ( 17.429 4.606 0.383) 18.032 18.579 ( 17.505 18.542 -2.363) 25.609 19.282 ( 3.841 12.970 -7.599) 15.515 19.703 ( -1.898 -21.899 26.436) 34.381 20.429 ( -7.422 -6.274 -7.827) 12.478 20.625 ( -11.410 -6.477 -0.869) 13.149 20.789 ( -2.685 -3.139 2.434) 4.794 21.370 ( 1.853 -2.010 2.172) 3.492 22.356 ( -11.599 -13.849 -7.039) 19.388 ======================= Grid point 13 (9/125) ======================= q-point: ( 0.44 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.954 ( 23.077 13.237 -14.408) 30.255 2.426 ( -4.434 1.116 3.547) 5.787 2.987 ( 10.338 13.051 4.121) 17.152 3.253 ( -0.836 -4.005 0.849) 4.178 3.567 ( -4.566 5.207 -4.604) 8.316 3.682 ( 5.196 1.531 3.830) 6.634 3.790 ( 5.086 4.929 -3.677) 7.980 3.859 ( 0.633 2.943 0.146) 3.014 4.057 ( 0.824 2.990 5.362) 6.194 4.403 ( 1.760 -0.141 4.343) 4.688 4.531 ( -6.757 -0.298 4.431) 8.086 4.618 ( 2.693 -14.398 9.129) 17.260 4.747 ( -9.038 -6.496 -6.602) 12.941 4.936 ( -0.115 5.853 5.974) 8.364 5.114 ( 10.062 13.371 -1.424) 16.795 5.455 ( -4.022 -4.428 -8.203) 10.152 5.587 ( 8.739 3.207 8.178) 12.390 5.891 ( -4.389 -10.511 2.516) 11.665 6.038 ( 0.701 8.245 -0.818) 8.315 6.111 ( -2.102 -3.991 -8.427) 9.558 6.329 ( 2.206 -3.285 -0.112) 3.959 6.583 ( 0.019 0.021 4.339) 4.339 6.752 ( -11.415 -5.954 -8.096) 15.209 6.855 ( 0.131 8.298 -8.279) 11.722 7.068 ( -9.557 -0.827 0.351) 9.599 7.259 ( -3.654 -0.898 -0.782) 3.843 7.576 ( 12.942 -1.453 3.950) 13.609 7.736 ( 3.735 4.830 5.769) 8.400 7.852 ( 2.481 3.842 -6.925) 8.299 8.210 ( -2.917 -4.264 3.472) 6.225 8.432 ( -3.694 7.018 4.808) 9.274 8.613 ( -8.589 -3.091 1.769) 9.299 8.761 ( 2.707 -7.885 4.108) 9.293 8.885 ( -2.813 -4.597 -3.070) 6.203 8.921 ( 2.819 -4.349 -9.131) 10.499 9.340 ( 2.532 -5.669 2.047) 6.538 9.404 ( -3.762 3.554 0.226) 5.180 9.518 ( 3.351 -1.814 -3.789) 5.374 9.752 ( 0.257 -0.992 -1.804) 2.075 9.819 ( -3.550 -7.252 -0.557) 8.093 10.026 ( 0.415 5.079 2.418) 5.641 10.247 ( -5.234 6.225 -5.855) 10.021 10.836 ( 4.167 -5.964 -3.519) 8.082 10.931 ( -1.524 -0.532 1.491) 2.197 11.285 ( 0.165 2.030 6.620) 6.927 11.446 ( 2.311 2.489 0.377) 3.418 11.586 ( 1.867 8.811 -1.735) 9.172 11.721 ( 6.622 -2.686 2.725) 7.648 12.035 ( -3.760 -2.199 -3.703) 5.717 12.387 ( -5.913 1.114 5.928) 8.447 12.442 ( -9.294 -7.111 -1.776) 11.837 12.858 ( -6.028 -10.397 2.328) 12.241 13.218 ( 0.432 1.038 -0.281) 1.158 13.326 ( 7.637 -8.809 0.019) 11.659 13.606 ( 2.764 6.855 -0.746) 7.428 13.788 ( 3.752 5.473 -0.646) 6.667 14.260 ( 3.179 -1.936 -5.699) 6.807 14.513 ( -2.777 -8.475 7.496) 11.650 14.583 ( -3.775 -4.867 -2.853) 6.788 15.023 ( -3.578 -3.373 6.428) 8.093 15.271 ( -13.081 9.763 -9.961) 19.122 16.105 ( 11.976 2.479 8.642) 14.976 16.673 ( 1.760 10.228 -5.579) 11.783 16.811 ( -5.599 1.674 -1.693) 6.084 17.374 ( 6.249 3.332 7.467) 10.291 18.121 ( 5.868 16.501 -3.239) 17.811 18.349 ( 11.960 4.532 0.812) 12.816 18.938 ( 6.227 6.534 -5.344) 10.489 19.223 ( 0.669 -10.951 0.772) 10.998 19.818 ( 6.379 4.904 19.480) 21.076 20.193 ( -11.347 -1.300 -7.139) 13.469 20.347 ( -6.915 -10.125 -5.430) 13.410 20.729 ( -5.497 1.099 7.432) 9.309 21.444 ( 8.606 -1.270 0.948) 8.751 21.975 ( -12.045 -12.955 -8.095) 19.454 ======================= Grid point 14 (10/125) ======================= q-point: (-0.44 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.321 ( -6.362 0.963 4.904) 8.090 2.428 ( 23.630 6.509 -8.243) 25.859 2.948 ( -20.465 2.027 2.785) 20.753 3.349 ( 1.420 1.707 -4.359) 4.892 3.577 ( 5.399 5.457 -2.125) 7.965 3.692 ( -3.402 -3.667 5.133) 7.167 3.838 ( -1.107 -1.358 -5.268) 5.551 3.971 ( 1.087 6.918 -1.864) 7.247 4.130 ( 5.885 1.176 3.394) 6.895 4.257 ( -11.014 -8.494 -0.225) 13.911 4.474 ( -1.258 0.681 5.890) 6.062 4.551 ( -1.638 -6.386 4.317) 7.880 4.572 ( 1.067 -8.510 1.066) 8.643 4.956 ( -2.752 9.428 3.120) 10.305 5.315 ( 1.369 -5.377 -11.044) 12.359 5.555 ( 7.113 13.773 9.407) 18.133 5.653 ( -7.508 -15.735 2.757) 17.651 5.892 ( 8.260 0.968 6.821) 10.755 5.942 ( 2.277 0.952 -10.434) 10.721 6.163 ( 2.294 9.394 -1.703) 9.819 6.231 ( -3.741 -3.339 -7.649) 9.146 6.553 ( -3.490 -0.853 -4.391) 5.673 6.676 ( 2.518 4.529 9.613) 10.921 6.960 ( -6.468 5.261 3.014) 8.865 6.979 ( 7.831 5.366 -5.844) 11.148 7.129 ( -7.198 -2.978 4.148) 8.825 7.701 ( -0.498 2.165 -8.017) 8.319 7.783 ( 1.775 -1.074 8.005) 8.269 7.940 ( 0.984 -9.712 -8.411) 12.886 8.133 ( 1.604 2.241 6.574) 7.128 8.366 ( -8.185 -4.103 -1.261) 9.243 8.566 ( 0.861 5.086 4.977) 7.168 8.736 ( 1.797 -4.899 6.946) 8.688 8.836 ( 3.432 -1.355 -0.527) 3.728 8.937 ( 4.734 -2.567 -4.482) 7.007 9.318 ( 1.115 -2.070 -7.178) 7.553 9.391 ( -2.321 -2.166 4.981) 5.907 9.444 ( 1.031 -7.934 -6.891) 10.559 9.780 ( 2.872 -1.801 0.954) 3.521 9.832 ( 5.042 4.667 4.597) 8.266 10.037 ( -3.969 2.502 1.077) 4.814 10.223 ( -5.090 11.038 -7.406) 14.234 10.812 ( -0.817 -1.945 -1.906) 2.843 10.932 ( 3.525 -2.956 -4.679) 6.562 11.319 ( -1.893 1.191 6.370) 6.752 11.433 ( -3.375 -2.135 2.290) 4.604 11.707 ( -1.102 5.507 0.105) 5.617 11.851 ( 6.764 0.943 2.425) 7.247 11.953 ( 0.379 -0.711 -3.562) 3.652 12.210 ( -4.071 -4.601 -0.816) 6.197 12.347 ( -2.737 -1.045 3.689) 4.711 12.799 ( 5.737 -1.339 2.116) 6.259 13.163 ( 1.318 -9.237 1.051) 9.390 13.401 ( 4.146 -1.663 -3.240) 5.518 13.687 ( -1.486 5.377 0.100) 5.580 13.845 ( -1.664 2.037 -0.847) 2.764 14.276 ( 4.600 -2.264 -8.054) 9.547 14.438 ( -0.678 -8.279 8.172) 11.652 14.524 ( 1.390 0.016 -2.273) 2.664 14.980 ( -1.652 -1.098 4.277) 4.715 15.149 ( -7.427 8.454 -2.816) 11.600 16.325 ( 6.609 2.160 8.694) 11.132 16.674 ( -5.260 -0.587 -12.488) 13.563 16.805 ( -3.873 15.268 6.640) 17.094 17.469 ( -1.250 2.474 3.931) 4.810 18.202 ( -4.784 -5.292 -8.809) 11.335 18.546 ( 2.610 4.437 2.686) 5.806 18.918 ( 2.195 -5.098 0.648) 5.589 19.209 ( 0.109 -4.698 0.092) 4.700 19.974 ( -9.373 -0.368 -3.408) 9.980 20.024 ( 3.155 7.005 -3.493) 8.440 20.228 ( 4.532 -3.675 6.115) 8.452 20.721 ( -2.147 6.739 6.855) 9.850 21.561 ( -1.237 -9.860 -7.699) 12.570 21.734 ( 7.633 -0.261 1.852) 7.859 ======================= Grid point 15 (11/125) ======================= q-point: (-0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.164 ( -16.639 -0.964 2.035) 16.791 2.569 ( -19.541 -4.794 2.698) 20.301 2.876 ( 15.953 10.525 -1.203) 19.150 3.199 ( -7.881 -7.880 -2.758) 11.481 3.495 ( -11.027 -4.635 -7.855) 14.310 3.687 ( -2.792 3.296 1.657) 4.627 3.799 ( 0.515 -0.699 1.048) 1.360 3.932 ( -11.697 -4.496 0.136) 12.533 3.994 ( -5.945 7.120 -1.964) 9.482 4.359 ( 3.348 -4.090 -0.837) 5.351 4.423 ( 2.607 2.751 -0.095) 3.791 4.516 ( 3.956 -5.029 -3.336) 7.216 4.581 ( 4.383 -9.148 14.995) 18.103 5.065 ( 4.289 6.817 0.778) 8.092 5.193 ( -10.481 -2.009 1.024) 10.720 5.400 ( -0.336 -2.722 -13.099) 13.383 5.765 ( -2.640 7.473 3.949) 8.855 5.785 ( 4.368 -9.866 8.527) 13.752 6.152 ( -0.186 1.972 -4.820) 5.211 6.244 ( -1.063 6.416 -1.823) 6.754 6.348 ( 18.446 4.930 -2.274) 19.228 6.485 ( -1.430 1.705 -10.074) 10.317 6.774 ( -5.796 10.236 5.703) 13.073 6.947 ( 3.646 -3.502 6.358) 8.123 7.071 ( 0.045 0.081 12.061) 12.061 7.154 ( 5.458 4.126 -4.455) 8.164 7.628 ( -4.577 -0.555 -4.372) 6.354 7.695 ( -3.361 -11.899 -6.757) 14.090 7.877 ( 1.372 2.634 8.884) 9.368 8.073 ( -6.876 -6.700 -1.757) 9.760 8.324 ( -0.352 6.341 2.293) 6.752 8.667 ( 4.306 1.992 -0.333) 4.756 8.792 ( 3.964 -2.023 7.476) 8.700 8.937 ( 5.967 -1.931 2.195) 6.645 9.006 ( 6.815 1.841 -2.322) 7.431 9.204 ( -2.304 -9.827 -8.300) 13.068 9.308 ( 2.641 -3.768 -0.580) 4.638 9.542 ( 5.618 3.907 4.485) 8.182 9.764 ( -1.601 -5.678 1.802) 6.168 9.910 ( -5.338 0.419 3.178) 6.227 10.114 ( 11.475 7.692 -0.603) 13.828 10.226 ( -5.339 12.453 -5.567) 14.648 10.782 ( 2.209 -1.594 -4.977) 5.674 10.926 ( 1.333 -1.954 -6.969) 7.359 11.298 ( -1.988 -2.348 6.109) 6.840 11.351 ( -3.242 -3.388 1.552) 4.939 11.632 ( -8.913 4.417 -0.008) 9.947 11.872 ( -3.278 -6.222 -3.130) 7.698 12.011 ( 3.185 3.491 8.121) 9.396 12.178 ( 4.525 -3.666 -2.674) 6.408 12.474 ( 9.975 7.041 4.017) 12.854 12.963 ( 8.803 1.216 0.431) 8.897 13.147 ( 7.358 -5.657 0.273) 9.286 13.379 ( -2.458 -1.712 -6.202) 6.887 13.635 ( -7.531 0.108 0.989) 7.597 13.778 ( -5.647 -1.102 0.189) 5.756 14.318 ( 1.437 -2.091 0.453) 2.578 14.404 ( 6.715 -3.854 -2.862) 8.254 14.600 ( 5.604 2.508 0.517) 6.161 14.991 ( 3.712 -0.578 -1.141) 3.926 15.158 ( -3.357 8.876 7.526) 12.111 16.435 ( -8.479 6.261 -6.771) 12.528 16.480 ( -0.985 -7.553 3.536) 8.398 16.929 ( -0.476 10.421 5.074) 11.601 17.418 ( -7.990 1.483 -3.885) 9.007 17.868 ( -16.337 -7.953 -3.706) 18.544 18.451 ( -12.579 -5.129 2.920) 13.894 18.912 ( -8.404 -3.995 2.995) 9.775 19.143 ( 4.031 -7.851 1.367) 8.931 19.792 ( -5.694 2.101 -16.163) 17.265 20.171 ( 8.991 7.688 -2.334) 12.058 20.408 ( 9.104 2.247 9.491) 13.342 20.841 ( 3.289 8.512 3.084) 9.632 21.339 ( -3.089 -10.659 -5.807) 12.525 22.043 ( 17.937 4.094 3.430) 18.715 ======================= Grid point 16 (12/125) ======================= q-point: (-0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.722 ( -31.517 4.279 -6.609) 32.486 2.069 ( -29.752 -14.668 1.545) 33.208 2.905 ( -26.627 -5.798 -2.596) 27.375 3.071 ( -8.227 -1.126 2.903) 8.797 3.327 ( 15.097 0.405 -1.616) 15.189 3.593 ( -10.210 -1.153 -1.469) 10.380 3.731 ( -5.264 3.533 1.389) 6.490 3.873 ( 1.646 2.755 6.135) 6.924 3.980 ( -2.967 5.533 -6.818) 9.269 4.229 ( -2.834 -1.179 -0.964) 3.217 4.425 ( -0.569 -12.043 1.425) 12.140 4.592 ( 6.542 1.194 -4.101) 7.813 4.741 ( 13.623 -2.454 5.195) 14.785 5.077 ( -4.575 1.643 9.166) 10.375 5.208 ( 5.153 3.189 -3.252) 6.877 5.408 ( 4.245 3.506 -10.870) 12.185 5.685 ( -4.647 -0.830 0.454) 4.743 5.886 ( 1.673 -2.973 16.724) 17.068 6.161 ( 1.012 -1.297 -4.579) 4.865 6.269 ( 2.635 1.528 -1.483) 3.388 6.335 ( -6.464 1.578 -11.661) 13.425 6.654 ( 1.503 2.306 -2.707) 3.861 6.751 ( -5.190 5.470 9.285) 11.961 7.064 ( 0.760 -1.608 -2.954) 3.448 7.172 ( 4.515 0.447 5.223) 6.919 7.208 ( 11.951 1.975 1.497) 12.206 7.456 ( -5.422 -0.717 -5.202) 7.548 7.667 ( 5.419 -6.806 1.608) 8.847 7.920 ( 1.630 -5.493 -3.319) 6.622 8.035 ( 2.029 10.926 9.712) 14.758 8.354 ( -3.828 6.306 1.942) 7.628 8.700 ( 2.182 -7.262 -0.541) 7.602 8.895 ( 1.252 5.868 1.233) 6.125 8.932 ( -0.294 -4.196 0.539) 4.241 9.063 ( 1.430 -6.098 0.299) 6.270 9.202 ( 8.957 -1.357 -6.635) 11.229 9.335 ( 0.819 -1.974 6.926) 7.248 9.633 ( -3.826 6.494 -5.480) 9.319 9.667 ( -3.520 -6.829 9.662) 12.344 9.891 ( 5.655 1.222 2.546) 6.321 10.204 ( -3.952 4.985 -7.143) 9.565 10.452 ( 16.390 7.247 2.264) 18.063 10.847 ( 7.800 -0.096 -6.349) 10.058 10.907 ( 1.654 1.062 -4.700) 5.095 11.281 ( -1.401 -2.174 -0.753) 2.694 11.285 ( 0.566 -2.103 5.941) 6.327 11.525 ( -7.488 1.679 1.745) 7.869 11.726 ( -4.685 -4.658 -2.311) 6.999 12.120 ( -0.184 4.144 10.516) 11.304 12.213 ( 3.780 -2.547 -4.918) 6.705 12.703 ( 6.223 2.919 2.959) 7.484 13.067 ( 1.478 2.080 -3.442) 4.284 13.236 ( -0.502 -4.873 -4.306) 6.522 13.341 ( 10.057 1.794 -2.888) 10.616 13.512 ( -3.047 -2.935 3.704) 5.623 13.656 ( -6.637 -1.176 1.060) 6.823 14.230 ( -5.829 -5.973 8.046) 11.593 14.604 ( 13.091 2.757 -5.120) 14.324 14.789 ( 13.994 5.256 -1.893) 15.068 15.084 ( 6.324 2.322 -4.187) 7.932 15.262 ( 0.883 8.387 12.703) 15.248 16.088 ( -16.715 -9.507 -13.353) 23.411 16.537 ( -1.682 5.913 7.429) 9.642 16.954 ( -1.543 -12.793 -2.535) 13.133 17.189 ( -10.606 4.634 -10.437) 15.585 17.632 ( -14.072 10.626 9.175) 19.878 18.103 ( -16.612 -13.443 2.582) 21.526 18.562 ( -24.433 -2.782 -0.738) 24.602 19.112 ( -6.893 -6.044 14.450) 17.113 19.764 ( 10.297 3.544 -26.231) 28.402 20.429 ( 10.634 5.462 2.500) 12.214 20.624 ( 9.102 4.383 1.587) 10.226 20.962 ( 4.378 -0.408 -3.803) 5.814 21.241 ( 0.950 -3.034 2.896) 4.301 22.410 ( 17.813 3.193 2.108) 18.220 ======================= Grid point 17 (13/125) ======================= q-point: (-0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.173 ( -33.910 8.762 -18.037) 39.396 1.343 ( -36.872 -9.455 6.886) 38.683 2.080 ( -54.113 0.978 6.219) 54.478 3.122 ( 3.471 -1.215 1.246) 3.883 3.323 ( -9.608 0.645 -3.136) 10.127 3.608 ( 9.284 -2.202 3.993) 10.344 3.753 ( 1.976 4.151 1.468) 4.827 3.908 ( -0.834 0.253 1.371) 1.624 3.938 ( -0.856 1.482 -8.618) 8.786 4.262 ( 5.213 -9.179 2.845) 10.933 4.358 ( 0.110 6.809 0.637) 6.839 4.667 ( 3.473 0.149 -5.815) 6.775 4.907 ( -1.890 -0.796 10.026) 10.234 5.121 ( 8.985 0.871 0.793) 9.062 5.284 ( 6.112 -1.959 -0.905) 6.482 5.494 ( 4.644 3.665 -9.229) 10.962 5.601 ( -3.940 -2.157 2.817) 5.303 5.912 ( -3.370 -2.528 14.910) 15.493 6.047 ( -9.694 1.942 -11.861) 15.441 6.288 ( 5.309 1.588 -5.188) 7.591 6.337 ( 3.546 -2.465 -1.925) 4.728 6.546 ( -9.075 -1.096 3.151) 9.668 6.707 ( -8.613 2.747 4.311) 10.016 6.911 ( -8.716 -0.344 -3.201) 9.292 7.324 ( 8.046 -1.775 8.137) 11.580 7.458 ( 6.134 2.494 -5.685) 8.727 7.565 ( 10.535 5.773 -1.829) 12.151 7.671 ( 9.398 -6.218 4.628) 12.182 7.958 ( 10.649 -6.311 -8.068) 14.776 8.193 ( 1.443 2.595 3.344) 4.472 8.404 ( 0.023 7.290 5.660) 9.229 8.622 ( -2.214 -3.625 0.835) 4.329 8.855 ( -5.552 2.930 -0.922) 6.345 8.961 ( -1.412 1.373 7.611) 7.861 9.068 ( 3.327 -2.353 -3.497) 5.370 9.190 ( -1.965 -3.153 -5.130) 6.334 9.357 ( 0.548 -4.282 7.218) 8.410 9.540 ( -12.616 7.351 2.343) 14.788 9.599 ( -0.719 -2.744 -2.800) 3.985 10.087 ( 9.634 0.964 3.204) 10.199 10.201 ( 6.305 -1.260 -4.471) 7.831 10.805 ( 16.246 2.130 4.281) 16.935 10.912 ( 7.237 -0.953 -9.459) 11.949 11.025 ( 6.544 2.514 -0.409) 7.023 11.257 ( 1.813 -1.958 -2.809) 3.875 11.323 ( 1.272 1.018 5.223) 5.471 11.417 ( -5.368 -1.413 0.094) 5.552 11.614 ( -3.423 -2.046 -0.518) 4.021 12.092 ( -11.358 2.982 3.745) 12.326 12.260 ( 4.126 0.081 2.085) 4.623 12.756 ( -3.222 -0.190 -1.603) 3.603 12.949 ( -6.432 0.643 -4.077) 7.642 13.303 ( 8.807 -0.185 -2.695) 9.212 13.480 ( 6.605 -5.421 6.186) 10.549 13.521 ( 0.091 0.006 -0.505) 0.513 13.596 ( 3.389 0.330 0.256) 3.415 14.108 ( -7.710 0.090 7.010) 10.421 14.784 ( 7.404 1.015 -1.509) 7.625 15.175 ( 17.382 -2.798 2.347) 17.761 15.184 ( 4.260 15.211 -4.277) 16.366 15.434 ( 1.459 -3.832 1.150) 4.258 15.662 ( -3.687 -7.374 -4.400) 9.345 16.530 ( -9.605 1.428 -3.999) 10.502 16.735 ( -0.961 -4.468 0.783) 4.636 17.100 ( -7.029 5.436 -5.895) 10.663 17.557 ( -11.619 0.125 10.212) 15.469 17.700 ( -13.508 -3.828 -0.335) 14.044 18.081 ( -28.419 2.133 -0.447) 28.503 18.929 ( -14.909 0.265 9.806) 17.847 19.947 ( 16.391 -0.116 -14.011) 21.563 20.622 ( 6.190 1.021 3.671) 7.269 20.818 ( 9.105 3.229 -6.675) 11.743 20.974 ( 5.415 -6.939 -3.336) 9.413 21.284 ( -0.553 2.548 6.564) 7.063 22.715 ( 14.210 0.016 0.133) 14.210 ======================= Grid point 19 (14/125) ======================= q-point: ( 0.11 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.307 ( -8.123 32.170 7.858) 34.097 1.361 ( -22.936 27.261 7.508) 36.409 2.257 ( -25.157 38.565 31.298) 55.675 3.038 ( 2.986 -0.667 -11.484) 11.885 3.310 ( -7.112 8.704 -5.191) 12.381 3.583 ( 4.783 -8.296 0.324) 9.581 3.762 ( 1.714 0.359 2.352) 2.932 3.897 ( 6.607 0.571 -0.406) 6.644 4.033 ( -0.286 3.565 5.654) 6.690 4.235 ( -7.768 -11.485 -0.797) 13.888 4.354 ( 5.012 3.045 0.046) 5.865 4.667 ( -6.620 -2.461 -7.276) 10.140 4.816 ( 6.164 -2.360 -2.253) 6.974 5.139 ( 6.586 -7.322 3.877) 10.584 5.347 ( 1.711 -5.762 7.050) 9.264 5.499 ( -3.206 2.082 -2.859) 4.773 5.676 ( -3.296 3.414 -19.025) 19.608 5.683 ( 4.924 0.852 10.435) 11.570 6.173 ( -3.957 4.022 4.704) 7.346 6.333 ( 1.981 -4.164 -1.351) 4.806 6.360 ( 1.323 4.964 1.947) 5.494 6.474 ( -1.757 11.481 -7.104) 13.615 6.564 ( -7.607 1.593 -11.472) 13.856 7.036 ( -2.434 6.828 11.771) 13.824 7.200 ( -1.936 -14.526 -7.886) 16.642 7.539 ( 0.922 0.176 -0.161) 0.952 7.629 ( 7.905 -4.882 11.033) 14.424 7.646 ( 11.801 -13.888 1.735) 18.307 8.061 ( 4.981 -4.995 4.538) 8.388 8.101 ( 5.756 -4.374 -6.785) 9.915 8.331 ( 3.391 4.190 -6.832) 8.702 8.580 ( -9.274 -1.572 -5.416) 10.854 8.874 ( -1.675 0.605 -7.081) 7.301 8.901 ( -1.299 7.588 5.741) 9.603 9.075 ( -0.411 -8.115 -2.490) 8.499 9.188 ( -4.809 1.971 -6.360) 8.214 9.306 ( -3.361 -2.476 2.829) 5.043 9.466 ( -4.683 4.947 -2.928) 7.415 9.691 ( 4.144 6.016 6.049) 9.485 10.065 ( 7.645 -7.686 0.344) 10.846 10.231 ( -0.206 -1.693 1.522) 2.286 10.608 ( 3.808 -8.647 -16.518) 19.030 11.003 ( 1.506 -6.926 -4.102) 8.189 11.099 ( 6.302 -3.482 4.302) 8.387 11.274 ( -0.745 -0.782 -0.575) 1.223 11.306 ( -0.580 -6.481 8.147) 10.427 11.367 ( -1.487 4.952 -5.858) 7.814 11.662 ( -1.420 3.984 5.482) 6.924 11.994 ( -0.078 12.311 -6.851) 14.089 12.324 ( 1.319 -4.493 7.865) 9.154 12.763 ( 2.164 -0.256 -0.245) 2.193 13.013 ( -7.532 7.673 5.264) 11.971 13.326 ( 1.744 -6.917 0.276) 7.139 13.399 ( -2.539 -10.962 -4.378) 12.074 13.525 ( 0.258 -1.122 0.179) 1.166 13.599 ( 3.502 -2.852 0.903) 4.606 14.017 ( -1.860 7.765 -5.715) 9.819 14.783 ( 3.433 -5.540 -3.559) 7.426 15.145 ( 6.291 -8.971 -2.319) 11.200 15.257 ( 10.972 4.169 6.242) 13.294 15.385 ( 7.145 -17.708 -3.611) 19.433 15.869 ( -8.393 6.421 23.210) 25.502 16.509 ( 4.714 5.129 -6.383) 9.448 16.771 ( -16.479 -3.935 5.681) 17.870 17.181 ( 2.819 14.407 6.173) 15.926 17.418 ( -3.234 7.335 -10.721) 13.387 17.703 ( -9.353 9.534 0.129) 13.356 18.083 ( -13.269 25.493 -0.192) 28.740 18.798 ( -5.854 12.409 -8.668) 16.229 20.249 ( 4.306 -15.205 29.226) 33.225 20.578 ( 6.096 -4.239 -2.819) 7.942 20.886 ( 9.872 -6.715 2.525) 12.203 21.012 ( -8.766 -9.504 3.069) 13.289 21.216 ( 5.909 2.785 -3.598) 7.458 22.679 ( 7.283 -12.844 -5.164) 15.642 ======================= Grid point 20 (15/125) ======================= q-point: ( 0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.216 ( -14.193 28.022 1.455) 31.445 1.801 ( 4.870 35.283 12.861) 37.868 2.608 ( 4.589 36.201 27.172) 45.496 3.052 ( 3.365 0.487 -6.590) 7.416 3.261 ( -6.045 10.891 -11.532) 16.974 3.658 ( 8.942 -3.243 4.044) 10.336 3.759 ( -0.914 0.903 -1.585) 2.040 3.846 ( -14.078 -11.335 5.333) 18.845 4.047 ( 1.855 -3.396 8.045) 8.928 4.129 ( 6.443 6.453 1.049) 9.179 4.486 ( 1.373 3.677 0.523) 3.959 4.509 ( -5.880 0.512 -10.535) 12.076 4.881 ( 7.600 -7.433 -2.898) 11.018 5.208 ( 4.151 -5.782 2.241) 7.462 5.298 ( -1.989 -6.665 9.558) 11.821 5.372 ( -6.106 -2.608 -0.278) 6.645 5.664 ( 0.651 8.362 -14.133) 16.434 5.773 ( 2.113 0.455 0.987) 2.376 6.195 ( 1.485 2.171 0.465) 2.671 6.266 ( -4.350 -0.200 -4.589) 6.326 6.375 ( -8.331 0.463 7.506) 11.223 6.498 ( 3.979 6.157 -15.318) 16.982 6.574 ( 3.261 6.722 -1.280) 7.580 7.009 ( 0.962 -10.858 0.487) 10.912 7.153 ( 1.623 5.436 -0.157) 5.675 7.424 ( -3.122 -12.603 0.164) 12.985 7.620 ( -2.521 -11.591 7.480) 14.023 7.781 ( 7.208 -1.984 3.602) 8.298 8.075 ( -14.863 -6.108 -1.412) 16.131 8.157 ( 1.497 4.741 -3.447) 6.049 8.208 ( 13.839 -5.707 8.974) 17.454 8.659 ( 3.316 5.615 -12.773) 14.341 8.769 ( -1.230 1.948 -4.312) 4.889 8.982 ( 1.042 -6.314 -1.183) 6.508 9.063 ( 4.207 -1.953 -6.854) 8.276 9.120 ( -1.046 7.908 -3.697) 8.792 9.306 ( 0.286 2.932 7.593) 8.145 9.444 ( 1.113 -1.076 -0.228) 1.565 9.832 ( 3.158 5.303 3.411) 7.051 10.097 ( 3.320 -8.112 2.712) 9.175 10.136 ( -7.271 -4.710 3.916) 9.507 10.460 ( -2.633 -9.820 -14.059) 17.349 10.870 ( -3.633 -8.027 -8.372) 12.154 11.077 ( -3.901 -7.898 5.286) 10.273 11.203 ( 2.951 3.151 -5.439) 6.944 11.359 ( 1.817 1.270 0.392) 2.251 11.411 ( 0.119 1.956 3.662) 4.153 11.737 ( 0.174 5.703 3.336) 6.609 12.111 ( 0.897 7.577 -3.850) 8.546 12.367 ( 3.052 -2.867 11.380) 12.126 12.784 ( 2.648 -5.229 0.075) 5.862 12.900 ( -8.363 7.179 -0.570) 11.036 13.266 ( -0.126 -4.971 0.701) 5.021 13.375 ( 7.712 -8.266 -2.493) 11.576 13.520 ( -0.135 -3.638 0.454) 3.668 13.605 ( -0.289 1.686 1.348) 2.178 14.109 ( 4.449 5.017 -6.080) 9.051 14.734 ( 0.040 -6.124 -5.483) 8.220 15.023 ( -3.012 -18.101 4.619) 18.923 15.240 ( -3.750 -12.802 -1.316) 13.405 15.475 ( 2.739 10.087 3.228) 10.940 15.927 ( -0.719 1.339 18.257) 18.320 16.464 ( -9.032 3.891 0.053) 9.835 16.749 ( 8.208 6.485 -8.453) 13.449 17.146 ( -12.557 2.451 -2.228) 12.986 17.511 ( 10.369 12.585 8.806) 18.532 17.899 ( 5.501 15.901 -2.284) 16.980 18.185 ( -3.765 28.142 -3.561) 28.616 18.989 ( 9.390 19.077 -4.042) 21.643 20.055 ( -13.499 -22.763 23.042) 35.090 20.660 ( 6.083 -4.090 2.087) 7.621 20.693 ( -10.572 -10.664 1.228) 15.066 20.922 ( 1.154 -5.430 -4.998) 7.470 21.334 ( 3.426 -2.188 2.700) 4.880 22.572 ( 0.273 -16.526 -6.574) 17.787 ======================= Grid point 21 (16/125) ======================= q-point: ( 0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.393 ( 3.401 25.813 -10.494) 28.072 2.285 ( 6.878 29.299 14.683) 33.487 2.955 ( 1.779 -1.035 -9.166) 9.394 3.144 ( 0.022 8.278 -5.785) 10.099 3.367 ( 7.372 18.016 13.576) 23.732 3.553 ( -5.716 -7.376 2.991) 9.799 3.787 ( 0.109 6.738 1.224) 6.850 3.855 ( 11.176 -1.282 7.154) 13.331 4.132 ( 0.171 7.632 8.530) 11.447 4.291 ( -0.149 0.949 2.358) 2.546 4.380 ( -0.193 7.180 -1.075) 7.263 4.523 ( 2.084 -2.178 -0.304) 3.030 4.834 ( -1.807 -9.318 1.761) 9.654 5.099 ( -6.240 -9.462 -6.181) 12.911 5.219 ( -2.701 -5.872 -4.111) 7.660 5.376 ( 3.742 3.931 10.395) 11.727 5.728 ( 2.378 1.595 2.767) 3.982 5.802 ( -0.643 8.351 -17.382) 19.295 6.142 ( -2.070 -4.733 -6.439) 8.255 6.192 ( -7.338 -0.404 0.290) 7.354 6.289 ( -3.020 -0.992 11.268) 11.708 6.534 ( 3.060 4.798 -12.728) 13.942 6.743 ( 8.779 -1.397 -2.812) 9.324 6.982 ( 5.601 -4.628 -1.292) 7.380 7.143 ( -4.110 -5.416 -1.839) 7.043 7.261 ( -2.523 -3.625 1.649) 4.714 7.562 ( 2.517 -2.307 1.742) 3.833 7.652 ( -13.371 -8.100 1.299) 15.687 7.953 ( -1.635 8.069 2.631) 8.643 8.211 ( 0.780 1.762 2.732) 3.344 8.465 ( 13.557 -3.751 5.875) 15.244 8.606 ( -3.450 2.214 -4.702) 6.238 8.850 ( 4.896 2.652 -7.049) 8.983 8.901 ( -3.344 -3.230 -2.114) 5.107 8.980 ( -2.634 -5.060 -5.601) 7.994 9.185 ( -0.695 -1.091 4.868) 5.037 9.371 ( 2.556 -1.969 -3.624) 4.852 9.488 ( 5.529 0.713 -2.985) 6.324 9.901 ( -2.349 -8.159 0.166) 8.492 9.941 ( -7.971 0.987 8.196) 11.475 10.067 ( -2.915 -1.722 1.394) 3.662 10.283 ( 1.686 -7.108 -6.703) 9.915 10.702 ( -1.911 -6.821 -6.472) 9.595 11.024 ( 0.388 -3.252 4.881) 5.878 11.270 ( 1.371 4.210 -0.435) 4.449 11.376 ( -0.130 3.890 -5.930) 7.093 11.465 ( 2.378 2.484 3.620) 4.993 11.766 ( -4.255 5.279 2.514) 7.231 12.128 ( -1.657 -0.081 -1.917) 2.535 12.417 ( 0.780 -4.196 10.473) 11.310 12.739 ( -1.040 -7.208 -0.500) 7.300 12.940 ( 4.202 3.697 -2.670) 6.202 13.183 ( -5.159 -2.910 1.639) 6.146 13.349 ( -0.834 -12.153 -0.245) 12.185 13.491 ( 1.806 2.724 -3.323) 4.661 13.660 ( 1.578 5.665 0.480) 5.900 14.175 ( 3.248 -0.686 -7.301) 8.021 14.631 ( -2.337 -5.896 -3.121) 7.069 14.772 ( -6.485 -16.406 4.585) 18.227 15.095 ( -2.491 -4.143 3.671) 6.070 15.669 ( 9.357 4.600 11.751) 15.710 15.844 ( -16.668 4.885 1.263) 17.415 16.507 ( 8.687 6.906 -12.110) 16.426 16.843 ( -2.286 8.470 -0.787) 8.809 17.177 ( 6.097 6.245 6.083) 10.639 17.819 ( 10.742 6.900 4.830) 13.650 18.127 ( 1.258 21.218 -1.619) 21.317 18.504 ( 11.188 21.310 -3.257) 24.288 19.278 ( 2.256 5.925 -9.901) 11.756 19.717 ( -6.711 -12.201 28.641) 31.847 20.433 ( -6.599 -10.153 -1.534) 12.206 20.728 ( -0.290 -2.792 5.982) 6.608 20.787 ( -4.273 -4.751 -7.781) 10.069 21.325 ( -0.202 -4.948 2.165) 5.405 22.316 ( -5.724 -17.749 -8.279) 20.405 ======================= Grid point 22 (17/125) ======================= q-point: ( 0.44 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.714 ( 13.361 18.739 -15.398) 27.691 2.606 ( -5.679 8.942 5.454) 11.914 2.979 ( 5.677 16.350 1.666) 17.388 3.154 ( 5.379 -8.510 1.510) 10.180 3.553 ( 4.925 5.861 -7.529) 10.737 3.646 ( 4.236 5.720 6.715) 9.785 3.895 ( 0.981 4.916 1.050) 5.122 3.965 ( -5.835 2.287 1.118) 6.366 4.048 ( -4.068 0.434 3.354) 5.291 4.357 ( 3.406 -3.867 6.921) 8.629 4.513 ( -0.539 -4.682 7.437) 8.804 4.570 ( 4.291 1.009 0.189) 4.412 4.783 ( -7.311 -11.332 -6.413) 14.933 4.961 ( 10.683 16.488 10.339) 22.201 5.096 ( -1.793 -3.605 -5.415) 6.748 5.534 ( 4.491 1.774 8.206) 9.521 5.620 ( -15.370 5.393 -5.772) 17.281 5.844 ( 2.633 -3.082 -2.930) 5.002 5.999 ( -2.215 -8.013 -4.430) 9.420 6.141 ( 0.415 3.732 -1.731) 4.135 6.273 ( 0.220 -3.512 5.235) 6.308 6.595 ( 2.508 0.410 4.291) 4.987 6.729 ( -1.590 -2.521 -14.925) 15.220 6.963 ( -4.026 1.190 -9.003) 9.934 7.179 ( 5.416 -2.995 -4.283) 7.526 7.212 ( 0.395 3.828 2.274) 4.470 7.423 ( -1.590 -5.894 10.505) 12.151 7.656 ( 6.726 -0.066 -3.051) 7.386 7.974 ( -7.165 8.338 0.151) 10.995 8.237 ( -0.755 -0.623 5.175) 5.267 8.566 ( -3.512 1.127 -0.019) 3.688 8.608 ( 5.608 -6.872 4.613) 9.998 8.787 ( -4.639 -0.373 -5.101) 6.904 8.827 ( -4.636 -1.996 -1.010) 5.147 8.875 ( -2.969 -0.788 -5.632) 6.415 9.192 ( 5.707 -7.253 1.562) 9.360 9.324 ( 2.439 -8.788 -4.976) 10.389 9.578 ( 2.504 4.587 -2.954) 6.003 9.686 ( -7.089 -10.395 -0.693) 12.601 9.881 ( -4.266 -0.070 5.710) 7.128 10.036 ( 2.090 0.636 -2.142) 3.059 10.329 ( 1.574 6.342 -2.180) 6.888 10.646 ( 4.808 -5.483 -1.153) 7.383 11.010 ( -2.767 -0.873 3.664) 4.674 11.323 ( 0.733 3.118 3.088) 4.449 11.439 ( 2.903 6.591 -3.086) 7.835 11.571 ( 5.411 3.754 -0.480) 6.603 11.742 ( -4.849 4.744 2.865) 7.364 12.030 ( -4.031 -6.344 -3.058) 8.115 12.421 ( -0.234 -3.663 7.763) 8.586 12.588 ( -7.393 -4.806 -2.729) 9.230 12.864 ( -6.670 -12.323 -0.805) 14.035 13.143 ( -1.234 -13.420 1.827) 13.600 13.226 ( 2.138 6.198 -0.454) 6.572 13.588 ( 4.896 5.885 -3.611) 8.464 13.781 ( 4.330 6.961 -0.102) 8.198 14.152 ( 1.848 -5.765 -5.855) 8.422 14.524 ( -3.716 -5.431 5.372) 8.495 14.565 ( -3.454 -7.430 -2.821) 8.665 15.065 ( -1.178 -1.589 5.710) 6.043 15.573 ( -16.215 4.200 -4.575) 17.363 15.982 ( 13.404 4.367 12.810) 19.048 16.664 ( 3.943 11.863 -21.343) 24.735 16.922 ( 1.644 5.122 11.057) 12.296 17.381 ( 2.991 11.013 7.399) 13.601 18.047 ( 10.046 -0.695 -3.244) 10.580 18.383 ( 3.276 22.826 0.845) 23.076 18.873 ( 8.114 10.783 -1.749) 13.608 19.043 ( -2.660 -19.113 -3.910) 19.689 19.891 ( 4.520 9.172 20.920) 23.285 20.247 ( -3.456 -7.956 -0.241) 8.677 20.471 ( -15.607 -3.033 -8.829) 18.186 20.817 ( 1.650 0.628 7.497) 7.702 21.287 ( 3.275 -6.045 -1.268) 6.991 21.974 ( -8.842 -16.377 -8.941) 20.647 ======================= Grid point 23 (18/125) ======================= q-point: ( 0.56 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.084 ( 17.562 8.470 -9.660) 21.759 2.521 ( -7.627 7.804 4.943) 11.980 3.166 ( -1.194 -4.848 1.950) 5.360 3.302 ( 6.519 10.863 -1.197) 12.725 3.625 ( -1.237 1.898 -10.826) 11.060 3.683 ( -3.922 4.927 1.621) 6.503 3.843 ( 1.033 -0.246 4.715) 4.833 3.992 ( -0.439 4.926 -1.171) 5.082 4.071 ( 2.721 -3.043 10.712) 11.463 4.360 ( -2.824 -5.288 -0.205) 5.998 4.454 ( -4.748 -7.418 3.503) 9.478 4.479 ( -2.436 -6.950 1.199) 7.462 4.629 ( -0.104 3.632 -1.331) 3.869 5.088 ( 7.909 -0.550 -9.898) 12.682 5.268 ( -14.964 3.385 9.932) 18.276 5.492 ( 5.189 -1.225 3.545) 6.403 5.654 ( 8.937 2.335 6.429) 11.254 5.768 ( 0.444 0.935 -0.889) 1.365 5.923 ( -2.641 -5.368 -4.782) 7.659 6.215 ( -2.471 1.314 -1.773) 3.313 6.236 ( 1.975 3.713 -4.781) 6.367 6.576 ( -3.414 -1.225 -8.068) 8.846 6.699 ( 4.117 2.098 13.275) 14.056 6.959 ( 0.127 7.469 -7.370) 10.493 7.120 ( -2.811 3.200 -2.059) 4.731 7.204 ( -4.968 -2.883 -0.385) 5.757 7.591 ( 13.954 -1.608 5.925) 15.245 7.743 ( 6.024 -4.741 -6.853) 10.283 7.873 ( -10.502 4.207 -1.598) 11.426 8.189 ( -3.998 -2.418 5.731) 7.394 8.469 ( -6.998 -2.297 -0.052) 7.366 8.593 ( 1.104 -3.147 6.506) 7.311 8.717 ( -0.704 -4.334 -3.601) 5.679 8.796 ( 1.850 0.164 0.627) 1.960 8.832 ( -0.011 2.425 0.211) 2.434 9.173 ( 2.497 -8.840 -4.686) 10.312 9.314 ( 4.431 -3.996 -6.318) 8.690 9.460 ( -5.910 -6.991 2.180) 9.410 9.682 ( 6.023 3.008 -1.998) 7.023 9.865 ( -1.320 1.347 4.110) 4.522 10.083 ( 1.324 1.400 -2.752) 3.359 10.387 ( -3.124 11.975 -4.831) 13.285 10.725 ( 6.949 -3.219 2.844) 8.169 10.931 ( -5.682 -0.844 -0.399) 5.759 11.380 ( -0.345 0.702 6.073) 6.123 11.504 ( -2.292 3.092 -0.045) 3.850 11.719 ( 7.724 0.995 0.061) 7.788 11.774 ( 1.984 8.410 1.538) 8.777 11.884 ( -2.012 -6.066 -4.377) 7.746 12.295 ( -7.222 -6.122 -2.793) 9.871 12.468 ( -9.726 2.457 4.499) 10.994 12.677 ( 3.520 -7.815 1.431) 8.689 12.969 ( 2.189 -19.336 0.634) 19.470 13.359 ( 3.073 5.883 -1.463) 6.797 13.716 ( 3.495 5.066 -1.164) 6.264 13.896 ( 0.096 5.401 -0.747) 5.453 14.116 ( 4.787 -6.162 -5.520) 9.558 14.426 ( -3.259 -6.359 5.342) 8.922 14.492 ( 0.688 -0.458 -1.914) 2.085 15.031 ( -3.547 -2.477 3.774) 5.741 15.388 ( -9.607 8.909 -2.236) 13.292 16.269 ( 9.865 -0.198 13.461) 16.690 16.670 ( -4.927 9.762 -22.847) 25.329 17.076 ( 0.591 8.080 15.739) 17.702 17.534 ( -1.037 8.961 3.918) 9.835 18.117 ( 4.406 -5.279 -9.530) 11.752 18.618 ( -1.876 7.245 2.908) 8.029 18.769 ( 4.595 -5.549 -2.822) 7.738 19.136 ( 5.187 -1.678 0.934) 5.531 20.048 ( -1.362 2.558 0.435) 2.930 20.108 ( -7.025 -5.428 -4.257) 9.846 20.246 ( -3.668 6.012 10.383) 12.546 20.863 ( -3.435 4.880 7.727) 9.763 21.338 ( 10.178 -7.880 -7.186) 14.742 21.663 ( -4.415 -9.960 -4.391) 11.746 ======================= Grid point 24 (19/125) ======================= q-point: (-0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( 3.984 -4.109 5.290) 7.794 2.716 ( 11.364 17.267 -2.201) 20.788 2.892 ( -21.179 -0.444 -12.149) 24.420 3.327 ( -10.552 -3.732 -1.433) 11.284 3.580 ( 0.246 -5.879 4.603) 7.470 3.684 ( -0.195 2.620 0.057) 2.628 3.805 ( -1.871 1.910 0.493) 2.719 4.105 ( -1.886 4.701 0.510) 5.091 4.122 ( -7.750 -7.371 -0.475) 10.706 4.189 ( 7.789 3.320 4.523) 9.599 4.354 ( -3.085 -4.961 -1.762) 6.101 4.473 ( 3.043 -4.368 6.566) 8.453 4.681 ( -1.410 7.841 0.729) 8.000 5.036 ( -5.003 -6.990 -0.321) 8.602 5.258 ( 2.690 9.892 -0.621) 10.270 5.369 ( -1.497 -14.127 5.354) 15.181 5.677 ( -7.074 -7.780 -5.974) 12.094 5.853 ( 1.050 4.699 0.380) 4.830 6.021 ( 17.605 3.697 -3.272) 18.284 6.153 ( -1.090 1.276 -2.697) 3.177 6.341 ( 1.263 7.054 -0.524) 7.185 6.523 ( -2.822 3.319 -8.478) 9.532 6.849 ( 2.877 -0.304 13.834) 14.133 6.971 ( -0.656 0.607 -2.632) 2.780 7.111 ( 3.415 -0.189 2.257) 4.098 7.175 ( -2.061 7.003 1.844) 7.529 7.581 ( -7.666 -8.808 -7.944) 14.123 7.740 ( -7.194 0.980 -0.953) 7.322 7.837 ( 9.165 1.003 3.798) 9.971 8.139 ( -3.507 -4.188 2.348) 5.946 8.389 ( 0.457 4.476 1.659) 4.796 8.602 ( 0.336 -4.282 -0.438) 4.317 8.736 ( 5.692 0.468 6.978) 9.017 8.862 ( 6.060 -2.190 -2.690) 6.982 8.888 ( 2.096 3.595 4.401) 6.057 9.062 ( -0.438 -13.461 -1.857) 13.595 9.263 ( 0.433 0.753 -10.318) 10.354 9.482 ( 5.402 1.030 7.823) 9.562 9.770 ( -1.642 -2.013 3.790) 4.595 9.898 ( 7.016 2.032 -8.256) 11.024 10.081 ( -1.915 1.719 -0.091) 2.575 10.445 ( -4.010 15.835 -4.544) 16.955 10.764 ( -3.955 -1.131 -1.466) 4.367 10.839 ( 2.516 -4.244 -1.552) 5.172 11.329 ( -4.431 -5.060 7.033) 9.732 11.463 ( -6.036 3.339 1.243) 7.009 11.753 ( 2.346 -5.448 -5.943) 8.397 11.843 ( -6.548 2.274 1.167) 7.029 11.938 ( 9.703 1.382 1.593) 9.930 12.157 ( -3.727 -0.292 0.889) 3.843 12.427 ( 3.858 5.828 4.012) 8.059 12.771 ( 8.402 -8.875 1.495) 12.312 12.897 ( 10.723 -8.564 -0.866) 13.750 13.405 ( -1.744 2.554 -3.564) 4.719 13.749 ( -4.081 0.555 1.420) 4.356 13.873 ( -5.244 0.367 0.965) 5.345 14.171 ( 8.494 1.378 -9.076) 12.507 14.342 ( -1.394 -6.505 4.854) 8.235 14.544 ( 3.832 2.511 0.094) 4.583 14.951 ( -1.516 -3.677 1.369) 4.206 15.395 ( -4.712 13.851 5.153) 15.511 16.376 ( 2.202 -11.372 -4.334) 12.368 16.563 ( -5.743 8.127 -4.620) 10.972 17.183 ( -6.551 8.110 15.465) 18.651 17.508 ( -6.417 -1.406 -9.500) 11.550 18.019 ( -6.297 0.422 -0.657) 6.345 18.638 ( -1.347 -2.968 1.512) 3.593 18.818 ( 2.353 0.267 -0.275) 2.384 19.109 ( -2.562 -2.511 -2.746) 4.518 19.865 ( -7.824 -5.034 -3.382) 9.899 20.142 ( 3.481 10.487 -7.405) 13.301 20.365 ( 3.786 1.570 16.196) 16.707 20.867 ( -1.429 0.085 -0.780) 1.630 21.256 ( -1.455 -7.606 -5.648) 9.585 21.766 ( 16.783 0.668 1.128) 16.834 ======================= Grid point 25 (20/125) ======================= q-point: (-0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.233 ( -16.769 7.739 -4.960) 19.123 2.379 ( -21.421 -10.323 -5.361) 24.376 2.996 ( -9.077 -7.175 -1.602) 11.681 3.105 ( 11.635 10.296 -0.538) 15.546 3.454 ( -16.434 2.461 3.314) 16.944 3.764 ( -4.645 4.559 -2.794) 7.083 3.850 ( 3.398 2.021 8.365) 9.253 3.864 ( -8.131 -2.891 0.255) 8.633 4.095 ( 3.007 -14.315 0.045) 14.627 4.184 ( -6.615 5.239 -0.486) 8.452 4.410 ( 2.514 2.551 -1.374) 3.836 4.529 ( 3.352 0.201 2.498) 4.185 4.630 ( -7.834 4.266 7.816) 11.860 5.016 ( 10.423 -4.926 -6.286) 13.130 5.256 ( -6.053 0.592 9.813) 11.545 5.354 ( 0.488 5.398 -10.932) 12.202 5.597 ( 7.996 -11.449 6.282) 15.313 5.901 ( 1.128 2.228 -0.147) 2.501 6.160 ( -0.624 1.711 2.444) 3.048 6.187 ( 3.847 -3.046 -8.670) 9.962 6.403 ( -5.531 0.123 -12.111) 13.314 6.514 ( 9.518 6.626 -3.002) 11.980 6.912 ( 5.453 -4.936 7.478) 10.489 7.006 ( -0.661 2.492 3.025) 3.974 7.172 ( -2.045 3.445 8.026) 8.971 7.255 ( 0.065 7.995 -0.943) 8.051 7.344 ( 0.862 -11.480 -8.749) 14.460 7.605 ( -7.691 -1.408 3.337) 8.501 7.940 ( -2.590 -0.802 0.934) 2.868 8.106 ( 2.872 5.713 2.836) 6.995 8.478 ( -1.751 2.470 3.292) 4.473 8.579 ( 4.690 -3.861 0.980) 6.153 8.832 ( 3.175 -7.541 -1.011) 8.244 8.906 ( 5.723 -2.473 -0.434) 6.250 9.003 ( 2.615 4.141 9.091) 10.326 9.031 ( 5.867 3.454 -5.911) 9.016 9.300 ( 4.618 0.241 3.293) 5.677 9.616 ( -1.366 -3.752 -1.901) 4.423 9.673 ( 3.322 -1.093 8.717) 9.392 9.962 ( -4.591 3.667 -1.796) 6.144 10.125 ( 9.664 -1.337 -11.699) 15.233 10.449 ( -8.209 7.542 -4.059) 11.864 10.730 ( 4.829 3.684 -4.317) 7.452 10.861 ( 2.529 -2.532 2.736) 4.504 11.249 ( -2.113 -3.722 4.876) 6.488 11.383 ( -5.634 1.610 2.666) 6.438 11.676 ( -9.277 -2.989 1.399) 9.846 11.720 ( 0.165 -1.516 -7.480) 7.634 12.112 ( 5.253 0.413 -3.110) 6.119 12.165 ( 2.176 4.186 10.363) 11.387 12.614 ( 6.935 -0.791 1.156) 7.075 12.848 ( 15.350 -7.410 1.631) 17.123 13.122 ( 12.711 1.792 1.965) 12.986 13.317 ( -7.457 1.744 -8.600) 11.516 13.619 ( -8.990 -2.383 3.594) 9.971 13.768 ( -6.384 -0.457 1.369) 6.545 14.268 ( -0.469 -4.517 4.235) 6.209 14.382 ( 12.048 4.891 -4.509) 13.762 14.646 ( 5.570 1.761 -1.485) 6.028 14.958 ( 5.361 -2.095 1.835) 6.041 15.512 ( -3.670 17.536 8.266) 19.731 16.087 ( -9.303 -17.241 -19.346) 27.533 16.619 ( 1.321 3.225 10.305) 10.879 17.044 ( -16.828 -6.144 1.954) 18.021 17.307 ( -4.837 -0.027 -10.156) 11.249 17.987 ( -8.780 12.201 7.649) 16.865 18.337 ( -20.931 -7.947 1.912) 22.471 18.918 ( -12.621 4.247 -1.298) 13.380 19.072 ( 12.763 0.384 5.138) 13.764 19.655 ( -8.504 -3.358 -9.172) 12.951 20.334 ( 8.426 9.179 -3.914) 13.061 20.520 ( 7.329 -0.709 7.973) 10.853 20.785 ( 3.133 -12.343 -7.745) 14.905 21.245 ( 1.116 4.536 3.477) 5.823 22.102 ( 19.427 0.270 0.064) 19.429 ======================= Grid point 26 (21/125) ======================= q-point: (-0.11 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.703 ( -31.929 1.804 -19.487) 37.449 1.999 ( -28.822 10.176 8.546) 31.738 2.913 ( -7.327 -0.712 5.227) 9.029 3.037 ( -21.395 2.707 3.921) 21.920 3.404 ( 7.230 4.537 -0.318) 8.541 3.594 ( -10.534 4.625 -4.811) 12.470 3.751 ( -1.971 -5.006 -1.528) 5.593 3.932 ( -2.447 -1.925 1.764) 3.579 3.967 ( 1.150 -9.417 0.661) 9.510 4.149 ( -6.047 4.721 4.434) 8.861 4.457 ( 0.179 8.973 2.858) 9.419 4.602 ( 4.592 2.057 -1.181) 5.169 4.774 ( 12.229 1.472 5.375) 13.439 5.099 ( 5.992 -5.926 -6.307) 10.526 5.181 ( -4.680 -2.074 6.226) 8.060 5.391 ( 4.619 -0.564 -4.320) 6.349 5.630 ( 0.691 -2.371 -0.171) 2.476 5.950 ( -0.546 1.091 1.434) 1.883 6.141 ( 5.349 -5.101 -5.971) 9.502 6.197 ( -2.613 5.615 3.152) 6.949 6.280 ( -1.816 -0.292 -9.829) 9.999 6.608 ( -1.031 -2.401 -2.033) 3.310 6.926 ( -3.742 -6.393 -1.008) 7.476 7.003 ( -2.763 4.082 6.311) 8.008 7.246 ( 8.233 -0.111 -4.054) 9.178 7.305 ( 2.465 8.964 0.938) 9.343 7.389 ( 8.401 -6.490 2.367) 10.877 7.520 ( 0.735 -2.819 4.024) 4.968 7.877 ( -3.041 2.313 -4.257) 5.720 8.207 ( 0.750 1.968 1.016) 2.338 8.385 ( -1.684 -12.122 4.708) 13.113 8.694 ( 1.086 9.365 1.342) 9.523 8.818 ( 5.618 -6.242 -1.645) 8.558 8.980 ( 2.134 1.458 2.161) 3.369 9.126 ( 3.390 1.880 -7.787) 8.699 9.147 ( 0.413 10.646 8.197) 13.443 9.354 ( -1.261 -4.176 6.851) 8.122 9.520 ( 2.419 -7.112 3.707) 8.377 9.793 ( -6.378 5.803 -1.258) 8.714 9.941 ( 6.920 1.026 3.362) 7.762 10.089 ( -0.864 -5.590 -13.012) 14.189 10.487 ( 12.834 -3.569 -8.582) 15.846 10.856 ( 2.594 3.456 4.629) 6.332 10.926 ( 5.996 -0.731 1.736) 6.285 11.212 ( -0.296 -1.055 0.061) 1.098 11.360 ( -1.134 2.749 3.199) 4.368 11.501 ( -7.137 -3.796 0.244) 8.087 11.675 ( -2.982 3.544 -4.870) 6.721 12.140 ( 1.126 -2.064 -3.697) 4.381 12.293 ( 1.069 2.490 9.089) 9.485 12.697 ( 6.929 -4.187 0.286) 8.100 13.059 ( 4.051 -6.074 -1.824) 7.525 13.152 ( -0.016 7.977 -3.194) 8.592 13.322 ( 5.372 -2.460 5.824) 8.297 13.512 ( -1.154 -0.125 1.449) 1.857 13.662 ( -6.491 1.113 -0.029) 6.586 14.237 ( -2.894 1.042 4.433) 5.395 14.625 ( 10.952 1.030 -0.898) 11.037 14.793 ( 14.145 -4.009 -1.180) 14.749 15.106 ( 10.901 1.335 0.533) 10.995 15.603 ( -14.296 -20.561 -15.372) 29.384 15.675 ( -3.352 19.732 7.301) 21.305 16.633 ( -9.056 -9.849 -4.781) 14.208 16.795 ( 0.542 10.120 8.413) 13.172 17.206 ( -5.255 1.820 -7.601) 9.418 17.803 ( -22.207 -11.390 6.137) 25.701 18.021 ( -12.729 13.109 1.966) 18.378 18.603 ( -25.259 6.197 -1.281) 26.039 19.264 ( -13.566 4.469 15.140) 20.814 19.569 ( 18.505 -1.759 -10.785) 21.491 20.517 ( 6.932 0.326 -3.884) 7.952 20.629 ( 8.609 -7.508 -1.849) 11.571 20.782 ( 8.768 -2.273 -0.959) 9.108 21.330 ( 0.435 3.234 3.996) 5.159 22.413 ( 17.670 -3.129 -1.756) 18.031 ======================= Grid point 28 (22/125) ======================= q-point: ( 0.11 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.769 ( -9.422 27.169 2.618) 28.875 2.066 ( -23.982 19.289 1.217) 30.801 2.893 ( -2.184 2.753 -9.316) 9.957 3.166 ( -16.778 18.760 19.371) 31.760 3.372 ( 2.746 -7.330 6.176) 9.970 3.561 ( -6.932 9.710 -5.714) 13.228 3.735 ( 4.711 3.533 1.894) 6.186 3.823 ( -1.299 -1.411 -1.302) 2.318 4.046 ( 5.293 4.857 3.068) 7.812 4.272 ( -2.655 1.442 4.678) 5.569 4.382 ( -8.260 -5.452 -4.786) 10.994 4.634 ( 2.843 -7.421 2.638) 8.374 4.703 ( 3.112 -8.527 0.432) 9.088 4.993 ( 0.618 1.325 -4.472) 4.705 5.233 ( 6.648 -4.906 -0.927) 8.314 5.546 ( 2.147 1.058 10.871) 11.132 5.687 ( -6.229 -6.849 -5.145) 10.591 5.707 ( 2.804 10.822 -4.549) 12.070 6.200 ( 1.289 -0.987 2.008) 2.582 6.267 ( 0.841 1.016 -0.984) 1.646 6.432 ( 1.144 5.730 1.223) 5.970 6.607 ( -3.545 11.458 -10.962) 16.249 6.674 ( -4.351 1.119 -2.011) 4.922 7.014 ( 4.533 -8.771 -11.345) 15.039 7.093 ( 6.920 -13.980 2.991) 15.883 7.266 ( 6.639 -0.544 3.995) 7.767 7.558 ( -1.164 0.626 7.981) 8.090 7.639 ( -5.574 -3.526 -1.566) 6.779 7.902 ( 10.851 7.402 -7.207) 14.982 8.013 ( -3.364 -7.340 7.149) 10.784 8.332 ( 1.290 4.408 -1.854) 4.953 8.687 ( -8.094 -5.913 -2.711) 10.384 8.821 ( 4.280 -2.636 -8.222) 9.636 8.936 ( 0.300 -1.109 0.383) 1.211 9.077 ( -4.879 -2.415 1.181) 5.570 9.233 ( -5.176 -5.076 -6.273) 9.587 9.275 ( 3.940 -4.170 2.610) 6.303 9.576 ( -4.831 0.868 -3.914) 6.277 9.709 ( 1.352 2.316 6.829) 7.337 9.874 ( 5.657 -1.689 0.015) 5.904 10.252 ( 2.265 5.908 0.646) 6.360 10.360 ( 10.051 -5.897 -8.877) 14.649 10.892 ( 2.340 -5.346 1.427) 6.008 11.011 ( 2.382 -1.077 3.354) 4.252 11.281 ( 1.052 -0.704 8.151) 8.248 11.286 ( -2.572 -4.463 1.227) 5.295 11.460 ( -4.489 7.439 -7.665) 11.586 11.774 ( -3.659 5.284 4.073) 7.609 12.016 ( 2.074 1.640 -5.841) 6.411 12.282 ( 0.972 -6.697 6.191) 9.172 12.662 ( 6.914 -3.850 -3.412) 8.618 13.091 ( 4.374 -4.311 0.746) 6.186 13.255 ( 0.261 -5.655 0.112) 5.662 13.430 ( -1.105 -1.128 9.033) 9.170 13.450 ( -4.921 -1.151 -5.445) 7.429 13.632 ( -4.700 5.295 -2.348) 7.459 14.127 ( -6.582 2.820 -7.398) 10.296 14.631 ( 4.681 -7.541 -2.321) 9.174 14.828 ( 11.318 -10.648 4.091) 16.069 15.101 ( 5.065 -11.469 -4.235) 13.234 15.224 ( 9.765 10.231 9.551) 17.066 16.235 ( -9.334 15.515 9.375) 20.389 16.418 ( 1.462 -1.708 -11.291) 11.513 16.996 ( -5.590 -6.049 4.910) 9.589 17.319 ( -0.813 13.194 7.312) 15.107 17.535 ( -5.836 16.586 -4.144) 18.064 18.071 ( -19.176 7.272 -2.497) 20.660 18.559 ( -13.491 20.250 -1.257) 24.365 18.984 ( -10.120 1.653 -6.386) 12.080 20.118 ( 10.422 -7.412 29.018) 31.711 20.399 ( 6.973 -6.209 -1.341) 9.433 20.610 ( 12.850 -7.986 -0.952) 15.159 20.972 ( 8.603 0.546 -2.218) 8.901 21.222 ( -9.276 -4.550 -0.190) 10.334 22.347 ( 11.484 -14.066 -7.667) 19.711 ======================= Grid point 29 (23/125) ======================= q-point: ( 0.22 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.815 ( -18.901 21.205 2.443) 28.511 2.096 ( 0.759 30.303 3.970) 30.571 2.818 ( -2.072 1.111 -8.349) 8.674 3.256 ( -8.174 22.395 22.024) 32.457 3.411 ( 0.013 5.869 -4.588) 7.450 3.546 ( 1.113 3.503 -2.282) 4.327 3.754 ( -2.250 -2.514 -3.608) 4.940 3.864 ( 5.596 -7.106 4.429) 10.071 4.047 ( -8.644 -1.693 7.830) 11.785 4.249 ( 2.866 13.077 8.049) 15.621 4.416 ( 2.457 3.232 -2.341) 4.686 4.607 ( 0.435 -4.784 -0.482) 4.828 4.701 ( 2.143 -1.224 1.029) 2.674 5.011 ( 5.272 -5.420 -4.213) 8.656 5.224 ( 4.268 -8.940 -2.716) 10.272 5.451 ( -8.358 -5.606 -3.284) 10.586 5.680 ( 4.972 2.191 4.592) 7.113 5.828 ( -2.418 8.240 4.715) 9.797 6.191 ( -4.034 -1.578 -4.896) 6.537 6.227 ( 3.234 -5.440 1.894) 6.606 6.493 ( -1.336 8.096 -17.785) 19.586 6.535 ( -3.983 1.743 2.451) 4.991 6.654 ( -6.066 3.836 -3.605) 8.032 6.876 ( 0.438 -4.054 -6.530) 7.699 7.164 ( 5.327 -3.609 6.017) 8.809 7.415 ( -3.417 -2.420 -1.632) 4.494 7.518 ( 8.930 -9.990 2.194) 13.578 7.548 ( 2.681 -6.646 6.651) 9.777 8.038 ( 6.494 2.096 8.778) 11.118 8.130 ( 6.925 6.999 -5.766) 11.410 8.292 ( -11.547 -1.339 -2.567) 11.904 8.545 ( 3.937 2.419 -9.251) 10.341 8.821 ( -1.382 0.077 -7.300) 7.430 8.872 ( -0.481 -8.350 -0.922) 8.414 8.973 ( 0.972 -4.176 0.140) 4.290 9.198 ( 0.309 6.412 -3.749) 7.434 9.320 ( 5.159 -6.226 1.724) 8.267 9.425 ( -7.016 -3.385 2.893) 8.310 9.824 ( 3.737 2.680 3.214) 5.610 9.953 ( 4.474 -3.293 2.895) 6.264 10.218 ( -3.432 -4.092 -6.416) 8.348 10.418 ( -0.936 1.855 -2.581) 3.313 10.808 ( -2.937 -6.583 -5.989) 9.372 11.058 ( 0.629 -7.290 6.251) 9.624 11.184 ( -0.595 0.641 -2.386) 2.541 11.345 ( 1.407 1.452 4.314) 4.765 11.459 ( -0.883 5.837 0.107) 5.904 11.823 ( -1.229 6.790 3.588) 7.778 12.079 ( 5.383 0.939 -5.043) 7.436 12.308 ( 5.256 -3.622 6.911) 9.408 12.680 ( 1.185 -6.578 -0.189) 6.687 13.069 ( 1.874 -15.822 -0.311) 15.935 13.198 ( 0.842 -6.056 0.349) 6.124 13.241 ( -8.563 9.790 -1.909) 13.146 13.502 ( 1.165 -1.368 2.961) 3.464 13.633 ( -0.077 4.291 -0.995) 4.405 14.085 ( -0.715 2.689 -4.889) 5.625 14.613 ( 3.440 -7.002 -5.334) 9.451 14.879 ( 4.575 -11.301 4.639) 13.044 15.051 ( 4.803 -10.666 -2.116) 11.887 15.568 ( 7.889 14.453 2.480) 16.652 16.092 ( -11.752 -2.349 10.494) 15.929 16.547 ( 8.805 8.584 -7.495) 14.401 16.790 ( -14.615 0.878 9.625) 17.521 17.372 ( -11.954 -2.016 -0.167) 12.124 17.623 ( 3.515 21.588 -3.741) 22.190 17.997 ( -2.888 17.744 0.702) 17.991 18.584 ( -10.799 23.515 -3.004) 26.050 18.975 ( 7.025 9.173 -3.887) 12.190 20.125 ( -6.583 -17.710 23.135) 29.869 20.489 ( 9.567 -4.314 2.106) 10.704 20.740 ( 8.712 -7.687 -0.304) 11.622 20.820 ( -13.609 -10.416 2.610) 17.336 21.229 ( 7.238 0.832 -3.364) 8.025 22.306 ( 6.106 -17.493 -9.093) 20.639 ======================= Grid point 30 (24/125) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.741 ( -14.734 24.389 -3.562) 28.716 2.454 ( 9.533 13.446 2.453) 16.664 2.836 ( 2.742 9.076 -3.858) 10.236 3.315 ( -7.600 8.651 -7.981) 14.010 3.524 ( 1.263 11.994 4.473) 12.863 3.579 ( -6.852 -6.750 3.599) 10.270 3.698 ( 8.820 1.193 7.324) 11.526 3.884 ( -0.365 3.511 10.135) 10.732 4.128 ( 5.856 4.492 12.572) 14.579 4.398 ( -0.873 -3.787 -2.915) 4.858 4.471 ( -1.217 15.699 8.793) 18.035 4.546 ( -3.482 2.275 -2.883) 5.061 4.734 ( 1.738 -2.345 -3.280) 4.391 4.992 ( 2.749 -9.598 -6.504) 11.916 5.243 ( -1.637 -5.745 -5.265) 7.963 5.281 ( 4.762 -2.459 5.536) 7.706 5.790 ( 1.408 -0.422 3.863) 4.133 5.832 ( -4.586 11.030 -0.857) 11.976 6.084 ( -1.017 -6.069 -3.623) 7.141 6.235 ( -0.231 -5.547 -3.707) 6.675 6.397 ( -1.238 -1.480 -11.077) 11.244 6.512 ( -4.821 0.884 3.314) 5.917 6.588 ( 3.605 -1.625 -0.562) 3.994 6.890 ( -0.506 3.540 -6.195) 7.153 7.155 ( -3.428 -7.906 4.685) 9.809 7.298 ( -1.448 -1.689 0.746) 2.347 7.468 ( 2.765 -2.045 -3.139) 4.656 7.716 ( 3.641 -5.514 3.147) 7.319 8.043 ( -5.958 1.294 0.921) 6.166 8.240 ( 2.657 2.755 6.803) 7.806 8.286 ( 7.283 6.272 0.880) 9.652 8.601 ( 1.447 0.912 -12.621) 12.736 8.757 ( 3.448 -1.298 -2.928) 4.706 8.880 ( 1.509 -2.001 -2.866) 3.807 8.941 ( 1.210 -2.768 -1.047) 3.197 9.194 ( -4.052 -2.937 -5.052) 7.111 9.342 ( 5.293 -5.173 2.844) 7.929 9.367 ( -0.067 -1.956 2.629) 3.277 9.905 ( -1.047 1.989 2.497) 3.359 9.979 ( 2.902 -5.156 -0.062) 5.917 10.062 ( -2.430 -5.418 -4.874) 7.682 10.332 ( -9.642 1.286 5.973) 11.415 10.659 ( -2.588 -5.219 -7.756) 9.700 10.977 ( 0.320 -5.954 4.243) 7.319 11.285 ( 3.804 9.001 -3.447) 10.362 11.373 ( -0.252 -0.180 0.088) 0.322 11.510 ( -0.459 4.893 3.556) 6.066 11.876 ( -1.040 5.653 0.340) 5.758 12.135 ( 1.348 -0.265 -2.146) 2.548 12.386 ( 2.682 -4.555 6.655) 8.499 12.592 ( 1.543 -13.882 2.003) 14.111 12.973 ( -0.883 -2.332 -2.361) 3.434 13.177 ( 1.866 -2.421 1.928) 3.614 13.231 ( 0.391 -2.756 -3.511) 4.481 13.500 ( -1.028 2.398 -0.273) 2.624 13.691 ( 1.378 4.253 0.558) 4.505 14.077 ( 1.440 -1.933 -4.865) 5.430 14.562 ( 0.858 -5.655 -6.207) 8.441 14.790 ( -5.405 -8.378 8.145) 12.874 15.055 ( 4.803 -4.838 -2.356) 7.213 15.709 ( -3.460 6.181 8.776) 11.278 16.024 ( 0.294 -0.613 0.450) 0.815 16.547 ( -12.050 4.760 -1.614) 13.056 16.830 ( 11.989 7.048 -5.305) 14.885 17.204 ( -3.911 3.236 5.365) 7.385 17.893 ( 0.623 16.571 7.035) 18.013 18.194 ( 6.734 15.193 -3.434) 16.970 18.651 ( -3.574 21.352 -6.763) 22.681 19.234 ( 7.299 4.584 -2.248) 8.907 19.871 ( -9.946 -9.914 20.207) 24.608 20.471 ( -10.199 -11.976 2.987) 16.011 20.616 ( 7.061 -6.097 5.519) 10.839 20.776 ( 0.616 -2.484 -4.908) 5.535 21.287 ( 1.303 -2.586 -0.690) 2.977 22.139 ( 0.315 -18.468 -9.808) 20.913 ======================= Grid point 31 (25/125) ======================= q-point: ( 0.44 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.776 ( -3.545 20.937 -10.932) 23.884 2.664 ( 9.259 -2.555 -0.952) 9.652 3.067 ( 2.614 18.068 5.696) 19.125 3.168 ( -10.022 2.460 0.415) 10.328 3.495 ( 3.282 -0.163 1.775) 3.735 3.687 ( 2.973 8.356 2.033) 9.099 3.833 ( 3.542 -3.448 0.734) 4.997 3.988 ( 1.844 4.020 8.337) 9.437 4.255 ( -2.462 -2.483 -0.466) 3.527 4.320 ( -5.208 -0.852 1.503) 5.487 4.493 ( 5.039 3.668 4.013) 7.412 4.575 ( -5.455 0.454 3.146) 6.314 4.728 ( -1.066 -7.081 -6.068) 9.386 4.962 ( 3.487 6.226 -1.173) 7.232 5.115 ( -1.247 1.574 0.377) 2.043 5.475 ( 8.759 0.837 5.349) 10.297 5.791 ( -0.305 0.024 4.110) 4.122 5.859 ( -5.105 6.235 -9.828) 12.709 5.962 ( -4.886 -5.863 -5.370) 9.332 6.109 ( 1.442 -7.859 3.152) 8.590 6.341 ( -7.206 -1.577 10.299) 12.668 6.502 ( 6.179 -0.866 -5.141) 8.084 6.646 ( 3.232 -0.762 -9.236) 9.815 6.903 ( 6.271 -0.969 -2.197) 6.715 7.059 ( -1.511 0.518 -4.047) 4.351 7.300 ( -1.643 2.386 1.298) 3.174 7.515 ( 5.295 -0.876 -7.063) 8.871 7.546 ( -11.655 -5.698 10.246) 16.531 8.132 ( 2.575 7.752 -1.681) 8.340 8.263 ( -1.299 0.430 4.222) 4.438 8.453 ( 5.532 -1.820 2.051) 6.175 8.592 ( 0.550 0.882 -0.408) 1.117 8.751 ( -0.944 -3.816 -6.317) 7.440 8.876 ( 1.802 -0.464 -7.248) 7.483 8.963 ( -3.367 5.409 0.800) 6.422 9.053 ( 1.099 -9.742 -0.483) 9.815 9.225 ( -3.790 -10.312 -1.730) 11.122 9.458 ( 5.728 -1.402 -1.071) 5.993 9.794 ( -8.719 -2.876 0.996) 9.235 9.917 ( -0.326 -2.864 -3.846) 4.806 10.037 ( -2.589 -0.803 3.534) 4.454 10.327 ( 3.938 5.042 8.389) 10.551 10.582 ( -0.022 -0.657 -3.931) 3.985 10.986 ( 3.243 -3.915 2.842) 5.824 11.357 ( -0.418 1.272 -0.653) 1.489 11.446 ( 3.973 10.950 -3.495) 12.161 11.562 ( 0.030 3.572 2.465) 4.340 11.889 ( -3.655 4.750 0.879) 6.058 12.060 ( -6.678 -3.871 -2.728) 8.186 12.400 ( 3.065 -3.962 5.448) 7.400 12.474 ( 1.690 -16.582 -0.431) 16.674 12.886 ( -5.437 -4.892 -3.683) 8.189 13.113 ( -5.218 -7.760 -1.172) 9.424 13.251 ( 2.557 4.852 1.735) 5.752 13.551 ( 3.425 4.791 -2.729) 6.491 13.767 ( 3.165 3.468 -0.053) 4.696 14.054 ( 1.069 -4.053 -2.441) 4.851 14.490 ( -0.113 -4.212 -5.781) 7.153 14.637 ( -8.180 -3.276 7.508) 11.576 15.074 ( 1.350 -0.999 -0.668) 1.808 15.788 ( 0.259 -4.768 17.301) 17.948 15.921 ( -6.173 5.683 -6.887) 10.855 16.562 ( 8.655 8.364 -9.081) 15.078 17.006 ( 0.665 8.936 -7.291) 11.552 17.375 ( 13.334 2.710 12.537) 18.502 18.000 ( -4.608 7.268 4.282) 9.612 18.473 ( 8.720 14.128 -2.771) 16.832 18.829 ( 5.197 12.326 -5.633) 14.515 19.073 ( -14.389 -9.986 0.747) 17.530 19.968 ( 6.598 8.247 16.917) 19.943 20.229 ( -5.594 -11.353 4.081) 13.298 20.610 ( -4.249 -2.200 -13.290) 14.125 20.762 ( 3.229 -1.130 9.015) 9.642 21.239 ( -2.579 -3.407 -0.127) 4.275 21.885 ( -4.292 -16.098 -9.025) 18.948 ======================= Grid point 32 (26/125) ======================= q-point: ( 0.56 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.942 ( 6.238 13.382 -8.947) 17.264 2.741 ( -2.327 6.093 1.809) 6.768 3.025 ( 3.092 -9.284 10.673) 14.480 3.352 ( 2.658 12.461 2.085) 12.910 3.597 ( 1.549 0.937 -6.154) 6.415 3.754 ( 3.027 -6.485 1.337) 7.280 3.865 ( -1.469 12.357 -3.576) 12.948 3.996 ( -0.680 -4.520 1.562) 4.831 4.176 ( -3.164 6.623 0.852) 7.389 4.264 ( 1.375 -7.086 5.952) 9.356 4.455 ( -7.771 -11.678 -3.163) 14.380 4.546 ( -2.410 2.489 1.264) 3.688 4.667 ( 0.550 5.183 2.876) 5.953 4.914 ( 1.492 -4.236 -9.028) 10.083 5.357 ( 6.291 1.598 -0.176) 6.493 5.498 ( -1.445 -9.587 1.616) 9.829 5.710 ( -4.763 4.530 5.834) 8.789 5.815 ( -6.242 5.914 0.601) 8.620 5.901 ( 2.106 4.485 -0.049) 4.955 6.161 ( 6.580 -2.276 1.202) 7.066 6.272 ( -4.464 0.004 4.074) 6.043 6.554 ( 1.860 -2.067 -8.263) 8.719 6.656 ( 6.176 -0.995 2.695) 6.811 6.993 ( 0.997 6.432 -6.081) 8.908 7.130 ( 5.124 3.937 -8.492) 10.671 7.242 ( -4.525 -3.436 1.503) 5.877 7.410 ( 0.556 -4.513 11.703) 12.556 7.591 ( 6.513 -0.922 -3.801) 7.597 8.120 ( -9.471 5.165 -1.619) 10.909 8.250 ( -3.895 -2.386 1.095) 4.697 8.513 ( 6.121 -4.542 5.298) 9.282 8.551 ( -4.955 -2.863 1.154) 5.838 8.695 ( -1.234 3.669 -7.863) 8.765 8.784 ( -6.022 -6.164 -1.303) 8.716 8.866 ( 1.301 -1.582 -3.378) 3.951 9.077 ( -1.281 -7.197 -1.629) 7.489 9.185 ( 6.711 5.369 -1.179) 8.675 9.450 ( -1.676 -9.016 4.990) 10.440 9.661 ( -2.028 2.278 -3.807) 4.878 9.902 ( -0.065 -0.311 0.080) 0.328 10.046 ( 1.717 1.788 1.249) 2.776 10.511 ( 3.519 9.172 4.148) 10.664 10.607 ( 3.547 0.180 1.846) 4.002 10.986 ( -0.771 -2.731 -0.413) 2.868 11.387 ( 1.505 0.847 1.354) 2.195 11.547 ( 0.201 1.307 -1.307) 1.859 11.639 ( 2.814 5.259 -2.058) 6.310 11.839 ( -5.967 0.819 0.288) 6.029 11.924 ( -1.333 2.012 0.724) 2.520 12.292 ( -4.232 -12.639 -0.623) 13.343 12.484 ( 7.391 -1.992 0.679) 7.684 12.683 ( -7.787 -6.331 -3.442) 10.609 12.884 ( -11.542 -6.260 0.003) 13.131 13.360 ( 3.178 4.225 1.139) 5.409 13.675 ( 5.661 4.407 -1.100) 7.258 13.881 ( 7.235 1.384 -2.056) 7.648 14.010 ( -1.542 -3.046 1.114) 3.591 14.424 ( -0.995 -3.333 -4.695) 5.843 14.529 ( -5.237 0.474 5.951) 7.941 15.060 ( -1.453 -2.283 -1.608) 3.148 15.632 ( -11.039 3.673 3.208) 12.068 16.076 ( 11.753 -2.980 4.724) 13.013 16.812 ( 4.563 19.129 -17.575) 26.375 17.033 ( 3.230 -4.437 11.034) 12.324 17.701 ( 11.253 6.639 9.259) 16.014 17.922 ( -5.010 -3.809 -5.640) 8.451 18.636 ( -8.049 -10.248 -3.633) 13.528 18.782 ( 6.345 10.615 1.704) 12.484 19.061 ( 2.796 6.554 1.302) 7.243 20.063 ( -3.396 -11.597 4.674) 12.957 20.162 ( -0.560 6.252 3.136) 7.017 20.449 ( -8.062 5.651 -3.369) 10.406 20.919 ( 10.314 1.880 6.306) 12.235 21.131 ( -4.000 -5.519 -3.976) 7.891 21.630 ( -5.348 -9.142 -4.908) 11.673 ======================= Grid point 33 (27/125) ======================= q-point: (-0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.122 ( 8.021 0.767 -1.350) 8.170 2.801 ( -2.544 10.485 5.398) 12.065 3.089 ( 0.736 1.920 -3.318) 3.903 3.405 ( -3.147 -14.692 -1.092) 15.065 3.452 ( 0.596 6.404 -1.754) 6.666 3.770 ( -2.252 -4.951 0.732) 5.488 3.867 ( 1.214 4.378 -0.037) 4.543 4.080 ( -12.379 -6.169 -1.736) 13.940 4.162 ( 5.210 11.203 1.875) 12.497 4.258 ( 2.658 2.027 0.519) 3.382 4.307 ( 4.044 -8.037 6.679) 11.206 4.482 ( -9.915 -1.623 -4.905) 11.180 4.662 ( 2.028 2.588 -2.158) 3.933 5.020 ( 9.360 3.873 -0.349) 10.136 5.163 ( -4.572 -19.117 2.001) 19.757 5.453 ( -1.428 1.810 -1.071) 2.542 5.756 ( -4.446 4.732 0.297) 6.500 5.870 ( -10.392 0.784 0.516) 10.434 5.914 ( 5.739 8.016 0.233) 9.861 6.174 ( 1.674 0.126 -2.644) 3.132 6.316 ( 4.344 2.061 5.525) 7.324 6.560 ( 0.241 4.549 -8.137) 9.325 6.814 ( 8.485 -2.563 8.250) 12.109 6.977 ( -4.846 -5.480 -4.669) 8.678 7.062 ( -1.996 -3.042 1.827) 4.071 7.192 ( 0.287 1.005 -1.263) 1.640 7.599 ( 9.377 -4.805 10.047) 14.559 7.657 ( 5.504 5.473 -8.314) 11.375 7.953 ( -11.307 3.799 -2.173) 12.124 8.137 ( -3.278 -3.304 0.013) 4.655 8.443 ( -3.581 0.410 -0.812) 3.695 8.585 ( -1.513 -3.036 0.841) 3.494 8.666 ( 4.789 -1.128 1.167) 5.057 8.750 ( 2.167 1.497 -2.523) 3.647 8.898 ( 3.019 -0.139 4.383) 5.324 8.962 ( -0.859 -8.134 -1.206) 8.268 9.255 ( -2.164 3.165 -5.893) 7.030 9.452 ( 4.508 1.510 10.858) 11.853 9.713 ( 6.371 3.208 -9.939) 12.234 9.864 ( -4.631 -2.382 4.201) 6.691 10.094 ( 1.269 0.465 0.020) 1.352 10.630 ( -2.025 13.230 -3.179) 13.756 10.709 ( 6.352 -3.419 6.812) 9.922 10.885 ( -7.777 -0.836 -5.043) 9.306 11.362 ( -1.379 -6.210 2.485) 6.829 11.583 ( 3.970 -0.537 -1.057) 4.143 11.606 ( -4.687 -2.429 0.076) 5.280 11.853 ( 2.505 6.589 0.098) 7.050 12.036 ( -5.379 10.063 0.115) 11.411 12.093 ( 4.654 -10.917 -0.668) 11.887 12.516 ( -1.494 -7.562 -0.030) 7.708 12.576 ( -1.722 -3.413 0.262) 3.831 12.706 ( 2.695 3.935 0.038) 4.770 13.434 ( 0.850 2.337 -0.812) 2.616 13.784 ( 1.905 0.725 2.338) 3.102 13.941 ( -0.659 -5.423 0.809) 5.522 14.026 ( 5.594 5.794 -2.839) 8.540 14.346 ( -2.992 -3.026 0.299) 4.266 14.524 ( 0.923 3.258 0.024) 3.386 14.964 ( -3.754 -4.636 -0.422) 5.980 15.596 ( -3.130 9.848 2.563) 10.647 16.173 ( 5.139 -10.784 -3.380) 12.415 16.793 ( -11.118 6.897 0.677) 13.101 17.223 ( 10.499 0.120 1.961) 10.681 17.657 ( -15.299 -5.094 -1.400) 16.185 18.013 ( 13.260 2.515 0.039) 13.497 18.464 ( 0.596 -0.878 0.150) 1.072 19.028 ( 6.475 -5.932 -0.884) 8.826 19.034 ( -7.971 9.352 0.773) 12.312 19.920 ( -4.376 -5.421 4.428) 8.255 20.177 ( -0.828 9.607 -12.152) 15.513 20.411 ( -2.209 -2.188 9.817) 10.297 20.917 ( -9.396 -7.660 -3.081) 12.508 21.182 ( 9.395 5.420 1.180) 10.910 21.551 ( 4.887 -0.493 -0.113) 4.913 ======================= Grid point 34 (28/125) ======================= q-point: (-0.22 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.257 ( 8.237 -2.310 5.181) 10.001 2.644 ( -18.912 -1.402 -20.256) 27.748 3.072 ( 0.193 1.020 2.208) 2.440 3.252 ( -13.554 7.444 2.781) 15.711 3.646 ( 9.068 -0.674 8.894) 12.719 3.695 ( -2.019 -1.420 0.417) 2.503 3.861 ( 1.427 -6.665 -1.794) 7.048 3.888 ( -1.442 0.353 2.527) 2.931 4.117 ( -15.230 0.978 -6.367) 16.536 4.281 ( -0.827 2.385 -0.057) 2.525 4.350 ( 4.381 -2.051 3.260) 5.834 4.474 ( 5.857 2.245 2.984) 6.946 4.742 ( 8.666 -2.605 -7.189) 11.557 4.944 ( -7.811 -2.336 4.943) 9.534 5.252 ( 10.028 1.151 7.548) 12.604 5.486 ( -2.951 -2.973 1.457) 4.435 5.520 ( -16.528 10.117 -1.950) 19.476 5.800 ( 4.129 -6.078 -3.862) 8.301 6.067 ( 5.465 4.802 -6.522) 9.770 6.230 ( -0.719 3.987 2.683) 4.859 6.423 ( 3.226 0.370 3.250) 4.594 6.470 ( -6.150 -1.165 -10.431) 12.165 6.809 ( 2.703 -5.984 -4.965) 8.232 6.990 ( 3.659 -4.300 10.839) 12.222 7.053 ( 4.938 -7.250 0.521) 8.788 7.172 ( 0.193 -2.604 -1.158) 2.857 7.566 ( -6.602 3.256 6.439) 9.780 7.791 ( -8.259 4.533 -2.783) 9.823 7.917 ( 6.273 7.073 -2.562) 9.795 8.089 ( 0.836 -1.474 -0.465) 1.757 8.485 ( 6.254 4.011 -0.944) 7.490 8.501 ( -2.945 -4.303 1.343) 5.384 8.664 ( 1.186 -10.685 -0.835) 10.783 8.820 ( 4.240 2.407 0.891) 4.956 8.951 ( 4.301 1.866 -1.788) 5.018 9.053 ( 5.867 6.703 8.455) 12.282 9.257 ( 1.680 1.527 2.596) 3.448 9.594 ( 3.549 4.350 2.747) 6.250 9.720 ( -7.416 -5.853 4.470) 10.452 9.835 ( 8.967 1.418 -11.531) 14.676 10.083 ( -2.183 -1.889 0.993) 3.053 10.623 ( -8.538 -8.141 -9.688) 15.265 10.736 ( -0.658 12.270 -1.820) 12.422 10.817 ( 2.046 1.259 5.531) 6.030 11.293 ( -2.654 -2.968 3.500) 5.302 11.494 ( -3.425 -3.996 1.416) 5.450 11.643 ( 1.315 2.983 -1.133) 3.452 11.821 ( -10.262 -3.709 -1.550) 11.022 12.013 ( 6.658 6.721 -4.218) 10.358 12.235 ( 2.813 3.415 5.357) 6.948 12.420 ( 5.235 -17.812 0.011) 18.565 12.596 ( 6.435 5.657 3.652) 9.314 12.953 ( 12.454 8.228 0.910) 14.954 13.419 ( -3.903 2.133 -3.893) 5.911 13.746 ( -5.787 -2.414 2.305) 6.681 13.864 ( -4.069 -2.375 3.090) 5.635 14.188 ( 6.429 1.194 -0.977) 6.612 14.301 ( 1.347 3.056 0.639) 3.400 14.596 ( 2.838 3.133 -3.351) 5.395 14.889 ( 0.540 -3.665 3.705) 5.240 15.677 ( 0.857 6.159 -8.156) 10.257 16.012 ( -6.116 -10.055 -2.237) 11.980 16.704 ( -4.866 -1.787 12.301) 13.348 17.215 ( -9.609 -11.754 -16.567) 22.471 17.368 ( -6.591 2.619 7.309) 10.184 18.211 ( 1.037 9.183 2.324) 9.529 18.553 ( -4.731 -3.438 2.156) 6.233 18.829 ( 3.912 1.443 -1.949) 4.603 19.138 ( -2.443 4.981 -1.124) 5.660 19.806 ( -9.530 -0.496 6.072) 11.311 20.270 ( 6.195 8.831 -11.807) 15.992 20.383 ( 3.387 -10.481 -0.584) 11.031 20.675 ( -5.903 -8.319 2.473) 10.496 21.332 ( -0.949 9.601 4.913) 10.827 21.767 ( 17.455 -0.454 -1.574) 17.531 ======================= Grid point 35 (29/125) ======================= q-point: (-0.11 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.163 ( -24.989 3.430 -15.259) 29.480 2.377 ( 0.128 4.085 1.374) 4.312 2.942 ( -10.162 -0.758 3.231) 10.690 3.265 ( 2.321 7.457 -3.370) 8.506 3.560 ( -11.727 2.486 5.607) 13.234 3.643 ( 1.396 -14.393 0.327) 14.464 3.851 ( -7.985 -0.719 -1.500) 8.156 3.875 ( -4.880 5.438 -3.699) 8.189 3.978 ( -1.139 -0.359 7.490) 7.585 4.352 ( -0.544 5.970 2.667) 6.561 4.457 ( 10.131 -4.526 5.384) 12.333 4.552 ( 2.622 5.833 1.656) 6.606 4.760 ( -2.050 -2.825 3.712) 5.096 4.941 ( 3.271 7.631 -6.192) 10.358 5.180 ( -8.852 -9.496 -7.699) 15.093 5.408 ( -0.818 3.376 13.032) 13.487 5.577 ( 1.248 4.975 -3.458) 6.186 5.871 ( 11.483 -2.342 0.200) 11.721 6.067 ( -5.545 -2.906 -3.509) 7.177 6.233 ( 1.008 -0.069 -8.507) 8.566 6.317 ( -2.600 3.322 -0.318) 4.231 6.548 ( 4.711 -0.637 0.979) 4.854 6.788 ( 4.973 -13.012 0.407) 13.936 6.975 ( -1.675 0.672 -7.383) 7.601 7.066 ( 9.170 -7.442 -0.568) 11.823 7.229 ( 4.931 -3.983 5.146) 8.164 7.546 ( -5.570 10.129 4.369) 12.358 7.655 ( -11.613 4.594 3.428) 12.951 7.941 ( -4.076 2.692 -7.290) 8.775 8.176 ( 5.987 0.356 1.648) 6.220 8.367 ( -6.775 -7.877 5.108) 11.578 8.615 ( 7.866 -5.606 -2.248) 9.917 8.723 ( 7.516 6.869 2.374) 10.455 8.907 ( 5.135 -0.821 -0.439) 5.219 9.030 ( 3.854 2.612 -8.114) 9.355 9.250 ( 3.518 5.388 10.032) 11.919 9.364 ( 2.904 1.380 7.778) 8.416 9.509 ( -6.466 -2.783 2.958) 7.635 9.770 ( 7.591 4.289 0.544) 8.736 9.925 ( 6.799 -4.034 -13.726) 15.840 9.998 ( -5.222 -1.232 1.185) 5.494 10.337 ( -6.073 -9.457 -7.960) 13.772 10.840 ( 3.621 -1.191 4.047) 5.559 10.898 ( 0.634 6.608 2.672) 7.156 11.242 ( -2.472 0.766 0.169) 2.593 11.430 ( -2.256 0.468 2.132) 3.139 11.593 ( -7.752 -3.135 0.355) 8.370 11.730 ( -0.239 7.189 -3.977) 8.219 12.089 ( 1.093 -1.562 -4.876) 5.235 12.309 ( 0.559 -1.422 6.341) 6.522 12.447 ( 12.842 -6.971 1.084) 14.652 12.830 ( 12.993 0.744 1.802) 13.138 13.189 ( 4.318 0.839 4.306) 6.156 13.361 ( -3.258 8.920 -5.252) 10.852 13.601 ( -7.639 -2.396 2.380) 8.353 13.783 ( -5.391 0.526 1.514) 5.625 14.251 ( 3.343 -0.384 6.482) 7.303 14.468 ( 8.023 4.321 -1.516) 9.238 14.627 ( 2.353 -1.413 -2.990) 4.059 14.959 ( 7.030 -0.281 3.292) 7.768 15.476 ( -6.280 -18.557 -21.511) 29.094 15.985 ( -4.037 15.174 9.830) 18.525 16.658 ( -3.085 -5.793 4.872) 8.174 16.875 ( -5.820 -5.797 -4.409) 9.323 17.326 ( -6.018 4.437 -0.279) 7.482 18.128 ( -20.398 -3.712 1.611) 20.795 18.337 ( -8.549 9.092 1.438) 12.563 18.998 ( -11.038 3.568 -3.988) 12.267 19.206 ( 17.501 4.773 3.029) 18.391 19.620 ( -15.058 3.349 9.128) 17.925 20.305 ( 6.098 -13.338 -9.530) 17.490 20.426 ( 8.285 1.885 -6.223) 10.532 20.641 ( 5.306 -2.618 5.848) 8.319 21.406 ( -2.557 6.508 4.701) 8.426 22.050 ( 17.843 -4.137 -3.464) 18.641 ======================= Grid point 37 (30/125) ======================= q-point: ( 0.11 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.116 ( -7.947 9.375 -5.189) 13.340 2.535 ( -10.765 17.668 -1.791) 20.767 2.890 ( 8.449 -0.713 0.235) 8.482 3.243 ( -7.093 3.620 4.794) 9.295 3.550 ( -0.106 1.479 -1.455) 2.077 3.743 ( -1.041 -3.904 4.017) 5.698 3.789 ( -8.227 5.846 7.838) 12.779 3.939 ( -8.818 7.977 0.053) 11.890 4.019 ( 6.349 8.205 1.063) 10.429 4.372 ( -4.219 2.136 -0.298) 4.738 4.407 ( -3.659 -10.736 -8.636) 14.255 4.454 ( 8.459 -7.970 4.364) 12.414 4.558 ( -1.532 -6.855 2.586) 7.485 5.040 ( 6.556 -1.485 -2.358) 7.124 5.204 ( -12.044 8.738 1.994) 15.013 5.538 ( -0.410 -6.711 7.111) 9.786 5.634 ( 5.561 3.183 -9.014) 11.059 5.796 ( -4.767 3.063 4.163) 7.031 6.204 ( -0.131 1.166 3.066) 3.283 6.275 ( 6.942 7.133 4.304) 10.844 6.346 ( 8.560 -9.434 -3.283) 13.155 6.594 ( 5.744 -2.812 6.209) 8.914 6.714 ( 6.864 7.364 -3.037) 10.515 6.863 ( -2.614 0.604 -17.964) 18.163 6.887 ( -3.782 -3.342 -5.105) 7.179 7.194 ( 5.696 -3.280 2.246) 6.945 7.660 ( -4.513 0.855 -3.305) 5.659 7.754 ( -11.846 0.075 1.711) 11.969 7.814 ( 4.627 3.225 3.052) 6.413 8.125 ( -8.761 -0.428 5.972) 10.612 8.323 ( 4.148 3.029 2.039) 5.526 8.652 ( 7.201 -2.838 -5.021) 9.226 8.706 ( -3.426 -8.150 -3.166) 9.391 8.911 ( -0.466 -4.645 -1.757) 4.988 9.030 ( 5.370 -3.949 1.227) 6.778 9.263 ( -8.778 -6.145 -0.509) 10.727 9.268 ( -5.025 -1.412 -6.479) 8.320 9.522 ( 5.256 -1.364 2.736) 6.080 9.753 ( -3.243 -1.896 -2.306) 4.408 9.876 ( 1.219 5.471 -0.058) 5.605 10.104 ( 9.348 -3.545 -1.525) 10.113 10.275 ( 4.715 10.879 2.316) 12.081 10.837 ( 1.408 -2.140 3.614) 4.430 11.002 ( -0.165 -1.245 1.666) 2.086 11.281 ( -2.892 -5.939 4.792) 8.160 11.334 ( -2.263 2.918 -0.311) 3.706 11.605 ( -4.023 10.870 -3.515) 12.112 11.916 ( -1.370 5.269 -1.020) 5.539 11.946 ( -0.417 -3.532 1.610) 3.904 12.212 ( -0.156 -8.139 3.082) 8.704 12.414 ( 11.386 -5.368 -5.325) 13.668 12.948 ( 5.437 -8.429 -1.889) 10.207 13.135 ( -0.926 -8.813 -1.436) 8.977 13.438 ( -1.992 -0.527 2.777) 3.458 13.637 ( -3.401 7.406 1.167) 8.232 13.765 ( -5.217 3.988 -1.581) 6.754 14.210 ( -5.286 -0.463 -10.194) 11.493 14.484 ( 2.074 -7.713 1.551) 8.137 14.631 ( 5.350 -4.475 7.085) 9.942 14.943 ( 1.784 -4.472 -5.968) 7.668 15.221 ( 7.473 10.427 14.745) 19.544 16.325 ( -0.528 -6.202 -12.284) 13.771 16.524 ( -2.481 17.161 -1.608) 17.414 16.948 ( 7.499 1.435 7.314) 10.573 17.427 ( 0.608 6.526 -0.853) 6.609 17.949 ( -19.544 9.753 7.922) 23.235 18.414 ( -11.095 8.188 -2.809) 14.073 18.860 ( -5.287 4.988 -4.998) 8.821 19.124 ( -9.338 -3.038 -1.201) 9.893 20.008 ( 8.569 1.852 14.804) 17.206 20.249 ( 7.953 -2.073 12.109) 14.634 20.302 ( 7.187 -10.996 -7.029) 14.899 20.783 ( 11.042 1.854 -5.988) 12.697 21.397 ( -13.261 -1.718 3.046) 13.714 21.968 ( 11.679 -12.887 -8.264) 19.255 ======================= Grid point 38 (31/125) ======================= q-point: ( 0.22 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.084 ( -1.126 5.640 -3.247) 6.604 2.546 ( -14.196 25.683 -4.152) 29.637 2.936 ( -8.731 9.413 -3.752) 13.376 3.257 ( 9.042 -4.146 3.074) 10.412 3.554 ( 0.577 1.235 -1.315) 1.894 3.690 ( -4.121 0.503 2.000) 4.609 3.755 ( -2.254 0.202 11.946) 12.159 3.861 ( -8.284 8.089 -2.160) 11.778 4.155 ( -2.797 -2.210 2.807) 4.537 4.316 ( 6.029 9.236 10.702) 15.368 4.441 ( 0.273 -3.343 -2.795) 4.366 4.536 ( 1.437 9.947 -1.931) 10.234 4.556 ( 10.893 -8.538 6.057) 15.107 5.011 ( -0.352 -10.411 -7.701) 12.954 5.093 ( -6.143 5.305 0.077) 8.117 5.451 ( -0.921 -9.364 -2.437) 9.720 5.688 ( -1.749 3.945 11.923) 12.680 5.891 ( 4.887 4.913 0.378) 6.940 6.155 ( -2.227 -6.296 0.951) 6.746 6.323 ( -7.814 5.928 -0.648) 9.829 6.426 ( 8.328 -3.136 -6.498) 11.019 6.607 ( -5.607 -1.496 -5.193) 7.787 6.691 ( -4.258 -9.491 -10.410) 14.717 6.871 ( 6.264 4.020 -1.541) 7.601 6.970 ( 10.359 9.539 1.542) 14.166 7.286 ( 7.374 -2.713 0.423) 7.869 7.487 ( -9.817 -5.096 -3.062) 11.476 7.609 ( -6.877 -1.500 4.500) 8.354 7.960 ( 8.142 2.637 2.319) 8.868 8.118 ( 1.272 7.847 3.239) 8.584 8.415 ( 0.066 5.203 -1.011) 5.300 8.523 ( -6.050 -5.877 -3.587) 9.166 8.713 ( 5.742 -3.161 -1.954) 6.840 8.838 ( -1.706 -5.111 -3.991) 6.706 8.965 ( -5.827 -6.631 -2.221) 9.102 9.108 ( 6.643 -7.528 0.628) 10.059 9.249 ( -0.308 2.448 -1.320) 2.798 9.527 ( -5.118 -2.567 -0.646) 5.762 9.719 ( 4.317 -4.870 4.229) 7.761 9.963 ( 1.161 5.240 0.209) 5.371 10.140 ( 1.562 -5.624 -5.961) 8.343 10.452 ( 2.438 10.007 -2.997) 10.727 10.825 ( -3.662 -2.203 2.269) 4.839 10.995 ( 1.161 -5.240 3.563) 6.442 11.184 ( -0.310 -1.873 3.368) 3.867 11.383 ( -0.390 4.100 2.945) 5.063 11.594 ( -6.480 10.216 -3.539) 12.605 11.899 ( 0.279 -5.150 0.947) 5.243 11.987 ( 2.447 7.823 -0.704) 8.227 12.170 ( 4.661 -8.193 2.535) 9.762 12.569 ( 9.015 -2.961 -1.236) 9.569 12.820 ( 0.452 -17.686 0.047) 17.692 13.087 ( 5.111 -9.427 -0.199) 10.725 13.417 ( -2.455 1.259 -4.005) 4.863 13.597 ( -8.254 7.599 5.020) 12.291 13.713 ( -4.414 4.244 -2.249) 6.523 14.125 ( -2.703 1.277 -5.428) 6.196 14.456 ( 3.636 -7.183 -1.395) 8.171 14.698 ( 6.785 -5.590 2.451) 9.126 14.925 ( 1.881 -3.618 0.875) 4.171 15.553 ( 9.457 11.214 11.469) 18.620 16.161 ( -3.138 -6.821 -13.241) 15.222 16.660 ( -4.277 17.508 -0.114) 18.023 17.010 ( -4.131 -1.624 13.957) 14.646 17.570 ( -4.209 2.459 5.863) 7.624 17.709 ( -5.994 11.708 -12.791) 18.347 18.354 ( -11.633 18.923 2.929) 22.405 18.888 ( 5.292 -1.683 -3.188) 6.403 18.952 ( -10.069 13.118 -2.268) 16.692 20.132 ( -3.075 -13.278 14.862) 20.165 20.273 ( 11.161 -3.573 3.960) 12.370 20.483 ( 12.569 -3.077 1.306) 13.006 20.926 ( 0.001 -4.636 2.480) 5.258 21.153 ( -5.929 -0.561 -3.981) 7.164 21.964 ( 8.684 -15.668 -9.649) 20.347 ======================= Grid point 39 (32/125) ======================= q-point: ( 0.33 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.165 ( 1.074 7.363 2.272) 7.780 2.396 ( -14.613 7.089 -12.423) 20.448 3.001 ( 0.544 19.254 3.917) 19.656 3.356 ( 5.375 -1.181 -10.570) 11.917 3.542 ( -2.342 -0.962 -4.706) 5.344 3.666 ( -3.480 3.864 5.339) 7.453 3.773 ( -3.141 5.351 10.784) 12.442 3.899 ( 4.327 3.293 9.485) 10.933 4.163 ( 0.925 3.342 6.611) 7.465 4.337 ( -0.320 -10.330 -1.182) 10.402 4.530 ( 0.562 2.546 10.211) 10.539 4.659 ( 9.460 1.166 2.652) 9.894 4.691 ( -1.262 6.896 -6.228) 9.377 4.884 ( 0.320 -3.700 -9.821) 10.500 5.114 ( 3.188 4.700 6.640) 8.737 5.327 ( -4.935 -3.259 -0.770) 5.964 5.755 ( 1.633 -0.711 9.082) 9.255 5.965 ( 0.102 -2.615 2.224) 3.434 6.067 ( -0.081 -4.106 -1.820) 4.492 6.184 ( -8.045 1.056 -7.771) 11.235 6.373 ( -6.813 -2.145 -11.468) 13.510 6.518 ( 0.054 -0.998 -3.016) 3.177 6.575 ( 3.258 -2.614 -2.117) 4.683 6.990 ( -2.308 6.031 -2.515) 6.930 7.138 ( -3.671 -9.127 8.359) 12.909 7.228 ( 5.064 -2.695 2.282) 6.174 7.474 ( -5.694 -4.173 3.006) 7.672 7.538 ( 11.904 7.294 -7.730) 15.958 8.163 ( 3.641 3.081 0.596) 4.806 8.219 ( 0.476 2.430 4.864) 5.458 8.319 ( -4.448 5.054 -0.545) 6.755 8.519 ( 3.679 4.178 -8.280) 9.977 8.719 ( -2.118 -3.635 -1.497) 4.465 8.791 ( 5.757 -1.822 0.971) 6.116 8.889 ( 0.536 -3.463 1.242) 3.718 9.119 ( 3.441 -7.693 -2.825) 8.888 9.325 ( 3.121 5.888 -0.789) 6.711 9.354 ( -7.335 -8.345 1.906) 11.273 9.800 ( 8.654 -4.177 2.290) 9.879 9.988 ( -0.584 -1.772 -4.318) 4.704 10.040 ( -4.525 -1.862 0.006) 4.893 10.495 ( -3.406 5.145 -6.671) 9.087 10.685 ( -8.547 -3.943 1.328) 9.506 10.939 ( -0.754 -6.559 4.268) 7.862 11.295 ( 4.790 9.028 0.891) 10.258 11.400 ( -1.783 1.059 2.107) 2.956 11.607 ( -2.648 9.495 -0.161) 9.858 11.880 ( 3.350 -4.171 0.614) 5.385 12.104 ( 1.860 7.043 -2.084) 7.577 12.221 ( 8.330 -9.096 -1.043) 12.378 12.512 ( -4.230 -11.426 6.629) 13.870 12.812 ( 10.499 -8.555 0.804) 13.567 13.090 ( 3.129 -4.924 1.453) 6.013 13.329 ( -6.584 4.200 -6.790) 10.349 13.577 ( -4.326 3.648 2.732) 6.283 13.701 ( 0.442 2.985 -0.143) 3.021 14.066 ( -2.417 -0.447 -3.152) 3.997 14.448 ( 3.154 -4.672 -3.594) 6.686 14.784 ( 6.416 -3.194 1.894) 7.413 14.922 ( 0.043 -2.617 4.076) 4.844 15.811 ( 4.896 6.455 3.431) 8.798 16.000 ( -2.907 -3.975 -7.470) 8.947 16.688 ( -4.563 5.068 -1.147) 6.915 16.945 ( -11.519 2.645 14.988) 19.087 17.329 ( -8.401 1.614 -4.809) 9.813 17.981 ( 10.511 16.579 -5.049) 20.269 18.364 ( -8.698 14.567 4.370) 17.520 18.849 ( -1.288 5.008 -7.188) 8.855 19.129 ( 6.952 7.146 2.207) 10.211 19.972 ( -4.820 -7.864 6.557) 11.316 20.409 ( 6.383 -9.097 7.778) 13.565 20.600 ( -5.036 -8.636 5.524) 11.422 20.709 ( -1.461 0.508 0.066) 1.548 21.211 ( 5.298 1.151 -3.784) 6.612 21.879 ( 4.463 -15.488 -9.525) 18.722 ======================= Grid point 40 (33/125) ======================= q-point: ( 0.44 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.114 ( -15.589 17.074 -7.292) 24.243 2.364 ( 13.506 -10.596 0.532) 17.174 3.249 ( 3.608 13.458 3.016) 14.256 3.356 ( -8.715 5.311 -0.900) 10.246 3.463 ( 3.037 0.063 0.739) 3.126 3.661 ( -0.070 -3.333 -0.958) 3.469 3.857 ( 0.085 7.689 4.463) 8.891 4.013 ( 0.706 2.412 2.014) 3.220 4.164 ( 1.144 -12.886 2.550) 13.185 4.357 ( 4.125 4.419 6.084) 8.577 4.553 ( -3.050 3.281 2.475) 5.118 4.617 ( 0.801 -6.585 -3.058) 7.304 4.706 ( -5.027 0.628 -8.637) 10.013 4.984 ( 7.588 6.106 6.154) 11.521 5.125 ( -5.647 -2.521 -3.718) 7.216 5.389 ( 6.502 10.360 4.937) 13.190 5.773 ( 0.776 -8.911 4.724) 10.115 5.886 ( -2.325 -3.711 -5.571) 7.086 6.025 ( -3.651 3.600 -1.067) 5.237 6.054 ( -1.886 -4.247 1.883) 5.013 6.295 ( 3.646 -0.814 -4.277) 5.679 6.536 ( 0.071 1.118 -1.422) 1.810 6.578 ( -0.933 1.167 -4.122) 4.385 6.843 ( -3.828 -5.678 1.263) 6.964 7.094 ( -1.055 0.859 0.299) 1.393 7.314 ( 1.771 -0.046 2.786) 3.301 7.396 ( 1.330 -2.427 -2.486) 3.720 7.732 ( -0.952 3.305 1.174) 3.634 8.065 ( 0.169 0.336 -0.357) 0.519 8.315 ( -0.586 1.590 -0.419) 1.746 8.393 ( 3.739 1.112 1.005) 4.028 8.598 ( 1.721 5.110 -1.704) 5.655 8.697 ( 1.222 -0.060 -3.182) 3.409 8.838 ( 0.420 0.746 1.124) 1.413 8.919 ( 4.687 -2.243 -1.844) 5.513 9.061 ( -3.105 -1.714 -0.935) 3.668 9.147 ( -2.887 -13.412 1.223) 13.773 9.406 ( 1.514 2.517 -0.666) 3.012 9.851 ( -1.168 -3.182 -2.525) 4.227 9.954 ( -3.094 -0.757 1.764) 3.641 10.008 ( 3.887 0.972 0.477) 4.035 10.420 ( -5.401 1.631 3.043) 6.410 10.552 ( -0.692 -1.194 -2.796) 3.118 10.912 ( 1.212 -2.553 1.421) 3.163 11.356 ( -0.483 -0.438 -0.734) 0.982 11.496 ( 3.425 10.193 2.311) 10.999 11.636 ( -2.922 4.505 -1.022) 5.466 11.921 ( 2.411 -1.204 0.419) 2.727 12.140 ( -4.597 0.825 -1.610) 4.940 12.222 ( 6.253 -8.053 -4.512) 11.150 12.386 ( -1.422 -8.289 7.517) 11.280 12.882 ( 1.497 -2.670 -0.724) 3.145 13.093 ( 0.746 -2.861 -0.176) 2.962 13.274 ( -1.193 3.305 -1.374) 3.773 13.553 ( -0.721 1.861 -0.334) 2.024 13.749 ( 1.354 1.157 0.010) 1.781 14.021 ( -0.590 -0.707 -0.873) 1.269 14.432 ( 0.691 -2.585 -3.002) 4.021 14.800 ( -6.326 0.681 8.240) 10.411 14.952 ( 6.905 -2.816 -5.244) 9.116 15.842 ( -3.456 -0.012 7.795) 8.527 15.975 ( 1.847 0.157 -5.843) 6.130 16.606 ( -6.176 2.212 -1.664) 6.768 16.916 ( 5.243 3.245 -0.979) 6.244 17.308 ( 0.773 1.853 3.310) 3.871 18.223 ( -1.905 9.478 3.337) 10.227 18.412 ( 3.815 6.970 -1.242) 8.042 18.901 ( 0.451 8.742 -6.458) 10.878 19.168 ( -3.815 -6.539 3.379) 8.290 19.983 ( 4.344 6.441 5.500) 9.519 20.253 ( -7.795 -11.372 2.818) 14.072 20.512 ( 2.400 -4.088 0.493) 4.766 20.784 ( 1.043 1.847 1.707) 2.722 21.254 ( -0.033 0.381 -0.616) 0.725 21.747 ( 0.085 -10.671 -6.555) 12.524 ======================= Grid point 41 (34/125) ======================= q-point: (-0.44 -0.56 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.061 ( -6.503 14.007 -4.660) 16.131 2.533 ( 17.561 -9.842 4.143) 20.553 3.169 ( -11.551 -1.004 6.578) 13.331 3.411 ( 1.551 2.318 6.509) 7.081 3.547 ( -1.375 -11.850 -3.968) 12.572 3.646 ( 7.289 8.816 1.578) 11.547 3.933 ( 1.280 -2.888 -4.527) 5.521 4.009 ( -3.195 11.609 -7.484) 14.177 4.098 ( 2.703 -8.716 2.974) 9.598 4.344 ( -5.303 -2.756 -4.345) 7.389 4.502 ( -4.702 1.132 2.085) 5.267 4.609 ( -0.180 4.196 -2.680) 4.982 4.721 ( 2.648 3.776 9.494) 10.555 4.873 ( -7.487 -6.446 -6.273) 11.703 5.267 ( 8.300 2.561 -0.892) 8.732 5.428 ( -4.960 -11.630 -3.518) 13.124 5.738 ( 3.306 5.295 -1.300) 6.376 5.871 ( 1.480 2.139 -2.396) 3.537 6.019 ( -2.061 2.766 4.024) 5.300 6.065 ( 3.344 1.225 5.985) 6.965 6.381 ( 7.751 -4.167 6.617) 11.010 6.461 ( -7.644 2.995 -0.208) 8.212 6.551 ( 0.353 -2.341 -3.677) 4.373 6.924 ( 10.539 5.546 -0.925) 11.945 7.091 ( -0.963 3.830 -7.132) 8.152 7.285 ( -3.724 -3.093 -0.460) 4.863 7.450 ( 7.206 0.226 -2.607) 7.666 7.578 ( -13.655 -3.222 10.884) 17.757 8.194 ( 6.451 3.268 -8.086) 10.848 8.281 ( -3.822 -1.856 1.456) 4.492 8.400 ( 1.662 -5.953 5.758) 8.447 8.600 ( -3.043 -3.511 2.896) 5.475 8.701 ( 1.240 0.975 -8.679) 8.821 8.803 ( -6.291 -3.284 -0.371) 7.107 8.862 ( -1.304 0.979 -3.779) 4.116 9.035 ( -2.248 -3.454 0.916) 4.221 9.154 ( 7.648 9.328 0.555) 12.075 9.417 ( -0.474 -4.115 2.660) 4.923 9.767 ( -8.790 0.750 -1.872) 9.018 9.888 ( 0.527 1.432 1.413) 2.080 10.057 ( 1.145 0.192 0.300) 1.199 10.477 ( 4.853 -0.306 11.514) 12.499 10.605 ( 4.794 6.009 -4.257) 8.787 10.923 ( 2.194 -1.945 -1.695) 3.387 11.369 ( 1.676 0.918 -0.403) 1.953 11.531 ( -2.906 -5.401 -3.852) 7.242 11.691 ( 2.826 7.976 1.027) 8.524 11.890 ( -2.060 -9.410 0.383) 9.641 12.003 ( -8.195 5.242 1.841) 9.900 12.226 ( 0.752 -5.200 0.326) 5.265 12.390 ( 3.672 2.785 -2.055) 5.046 12.768 ( -9.683 -1.826 -3.631) 10.502 13.041 ( -5.542 0.986 -1.863) 5.929 13.330 ( 3.971 0.219 3.620) 5.378 13.609 ( 4.914 1.677 -0.587) 5.225 13.765 ( 2.096 -2.342 -1.383) 3.434 14.028 ( 0.685 0.697 2.113) 2.328 14.400 ( -1.104 -0.866 -1.651) 2.166 14.702 ( -9.074 2.529 6.111) 11.228 14.998 ( 3.733 -2.497 -8.063) 9.229 15.833 ( -4.730 -0.330 8.982) 10.157 15.946 ( 0.586 -0.441 -0.451) 0.860 16.674 ( 10.959 6.105 -2.799) 12.854 17.056 ( 4.625 4.437 -13.555) 14.994 17.392 ( 11.202 -9.119 10.593) 17.912 18.138 ( -11.581 -0.969 4.709) 12.539 18.579 ( 9.679 -1.789 -4.647) 10.884 18.822 ( -9.646 -1.255 1.848) 9.901 19.144 ( 0.250 7.085 0.048) 7.090 20.010 ( -2.083 -10.355 4.835) 11.617 20.244 ( 2.333 9.128 2.286) 9.694 20.527 ( 2.939 5.154 -12.341) 13.693 20.776 ( 0.235 -3.964 2.924) 4.932 21.216 ( -4.753 -1.018 2.640) 5.532 21.644 ( -3.384 -0.021 -0.193) 3.390 ======================= Grid point 43 (35/125) ======================= q-point: (-0.33 -0.56 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.076 ( -0.991 4.082 -1.042) 4.328 2.838 ( 21.351 -8.970 10.728) 25.523 3.020 ( -7.878 4.772 7.797) 12.068 3.296 ( -3.151 -16.146 -2.580) 16.651 3.528 ( -0.037 4.563 2.151) 5.045 3.737 ( -5.567 -5.333 -12.060) 14.313 3.851 ( 4.159 4.756 -7.934) 10.143 4.032 ( 7.471 -8.364 -1.229) 11.282 4.214 ( 5.154 8.878 2.946) 10.680 4.241 ( -2.595 -3.463 -1.166) 4.481 4.376 ( -12.737 6.241 1.674) 14.282 4.591 ( -8.547 -6.425 -11.940) 16.028 4.719 ( 1.173 9.809 5.965) 11.540 4.854 ( 4.279 -11.578 11.537) 16.895 5.144 ( -4.494 -2.371 -10.474) 11.641 5.381 ( 2.602 -1.121 -3.522) 4.520 5.836 ( 3.875 0.625 -4.447) 5.932 5.916 ( -1.448 3.626 0.462) 3.932 6.048 ( 4.905 -0.671 0.725) 5.004 6.182 ( -6.837 8.530 10.723) 15.313 6.367 ( -3.332 5.999 3.021) 7.498 6.528 ( 4.270 0.736 3.078) 5.315 6.586 ( 11.734 -4.477 -1.070) 12.604 6.990 ( -5.787 -5.287 -6.113) 9.940 7.125 ( -3.958 1.704 0.760) 4.376 7.223 ( 1.100 0.082 -1.475) 1.842 7.425 ( 2.798 -2.327 8.370) 9.127 7.586 ( 6.945 1.967 -1.286) 7.332 8.077 ( -8.785 -5.947 -2.808) 10.974 8.220 ( -3.848 0.893 -3.046) 4.988 8.486 ( -2.420 -4.085 -0.766) 4.810 8.500 ( 7.564 -2.719 3.341) 8.705 8.670 ( -5.175 -0.456 1.629) 5.444 8.733 ( 1.925 4.144 -6.660) 8.077 8.871 ( 1.440 2.016 0.253) 2.491 8.974 ( -4.800 1.381 3.776) 6.262 9.304 ( -2.590 0.070 -3.378) 4.258 9.423 ( 6.798 3.221 8.614) 11.436 9.665 ( -2.313 3.567 -6.474) 7.745 9.939 ( -1.001 2.086 5.213) 5.704 10.081 ( 0.828 0.340 0.425) 0.991 10.578 ( 4.480 -5.900 7.108) 10.266 10.757 ( 3.213 9.862 -1.154) 10.437 10.923 ( -0.041 0.510 -4.923) 4.950 11.310 ( -3.650 -7.825 -4.022) 9.525 11.473 ( 3.349 -3.354 -0.362) 4.753 11.733 ( -4.885 4.875 -0.026) 6.902 11.821 ( 8.233 -11.561 1.817) 14.308 11.985 ( -5.328 9.970 1.927) 11.468 12.162 ( -1.551 -4.615 0.260) 4.875 12.527 ( 4.700 9.692 -3.325) 11.273 12.542 ( -10.595 -1.063 -3.097) 11.090 12.918 ( -10.752 6.447 0.066) 12.537 13.411 ( 3.232 -0.305 2.644) 4.187 13.720 ( 6.113 -1.019 1.209) 6.314 13.789 ( 6.036 -5.196 -2.196) 8.262 14.067 ( 0.292 2.555 4.866) 5.504 14.368 ( -1.807 1.071 -1.768) 2.745 14.611 ( -6.221 3.599 2.163) 7.506 14.960 ( -1.223 -2.932 -5.618) 6.454 15.740 ( -6.300 2.401 -2.789) 7.296 16.009 ( 4.492 -4.035 7.320) 9.489 16.932 ( 8.584 -12.671 8.899) 17.704 17.036 ( 0.266 13.028 -18.326) 22.487 17.604 ( 17.168 -5.274 -2.588) 18.145 17.895 ( -10.090 -11.278 10.269) 18.288 18.593 ( -2.763 4.448 -2.495) 5.801 18.802 ( 6.405 -5.658 1.863) 8.747 19.162 ( -1.590 -2.211 -0.015) 2.724 19.956 ( -0.381 1.057 5.103) 5.226 20.265 ( -4.989 8.455 -13.793) 16.929 20.497 ( -7.899 -2.205 1.774) 8.391 20.888 ( 9.776 1.480 -8.332) 12.931 21.118 ( -2.163 -1.246 7.956) 8.339 21.628 ( -5.378 8.892 5.082) 11.568 ======================= Grid point 44 (36/125) ======================= q-point: (-0.22 -0.56 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.132 ( 5.242 -0.552 4.386) 6.858 2.817 ( -7.017 -6.324 -0.597) 9.465 3.042 ( -4.457 -14.184 -3.904) 15.372 3.332 ( 17.041 5.592 6.567) 19.100 3.544 ( -0.448 -4.651 -3.623) 5.913 3.609 ( -0.088 5.597 -0.275) 5.604 3.909 ( 1.516 -0.245 -1.690) 2.284 4.034 ( -11.336 2.166 -2.331) 11.774 4.129 ( 7.746 -9.884 2.575) 12.819 4.298 ( -4.863 0.471 -3.609) 6.074 4.356 ( -5.641 2.632 -7.301) 9.594 4.407 ( 5.285 7.205 -0.481) 8.948 4.652 ( -3.840 -14.119 1.288) 14.688 4.901 ( 3.819 2.083 7.115) 8.339 5.243 ( 7.049 10.864 3.828) 13.504 5.399 ( 3.711 -0.734 -7.080) 8.028 5.792 ( -9.156 -7.580 1.998) 12.053 5.878 ( 1.719 -0.250 -5.539) 5.806 6.071 ( -12.450 12.482 0.606) 17.640 6.193 ( 6.219 3.484 -1.833) 7.360 6.455 ( 0.293 -0.317 6.524) 6.538 6.539 ( -4.472 2.710 -5.554) 7.629 6.721 ( -4.961 -4.900 -5.432) 8.839 6.829 ( 10.623 -5.983 11.982) 17.094 6.996 ( -3.276 -9.785 5.153) 11.534 7.184 ( -3.793 -0.069 -1.973) 4.277 7.604 ( 5.965 -2.639 11.017) 12.803 7.743 ( 9.551 7.072 -7.093) 13.840 7.908 ( -1.818 -3.305 -5.777) 6.899 8.159 ( -2.667 3.256 -2.981) 5.158 8.414 ( -0.796 -2.010 -4.184) 4.710 8.560 ( -2.474 -1.436 5.351) 6.068 8.599 ( -0.675 -0.404 -0.032) 0.787 8.809 ( 1.466 5.212 -2.266) 5.870 8.940 ( -0.954 3.070 4.873) 5.838 9.019 ( 7.742 8.124 3.865) 11.870 9.271 ( 0.370 -0.524 3.471) 3.530 9.560 ( 2.766 1.020 -3.809) 4.816 9.686 ( 2.560 2.818 -1.308) 4.026 9.900 ( -7.169 0.565 5.634) 9.135 10.081 ( -0.718 -1.442 -0.046) 1.612 10.541 ( -0.292 -11.836 -1.354) 11.917 10.838 ( -2.064 0.661 -1.564) 2.672 10.909 ( -2.336 11.009 -4.816) 12.242 11.241 ( 4.220 -3.418 -0.306) 5.440 11.444 ( -0.320 -6.373 0.218) 6.384 11.764 ( -3.210 8.791 3.577) 10.019 11.821 ( 4.307 -12.106 0.772) 12.872 12.015 ( -0.262 9.089 -6.805) 11.357 12.141 ( 5.140 -5.962 1.508) 8.015 12.323 ( -10.245 -0.689 2.257) 10.513 12.711 ( -0.969 10.716 2.053) 10.954 12.903 ( 2.352 12.077 0.509) 12.315 13.448 ( 0.594 -0.006 -0.518) 0.788 13.766 ( 1.124 -4.504 1.113) 4.774 13.834 ( 4.292 -4.458 0.797) 6.239 14.137 ( 2.454 1.855 5.327) 6.151 14.352 ( -1.739 4.782 -0.813) 5.153 14.590 ( -0.753 4.444 -4.012) 6.034 14.887 ( -2.010 -2.237 1.738) 3.474 15.601 ( -3.521 -8.183 -18.114) 20.186 16.073 ( -0.126 2.992 13.997) 14.314 16.799 ( -5.408 -12.975 13.398) 19.419 17.109 ( 1.351 -1.468 -22.138) 22.227 17.532 ( -9.399 -6.637 5.505) 12.755 18.032 ( 20.738 0.556 0.728) 20.758 18.626 ( -0.319 0.266 0.746) 0.853 18.788 ( 0.324 -4.116 0.570) 4.168 19.145 ( 3.538 -1.565 -0.065) 3.869 20.007 ( -5.532 7.239 10.025) 13.547 20.188 ( -0.676 1.489 -18.730) 18.801 20.322 ( -6.041 -2.680 -4.751) 8.139 20.788 ( -10.519 -3.687 4.057) 11.862 21.351 ( 15.073 4.937 1.222) 15.908 21.657 ( -4.893 9.923 5.440) 12.329 ======================= Grid point 45 (37/125) ======================= q-point: (-0.11 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.254 ( 5.748 -3.586 5.695) 8.851 2.574 ( -15.264 11.530 -15.032) 24.329 2.891 ( 4.020 -18.470 5.966) 19.821 3.423 ( -1.479 -3.925 -6.864) 8.044 3.571 ( -2.036 7.528 4.833) 9.174 3.642 ( -1.597 -2.453 -0.746) 3.020 3.895 ( -1.966 -1.194 -2.063) 3.090 3.960 ( -0.931 -1.114 6.138) 6.307 4.137 ( -6.613 6.260 -4.410) 10.118 4.236 ( 8.615 -3.847 2.613) 9.790 4.392 ( 1.338 3.803 3.221) 5.161 4.500 ( 5.203 -1.887 1.159) 5.655 4.619 ( 8.015 0.707 -3.304) 8.698 4.945 ( -2.113 -1.188 -1.299) 2.750 5.421 ( -2.402 0.907 -2.646) 3.687 5.447 ( -6.824 3.782 5.480) 9.534 5.620 ( 11.954 -2.640 1.599) 12.346 5.816 ( -13.267 9.974 4.463) 17.188 6.073 ( 4.952 0.619 -8.006) 9.434 6.195 ( -10.854 -5.757 -4.805) 13.193 6.323 ( 3.051 -2.808 -6.959) 8.101 6.541 ( -2.889 1.868 11.171) 11.689 6.618 ( 0.863 -3.620 -5.824) 6.911 6.912 ( 2.058 -7.926 4.967) 9.577 7.018 ( 3.917 0.632 4.262) 5.823 7.085 ( -0.287 -3.722 -2.326) 4.399 7.669 ( -0.592 -0.101 11.560) 11.576 7.808 ( -1.862 1.487 -9.511) 9.805 7.995 ( 11.418 -0.316 -1.375) 11.505 8.122 ( -8.465 6.486 -4.290) 11.495 8.400 ( 6.534 -4.485 -4.354) 9.043 8.490 ( -5.908 -1.335 6.950) 9.219 8.671 ( 4.650 6.719 2.892) 8.668 8.856 ( -0.045 2.255 -2.034) 3.037 8.985 ( 2.002 2.828 -3.021) 4.596 9.278 ( 2.918 4.871 8.809) 10.480 9.328 ( 5.893 1.303 7.563) 9.676 9.557 ( 2.659 -1.374 -8.783) 9.279 9.724 ( -1.260 -0.342 6.504) 6.634 9.831 ( -1.596 4.335 -3.257) 5.652 10.027 ( -1.949 -4.027 0.313) 4.485 10.322 ( -6.931 -12.374 -8.007) 16.287 10.817 ( 0.225 0.525 1.331) 1.449 10.970 ( -0.348 5.790 -0.184) 5.804 11.284 ( -0.831 1.100 -1.468) 2.014 11.410 ( 3.028 -2.781 1.501) 4.376 11.706 ( -4.307 -2.915 -0.444) 5.220 11.822 ( -2.534 6.338 1.605) 7.012 12.021 ( -0.840 -4.716 -6.437) 8.024 12.204 ( 6.021 0.957 1.405) 6.257 12.298 ( 4.104 -1.000 4.236) 5.982 12.765 ( -1.340 7.217 3.098) 7.967 13.135 ( 6.894 6.011 3.185) 9.685 13.447 ( -0.427 4.538 -4.081) 6.118 13.685 ( -4.601 -5.233 0.974) 7.036 13.841 ( -0.364 -2.090 1.532) 2.617 14.225 ( 3.531 1.302 10.070) 10.751 14.426 ( 2.689 6.406 -1.343) 7.076 14.594 ( -0.441 1.231 -7.831) 7.939 14.896 ( 2.247 0.549 5.889) 6.327 15.312 ( -5.104 -14.692 -20.047) 25.373 16.194 ( -0.676 10.323 11.446) 15.429 16.649 ( -2.075 -12.363 9.172) 15.533 16.889 ( -8.127 -6.868 -11.218) 15.462 17.432 ( -2.353 0.290 0.943) 2.552 18.291 ( 4.624 -1.765 -4.697) 6.823 18.514 ( -5.105 0.213 2.340) 5.619 18.900 ( 7.913 2.321 1.736) 8.426 19.204 ( 1.649 2.689 0.533) 3.198 19.937 ( -10.906 4.349 7.272) 13.811 20.081 ( -0.862 -8.444 -6.458) 10.665 20.296 ( 4.864 3.893 -13.627) 14.984 20.628 ( -4.904 -3.516 7.790) 9.854 21.581 ( -0.648 8.116 4.738) 9.420 21.730 ( 8.584 0.050 -1.718) 8.755 ======================= Grid point 93 (38/125) ======================= q-point: ( 0.11 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.514 ( -0.000 0.000 40.857) 40.857 0.514 ( -0.000 0.000 40.857) 40.857 0.936 ( -0.000 0.000 74.655) 74.655 3.066 ( 0.000 -0.000 -8.822) 8.822 3.066 ( 0.000 -0.000 -8.822) 8.822 3.790 ( -0.000 0.000 0.491) 0.491 3.790 ( -0.000 0.000 0.491) 0.491 3.978 ( 0.000 -0.000 -3.195) 3.195 4.057 ( -0.000 0.000 1.805) 1.805 4.400 ( 0.000 -0.000 -2.529) 2.529 4.400 ( 0.000 -0.000 -2.529) 2.529 4.655 ( -0.000 0.000 2.949) 2.949 4.655 ( -0.000 0.000 2.949) 2.949 5.421 ( 0.000 -0.000 -12.550) 12.550 5.421 ( 0.000 -0.000 -12.550) 12.550 5.462 ( 0.000 -0.000 -8.657) 8.657 5.677 ( -0.000 0.000 7.431) 7.431 5.804 ( -0.000 0.000 12.518) 12.518 5.804 ( -0.000 0.000 12.518) 12.518 6.278 ( 0.000 -0.000 -1.003) 1.003 6.397 ( 0.000 -0.000 -34.038) 34.038 6.516 ( -0.000 -0.000 -0.077) 0.077 6.516 ( 0.000 0.000 -0.077) 0.077 7.014 ( -0.000 0.000 12.695) 12.695 7.453 ( 0.000 -0.000 -1.861) 1.861 7.453 ( 0.000 -0.000 -1.861) 1.861 7.818 ( -0.000 0.000 4.911) 4.911 8.189 ( 0.000 -0.000 -0.349) 0.349 8.266 ( 0.000 -0.000 -9.347) 9.347 8.266 ( 0.000 -0.000 -9.347) 9.347 8.332 ( -0.000 0.000 3.588) 3.588 8.477 ( -0.000 0.000 4.483) 4.483 8.477 ( -0.000 0.000 4.483) 4.483 8.833 ( 0.000 -0.000 -7.024) 7.024 9.116 ( -0.000 0.000 2.664) 2.664 9.116 ( -0.000 0.000 2.664) 2.664 9.287 ( -0.000 0.000 9.437) 9.437 9.287 ( -0.000 0.000 9.437) 9.437 9.312 ( -0.000 0.000 8.295) 8.295 10.279 ( -0.000 0.000 3.570) 3.570 10.279 ( -0.000 0.000 3.570) 3.570 10.801 ( 0.000 -0.000 -18.120) 18.120 11.123 ( 0.000 -0.000 -4.041) 4.041 11.123 ( 0.000 -0.000 -4.041) 4.041 11.225 ( 0.000 -0.000 -12.521) 12.521 11.225 ( 0.000 -0.000 -12.521) 12.521 11.445 ( -0.000 0.000 15.037) 15.037 11.632 ( -0.000 0.000 7.511) 7.511 11.632 ( -0.000 0.000 7.511) 7.511 12.369 ( -0.000 0.000 2.203) 2.203 12.938 ( -0.000 0.000 1.010) 1.010 12.938 ( -0.000 0.000 1.010) 1.010 13.170 ( -0.000 0.000 6.515) 6.515 13.568 ( 0.000 -0.000 -3.885) 3.885 13.687 ( -0.000 0.000 2.609) 2.609 13.764 ( -0.000 0.000 1.179) 1.179 13.764 ( -0.000 0.000 1.179) 1.179 14.884 ( 0.000 -0.000 -8.563) 8.563 14.944 ( 0.000 -0.000 -0.555) 0.555 15.856 ( -0.000 0.000 0.888) 0.888 15.856 ( 0.000 0.000 0.888) 0.888 16.243 ( 0.000 -0.000 -3.340) 3.340 16.243 ( 0.000 -0.000 -3.340) 3.340 16.820 ( -0.000 0.000 0.219) 0.219 17.329 ( 0.000 -0.000 -0.757) 0.757 17.329 ( 0.000 -0.000 -0.757) 0.757 17.508 ( -0.000 0.000 1.373) 1.373 17.508 ( -0.000 0.000 1.373) 1.373 17.708 ( -0.000 0.000 3.265) 3.265 20.733 ( -0.000 0.000 0.279) 0.279 20.733 ( 0.000 0.000 0.279) 0.279 21.076 ( -0.000 -0.000 -0.051) 0.051 21.076 ( 0.000 0.000 -0.051) 0.051 21.680 ( 0.000 -0.000 -2.905) 2.905 22.994 ( -0.000 0.000 1.977) 1.977 ======================= Grid point 94 (39/125) ======================= q-point: ( 0.22 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.734 ( 22.511 -7.976 24.048) 33.892 1.059 ( 21.907 21.798 25.374) 39.986 1.819 ( 35.887 24.216 52.368) 67.946 2.995 ( -2.285 0.389 -14.654) 14.837 3.126 ( 8.365 2.079 -9.702) 12.978 3.715 ( -4.103 -1.743 -0.913) 4.550 3.817 ( -2.824 4.249 1.933) 5.456 3.924 ( -7.747 -7.311 0.038) 10.652 3.977 ( 2.864 -3.430 3.188) 5.489 4.312 ( -4.669 -3.920 1.371) 6.249 4.406 ( -1.128 4.379 -1.348) 4.718 4.608 ( 5.824 -1.544 -8.823) 10.684 4.862 ( 0.857 6.796 6.083) 9.161 5.239 ( -3.085 -3.522 -1.815) 5.022 5.398 ( 0.692 -4.435 -10.510) 11.428 5.539 ( 0.409 7.372 -7.725) 10.686 5.585 ( -8.208 -3.866 4.512) 10.133 5.678 ( 0.896 -5.090 7.814) 9.368 6.097 ( 7.734 4.967 5.685) 10.807 6.223 ( 2.492 1.650 -20.514) 20.730 6.307 ( 2.408 -0.915 -3.539) 4.378 6.414 ( -4.543 -2.368 -0.950) 5.210 6.563 ( 1.069 4.130 0.667) 4.318 6.999 ( 1.793 -0.559 14.291) 14.414 7.423 ( -1.304 -3.544 -4.736) 6.057 7.463 ( -0.333 7.750 -2.752) 8.231 7.755 ( -7.952 -4.811 16.751) 19.157 7.963 ( -6.919 -13.045 -10.011) 17.840 7.974 ( -18.531 -9.498 -0.253) 20.825 8.196 ( 1.553 -4.475 -3.384) 5.822 8.367 ( -8.047 8.038 1.507) 11.473 8.602 ( 5.766 11.157 -12.049) 17.405 8.707 ( 9.890 -2.206 -0.095) 10.134 8.878 ( 2.938 7.887 -1.993) 8.650 9.141 ( 1.884 -0.500 0.412) 1.992 9.179 ( 4.506 -4.814 -2.587) 7.083 9.267 ( -2.991 8.275 4.305) 9.796 9.490 ( 3.579 1.335 1.494) 4.101 9.532 ( 9.157 4.393 9.872) 14.163 10.198 ( -7.831 -3.141 1.568) 8.582 10.268 ( -2.999 -3.018 0.917) 4.352 10.712 ( -7.360 -1.103 -18.727) 20.152 11.070 ( -1.131 -3.915 -6.828) 7.951 11.097 ( -0.955 -2.516 -7.178) 7.666 11.187 ( 5.411 -2.330 -12.883) 14.166 11.265 ( 2.341 2.491 -4.446) 5.609 11.444 ( -2.001 -1.356 8.823) 9.148 11.644 ( 0.061 0.032 6.466) 6.467 11.841 ( 6.960 10.399 5.266) 13.576 12.400 ( 0.338 1.394 4.582) 4.801 12.758 ( -3.020 -4.639 8.268) 9.950 12.962 ( 1.525 -0.171 2.947) 3.323 13.338 ( 5.191 1.458 -1.635) 5.635 13.488 ( -3.914 -2.804 -2.035) 5.227 13.635 ( -5.085 -2.758 1.709) 6.032 13.695 ( -6.906 -2.959 1.450) 7.651 13.893 ( 6.131 10.476 -3.417) 12.610 14.828 ( -2.358 -1.348 -9.061) 9.460 15.055 ( 6.618 6.455 0.426) 9.255 15.481 ( -15.590 -12.024 2.547) 19.853 15.645 ( -13.888 -13.709 7.157) 20.786 16.050 ( -21.931 -0.390 13.364) 25.685 16.359 ( 7.996 -7.508 1.447) 11.064 16.784 ( 9.304 3.910 3.282) 10.612 16.974 ( 7.714 -3.021 3.050) 8.829 17.350 ( -7.680 3.774 -1.255) 8.649 17.626 ( 7.612 13.475 -0.112) 15.477 17.658 ( 21.047 7.461 -0.313) 22.333 18.513 ( 22.522 17.252 -11.776) 30.717 20.554 ( -10.513 -14.935 20.117) 27.171 20.679 ( -7.558 1.816 2.246) 8.091 20.988 ( -2.608 -4.491 -4.834) 7.095 20.998 ( -2.321 -15.631 3.221) 16.127 21.352 ( -10.901 4.593 9.426) 15.125 22.854 ( -9.670 -5.429 -2.236) 11.313 ======================= Grid point 95 (40/125) ======================= q-point: ( 0.33 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.227 ( 29.123 0.090 6.062) 29.747 1.778 ( 24.892 19.979 14.588) 35.094 2.807 ( 12.130 12.262 6.917) 18.583 2.914 ( 16.003 8.342 12.974) 22.226 3.302 ( 13.050 2.908 -10.943) 17.278 3.608 ( -11.009 0.565 -0.598) 11.040 3.686 ( -2.186 -6.577 4.443) 8.233 3.854 ( -0.614 3.460 -0.037) 3.514 4.014 ( 0.194 -2.650 1.424) 3.015 4.242 ( 0.806 -1.986 8.266) 8.539 4.455 ( 0.858 6.028 -3.473) 7.009 4.661 ( 6.800 -2.710 -6.291) 9.652 4.848 ( -9.490 6.720 1.536) 11.730 5.154 ( -10.022 -0.715 2.609) 10.381 5.285 ( -7.054 -7.113 0.276) 10.022 5.428 ( 6.374 -8.429 -0.786) 10.597 5.586 ( -0.473 0.220 -2.610) 2.662 5.752 ( 3.450 6.142 -0.705) 7.080 6.162 ( 1.122 -2.893 -7.243) 7.879 6.226 ( 0.166 -4.474 -2.133) 4.959 6.310 ( 5.237 1.834 -6.036) 8.199 6.440 ( 4.678 2.285 -1.186) 5.340 6.658 ( 2.383 7.865 -5.069) 9.656 7.099 ( 0.918 0.993 4.191) 4.404 7.273 ( -7.379 -4.394 -4.152) 9.540 7.481 ( -21.352 -6.191 2.682) 22.393 7.575 ( 6.394 1.201 -1.301) 6.635 7.644 ( -7.011 -5.524 13.550) 16.225 7.749 ( -1.661 -5.004 -8.513) 10.013 8.201 ( 0.961 0.378 0.168) 1.046 8.325 ( -6.517 6.981 2.140) 9.787 8.717 ( 3.905 5.131 -7.810) 10.127 8.813 ( 4.332 1.130 -9.163) 10.198 8.943 ( -2.219 -1.199 9.054) 9.399 9.075 ( -1.970 -1.869 -4.984) 5.676 9.283 ( 8.589 -0.177 -7.714) 11.546 9.345 ( -3.177 9.701 1.551) 10.325 9.505 ( 1.179 -4.205 7.251) 8.465 9.731 ( 2.695 7.010 8.231) 11.143 9.980 ( -11.328 -5.267 0.091) 12.493 10.173 ( -1.685 -6.757 1.011) 7.037 10.450 ( -9.955 -5.314 -11.793) 16.323 10.986 ( 0.411 -4.682 -5.974) 7.601 10.996 ( -5.171 -1.318 -2.194) 5.770 11.236 ( 7.023 0.685 -11.230) 13.263 11.286 ( 0.218 -0.291 4.442) 4.457 11.447 ( -1.019 0.387 6.455) 6.546 11.694 ( 3.557 -0.641 3.779) 5.229 12.011 ( 0.198 7.214 0.911) 7.274 12.427 ( -3.174 2.804 7.479) 8.595 12.712 ( -3.634 -2.169 -1.264) 4.417 13.034 ( 5.507 -2.103 2.394) 6.363 13.313 ( -2.037 -5.539 1.692) 6.140 13.504 ( -2.880 -2.272 0.290) 3.680 13.519 ( -3.789 -0.469 1.853) 4.244 13.547 ( 0.517 1.634 -1.178) 2.079 14.071 ( 4.690 9.351 -6.768) 12.460 14.710 ( -4.591 -2.312 -7.489) 9.083 15.076 ( -17.190 -6.102 1.495) 18.302 15.190 ( -3.387 2.373 9.211) 10.097 15.331 ( -12.068 -7.716 -0.251) 14.326 15.919 ( 8.769 -8.376 7.889) 14.467 16.436 ( 3.029 2.093 -1.012) 3.818 17.004 ( 2.955 -2.763 -9.217) 10.066 17.128 ( 17.648 -6.942 7.987) 20.577 17.360 ( -1.558 22.227 4.325) 22.698 17.926 ( 15.278 8.190 -1.696) 17.418 18.196 ( 23.445 15.289 -2.427) 28.095 18.929 ( 11.025 16.310 -2.988) 19.912 20.292 ( -9.553 -19.894 24.392) 32.894 20.532 ( -8.260 -5.079 1.797) 9.861 20.758 ( -11.588 -7.126 0.522) 13.614 20.886 ( -0.305 -8.195 -4.954) 9.581 21.339 ( -2.447 6.700 1.943) 7.393 22.549 ( -14.690 -8.013 -7.024) 18.148 ======================= Grid point 96 (41/125) ======================= q-point: ( 0.44 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.747 ( 27.004 2.890 -3.276) 27.355 2.329 ( 11.163 9.971 3.927) 15.475 2.811 ( 7.957 4.094 -6.032) 10.791 3.312 ( -7.165 -0.637 3.247) 7.892 3.489 ( 6.695 0.705 -5.503) 8.695 3.650 ( 11.302 5.227 9.933) 15.928 3.717 ( 8.288 2.033 10.866) 13.816 3.859 ( -0.160 -2.621 -3.796) 4.616 3.976 ( -1.476 4.125 1.767) 4.724 4.345 ( 1.727 5.386 6.334) 8.492 4.492 ( -1.055 2.948 -4.394) 5.396 4.725 ( -6.245 4.615 3.396) 8.475 4.819 ( -7.762 7.138 4.783) 11.580 4.915 ( 0.660 -4.209 -2.899) 5.153 5.103 ( -1.081 -10.341 4.421) 11.298 5.468 ( 4.345 -5.878 -12.292) 14.301 5.611 ( 3.930 -0.668 10.258) 11.005 5.834 ( -1.725 8.576 -2.290) 9.042 6.120 ( 2.289 -8.193 1.300) 8.606 6.195 ( 0.699 -4.844 -0.126) 4.896 6.365 ( 1.912 0.054 -4.640) 5.019 6.556 ( 7.114 1.696 -4.677) 8.681 6.704 ( 0.547 3.028 -7.218) 7.846 6.856 ( -17.166 -6.510 -2.796) 18.571 7.105 ( -16.142 -1.129 -2.659) 16.399 7.245 ( 0.094 -0.095 -0.168) 0.215 7.626 ( 2.417 0.331 0.451) 2.481 7.700 ( 6.298 -1.636 4.345) 7.824 7.739 ( 3.944 4.350 -0.565) 5.899 8.246 ( 0.392 5.679 5.361) 7.820 8.299 ( -3.578 2.847 2.040) 5.007 8.693 ( -5.833 -2.570 -7.980) 10.213 8.827 ( -0.350 2.538 3.608) 4.425 8.932 ( 0.286 -2.307 -3.680) 4.352 9.015 ( 1.820 -6.115 -4.269) 7.676 9.288 ( -6.044 4.208 0.155) 7.366 9.397 ( 1.369 6.078 -8.504) 10.542 9.523 ( -0.100 -4.437 3.764) 5.819 9.752 ( -3.272 -1.616 -1.789) 4.064 9.871 ( -0.930 4.657 5.243) 7.074 10.089 ( 0.753 -10.099 2.748) 10.494 10.210 ( -7.308 -2.764 -4.872) 9.207 10.898 ( -3.583 -1.626 -0.066) 3.936 10.954 ( 2.426 -2.378 -5.474) 6.442 11.304 ( 0.859 0.805 5.241) 5.372 11.382 ( 10.389 1.863 -5.307) 11.813 11.459 ( -3.107 3.492 6.203) 7.766 11.783 ( 6.757 -1.799 1.422) 7.136 12.022 ( -3.868 2.461 0.619) 4.627 12.392 ( -6.833 1.952 6.579) 9.684 12.532 ( -11.058 -4.015 -4.816) 12.712 13.030 ( -4.227 -5.485 0.242) 6.930 13.215 ( -1.720 -3.923 -2.056) 4.751 13.477 ( 2.289 1.696 5.454) 6.153 13.498 ( 2.853 -1.103 -1.427) 3.375 13.686 ( 6.369 4.343 -1.062) 7.782 14.179 ( 2.845 5.957 -10.039) 12.015 14.577 ( -4.560 -1.491 -6.064) 7.733 14.781 ( -10.278 -6.624 8.890) 15.118 15.073 ( -10.592 0.929 -0.823) 10.664 15.180 ( -3.234 -3.524 11.758) 12.694 16.109 ( 15.429 -4.357 -2.277) 16.193 16.490 ( -2.085 8.115 -2.495) 8.742 16.882 ( -0.652 -10.261 -6.612) 12.224 17.368 ( 5.481 2.023 11.373) 12.786 17.744 ( 17.546 17.016 2.500) 24.569 18.260 ( 14.224 6.497 -2.614) 15.855 18.682 ( 15.973 12.665 -5.140) 21.022 19.192 ( 3.349 11.499 -0.812) 12.004 20.056 ( -6.858 -14.603 18.276) 24.379 20.319 ( -7.687 -11.922 5.823) 15.334 20.483 ( -10.925 -4.689 -3.079) 12.281 20.766 ( -5.402 -3.626 -0.390) 6.517 21.412 ( 4.018 5.259 0.021) 6.618 22.157 ( -15.775 -8.576 -9.659) 20.389 ======================= Grid point 97 (42/125) ======================= q-point: ( 0.56 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.145 ( 12.957 6.979 -5.282) 15.636 2.492 ( 13.207 -4.820 -1.918) 14.190 2.910 ( -14.503 4.162 8.841) 17.488 3.311 ( 9.737 0.632 0.277) 9.761 3.508 ( 2.007 0.018 -1.715) 2.640 3.787 ( -0.428 -5.416 -1.482) 5.631 3.830 ( 3.370 2.471 -5.603) 6.990 3.900 ( 1.295 -1.894 7.636) 7.974 4.055 ( 4.020 5.514 1.078) 6.909 4.399 ( -9.824 -4.901 1.077) 11.031 4.437 ( -0.759 4.746 5.792) 7.527 4.551 ( -7.180 3.441 -8.648) 11.755 4.727 ( -3.597 11.092 2.479) 11.921 4.911 ( 0.518 -11.842 9.449) 15.159 5.363 ( 13.041 4.862 2.637) 14.165 5.370 ( 0.488 -3.413 -4.464) 5.640 5.728 ( -1.280 10.394 -0.548) 10.487 5.882 ( 0.941 -0.404 -0.459) 1.122 6.042 ( 1.059 -13.948 7.887) 16.058 6.129 ( -2.696 -4.358 -2.357) 5.641 6.293 ( -3.130 -3.857 -2.328) 5.486 6.561 ( -5.673 -1.473 -4.548) 7.418 6.648 ( -1.404 0.644 5.672) 5.879 6.774 ( 7.444 5.996 -11.946) 15.299 6.943 ( -0.320 2.602 0.142) 2.626 7.174 ( -6.473 -1.096 2.121) 6.900 7.620 ( -0.455 1.674 -11.827) 11.953 7.833 ( 3.618 -0.035 10.213) 10.835 7.929 ( 9.962 5.263 -0.209) 11.268 8.218 ( -4.625 -6.007 2.897) 8.116 8.391 ( 2.500 7.817 6.363) 10.384 8.509 ( -7.690 -3.325 -4.194) 9.369 8.819 ( -4.520 3.323 1.331) 5.766 8.873 ( -1.021 -5.041 1.095) 5.259 8.982 ( 3.231 -2.820 -2.015) 4.739 9.264 ( -2.162 2.156 -6.791) 7.446 9.363 ( 0.302 2.582 -4.780) 5.441 9.531 ( 1.859 -0.561 -9.057) 9.263 9.736 ( -0.950 4.526 1.760) 4.949 9.875 ( 1.402 -3.713 3.016) 4.985 10.028 ( -4.699 0.263 4.662) 6.624 10.136 ( 3.152 -5.841 1.090) 6.726 10.832 ( -2.245 -1.248 -1.630) 3.042 10.956 ( 2.527 -1.930 -6.941) 7.635 11.338 ( -0.533 -0.580 7.047) 7.091 11.448 ( -3.396 3.038 3.474) 5.730 11.603 ( 9.719 4.469 -0.454) 10.706 11.872 ( 2.136 -1.594 2.740) 3.822 11.960 ( -1.619 -2.418 -0.356) 2.931 12.273 ( -5.420 -1.168 -1.723) 5.806 12.349 ( -6.371 2.655 0.726) 6.940 12.860 ( -5.072 -4.260 -0.591) 6.650 13.189 ( -0.733 2.120 -3.006) 3.751 13.533 ( 5.494 -8.109 -0.678) 9.818 13.563 ( -0.787 6.730 2.235) 7.135 13.798 ( 2.742 1.685 -1.645) 3.615 14.205 ( 0.624 3.643 -13.662) 14.153 14.499 ( -1.275 0.908 -2.623) 3.055 14.649 ( -3.433 -5.344 8.742) 10.806 14.957 ( -5.023 3.078 1.327) 6.039 15.167 ( 1.929 -7.002 14.846) 16.528 16.281 ( 6.537 1.002 -5.688) 8.723 16.518 ( -3.750 11.542 -0.800) 12.162 16.769 ( 1.571 -10.165 -2.338) 10.549 17.460 ( -0.775 1.497 6.172) 6.398 18.174 ( 12.679 4.171 0.551) 13.358 18.492 ( 7.063 3.346 -1.748) 8.009 18.900 ( 2.481 5.156 -3.911) 6.931 19.266 ( -1.833 2.150 0.963) 2.985 19.958 ( 0.593 -1.722 5.019) 5.339 20.068 ( -10.595 -9.637 0.203) 14.324 20.339 ( 0.632 -5.173 5.003) 7.224 20.651 ( -6.259 2.410 4.220) 7.924 21.584 ( 8.425 4.469 -2.926) 9.976 21.795 ( -10.380 -5.698 -6.925) 13.717 ======================= Grid point 98 (43/125) ======================= q-point: (-0.33 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.234 ( -6.620 -3.349 1.320) 7.535 2.601 ( -10.997 1.225 -0.720) 11.088 2.795 ( 12.132 -1.600 6.385) 13.803 3.344 ( -2.686 -7.592 1.963) 8.289 3.558 ( -1.213 -3.474 -6.851) 7.777 3.632 ( -11.521 2.655 5.486) 13.034 3.794 ( 1.600 -1.264 -6.778) 7.078 3.913 ( -0.858 0.206 0.054) 0.884 4.060 ( -11.809 -6.315 0.578) 13.404 4.307 ( 9.615 3.970 -2.599) 10.722 4.449 ( -3.340 0.929 4.099) 5.369 4.568 ( 4.254 -1.322 -2.941) 5.338 4.810 ( -2.960 9.076 2.551) 9.881 4.928 ( 8.743 -7.896 12.944) 17.502 5.198 ( -8.723 -0.739 -4.877) 10.021 5.459 ( -11.489 -4.797 -10.746) 16.446 5.679 ( -0.138 1.867 5.014) 5.352 5.896 ( 1.071 13.851 -2.978) 14.208 5.989 ( 0.389 -7.861 3.355) 8.555 6.207 ( 8.564 0.857 7.427) 11.368 6.338 ( 10.748 -3.439 -2.376) 11.532 6.435 ( -4.459 -0.017 -7.986) 9.147 6.677 ( -0.239 2.404 5.872) 6.350 6.941 ( 7.236 5.425 0.240) 9.047 7.052 ( 2.491 2.330 -3.620) 4.974 7.107 ( 3.001 1.079 5.640) 6.479 7.565 ( -1.550 1.709 -11.453) 11.683 7.847 ( -9.113 -4.366 7.229) 12.424 7.981 ( 0.098 -7.519 0.215) 7.523 8.172 ( -0.255 2.589 3.304) 4.206 8.284 ( -4.911 -6.081 -1.070) 7.890 8.562 ( 4.153 6.431 1.696) 7.841 8.843 ( -0.814 7.458 -0.795) 7.545 8.866 ( 3.630 -0.062 2.812) 4.592 9.039 ( 5.244 -1.473 2.043) 5.817 9.218 ( 0.652 -0.061 -8.045) 8.072 9.391 ( -1.396 1.330 -15.025) 15.148 9.474 ( 0.473 0.126 1.524) 1.600 9.843 ( 3.281 -0.029 2.630) 4.205 9.906 ( 0.502 8.574 2.369) 8.909 9.997 ( -1.053 1.585 3.930) 4.367 10.131 ( 5.899 -10.985 2.814) 12.782 10.788 ( 0.526 -0.590 -4.897) 4.961 10.931 ( -0.075 -1.543 -6.775) 6.949 11.321 ( -3.787 -0.393 6.427) 7.470 11.440 ( -1.036 1.103 0.985) 1.805 11.599 ( -7.265 -4.501 -0.510) 8.561 11.914 ( -5.719 4.514 3.323) 8.008 11.994 ( 9.177 -1.385 5.259) 10.668 12.232 ( 0.977 -2.326 -2.737) 3.723 12.368 ( 6.144 5.552 -0.992) 8.340 12.857 ( 3.305 7.081 -0.218) 7.818 13.186 ( 0.103 1.353 -3.532) 3.783 13.482 ( -1.351 -8.837 -2.697) 9.338 13.581 ( -4.468 4.277 1.376) 6.337 13.794 ( -2.200 -1.137 -2.180) 3.300 14.206 ( 3.002 4.362 -13.289) 14.306 14.518 ( 0.647 1.639 1.919) 2.605 14.603 ( 1.040 -3.283 3.500) 4.910 14.966 ( 1.100 3.382 2.239) 4.203 15.228 ( 6.631 -10.239 17.685) 21.484 16.272 ( -9.201 7.979 -6.333) 13.727 16.595 ( -0.794 2.056 5.674) 6.087 16.732 ( 5.548 -0.993 -4.595) 7.272 17.424 ( -5.651 -1.576 2.000) 6.198 18.105 ( -10.319 -14.971 -2.806) 18.398 18.501 ( -7.476 0.333 -1.394) 7.612 19.021 ( 3.168 -1.231 4.949) 6.004 19.220 ( 0.989 0.929 -4.629) 4.824 19.751 ( -15.270 -4.903 -4.558) 16.673 20.084 ( 11.185 0.475 3.044) 11.602 20.404 ( 5.812 0.644 4.430) 7.336 20.677 ( -0.043 8.837 5.826) 10.584 21.474 ( -6.239 -5.395 -8.834) 12.086 21.931 ( 14.375 7.936 1.144) 16.460 ======================= Grid point 99 (44/125) ======================= q-point: (-0.22 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.835 ( -22.471 -16.215 -0.616) 27.718 2.339 ( -24.221 -8.971 5.939) 26.504 2.918 ( 0.311 4.994 -0.007) 5.003 3.205 ( -23.828 -14.069 -1.843) 27.733 3.400 ( 15.112 -3.702 3.606) 15.971 3.577 ( -1.221 2.091 0.399) 2.454 3.735 ( -11.178 -5.121 -0.593) 12.310 3.847 ( 0.626 0.561 -3.404) 3.506 3.904 ( -0.022 0.050 -0.380) 0.383 4.299 ( -11.469 -6.154 3.738) 13.542 4.481 ( 4.891 3.037 -2.976) 6.481 4.623 ( 4.333 -0.956 -3.226) 5.487 4.825 ( 0.273 3.264 -1.766) 3.721 5.069 ( 5.808 -0.137 4.007) 7.058 5.087 ( -2.951 1.758 8.160) 8.853 5.328 ( 3.729 2.142 -9.076) 10.043 5.679 ( -3.185 1.187 3.684) 5.013 5.978 ( -1.090 0.453 3.124) 3.340 6.087 ( 6.146 9.100 -0.717) 11.004 6.265 ( 1.486 -7.647 5.272) 9.406 6.310 ( -6.435 1.962 -2.961) 7.351 6.553 ( 8.494 2.132 -4.435) 9.816 6.734 ( 5.549 -1.081 1.003) 5.742 7.044 ( -0.429 1.304 -1.880) 2.327 7.167 ( 6.652 0.963 -6.955) 9.672 7.213 ( 8.633 1.894 5.570) 10.447 7.490 ( -10.009 -3.576 -1.049) 10.680 7.629 ( -4.643 8.062 2.059) 9.528 7.975 ( -1.746 -1.199 11.022) 11.224 8.095 ( 4.639 -10.964 -5.486) 13.108 8.259 ( -2.453 3.551 0.675) 4.368 8.717 ( 6.569 3.405 -0.394) 7.410 8.833 ( -3.340 1.984 -0.366) 3.902 8.979 ( 1.736 3.280 -4.616) 5.923 9.134 ( 4.276 -2.621 6.537) 8.239 9.190 ( 3.394 -1.036 -9.429) 10.074 9.383 ( 4.777 0.686 -5.163) 7.068 9.432 ( -10.353 7.635 -4.459) 13.614 9.858 ( 0.117 -5.576 3.748) 6.720 9.975 ( -0.389 -1.347 9.499) 9.602 10.005 ( 1.388 3.317 -2.775) 4.542 10.320 ( 17.495 4.366 0.032) 18.032 10.824 ( 5.979 0.686 -3.869) 7.154 10.885 ( -0.558 -0.325 -4.327) 4.375 11.272 ( -3.986 0.857 3.660) 5.479 11.423 ( -0.038 -4.505 0.821) 4.579 11.448 ( -6.001 1.285 -1.747) 6.381 11.821 ( -7.630 -1.273 3.572) 8.521 12.113 ( 2.983 0.644 8.805) 9.319 12.247 ( 2.971 -2.204 -4.491) 5.819 12.602 ( 9.955 7.508 -0.039) 12.469 13.017 ( 3.335 5.375 -0.652) 6.359 13.228 ( 4.249 5.236 -3.234) 7.479 13.305 ( -5.974 -5.987 -4.226) 9.455 13.530 ( -3.413 0.967 -0.187) 3.552 13.700 ( -4.942 -2.892 -0.843) 5.788 14.263 ( -0.122 4.641 -8.577) 9.753 14.579 ( 7.674 -0.236 3.156) 8.301 14.688 ( 7.430 3.843 1.060) 8.432 15.069 ( 6.601 2.365 0.181) 7.014 15.317 ( 6.911 -10.768 17.449) 21.638 16.084 ( -18.138 6.160 -3.832) 19.535 16.542 ( -1.784 -6.045 1.613) 6.506 16.892 ( 3.565 11.993 -3.732) 13.057 17.244 ( -7.571 -8.236 -1.848) 11.338 17.714 ( -13.465 -15.605 3.395) 20.889 18.271 ( -15.405 -3.509 -1.827) 15.905 18.756 ( -18.189 -14.416 -0.191) 23.210 19.365 ( -7.678 -11.802 11.722) 18.320 19.497 ( 7.402 13.156 -15.860) 21.896 20.361 ( 15.814 1.474 4.844) 16.605 20.544 ( 4.936 4.757 1.151) 6.951 20.827 ( 2.845 10.232 2.434) 10.895 21.339 ( -1.067 -3.776 -4.040) 5.632 22.289 ( 15.900 8.972 -0.526) 18.265 ======================= Grid point 100 (45/125) ======================= q-point: (-0.11 0.11 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.232 ( -23.371 -21.342 -1.721) 31.696 1.686 ( -35.399 -15.658 6.311) 39.219 2.349 ( -42.947 -23.561 7.976) 49.630 3.101 ( 3.254 4.582 0.911) 5.693 3.374 ( -8.163 -7.281 -6.070) 12.510 3.619 ( -0.465 7.163 0.817) 7.224 3.715 ( 8.886 -4.681 6.251) 11.830 3.877 ( 4.805 -0.029 -5.973) 7.666 3.949 ( 2.579 -0.305 6.669) 7.156 4.131 ( -3.366 5.109 -1.476) 6.294 4.486 ( -3.325 -2.338 -0.247) 4.072 4.637 ( 3.253 -1.975 -9.158) 9.917 4.904 ( 0.406 5.748 0.945) 5.839 5.157 ( 4.825 0.144 3.500) 5.962 5.193 ( 5.012 6.776 4.955) 9.776 5.416 ( 6.075 -1.318 -5.125) 8.057 5.653 ( -1.756 -0.829 6.435) 6.722 5.922 ( -6.805 3.954 -10.638) 13.233 6.117 ( -5.783 -7.917 6.109) 11.552 6.272 ( 4.321 -1.190 1.311) 4.670 6.322 ( 5.311 3.913 2.957) 7.229 6.537 ( -6.975 -1.207 1.288) 7.195 6.744 ( -6.031 -6.533 -14.535) 17.039 6.950 ( -2.091 -1.390 5.383) 5.940 7.241 ( -0.383 3.359 -11.418) 11.908 7.422 ( 14.785 4.112 -0.484) 15.354 7.499 ( 9.008 1.521 10.441) 13.874 7.717 ( -1.104 7.944 6.340) 10.224 8.016 ( 1.020 9.057 10.882) 14.194 8.157 ( 12.720 -7.438 -2.827) 15.004 8.225 ( -2.961 1.678 -4.721) 5.820 8.768 ( -6.914 1.937 -4.342) 8.391 8.785 ( 1.907 -4.995 -0.558) 5.376 9.000 ( 3.316 2.234 -0.740) 4.066 9.124 ( -3.885 -4.903 0.583) 6.283 9.228 ( 3.610 -1.079 -12.008) 12.585 9.276 ( -12.501 9.565 -3.307) 16.084 9.448 ( 2.999 -3.230 -0.748) 4.471 9.748 ( -7.417 -4.746 9.755) 13.141 10.071 ( 6.058 2.454 3.287) 7.316 10.119 ( 8.332 4.881 -2.557) 9.989 10.659 ( 14.956 5.638 -14.250) 21.413 10.915 ( 4.823 2.238 6.342) 8.276 10.977 ( 9.960 2.225 1.119) 10.266 11.244 ( -1.218 1.398 -0.667) 1.971 11.374 ( -0.699 -2.430 1.802) 3.105 11.383 ( -3.902 1.833 -3.029) 5.269 11.689 ( -6.542 -2.057 4.033) 7.955 12.152 ( -5.984 -6.041 4.075) 9.429 12.243 ( 3.216 2.742 1.126) 4.373 12.773 ( 2.041 2.353 1.817) 3.606 12.935 ( -5.632 -6.942 -4.444) 9.983 13.279 ( 5.210 2.577 -2.294) 6.248 13.406 ( 4.925 12.014 -2.613) 13.245 13.523 ( 1.238 0.389 -0.742) 1.496 13.590 ( -2.265 -1.901 1.181) 3.184 14.179 ( -7.559 -0.713 -3.735) 8.462 14.752 ( 7.327 2.298 1.414) 7.808 14.989 ( 17.853 7.092 0.312) 19.212 15.229 ( 11.708 -4.709 4.246) 13.315 15.403 ( 1.670 2.332 6.990) 7.555 15.780 ( -15.582 0.621 2.966) 15.874 16.459 ( -2.178 -4.463 0.724) 5.018 16.860 ( -10.895 3.046 -9.243) 14.609 17.187 ( 10.813 -13.517 -3.466) 17.653 17.384 ( -16.936 1.124 10.668) 20.048 17.924 ( -17.076 -4.972 -1.603) 17.857 18.217 ( -23.445 -17.194 -1.282) 29.102 19.033 ( -16.850 -5.642 -0.883) 17.791 19.853 ( 18.799 5.130 4.934) 20.101 20.613 ( 6.134 2.395 4.561) 8.010 20.705 ( 10.876 3.416 -2.262) 11.622 20.966 ( 2.526 6.773 -1.271) 7.340 21.305 ( -0.128 -1.112 1.234) 1.666 22.630 ( 13.547 7.848 -2.231) 15.814 ======================= Grid point 103 (46/125) ======================= q-point: ( 0.22 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.835 ( -16.600 10.409 28.050) 34.215 1.219 ( 7.997 28.305 28.498) 40.954 2.011 ( 2.527 35.593 55.205) 65.733 2.975 ( 4.655 2.140 -15.627) 16.446 3.043 ( -5.704 5.350 -13.215) 15.355 3.753 ( -1.567 -2.409 -1.650) 3.314 3.769 ( 5.575 -3.090 2.390) 6.808 3.984 ( -4.314 1.680 2.580) 5.300 4.010 ( -2.424 -2.209 2.766) 4.290 4.297 ( 4.124 -10.349 -0.150) 11.141 4.400 ( 0.034 1.084 0.752) 1.319 4.482 ( -2.040 -1.554 -8.846) 9.210 4.933 ( 4.602 6.166 0.421) 7.706 5.239 ( -2.018 -0.713 1.741) 2.758 5.369 ( -4.955 -0.040 -3.138) 5.865 5.462 ( 4.460 3.662 -16.052) 17.058 5.565 ( 0.935 -12.433 7.568) 14.585 5.799 ( -3.751 -0.324 5.103) 6.341 6.091 ( 3.261 4.932 -11.674) 13.086 6.121 ( -1.996 7.594 -10.240) 12.904 6.313 ( -0.719 5.197 -3.066) 6.077 6.443 ( -2.162 -3.349 -1.553) 4.278 6.535 ( 4.416 -0.968 4.478) 6.363 7.062 ( -1.428 1.711 11.079) 11.301 7.270 ( 0.668 -11.745 -4.143) 12.472 7.524 ( 3.181 3.745 -1.606) 5.170 7.839 ( -1.323 -3.658 11.649) 12.281 7.966 ( -1.480 -15.479 -2.585) 15.763 8.102 ( -2.262 -5.320 -4.643) 7.414 8.183 ( -9.772 -4.737 -7.322) 13.098 8.384 ( 14.075 -0.184 0.201) 14.077 8.446 ( 8.034 4.051 -5.241) 10.413 8.683 ( -9.104 4.278 -5.127) 11.290 8.874 ( 5.669 10.055 -2.084) 11.730 9.087 ( -2.627 -3.896 0.759) 4.760 9.191 ( 5.027 -7.346 4.067) 9.786 9.269 ( -0.303 4.787 10.172) 11.246 9.390 ( -1.224 3.932 4.058) 5.782 9.697 ( 0.319 11.639 5.683) 12.956 10.251 ( -0.782 -4.509 2.303) 5.123 10.267 ( 1.344 -5.997 4.327) 7.516 10.590 ( 0.659 -8.385 -17.356) 19.287 10.975 ( -2.894 -5.581 -12.397) 13.900 11.108 ( 0.386 1.748 -12.326) 12.456 11.153 ( -3.855 1.230 -4.381) 5.964 11.266 ( 0.089 8.900 -7.478) 11.625 11.458 ( -0.570 -4.557 9.049) 10.148 11.703 ( 0.967 0.097 6.391) 6.464 11.873 ( 3.313 13.264 4.206) 14.304 12.421 ( 1.157 1.370 5.777) 6.049 12.831 ( -2.841 -4.766 9.168) 10.716 12.909 ( -0.507 -2.717 1.307) 3.057 13.314 ( -0.478 1.804 1.911) 2.671 13.466 ( -0.112 -4.544 -2.718) 5.296 13.661 ( -1.645 -3.740 1.647) 4.405 13.671 ( 4.052 -9.102 2.184) 10.200 13.923 ( 3.728 10.631 -2.263) 11.491 14.782 ( -0.083 -1.948 -11.769) 11.929 15.071 ( 0.680 11.381 -1.153) 11.459 15.521 ( 0.331 -16.936 1.830) 17.038 15.649 ( -4.270 -22.555 2.680) 23.111 16.123 ( 9.585 -6.538 11.821) 16.564 16.403 ( -11.350 2.859 2.873) 12.052 16.681 ( -1.647 -6.165 2.200) 6.750 16.987 ( -5.801 5.457 2.037) 8.221 17.418 ( 9.833 1.058 0.297) 9.894 17.627 ( -0.648 23.885 -2.040) 23.980 17.634 ( 1.734 9.636 0.834) 9.826 18.481 ( 3.244 31.259 -8.508) 32.558 20.580 ( -4.966 -15.062 12.822) 20.394 20.744 ( 5.200 -2.069 4.071) 6.921 20.907 ( -11.317 -14.086 0.688) 18.083 21.013 ( -2.303 -5.028 -0.985) 5.618 21.425 ( 5.954 -7.431 7.099) 11.878 22.846 ( 0.162 -12.669 -1.353) 12.742 ======================= Grid point 104 (47/125) ======================= q-point: ( 0.33 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.974 ( 7.507 12.029 14.804) 20.499 1.775 ( 12.016 27.350 23.469) 37.990 2.798 ( 20.549 25.175 30.206) 44.367 2.906 ( -6.728 4.567 -15.518) 17.520 3.086 ( 10.112 7.334 -7.586) 14.615 3.693 ( -2.063 0.631 -4.276) 4.790 3.752 ( -8.245 -7.886 4.628) 12.312 3.922 ( 3.584 -0.146 6.392) 7.330 3.986 ( -2.828 5.598 3.766) 7.315 4.302 ( -4.752 0.484 1.951) 5.160 4.382 ( 10.826 -6.127 -0.362) 12.445 4.514 ( 2.278 1.790 -3.175) 4.298 4.999 ( -0.868 -2.862 -0.823) 3.102 5.214 ( 0.476 -2.486 -8.674) 9.036 5.274 ( -7.350 4.862 7.421) 11.521 5.395 ( -3.927 -11.724 -0.878) 12.395 5.592 ( 6.324 4.351 -10.805) 13.254 5.732 ( -2.647 1.268 4.760) 5.592 6.093 ( 3.017 4.729 -18.979) 19.790 6.183 ( -0.378 2.299 -3.098) 3.877 6.300 ( -4.570 -0.316 2.615) 5.274 6.407 ( 2.080 1.601 -1.282) 2.921 6.668 ( 5.685 6.194 0.004) 8.407 7.102 ( -0.201 0.348 7.775) 7.786 7.211 ( 4.783 -9.063 -5.272) 11.524 7.474 ( -5.513 -10.801 -5.357) 13.257 7.702 ( -4.428 -8.932 5.412) 11.344 7.784 ( -8.474 0.438 3.126) 9.043 7.853 ( -14.054 -3.725 1.715) 14.640 8.141 ( 4.366 2.737 -1.595) 5.394 8.499 ( -3.222 5.828 -5.589) 8.694 8.599 ( 10.009 -4.813 4.751) 12.080 8.679 ( 5.167 6.806 -17.839) 19.780 9.012 ( -1.794 -3.700 3.525) 5.416 9.075 ( 7.691 2.963 -3.739) 9.051 9.120 ( -4.684 -3.134 3.479) 6.623 9.411 ( 6.100 -3.117 9.603) 11.796 9.464 ( 0.605 3.741 -0.971) 3.912 9.835 ( 0.745 9.490 8.044) 12.463 10.108 ( -7.805 -7.802 3.279) 11.512 10.181 ( -5.969 -6.630 3.422) 9.555 10.424 ( -1.349 -10.301 -13.917) 17.367 10.825 ( 0.494 -8.033 -10.298) 13.070 11.057 ( -1.744 -0.240 -1.444) 2.277 11.165 ( 1.779 6.184 -10.966) 12.715 11.296 ( -0.309 2.806 -1.443) 3.170 11.456 ( 0.681 -0.931 4.999) 5.131 11.718 ( -2.275 1.464 5.023) 5.705 12.060 ( 3.142 6.606 0.352) 7.323 12.499 ( 1.006 1.405 7.839) 8.027 12.760 ( -3.277 0.332 4.100) 5.259 12.933 ( 4.824 -3.269 1.154) 5.941 13.293 ( -2.659 -5.208 3.685) 6.912 13.461 ( 3.105 -0.090 -2.534) 4.009 13.565 ( -4.298 -6.168 1.558) 7.677 13.605 ( -3.155 -2.976 0.021) 4.337 14.071 ( 3.405 7.778 -4.930) 9.818 14.695 ( -1.543 -3.199 -10.771) 11.342 15.208 ( 4.974 -9.670 0.670) 10.895 15.251 ( -12.508 -15.881 3.572) 20.529 15.409 ( -4.275 8.614 4.020) 10.423 16.009 ( -17.245 -9.902 15.701) 25.337 16.323 ( 7.283 3.634 -6.641) 10.505 16.800 ( 10.957 -1.452 2.277) 11.284 17.033 ( 0.674 8.330 0.063) 8.357 17.666 ( -2.809 20.570 -1.698) 20.830 17.702 ( 13.350 6.847 0.627) 15.016 18.059 ( 15.325 21.490 -1.096) 26.417 18.905 ( 11.567 23.262 -5.204) 26.495 20.300 ( -9.321 -26.834 25.904) 38.444 20.589 ( -8.610 -8.450 -3.560) 12.578 20.811 ( 2.508 -2.217 3.715) 5.000 20.871 ( -7.683 -6.220 -3.413) 10.458 21.415 ( -1.623 -2.348 2.348) 3.696 22.615 ( -8.271 -14.658 -5.554) 17.723 ======================= Grid point 105 (48/125) ======================= q-point: ( 0.44 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.369 ( 19.698 9.895 1.568) 22.100 2.325 ( 10.194 19.888 12.107) 25.417 2.759 ( -1.531 5.723 -10.531) 12.083 3.202 ( 14.653 0.426 -12.950) 19.560 3.465 ( -0.357 4.633 7.899) 9.164 3.621 ( 5.616 1.854 13.371) 14.621 3.729 ( -0.472 8.185 5.927) 10.117 3.920 ( -9.178 1.459 -3.566) 9.953 4.018 ( 2.488 3.753 2.677) 5.239 4.400 ( 4.206 4.351 12.762) 14.124 4.510 ( 2.012 4.321 -1.805) 5.096 4.591 ( 15.059 -0.678 3.779) 15.540 4.894 ( -5.874 -2.271 1.748) 6.535 5.021 ( -5.396 -14.528 0.766) 15.516 5.150 ( -9.170 -5.935 -5.351) 12.164 5.362 ( -0.266 9.664 -6.142) 11.454 5.607 ( -1.159 -0.325 2.768) 3.019 5.838 ( 7.456 2.615 -2.040) 8.161 6.081 ( -2.513 0.175 -0.340) 2.542 6.132 ( -0.966 -4.562 -1.713) 4.967 6.331 ( 2.246 4.469 -4.264) 6.573 6.441 ( 4.178 2.121 -7.743) 9.051 6.746 ( -3.478 2.027 -3.041) 5.045 7.043 ( -10.543 -7.727 -3.820) 13.618 7.171 ( 6.731 -0.495 2.601) 7.233 7.270 ( -6.854 -8.061 -5.652) 11.996 7.583 ( -2.616 -5.192 9.239) 10.916 7.643 ( 3.038 -1.309 1.185) 3.514 7.803 ( -4.911 8.612 -1.269) 9.994 8.231 ( 2.591 2.053 1.044) 3.467 8.481 ( -4.498 6.911 0.999) 8.306 8.706 ( 2.916 2.084 -6.596) 7.507 8.744 ( 5.486 -1.851 -7.066) 9.135 8.917 ( -5.889 -6.994 4.354) 10.127 8.935 ( -2.327 -7.197 -4.252) 8.677 9.291 ( 8.390 4.176 -4.538) 10.413 9.417 ( -0.494 -3.637 -5.062) 6.252 9.490 ( -1.964 -1.216 5.906) 6.341 9.872 ( -8.491 -2.621 8.099) 12.023 9.948 ( -2.298 -1.953 2.257) 3.767 10.035 ( -3.208 -4.175 2.298) 5.744 10.266 ( -3.210 -2.259 -6.205) 7.342 10.766 ( 5.469 -7.403 -6.557) 11.301 11.004 ( -4.877 1.302 0.365) 5.061 11.255 ( 5.841 7.950 -9.809) 13.912 11.326 ( 1.333 0.081 5.093) 5.265 11.504 ( 1.799 2.221 2.946) 4.105 11.722 ( -0.084 0.117 4.838) 4.840 12.097 ( -2.120 -0.497 -0.650) 2.273 12.507 ( -2.390 -1.515 6.458) 7.051 12.661 ( -9.387 -3.266 -2.194) 10.179 13.051 ( 5.487 4.943 1.343) 7.506 13.134 ( -5.677 -12.507 1.301) 13.797 13.428 ( -2.568 -8.811 1.154) 9.250 13.493 ( 3.016 1.526 -0.672) 3.446 13.640 ( 3.891 6.346 -0.482) 7.459 14.147 ( 1.977 3.101 -7.239) 8.119 14.585 ( -2.523 -3.017 -8.203) 9.097 14.869 ( -8.911 -16.619 6.190) 19.847 15.168 ( -1.980 -6.494 3.995) 7.877 15.418 ( -14.580 9.174 4.052) 17.697 15.920 ( 6.796 5.132 5.886) 10.352 16.464 ( 8.391 1.190 -6.348) 10.589 16.859 ( -3.042 2.242 -0.789) 3.860 17.248 ( 11.970 5.189 8.388) 15.510 17.851 ( -0.841 21.913 -2.929) 22.124 18.034 ( 15.961 7.411 -0.586) 17.607 18.546 ( 16.035 18.960 -2.846) 24.994 19.195 ( 5.326 6.520 -6.029) 10.355 20.064 ( -2.861 -18.039 28.553) 33.895 20.356 ( -7.913 -6.862 -2.528) 10.774 20.599 ( -12.388 -8.719 -3.007) 15.444 20.835 ( -0.786 0.275 4.350) 4.429 21.377 ( 0.750 -2.560 -1.321) 2.976 22.250 ( -12.309 -14.435 -9.266) 21.112 ======================= Grid point 106 (49/125) ======================= q-point: ( 0.56 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.844 ( 23.838 9.441 -2.571) 25.768 2.436 ( -4.774 3.378 -2.281) 6.277 3.049 ( 14.247 14.561 5.503) 21.102 3.276 ( -6.651 -5.104 2.546) 8.762 3.477 ( 5.693 5.009 -9.234) 11.949 3.663 ( -3.011 -3.212 -3.117) 5.395 3.790 ( 2.640 6.172 0.498) 6.731 3.927 ( 0.602 1.263 10.760) 10.851 4.119 ( 1.269 5.187 4.694) 7.110 4.444 ( -1.775 -2.921 2.073) 3.997 4.524 ( -1.599 4.668 -5.910) 7.699 4.668 ( -10.721 -8.961 -3.399) 14.380 4.756 ( 3.439 -17.724 10.661) 20.967 4.972 ( -6.967 7.148 -2.891) 10.392 5.189 ( 13.223 10.648 11.282) 20.384 5.353 ( 0.591 5.155 -3.718) 6.383 5.678 ( 6.944 0.255 5.778) 9.038 5.914 ( 2.505 -7.233 0.725) 7.689 6.002 ( -7.899 1.205 -5.231) 9.550 6.086 ( 1.924 -2.694 3.878) 5.099 6.303 ( -4.172 -5.428 -4.295) 8.082 6.562 ( 5.148 5.489 -16.772) 18.382 6.642 ( -3.231 0.713 3.300) 4.673 6.839 ( -5.301 1.556 3.685) 6.641 7.055 ( -7.780 0.315 -3.301) 8.457 7.231 ( -1.152 -0.590 -2.247) 2.593 7.634 ( 1.739 1.767 2.614) 3.603 7.767 ( 9.223 -0.066 -4.922) 10.455 7.799 ( 1.116 1.981 4.878) 5.382 8.248 ( -2.548 -1.412 2.126) 3.607 8.480 ( -3.449 2.852 2.652) 5.202 8.633 ( -7.314 2.710 -0.872) 7.848 8.806 ( 6.909 -5.238 -7.934) 11.753 8.829 ( 0.887 -4.488 4.387) 6.339 8.841 ( 0.504 -4.561 -1.509) 4.831 9.291 ( -1.659 -9.215 -5.753) 10.989 9.386 ( 1.197 -2.081 -8.592) 8.921 9.444 ( -3.098 7.368 -2.066) 8.256 9.796 ( 0.346 -9.646 6.109) 11.423 9.845 ( -3.612 1.834 4.374) 5.961 10.034 ( 1.659 0.255 -1.794) 2.457 10.206 ( -5.176 5.241 -0.246) 7.370 10.788 ( 4.478 -3.215 -3.253) 6.401 10.928 ( -4.264 0.421 -1.404) 4.509 11.370 ( 0.860 1.137 5.082) 5.278 11.448 ( 7.742 6.645 0.275) 10.207 11.564 ( 1.095 4.052 -0.766) 4.267 11.779 ( 5.439 -1.129 5.664) 7.933 11.995 ( -4.732 -4.658 -2.698) 7.167 12.391 ( -11.593 -5.841 -4.391) 13.704 12.470 ( -4.793 0.293 5.526) 7.321 12.880 ( -6.061 -9.989 0.974) 11.724 13.196 ( 1.272 3.466 -2.534) 4.478 13.340 ( 5.226 -10.900 1.076) 12.136 13.603 ( 4.083 5.295 0.693) 6.722 13.771 ( 3.338 5.510 -1.962) 6.734 14.152 ( 1.414 -0.199 -10.119) 10.219 14.498 ( -0.969 -1.206 -5.232) 5.456 14.654 ( -3.440 -11.796 7.986) 14.655 15.088 ( -5.193 -1.019 3.772) 6.499 15.260 ( -9.498 2.753 7.866) 12.636 16.177 ( 7.603 10.869 1.473) 13.345 16.559 ( 7.098 -4.659 -8.203) 11.805 16.839 ( -8.346 15.248 4.126) 17.865 17.488 ( 5.096 0.455 9.792) 11.048 18.040 ( 6.844 10.136 -9.457) 15.460 18.367 ( 11.070 9.122 2.169) 14.507 18.870 ( 5.359 6.338 -5.470) 9.941 19.229 ( 5.209 -7.524 -0.022) 9.151 20.000 ( -5.063 -2.260 4.901) 7.400 20.188 ( -9.362 -2.840 8.102) 12.702 20.320 ( -4.193 -7.326 3.736) 9.231 20.819 ( -5.282 2.594 7.026) 9.165 21.416 ( 8.744 -2.566 -6.112) 10.973 21.864 ( -10.934 -11.673 -8.849) 18.279 ======================= Grid point 107 (50/125) ======================= q-point: (-0.33 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.359 ( 24.567 8.657 -3.281) 26.254 2.371 ( -6.297 2.872 2.207) 7.264 2.962 ( -17.774 -6.840 0.376) 19.048 3.333 ( 2.350 1.463 2.123) 3.489 3.560 ( -2.504 6.127 -0.285) 6.625 3.659 ( 6.634 -0.579 -8.470) 10.774 3.844 ( -8.638 -4.425 4.708) 10.787 3.966 ( 5.150 6.869 0.993) 8.642 4.176 ( -4.030 3.310 2.350) 5.720 4.265 ( -6.563 -7.424 3.526) 10.518 4.461 ( -0.233 -3.822 -5.024) 6.317 4.560 ( -3.253 2.173 2.333) 4.554 4.715 ( 6.641 -13.168 12.083) 19.065 5.011 ( -3.685 13.008 4.165) 14.147 5.170 ( 1.305 -5.970 -10.480) 12.131 5.634 ( -12.779 -2.622 -0.688) 13.063 5.695 ( 3.179 0.301 5.785) 6.608 5.847 ( 5.846 -2.225 -2.036) 6.578 5.986 ( 11.035 -1.167 7.004) 13.122 6.107 ( -5.094 3.439 -7.979) 10.071 6.164 ( 2.931 0.390 -2.758) 4.043 6.505 ( -3.666 -0.971 -2.971) 4.817 6.762 ( 1.293 8.286 2.880) 8.867 6.908 ( 4.744 8.641 -3.687) 10.525 7.007 ( -1.337 3.221 4.055) 5.349 7.165 ( -2.189 -1.539 2.544) 3.692 7.593 ( -4.571 3.503 -9.550) 11.152 7.819 ( 2.025 -9.936 -9.572) 13.944 7.909 ( 4.563 -1.865 12.210) 13.168 8.224 ( 0.127 0.391 6.343) 6.356 8.363 ( -8.260 -3.025 0.518) 8.812 8.601 ( -1.332 4.109 0.117) 4.321 8.821 ( 5.059 -4.650 4.787) 8.375 8.859 ( 2.329 0.658 5.047) 5.597 8.880 ( 5.890 -1.972 -4.039) 7.409 9.185 ( 0.437 -0.110 -11.211) 11.220 9.311 ( -1.696 -8.943 -10.654) 14.013 9.470 ( 2.630 5.004 2.524) 6.191 9.785 ( 4.633 -3.789 -0.055) 5.985 9.896 ( 2.665 2.199 5.255) 6.289 10.024 ( -1.328 -0.664 -4.282) 4.532 10.175 ( -6.434 8.871 1.357) 11.042 10.777 ( -2.535 -0.900 -3.654) 4.537 10.880 ( 0.965 -1.245 -2.710) 3.135 11.398 ( -2.132 2.237 3.956) 5.020 11.481 ( -3.398 -4.487 6.213) 8.384 11.703 ( -1.789 5.599 -0.629) 5.911 11.855 ( 4.433 -1.921 -1.686) 5.117 11.954 ( 7.406 0.033 3.002) 7.992 12.189 ( -3.804 -3.284 -1.925) 5.382 12.386 ( -3.843 0.289 2.276) 4.476 12.816 ( 4.856 -1.104 0.755) 5.037 13.155 ( 0.802 -7.076 -2.379) 7.508 13.369 ( 2.803 -3.294 -1.910) 4.728 13.697 ( -1.141 4.687 1.137) 4.956 13.820 ( -1.182 2.982 -2.980) 4.378 14.123 ( 2.359 -0.126 -12.438) 12.660 14.508 ( 3.210 1.563 -1.349) 3.817 14.543 ( -0.901 -9.657 5.695) 11.247 15.006 ( -3.563 -1.378 4.131) 5.627 15.241 ( -2.557 3.898 13.186) 13.986 16.343 ( 0.511 8.243 -9.656) 12.706 16.556 ( 3.456 -7.536 -0.043) 8.291 16.923 ( -7.733 21.701 10.559) 25.342 17.500 ( -4.105 -1.554 -0.158) 4.392 18.096 ( -2.221 -6.556 -6.913) 9.783 18.580 ( 1.284 6.024 2.638) 6.701 18.908 ( 6.672 -4.460 -2.251) 8.335 19.200 ( -3.002 -6.324 -1.637) 7.190 19.933 ( -7.770 -1.974 -2.044) 8.274 19.989 ( -1.226 0.971 0.098) 1.567 20.377 ( 2.826 3.150 14.190) 14.808 20.798 ( -3.124 4.693 5.398) 7.805 21.424 ( -1.197 -9.892 -13.294) 16.614 21.746 ( 10.757 1.176 -0.367) 10.828 ======================= Grid point 108 (51/125) ======================= q-point: (-0.22 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.131 ( -21.541 -2.794 -8.809) 23.440 2.593 ( -11.820 -6.154 2.154) 13.499 2.896 ( 16.647 7.785 5.375) 19.147 3.168 ( -7.334 -9.526 -2.157) 12.214 3.462 ( -12.979 -1.123 2.623) 13.289 3.690 ( -5.143 0.542 -2.549) 5.766 3.784 ( 4.379 3.881 -2.439) 6.340 3.944 ( -12.531 -3.967 0.545) 13.156 4.024 ( -7.460 6.639 8.286) 12.976 4.372 ( 5.355 -1.529 1.778) 5.846 4.428 ( 0.467 -2.866 0.295) 2.919 4.478 ( 0.643 -3.238 -0.865) 3.412 4.754 ( 0.447 -9.955 10.900) 14.768 5.045 ( 1.362 2.962 -3.559) 4.826 5.191 ( 4.687 3.860 -7.192) 9.412 5.296 ( -9.174 -1.841 2.880) 9.790 5.765 ( -4.285 1.266 -0.518) 4.498 5.945 ( 10.203 -6.268 12.836) 17.555 6.092 ( 2.948 2.764 -4.655) 6.164 6.181 ( -2.135 3.710 -9.114) 10.069 6.286 ( 14.439 3.700 -8.955) 17.389 6.414 ( -2.859 0.314 2.081) 3.550 6.844 ( -4.384 10.923 5.064) 12.813 7.014 ( 5.927 -1.966 -4.421) 7.651 7.046 ( -1.688 4.791 -1.771) 5.379 7.205 ( 1.558 1.651 7.093) 7.448 7.551 ( 5.760 -3.286 -8.026) 10.411 7.632 ( -7.033 -7.025 -3.011) 10.386 8.009 ( 2.102 2.130 12.122) 12.486 8.083 ( -8.730 -6.681 2.888) 11.366 8.368 ( -1.407 6.107 4.185) 7.536 8.645 ( 3.753 1.319 -3.123) 5.058 8.867 ( 0.248 -0.178 3.356) 3.369 8.947 ( 4.316 0.850 -1.193) 4.558 8.987 ( 7.148 -1.660 0.188) 7.341 9.099 ( 0.631 -6.604 -7.257) 9.833 9.274 ( 6.540 0.649 -3.422) 7.410 9.586 ( 1.335 4.957 0.811) 5.197 9.805 ( 0.591 -1.834 2.515) 3.168 9.912 ( -0.374 -7.208 -2.511) 7.641 10.067 ( 8.127 2.998 -5.011) 10.007 10.190 ( -4.114 13.256 0.944) 13.911 10.715 ( 1.651 -1.983 -5.727) 6.281 10.887 ( 0.508 0.432 1.041) 1.236 11.360 ( -4.528 -0.803 0.720) 4.655 11.397 ( -2.474 -5.025 8.017) 9.780 11.598 ( -7.801 4.014 -4.879) 10.039 11.862 ( -2.225 -7.337 0.990) 7.731 12.117 ( 7.379 0.293 4.120) 8.456 12.155 ( 0.737 0.136 3.629) 3.705 12.507 ( 9.796 8.444 0.902) 12.965 12.957 ( 7.776 1.106 -1.306) 7.962 13.138 ( 7.459 -4.169 -1.465) 8.670 13.307 ( -4.529 -3.155 -4.800) 7.315 13.642 ( -7.053 0.950 -0.841) 7.166 13.771 ( -5.283 0.159 -0.989) 5.378 14.198 ( 8.223 5.359 -10.803) 14.596 14.474 ( 1.482 -7.796 6.045) 9.976 14.605 ( 5.599 1.858 -0.436) 5.915 14.991 ( 1.876 -1.544 3.052) 3.901 15.327 ( -0.836 5.619 16.878) 17.808 16.245 ( -5.604 -5.802 -17.080) 18.890 16.571 ( -1.424 2.953 6.085) 6.912 17.043 ( -6.041 13.630 11.919) 19.088 17.313 ( -10.515 -6.692 -12.297) 17.509 17.872 ( -11.104 -3.230 3.735) 12.152 18.482 ( -13.734 -2.904 1.881) 14.163 18.931 ( -11.830 -6.056 -0.059) 13.290 19.134 ( 16.050 -4.739 -3.553) 17.108 19.677 ( -15.399 -1.518 -0.625) 15.487 20.164 ( 11.840 5.865 0.903) 13.244 20.529 ( 3.935 4.093 9.606) 11.159 20.848 ( 2.524 2.909 -2.550) 4.619 21.269 ( 0.308 -6.268 -4.545) 7.748 22.049 ( 18.138 4.412 -2.355) 18.814 ======================= Grid point 109 (52/125) ======================= q-point: (-0.11 0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.575 ( -30.138 -3.420 -15.895) 34.244 2.131 ( -30.202 -13.063 9.117) 34.145 2.963 ( -19.625 -0.124 8.514) 21.393 3.108 ( -10.264 -5.137 3.299) 11.943 3.317 ( 8.941 0.418 -0.900) 8.996 3.553 ( -2.484 -1.714 -2.871) 4.165 3.763 ( -6.323 2.818 3.545) 7.778 3.855 ( -2.490 5.345 -6.741) 8.956 4.006 ( -4.836 3.071 9.884) 11.424 4.251 ( -2.743 -0.993 3.596) 4.630 4.416 ( -0.194 -11.550 -2.768) 11.879 4.542 ( 3.219 3.954 -3.106) 5.970 4.802 ( 11.476 -1.294 3.817) 12.163 5.154 ( 7.615 1.252 -1.885) 7.944 5.232 ( -5.250 0.409 10.867) 12.076 5.287 ( 5.098 3.774 -7.639) 9.929 5.699 ( -3.218 -0.165 1.658) 3.624 6.029 ( -2.017 -7.432 -14.080) 16.048 6.101 ( 1.091 1.675 12.636) 12.793 6.209 ( 2.955 4.040 -4.533) 6.753 6.239 ( 0.641 -5.845 -4.278) 7.271 6.614 ( 6.288 2.328 -3.088) 7.382 6.822 ( -12.962 10.245 -2.009) 16.644 6.984 ( -1.056 -0.062 -4.457) 4.581 7.178 ( 14.783 1.717 -0.059) 14.882 7.239 ( 0.744 0.312 -0.706) 1.072 7.492 ( -2.942 -0.860 8.189) 8.743 7.663 ( 12.284 -7.000 -1.743) 14.246 7.917 ( -4.584 -5.235 2.408) 7.363 8.149 ( 2.613 5.621 7.457) 9.697 8.392 ( -5.260 10.467 4.624) 12.594 8.667 ( 1.780 -5.753 -4.464) 7.496 8.882 ( -2.990 2.927 -1.323) 4.388 8.930 ( 4.047 -1.237 -1.446) 4.472 9.093 ( 4.686 0.435 -6.026) 7.646 9.110 ( 2.742 -4.702 2.030) 5.809 9.394 ( 3.531 1.892 1.828) 4.404 9.557 ( -8.685 6.123 -6.863) 12.650 9.806 ( -1.323 -7.301 11.833) 13.967 9.916 ( 9.080 1.091 0.098) 9.146 10.094 ( -0.530 0.891 -7.406) 7.478 10.391 ( 13.153 6.993 -9.020) 17.414 10.778 ( 7.799 0.827 -5.412) 9.528 10.940 ( 2.755 2.223 7.353) 8.161 11.271 ( -2.589 -2.555 -0.520) 3.674 11.367 ( -0.847 -1.798 6.094) 6.410 11.492 ( -6.580 3.032 -5.722) 9.232 11.733 ( -3.277 -7.342 2.538) 8.431 12.160 ( 1.245 -2.019 -3.358) 4.111 12.269 ( 2.067 3.654 12.529) 13.213 12.732 ( 6.197 2.704 1.538) 6.934 13.002 ( -4.676 1.863 -6.361) 8.111 13.185 ( 3.253 -4.226 -2.184) 5.763 13.341 ( 11.713 3.328 1.162) 12.232 13.528 ( -3.992 -0.451 -1.395) 4.252 13.658 ( -6.125 -0.901 -0.226) 6.195 14.260 ( -3.091 0.138 -4.476) 5.442 14.594 ( 12.788 0.382 4.840) 13.678 14.769 ( 13.226 4.099 -1.744) 13.957 15.062 ( 5.820 0.256 0.828) 5.884 15.459 ( 0.004 7.408 17.961) 19.428 15.928 ( -10.632 -15.444 -11.247) 21.865 16.588 ( -6.856 10.004 -0.283) 12.131 16.895 ( -7.553 -17.141 -6.780) 19.921 17.124 ( -5.920 6.458 0.931) 8.810 17.740 ( -12.316 9.916 7.772) 17.619 18.129 ( -17.882 -11.677 1.215) 21.392 18.541 ( -24.250 -2.762 -2.492) 24.533 19.331 ( -15.813 -3.109 15.932) 22.662 19.504 ( 20.296 1.498 -10.531) 22.914 20.446 ( 12.980 3.540 0.010) 13.455 20.659 ( 3.503 3.167 4.343) 6.416 20.888 ( 5.534 -4.087 -7.534) 10.203 21.286 ( 3.020 1.288 3.837) 5.050 22.397 ( 17.887 3.532 -4.104) 18.689 ======================= Grid point 112 (53/125) ======================= q-point: ( 0.22 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.462 ( -19.648 17.290 16.826) 31.114 1.505 ( -2.999 28.052 16.102) 32.484 2.664 ( -12.554 14.585 14.364) 24.014 2.925 ( -4.288 14.359 9.743) 17.874 3.195 ( -8.734 9.424 -12.905) 18.211 3.609 ( 5.432 -6.128 3.191) 8.789 3.792 ( -2.117 -0.524 1.813) 2.836 3.900 ( 11.553 0.460 1.291) 11.634 4.078 ( 0.117 3.650 2.652) 4.513 4.242 ( -8.534 -9.418 1.082) 12.755 4.370 ( 4.980 3.320 2.991) 6.691 4.557 ( -8.975 2.260 -7.890) 12.162 4.813 ( 5.412 -6.755 0.420) 8.666 5.196 ( 7.446 -8.942 3.719) 12.216 5.315 ( 4.595 -1.556 -14.642) 15.425 5.495 ( -8.324 -0.115 -2.994) 8.847 5.572 ( -3.404 4.534 10.199) 11.669 5.785 ( 5.885 1.935 4.627) 7.732 6.103 ( -5.802 5.634 -19.372) 20.992 6.234 ( -2.201 7.248 -10.703) 13.112 6.326 ( 2.650 0.307 -0.826) 2.793 6.439 ( -0.373 5.919 0.169) 5.933 6.529 ( -3.617 -0.882 1.961) 4.208 7.080 ( 0.478 -6.912 -3.416) 7.725 7.230 ( -3.520 -5.111 10.509) 12.205 7.499 ( -1.459 0.382 -4.535) 4.779 7.654 ( 16.736 -13.214 -0.554) 21.331 7.799 ( 5.493 -7.320 12.742) 15.688 7.939 ( 11.289 4.870 -11.612) 16.912 8.176 ( 2.565 -9.386 6.365) 11.627 8.246 ( -1.235 3.784 -4.399) 5.932 8.490 ( -9.158 0.290 -9.178) 12.969 8.796 ( -2.175 -0.260 -3.387) 4.033 8.967 ( -4.972 7.014 2.278) 8.895 9.037 ( 1.896 -7.171 -0.265) 7.423 9.134 ( -4.012 -5.126 -2.256) 6.889 9.353 ( 2.852 4.974 3.181) 6.557 9.493 ( -6.542 -2.135 7.187) 9.950 9.754 ( 2.946 4.561 4.884) 7.303 10.097 ( 8.825 -7.325 4.132) 12.190 10.238 ( 0.233 -0.997 -1.661) 1.951 10.449 ( 2.534 -6.454 -8.134) 10.688 10.910 ( -2.683 -6.089 -10.165) 12.150 11.044 ( 3.995 2.569 -8.203) 9.479 11.227 ( -6.440 0.147 -6.392) 9.075 11.300 ( 2.830 6.161 -3.667) 7.708 11.470 ( -0.157 -3.838 11.329) 11.962 11.724 ( -0.583 3.073 4.014) 5.089 11.965 ( 1.060 6.757 1.933) 7.107 12.421 ( 1.508 -2.911 7.661) 8.333 12.761 ( 4.127 -2.995 0.374) 5.113 13.064 ( -7.684 6.405 2.701) 10.362 13.328 ( -1.473 -6.716 1.693) 7.081 13.385 ( 0.409 -10.226 0.752) 10.261 13.526 ( 1.598 -1.614 0.189) 2.279 13.619 ( 4.003 -3.405 2.092) 5.657 13.966 ( -0.983 6.631 -3.084) 7.379 14.691 ( 2.040 -3.733 -10.455) 11.288 15.120 ( 5.921 -6.429 -1.463) 8.862 15.320 ( 6.118 0.144 3.045) 6.835 15.371 ( 6.407 -14.904 1.805) 16.323 16.144 ( -1.172 4.442 18.732) 19.287 16.404 ( 7.020 -0.366 -9.584) 11.886 16.850 ( -18.518 -1.705 6.496) 19.699 17.193 ( -1.982 15.095 -6.422) 16.524 17.353 ( 1.847 6.465 2.463) 7.161 17.703 ( -8.558 9.802 -0.147) 13.014 18.077 ( -13.780 24.416 -0.806) 28.048 18.732 ( -6.391 13.502 -2.131) 15.089 20.541 ( 0.576 -9.798 4.128) 10.647 20.605 ( 8.541 -7.584 18.685) 21.899 20.862 ( 5.784 -5.812 -5.578) 9.917 21.046 ( -7.375 -8.041 1.768) 11.053 21.209 ( 10.648 -2.495 2.265) 11.168 22.605 ( 8.570 -15.161 -5.968) 18.409 ======================= Grid point 113 (54/125) ======================= q-point: ( 0.33 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.307 ( -16.961 17.812 13.260) 27.942 2.003 ( 8.363 28.499 18.643) 35.067 2.725 ( 6.516 3.564 -13.013) 14.983 3.058 ( -8.835 10.144 -12.225) 18.177 3.197 ( 1.704 23.772 23.942) 33.782 3.652 ( 1.967 -3.474 -3.714) 5.453 3.790 ( 3.849 -1.211 6.176) 7.377 3.966 ( -10.245 -5.060 12.715) 17.095 4.120 ( 11.765 -1.351 2.128) 12.032 4.172 ( -3.176 11.118 7.468) 13.764 4.388 ( -5.304 0.476 -8.404) 9.949 4.507 ( 0.966 4.004 3.159) 5.190 4.851 ( 7.184 -7.568 -2.246) 10.673 5.197 ( 1.680 -9.691 -3.781) 10.537 5.300 ( -3.205 -3.218 -11.425) 12.295 5.396 ( 6.074 -5.855 0.947) 8.489 5.563 ( -8.270 12.459 4.578) 15.639 5.823 ( -3.435 -0.548 3.879) 5.210 6.027 ( 1.012 7.857 -23.222) 24.536 6.240 ( -1.039 3.438 -0.111) 3.593 6.337 ( 0.156 -1.829 -8.176) 8.379 6.473 ( -5.330 4.560 6.201) 9.362 6.582 ( 7.682 4.590 -0.160) 8.950 6.982 ( 4.095 -12.898 -1.788) 13.650 7.205 ( -4.306 3.132 4.768) 7.147 7.414 ( -2.018 -10.773 -1.244) 11.031 7.669 ( -3.950 -15.347 0.456) 15.854 7.801 ( 7.123 -1.229 -0.469) 7.244 8.044 ( -7.493 -0.847 -3.279) 8.223 8.130 ( -0.611 5.023 -0.440) 5.079 8.327 ( 12.907 -5.544 7.811) 16.073 8.477 ( 4.552 4.717 -13.273) 14.803 8.699 ( -3.269 3.861 -4.702) 6.907 8.986 ( -0.272 -6.823 2.241) 7.187 9.058 ( 0.188 -6.184 0.684) 6.225 9.074 ( 4.132 7.517 -0.336) 8.584 9.418 ( -1.329 -2.259 0.757) 2.728 9.456 ( 1.220 0.959 10.407) 10.522 9.870 ( 4.273 3.031 3.861) 6.508 10.118 ( -0.116 -8.532 -3.027) 9.054 10.168 ( -1.312 -6.422 2.183) 6.909 10.360 ( -4.563 -3.227 -1.297) 5.737 10.746 ( -3.295 -6.487 -10.610) 12.865 11.076 ( -2.866 0.742 -4.254) 5.183 11.122 ( 3.128 2.177 -6.487) 7.524 11.360 ( -1.499 3.567 -1.149) 4.036 11.470 ( -0.363 0.119 5.009) 5.024 11.771 ( 0.174 3.608 2.211) 4.235 12.089 ( 1.686 5.575 -0.087) 5.825 12.490 ( 3.823 -1.680 8.709) 9.659 12.781 ( 2.951 -5.968 -0.393) 6.669 12.921 ( -8.380 2.696 3.434) 9.449 13.295 ( 0.319 -5.195 3.617) 6.338 13.354 ( 5.282 -7.468 -0.310) 9.152 13.529 ( -0.086 -4.954 0.695) 5.003 13.624 ( -0.509 0.927 1.559) 1.884 14.040 ( 3.466 3.648 -4.885) 7.013 14.626 ( 0.071 -3.691 -10.821) 11.433 15.082 ( -0.758 -13.534 3.874) 14.098 15.223 ( -0.797 -14.997 -0.458) 15.025 15.501 ( 3.276 12.896 1.680) 13.411 16.130 ( -0.832 -6.098 10.795) 12.427 16.461 ( -16.895 2.588 -0.245) 17.094 16.665 ( 7.498 4.219 -3.907) 9.449 17.139 ( -5.094 7.423 1.140) 9.075 17.594 ( 8.962 14.009 4.459) 17.218 17.870 ( 5.137 14.198 -2.308) 15.274 18.136 ( -4.031 26.588 -3.812) 27.161 18.956 ( 8.183 20.178 -1.281) 21.811 20.332 ( -10.147 -22.061 18.703) 30.651 20.668 ( -11.225 -8.556 -0.848) 14.139 20.733 ( 4.534 -3.284 4.704) 7.312 20.871 ( -0.688 -7.422 -1.558) 7.615 21.356 ( 4.869 -4.173 0.374) 6.424 22.484 ( 0.566 -19.183 -6.891) 20.391 ======================= Grid point 114 (55/125) ======================= q-point: ( 0.44 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.356 ( -1.490 16.453 5.093) 17.287 2.471 ( 6.170 23.030 13.473) 27.385 2.802 ( 4.254 3.030 -13.043) 14.050 2.994 ( -0.031 10.911 -14.959) 18.516 3.537 ( 2.226 6.276 10.746) 12.642 3.596 ( 0.547 -2.414 2.435) 3.472 3.866 ( -0.031 4.421 8.661) 9.724 3.967 ( 4.393 0.347 10.713) 11.584 4.163 ( -10.995 6.059 -2.455) 12.792 4.331 ( 7.288 2.262 2.116) 7.919 4.433 ( 8.668 10.336 10.070) 16.833 4.536 ( -0.141 -0.531 3.803) 3.843 4.858 ( 3.389 -8.430 2.319) 9.377 5.016 ( -6.719 -10.400 -6.849) 14.150 5.140 ( -4.359 -4.771 -8.540) 10.709 5.469 ( 4.127 2.562 3.142) 5.785 5.624 ( -1.361 10.348 -8.839) 13.677 5.791 ( -0.409 0.845 5.664) 5.741 6.044 ( 1.049 0.407 -8.787) 8.858 6.206 ( -4.450 -1.735 -0.712) 4.829 6.326 ( 3.441 7.570 -8.372) 11.800 6.427 ( -4.884 -0.839 4.136) 6.455 6.746 ( 4.990 -1.171 -0.115) 5.127 6.936 ( 4.814 -10.764 -3.315) 12.249 7.144 ( -3.634 -3.847 -0.343) 5.303 7.251 ( -3.219 -2.527 -2.257) 4.674 7.546 ( 2.681 -5.939 -3.182) 7.252 7.709 ( -10.967 -6.080 7.488) 14.605 7.970 ( -2.284 8.063 -0.071) 8.381 8.222 ( 2.422 4.277 -0.876) 4.993 8.478 ( 7.293 -1.120 -6.451) 9.801 8.552 ( 6.484 -0.833 -4.276) 7.812 8.744 ( 0.362 9.198 -3.957) 10.020 8.890 ( -2.905 -7.403 0.327) 7.959 8.977 ( -3.730 -6.704 2.920) 8.208 9.190 ( 4.675 0.793 -2.584) 5.400 9.349 ( -2.847 -5.468 -2.674) 6.720 9.503 ( 2.260 -2.496 6.832) 7.617 9.931 ( -2.633 -8.808 2.860) 9.628 9.965 ( -2.445 -2.979 -3.300) 5.074 10.100 ( -3.640 -3.760 3.380) 6.231 10.265 ( -1.837 1.816 3.607) 4.436 10.625 ( 0.823 -4.430 -5.381) 7.018 11.060 ( 0.726 -1.346 1.367) 2.051 11.213 ( 4.205 8.725 -8.105) 12.629 11.332 ( -1.753 1.486 -0.585) 2.371 11.516 ( 1.030 2.593 3.847) 4.752 11.796 ( -2.647 3.665 2.206) 5.030 12.106 ( -1.928 -0.961 -1.792) 2.803 12.518 ( 0.120 -4.492 5.596) 7.176 12.719 ( -2.069 -7.688 -2.575) 8.368 12.940 ( 3.258 0.334 2.374) 4.045 13.219 ( -4.652 -3.072 3.794) 6.744 13.339 ( 0.688 -12.128 -0.695) 12.168 13.467 ( 0.164 1.364 -0.357) 1.420 13.666 ( 0.915 5.614 0.298) 5.696 14.092 ( 2.946 -0.495 -5.979) 6.684 14.541 ( -0.686 -3.491 -8.988) 9.666 14.856 ( -7.471 -15.432 7.227) 18.606 15.132 ( 0.554 -4.970 1.582) 5.245 15.711 ( 0.837 13.245 0.371) 13.277 15.984 ( -10.527 -6.471 14.910) 19.365 16.326 ( 3.246 6.515 -15.656) 17.265 16.859 ( 7.648 4.773 2.796) 9.439 17.256 ( 3.538 11.056 6.191) 13.156 17.857 ( 6.004 8.785 0.878) 10.677 18.093 ( 3.308 21.052 -3.368) 21.575 18.467 ( 13.324 19.937 -2.383) 24.098 19.176 ( -1.818 5.050 -6.862) 8.712 20.077 ( -2.849 -13.538 27.231) 30.544 20.423 ( -7.702 -6.658 0.487) 10.192 20.676 ( -6.694 -8.180 -7.969) 13.237 20.829 ( 1.767 -1.422 8.348) 8.650 21.331 ( -0.609 -5.554 -1.672) 5.832 22.204 ( -5.967 -18.956 -9.039) 21.832 ======================= Grid point 115 (56/125) ======================= q-point: ( 0.56 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.622 ( 12.688 13.557 1.130) 18.602 2.605 ( -6.939 8.371 -4.796) 11.884 3.025 ( 8.663 17.908 4.453) 20.386 3.129 ( 9.968 1.286 -5.322) 11.373 3.521 ( -3.173 1.215 2.164) 4.028 3.685 ( 1.344 3.813 0.517) 4.076 3.884 ( -3.154 -2.653 -2.380) 4.759 4.023 ( -4.474 7.985 8.116) 12.233 4.126 ( 3.130 0.342 7.615) 8.241 4.410 ( 1.180 -5.337 1.751) 5.739 4.545 ( 0.882 1.880 -3.589) 4.147 4.602 ( 2.443 -5.211 4.554) 7.339 4.705 ( -8.016 -13.017 -4.365) 15.899 4.931 ( 0.115 -3.101 -10.112) 10.577 5.202 ( 13.977 14.088 15.571) 25.225 5.550 ( -11.822 11.285 -2.325) 16.508 5.603 ( 4.097 -0.533 0.631) 4.180 5.842 ( -0.289 -2.532 3.902) 4.661 5.955 ( 0.144 -9.442 -2.330) 9.726 6.160 ( -1.803 3.310 1.866) 4.206 6.322 ( -4.903 -3.927 1.476) 6.453 6.480 ( 5.835 7.595 -13.419) 16.486 6.714 ( -1.866 -0.865 4.705) 5.135 6.869 ( -0.389 -4.626 -4.063) 6.169 7.098 ( 1.634 -2.341 -8.648) 9.107 7.232 ( -0.925 2.957 1.127) 3.297 7.539 ( 3.804 -5.428 0.290) 6.635 7.635 ( 3.521 -1.086 7.819) 8.644 7.959 ( -8.239 7.914 -2.565) 11.708 8.281 ( -0.069 0.942 1.766) 2.003 8.536 ( 1.648 0.808 -4.929) 5.260 8.609 ( 4.936 -2.760 -7.823) 9.653 8.746 ( -4.612 -5.230 0.811) 7.021 8.788 ( -2.461 -0.349 -5.069) 5.645 8.869 ( -3.242 3.308 5.571) 7.245 9.174 ( -1.038 -12.064 -2.572) 12.379 9.256 ( 3.842 -4.193 -5.593) 7.976 9.560 ( 1.460 2.761 -0.526) 3.167 9.746 ( -6.830 -12.734 7.814) 16.427 9.901 ( 0.322 -1.101 -3.275) 3.470 10.023 ( -2.217 0.462 1.737) 2.854 10.332 ( -1.263 7.674 1.989) 8.028 10.657 ( 6.527 -1.960 3.163) 7.513 11.021 ( -4.398 -0.421 -1.398) 4.634 11.358 ( 3.556 4.196 0.487) 5.522 11.398 ( 6.710 8.142 -0.844) 10.585 11.564 ( 0.953 1.929 -1.188) 2.458 11.791 ( -2.786 2.908 4.821) 6.281 11.993 ( -4.288 -6.853 -3.000) 8.622 12.463 ( -5.975 -5.719 -2.051) 8.522 12.572 ( -2.150 -3.494 1.137) 4.257 12.851 ( -5.562 -13.248 -1.039) 14.405 13.160 ( -2.052 -16.681 -0.508) 16.814 13.238 ( 1.344 8.352 3.338) 9.094 13.565 ( 5.406 5.333 0.256) 7.598 13.772 ( 3.567 6.858 -1.461) 7.867 14.082 ( 0.869 -2.948 -5.520) 6.318 14.466 ( -0.403 -2.750 -6.164) 6.762 14.647 ( -5.530 -9.456 7.825) 13.462 15.113 ( 0.372 -3.236 1.525) 3.597 15.561 ( -16.585 3.898 2.993) 17.298 16.153 ( 13.353 3.669 13.633) 19.433 16.397 ( 2.551 9.091 -20.690) 22.743 17.061 ( 5.407 7.388 11.161) 14.436 17.465 ( 2.572 12.452 5.733) 13.947 17.966 ( 3.412 -0.009 -9.620) 10.207 18.395 ( 6.965 21.204 1.228) 22.352 18.856 ( 4.280 11.166 -0.982) 11.998 18.994 ( 2.604 -14.177 -4.156) 15.001 20.098 ( -4.281 -1.353 7.886) 9.075 20.327 ( -0.116 -5.137 13.884) 14.804 20.388 ( -11.599 -3.889 -1.463) 12.321 20.899 ( 2.330 2.128 5.314) 6.180 21.240 ( 0.429 -7.191 -6.672) 9.819 21.860 ( -8.247 -15.254 -8.656) 19.380 ======================= Grid point 116 (57/125) ======================= q-point: ( 0.67 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.028 ( 18.832 7.230 0.518) 20.179 2.573 ( -5.318 12.018 3.140) 13.512 3.111 ( -10.065 -5.435 -9.593) 14.929 3.330 ( 8.343 6.757 4.839) 11.777 3.493 ( 1.896 1.638 -7.967) 8.352 3.726 ( -2.998 6.948 4.148) 8.629 3.920 ( 3.733 3.089 5.161) 7.079 4.002 ( -6.626 0.982 4.276) 7.946 4.191 ( 2.948 -4.877 7.439) 9.371 4.330 ( -4.143 -6.169 -2.925) 7.986 4.445 ( -4.445 -3.196 -2.828) 6.162 4.537 ( 2.244 -7.983 2.473) 8.653 4.618 ( -1.349 0.490 1.197) 1.869 4.931 ( 8.601 0.397 -12.312) 15.025 5.381 ( -13.196 6.335 5.018) 15.474 5.572 ( 5.618 -9.627 9.602) 14.712 5.691 ( 3.689 -1.571 -6.117) 7.314 5.771 ( 1.999 3.900 7.295) 8.510 5.892 ( -2.229 -3.381 -0.163) 4.053 6.160 ( -6.245 -0.456 -4.894) 7.947 6.217 ( 1.033 7.590 -0.813) 7.703 6.510 ( 0.614 -1.009 -2.388) 2.664 6.842 ( 2.686 11.982 2.921) 12.622 6.887 ( 4.512 -0.267 2.709) 5.270 7.065 ( 0.216 3.322 -5.886) 6.762 7.187 ( -3.627 -2.114 -1.552) 4.476 7.613 ( 6.563 -4.664 -8.690) 11.846 7.728 ( 0.061 1.275 7.682) 7.787 7.859 ( -3.773 0.756 1.709) 4.211 8.232 ( -1.782 -3.426 0.847) 3.954 8.472 ( -6.476 -2.093 0.487) 6.823 8.638 ( 1.561 -2.264 -4.734) 5.475 8.673 ( 2.324 -0.488 2.071) 3.151 8.756 ( 3.835 -1.992 -3.057) 5.294 8.897 ( 0.374 -0.106 3.921) 3.940 9.088 ( 2.129 -1.557 -4.371) 5.105 9.230 ( -0.568 -6.002 -5.757) 8.336 9.527 ( -4.325 0.239 1.765) 4.678 9.647 ( 5.142 -4.556 -0.086) 6.870 9.903 ( -0.383 -1.132 1.562) 1.967 10.040 ( 0.613 4.062 -2.874) 5.014 10.373 ( -4.394 9.996 1.828) 11.071 10.779 ( 4.715 0.214 5.621) 7.340 10.898 ( -6.992 -1.769 -4.112) 8.302 11.458 ( 2.034 2.921 4.459) 5.706 11.508 ( -2.170 -2.660 0.423) 3.459 11.683 ( 9.677 7.758 -2.479) 12.649 11.815 ( 3.519 -1.840 0.943) 4.082 11.846 ( -5.065 -0.957 0.151) 5.157 12.248 ( -6.405 -4.700 -4.206) 8.989 12.522 ( -9.755 0.804 3.773) 10.490 12.676 ( 5.656 -7.994 -1.471) 9.903 12.968 ( 1.793 -19.200 -1.070) 19.313 13.353 ( 1.362 5.401 0.741) 5.619 13.723 ( 4.417 5.650 2.018) 7.451 13.870 ( 0.344 6.678 -3.839) 7.711 14.033 ( 0.675 -3.694 -6.347) 7.375 14.435 ( 2.072 -3.216 -1.479) 4.102 14.528 ( -2.972 -4.626 4.419) 7.055 15.061 ( -2.893 -4.254 1.945) 5.500 15.430 ( -6.722 7.450 7.278) 12.396 16.343 ( 3.372 -6.508 -12.319) 14.335 16.492 ( 2.430 15.601 5.705) 16.788 17.269 ( 0.633 10.552 15.090) 18.424 17.552 ( -6.550 5.039 -1.565) 8.411 17.977 ( 6.667 -2.024 -12.025) 13.898 18.654 ( -3.185 -2.038 2.276) 4.413 18.735 ( 6.314 4.256 -1.993) 7.871 19.148 ( 4.296 -2.082 0.854) 4.850 19.987 ( -4.712 2.832 -8.310) 9.964 20.093 ( -8.166 -7.437 4.823) 12.052 20.472 ( -0.084 2.823 20.692) 20.884 20.936 ( -6.286 3.887 3.272) 8.082 21.197 ( 8.768 -8.339 -14.460) 18.855 21.620 ( -0.093 -6.656 -2.644) 7.163 ======================= Grid point 117 (58/125) ======================= q-point: (-0.22 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.274 ( 3.139 -0.600 -7.701) 8.338 2.701 ( -9.064 -4.152 -2.403) 10.255 2.796 ( 1.150 12.460 2.331) 12.728 3.321 ( -13.247 -4.114 0.160) 13.872 3.642 ( 11.802 3.616 -0.112) 12.344 3.688 ( -9.733 2.092 6.575) 11.930 3.804 ( -5.305 1.052 -0.669) 5.450 4.121 ( -6.520 -4.955 0.557) 8.208 4.139 ( -0.434 2.131 3.281) 3.937 4.204 ( 3.140 -7.211 -3.906) 8.781 4.366 ( -0.175 0.347 5.116) 5.131 4.544 ( 0.459 -4.359 4.525) 6.300 4.669 ( 7.927 2.333 -3.496) 8.972 5.017 ( 1.221 -1.545 -0.873) 2.154 5.282 ( -13.901 8.171 3.188) 16.437 5.425 ( -3.829 -7.496 3.415) 9.084 5.643 ( 7.618 -12.107 0.609) 14.317 5.843 ( 0.270 0.957 -1.610) 1.892 5.971 ( 8.545 0.508 -5.090) 9.959 6.139 ( 0.174 5.557 1.860) 5.863 6.306 ( -0.945 10.291 -8.133) 13.151 6.475 ( -3.000 -2.203 3.566) 5.155 6.882 ( 2.277 -1.645 -9.505) 9.912 7.006 ( -1.092 6.575 8.300) 10.645 7.152 ( 6.629 0.603 4.363) 7.959 7.187 ( 2.970 2.096 1.333) 3.872 7.447 ( -11.643 -1.515 -12.757) 17.338 7.713 ( -4.445 3.915 -3.127) 6.698 7.944 ( 8.295 -5.396 11.681) 15.309 8.176 ( -3.764 -5.830 3.395) 7.726 8.410 ( 2.350 3.386 1.641) 4.436 8.589 ( 0.136 -3.201 -1.471) 3.525 8.786 ( 7.086 0.445 0.424) 7.112 8.822 ( 5.789 -3.324 -1.469) 6.836 8.945 ( 1.936 1.060 -0.317) 2.230 9.053 ( -3.216 -7.586 2.426) 8.589 9.162 ( 4.235 5.436 -3.835) 7.887 9.579 ( 2.866 2.649 5.523) 6.763 9.720 ( 8.354 1.221 -13.416) 15.851 9.843 ( -3.634 -5.189 3.184) 7.090 10.071 ( -1.218 3.717 -1.670) 4.253 10.417 ( -4.916 13.523 0.282) 14.391 10.706 ( -6.566 -3.372 -6.445) 9.799 10.873 ( 2.786 -0.790 5.846) 6.524 11.400 ( -4.224 -5.388 2.168) 7.181 11.492 ( -4.253 2.787 4.326) 6.676 11.687 ( -1.853 -4.618 -4.080) 6.435 11.855 ( -4.034 0.607 0.471) 4.107 11.936 ( 9.352 -0.663 -1.750) 9.537 12.196 ( 2.020 2.113 5.224) 5.986 12.463 ( 2.349 6.103 1.564) 6.724 12.772 ( 8.274 -7.611 -1.483) 11.339 12.885 ( 11.072 -9.086 -0.833) 14.347 13.370 ( -3.910 1.936 -1.839) 4.735 13.759 ( -5.047 1.345 -1.105) 5.338 13.882 ( -5.595 3.013 0.579) 6.381 14.055 ( 8.349 3.641 -7.533) 11.820 14.400 ( 0.219 -7.534 4.120) 8.590 14.537 ( 3.788 1.974 -1.785) 4.630 14.987 ( -1.460 -3.728 4.695) 6.171 15.496 ( -0.903 9.269 9.009) 12.957 16.183 ( -5.419 -7.424 -16.105) 18.543 16.676 ( -0.328 7.415 13.562) 15.460 17.326 ( -4.984 -8.149 -13.179) 16.277 17.384 ( -13.031 7.117 10.752) 18.332 18.010 ( -1.661 6.138 -1.127) 6.458 18.662 ( 5.759 -5.424 1.969) 8.152 18.799 ( -3.414 2.121 -2.500) 4.733 19.074 ( -4.346 -2.314 -2.504) 5.524 19.891 ( -9.724 -3.458 7.035) 12.490 20.068 ( 6.418 6.902 -4.060) 10.262 20.555 ( 1.565 -2.627 12.898) 13.255 20.811 ( -4.227 -4.486 -7.243) 9.510 21.203 ( 1.719 1.264 -2.786) 3.509 21.754 ( 16.459 0.682 -2.939) 16.733 ======================= Grid point 118 (59/125) ======================= q-point: (-0.11 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.976 ( -25.061 2.415 -24.735) 35.295 2.486 ( -10.069 -8.044 12.262) 17.789 2.976 ( -9.257 -4.910 -0.718) 10.503 3.125 ( 8.574 8.424 2.406) 12.259 3.538 ( -12.809 2.088 8.823) 15.693 3.673 ( -9.740 3.885 -9.773) 14.334 3.879 ( -7.670 -2.912 1.413) 8.325 3.927 ( 3.568 6.630 4.490) 8.766 4.068 ( 3.794 -17.810 -4.092) 18.664 4.248 ( -2.176 6.533 9.285) 11.560 4.433 ( 1.582 1.020 4.711) 5.074 4.555 ( -0.068 3.626 1.865) 4.078 4.754 ( -9.031 1.904 10.808) 14.212 4.927 ( 8.953 -6.539 -6.593) 12.899 5.203 ( 0.568 3.384 -9.980) 10.553 5.410 ( -3.637 2.904 11.101) 12.037 5.652 ( 5.565 -13.062 1.465) 14.273 5.884 ( 3.915 1.336 -2.567) 4.868 6.074 ( 6.316 -1.403 -8.204) 10.448 6.208 ( 0.101 3.470 4.786) 5.912 6.234 ( -6.261 0.907 -12.301) 13.833 6.526 ( 5.723 3.544 4.240) 7.955 6.907 ( 6.386 -1.911 -9.692) 11.763 7.035 ( -1.628 -3.153 -0.214) 3.555 7.192 ( -5.900 4.284 -0.066) 7.291 7.226 ( -5.037 4.513 -5.176) 8.516 7.320 ( 9.503 -2.725 5.919) 11.522 7.657 ( -5.783 2.241 3.094) 6.931 7.960 ( -3.463 -6.656 1.804) 7.717 8.163 ( 3.345 1.964 5.936) 7.091 8.527 ( 0.025 0.761 4.574) 4.637 8.583 ( 3.916 0.679 0.105) 3.976 8.804 ( 2.420 -10.574 -1.526) 10.954 8.894 ( 4.818 0.766 -3.242) 5.857 8.940 ( 5.581 1.450 -7.123) 9.165 9.122 ( 1.384 7.853 8.643) 11.760 9.341 ( 7.693 4.964 2.218) 9.421 9.601 ( -1.742 -4.498 -0.773) 4.886 9.781 ( 2.180 -3.272 5.809) 7.014 9.828 ( 6.040 4.442 -14.769) 16.563 10.047 ( -2.245 -1.102 -0.520) 2.555 10.385 ( -6.246 3.239 -5.763) 9.095 10.679 ( 4.839 6.238 -3.760) 8.745 10.935 ( 2.334 -1.057 7.380) 7.812 11.293 ( -3.670 -3.689 2.237) 5.664 11.431 ( -4.729 0.008 3.953) 6.164 11.612 ( -5.440 3.214 -6.280) 8.909 11.715 ( -3.509 -7.722 1.909) 8.694 12.071 ( 6.293 0.017 -3.379) 7.143 12.300 ( 2.470 3.187 10.877) 11.600 12.614 ( 7.579 -3.103 -1.117) 8.266 12.864 ( 14.575 -3.917 0.819) 15.114 13.135 ( 13.926 5.104 0.063) 14.832 13.242 ( -9.298 -0.520 -2.938) 9.765 13.630 ( -8.028 -0.371 -1.888) 8.255 13.778 ( -7.504 0.551 0.423) 7.537 14.232 ( 5.577 4.283 -6.873) 9.833 14.420 ( 8.161 -1.580 8.050) 11.572 14.621 ( 5.581 0.780 -3.198) 6.479 14.995 ( 3.233 -1.042 4.579) 5.702 15.610 ( 1.616 3.139 3.324) 4.849 15.905 ( -11.204 -7.118 -5.168) 14.244 16.760 ( -1.351 4.401 10.934) 11.864 16.935 ( -15.944 -10.038 -16.823) 25.258 17.292 ( -7.816 0.237 5.826) 9.751 18.050 ( -6.743 12.416 2.537) 14.355 18.366 ( -20.907 -9.836 2.108) 23.201 18.897 ( -13.771 3.309 -1.879) 14.287 19.088 ( 21.589 4.565 -2.396) 22.196 19.672 ( -15.913 -2.400 11.534) 19.800 20.279 ( 10.237 5.369 -4.070) 12.256 20.568 ( 6.518 -10.969 -3.880) 13.337 20.736 ( 1.695 -2.614 3.033) 4.348 21.281 ( 2.202 5.984 1.933) 6.663 22.067 ( 19.290 0.503 -5.489) 20.062 ======================= Grid point 121 (60/125) ======================= q-point: ( 0.22 0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.806 ( -3.504 22.342 3.114) 22.829 2.113 ( -21.848 14.006 6.491) 26.751 2.732 ( -3.863 6.088 -14.725) 16.395 3.342 ( -0.659 0.485 1.400) 1.622 3.432 ( -6.145 9.281 -0.208) 11.132 3.600 ( -11.528 6.485 19.202) 23.317 3.761 ( 3.197 1.639 0.876) 3.698 3.848 ( -2.899 -1.614 6.244) 7.071 4.056 ( 8.103 9.730 -0.650) 12.679 4.310 ( -5.543 -4.903 0.594) 7.424 4.355 ( -0.353 -1.081 2.515) 2.761 4.663 ( 2.169 -8.800 2.047) 9.292 4.761 ( -3.885 1.321 8.169) 9.142 4.953 ( 3.944 -3.754 -2.385) 5.944 5.157 ( 2.654 -6.166 -10.593) 12.541 5.585 ( -2.147 -0.717 -4.717) 5.232 5.675 ( 2.028 -0.653 7.096) 7.409 5.753 ( 2.835 8.893 6.320) 11.272 6.198 ( -4.002 6.450 -3.727) 8.456 6.270 ( 1.221 -1.010 1.810) 2.406 6.291 ( -4.147 5.564 -19.408) 20.611 6.520 ( -1.854 4.777 -4.148) 6.593 6.648 ( -4.651 6.536 -1.246) 8.118 6.920 ( 4.758 -12.184 -4.248) 13.753 7.143 ( 15.225 -15.854 3.911) 22.326 7.289 ( 5.129 0.835 0.380) 5.210 7.538 ( -4.180 -2.433 -8.431) 9.720 7.707 ( 0.578 -3.144 9.340) 9.872 7.852 ( 5.115 10.240 0.283) 11.450 8.112 ( -2.914 -7.646 7.956) 11.413 8.307 ( -1.154 4.752 -2.085) 5.316 8.583 ( -6.452 -1.950 -13.650) 15.224 8.790 ( 0.281 -4.606 4.314) 6.317 8.935 ( 1.169 -5.183 -0.509) 5.338 9.079 ( -1.937 1.502 -0.684) 2.545 9.149 ( -5.522 -5.815 -6.630) 10.405 9.287 ( 4.061 -3.337 -1.167) 5.384 9.586 ( -2.510 -1.582 4.900) 5.728 9.795 ( 2.023 0.054 5.780) 6.124 9.892 ( 6.770 -0.741 3.250) 7.546 10.207 ( 0.849 -1.729 -6.523) 6.802 10.299 ( 7.882 1.859 -1.005) 8.160 10.884 ( -2.780 -3.139 -3.396) 5.396 10.975 ( 2.815 1.862 -4.788) 5.858 11.286 ( -0.654 0.076 0.361) 0.751 11.351 ( -5.703 7.351 -8.781) 12.793 11.465 ( 1.671 -4.476 14.433) 15.204 11.812 ( -2.214 6.658 2.122) 7.330 11.976 ( 0.514 -1.440 -0.752) 1.704 12.366 ( 2.092 -7.936 7.067) 10.830 12.625 ( 8.781 -3.870 -2.178) 9.840 13.090 ( 5.359 -5.662 -0.841) 7.841 13.262 ( 2.969 -7.048 1.003) 7.714 13.393 ( -7.822 -2.790 -3.162) 8.886 13.526 ( -0.722 1.160 5.635) 5.798 13.607 ( -4.435 4.915 -1.323) 6.751 14.048 ( -3.810 3.183 -5.354) 7.301 14.563 ( 2.870 -4.698 -7.398) 9.222 14.874 ( 7.825 -9.676 3.212) 12.852 15.072 ( 6.603 -10.876 0.223) 12.726 15.389 ( 5.868 8.921 15.046) 18.450 16.253 ( 3.517 3.530 -12.114) 13.099 16.323 ( -4.885 4.513 2.182) 6.999 17.064 ( 0.713 3.433 4.293) 5.543 17.326 ( -3.843 8.233 -3.075) 9.592 17.573 ( -13.760 13.464 7.923) 20.818 18.044 ( -16.973 9.039 -1.589) 19.295 18.532 ( -11.645 20.663 -2.911) 23.896 18.944 ( -10.931 -0.150 -0.434) 10.941 20.354 ( 12.736 -3.525 3.409) 13.648 20.493 ( 4.018 -13.116 16.446) 21.416 20.611 ( 12.529 -6.810 5.383) 15.242 20.921 ( 13.633 3.513 -5.032) 14.950 21.219 ( -11.910 -6.070 -1.148) 13.416 22.233 ( 11.924 -14.880 -9.819) 21.448 ======================= Grid point 122 (61/125) ======================= q-point: ( 0.33 0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.883 ( -20.355 16.265 7.986) 27.252 2.122 ( 8.151 18.929 -0.484) 20.615 2.692 ( -2.379 10.007 -9.367) 13.912 3.256 ( -7.078 7.811 -14.741) 18.122 3.546 ( -3.961 13.026 16.781) 21.609 3.571 ( 1.462 -2.044 5.556) 6.098 3.711 ( -1.147 -3.809 -2.473) 4.684 3.972 ( 7.407 0.358 11.326) 13.538 4.155 ( -5.554 -1.088 9.082) 10.701 4.306 ( 2.845 13.151 -3.443) 13.889 4.437 ( 2.537 5.052 11.378) 12.705 4.617 ( 0.784 -7.273 2.317) 7.673 4.725 ( -7.167 6.165 1.763) 9.617 4.969 ( 6.838 -10.850 -3.278) 13.237 5.127 ( 6.838 -4.372 -8.877) 12.028 5.425 ( -6.901 -5.304 -0.857) 8.746 5.756 ( 0.517 4.064 5.489) 6.849 5.916 ( 0.867 5.240 6.161) 8.134 6.055 ( -10.637 6.510 -17.326) 21.347 6.224 ( 0.939 -0.317 -8.874) 8.929 6.265 ( 1.162 -3.958 -4.605) 6.182 6.547 ( 0.702 3.186 -3.166) 4.547 6.647 ( -4.887 5.453 1.598) 7.495 6.827 ( 1.342 -6.114 -0.998) 6.339 7.269 ( 5.837 -4.465 10.066) 12.464 7.345 ( -2.447 -2.401 -9.286) 9.899 7.506 ( 10.027 -8.965 -3.884) 14.000 7.632 ( -1.354 -7.957 6.207) 10.182 8.048 ( 5.364 9.619 -5.691) 12.397 8.153 ( 6.596 0.162 8.727) 10.941 8.278 ( -7.308 1.379 0.620) 7.463 8.439 ( -1.690 1.264 -8.052) 8.324 8.750 ( -2.736 -1.545 -3.741) 4.885 8.889 ( 3.311 -6.277 4.850) 8.595 8.985 ( 0.201 -5.401 0.768) 5.459 9.141 ( -0.412 6.140 -5.224) 8.072 9.311 ( 4.287 -6.893 -1.733) 8.300 9.516 ( -2.753 -4.697 9.408) 10.869 9.876 ( 2.400 2.353 4.374) 5.516 9.990 ( 4.366 -4.675 2.711) 6.947 10.123 ( -2.126 -5.871 -6.587) 9.076 10.388 ( 0.658 2.552 -3.617) 4.475 10.748 ( -6.490 -3.299 -3.261) 7.978 11.055 ( 4.092 1.538 -4.408) 6.208 11.154 ( -6.845 0.203 -2.733) 7.373 11.387 ( 1.281 3.237 1.453) 3.772 11.498 ( 0.033 0.372 4.902) 4.916 11.846 ( -2.362 6.215 0.373) 6.659 12.046 ( 6.432 0.266 -0.326) 6.446 12.394 ( 6.204 -6.818 6.858) 11.489 12.680 ( 2.206 -4.464 -0.025) 4.979 13.081 ( 1.133 -15.770 2.409) 15.994 13.202 ( -5.182 4.960 -4.019) 8.223 13.224 ( 0.866 -6.240 3.728) 7.320 13.543 ( -1.942 0.383 3.040) 3.627 13.629 ( 1.701 3.378 0.049) 3.783 14.031 ( -0.922 2.655 -3.858) 4.773 14.527 ( 1.896 -4.579 -7.655) 9.119 14.917 ( 7.261 -9.257 1.163) 11.822 15.064 ( 2.420 -10.176 4.608) 11.430 15.621 ( 2.143 13.473 5.439) 14.686 16.103 ( -1.780 -9.081 -7.404) 11.852 16.492 ( 5.244 10.271 -1.898) 11.687 16.923 ( -19.611 2.744 9.291) 21.873 17.337 ( -10.128 4.015 -2.491) 11.176 17.609 ( 9.521 14.767 0.137) 17.571 18.015 ( -5.741 19.535 1.874) 20.448 18.541 ( -12.681 21.422 -3.531) 25.143 18.962 ( 8.506 9.440 1.270) 12.770 20.305 ( -3.035 -17.501 5.452) 18.581 20.623 ( 6.213 -6.581 17.622) 19.810 20.696 ( 7.403 -4.454 -4.755) 9.861 20.852 ( -14.749 -10.352 1.497) 18.082 21.189 ( 10.212 -0.548 -3.319) 10.752 22.186 ( 6.629 -18.738 -9.350) 21.965 ======================= Grid point 123 (62/125) ======================= q-point: ( 0.44 0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.725 ( -17.176 17.424 1.095) 24.491 2.437 ( 13.877 2.692 -5.734) 15.254 2.841 ( 1.561 22.604 5.491) 23.314 3.168 ( -7.254 11.783 -12.776) 18.833 3.584 ( -0.225 -3.686 4.842) 6.089 3.604 ( -0.099 3.135 1.126) 3.333 3.763 ( 6.052 -0.236 1.186) 6.171 4.064 ( -1.429 0.597 15.712) 15.788 4.242 ( 3.980 6.575 3.172) 8.315 4.334 ( -1.115 0.861 -4.739) 4.944 4.527 ( -0.927 -5.649 -0.173) 5.727 4.617 ( -7.145 11.694 6.505) 15.170 4.731 ( 5.485 -0.267 9.126) 10.651 4.925 ( 1.754 -6.694 -2.477) 7.350 5.157 ( -2.819 -2.753 -6.791) 7.851 5.338 ( 6.304 -1.526 3.539) 7.389 5.796 ( -3.461 5.839 -0.459) 6.803 5.878 ( -7.337 5.595 1.330) 9.322 6.007 ( 1.807 2.112 -8.380) 8.829 6.177 ( -0.711 -3.667 -8.132) 8.949 6.251 ( 5.873 -3.995 -2.225) 7.444 6.547 ( -3.501 1.077 -0.677) 3.725 6.610 ( 3.932 -8.140 2.221) 9.308 6.835 ( -2.221 4.199 -1.668) 5.034 7.184 ( -5.580 -6.304 -3.040) 8.951 7.298 ( -3.598 -0.784 1.322) 3.913 7.428 ( 2.416 -5.078 -2.622) 6.205 7.754 ( 7.124 -2.833 2.861) 8.183 8.063 ( -6.683 0.794 2.453) 7.163 8.221 ( 2.001 6.310 -5.779) 8.787 8.336 ( 6.674 2.006 1.070) 7.050 8.456 ( 3.133 4.045 -6.051) 7.924 8.744 ( 3.782 0.110 0.586) 3.829 8.889 ( -1.793 -4.422 4.196) 6.354 8.958 ( 0.911 -3.340 2.432) 4.230 9.126 ( -1.211 -3.631 -5.125) 6.397 9.335 ( 2.595 1.697 -2.099) 3.744 9.448 ( -1.047 -11.870 7.234) 13.940 9.923 ( -3.819 -4.904 -3.038) 6.918 9.968 ( -0.855 1.472 3.290) 3.704 10.037 ( 4.287 -5.472 -0.466) 6.966 10.373 ( -2.692 1.989 -1.032) 3.503 10.596 ( -4.718 -2.721 -0.943) 5.527 11.000 ( 0.301 -4.990 -0.465) 5.020 11.230 ( 3.061 11.985 -4.171) 13.054 11.389 ( -2.557 -0.172 1.459) 2.949 11.550 ( 0.621 3.940 3.129) 5.070 11.872 ( -0.919 5.096 -0.829) 5.244 12.114 ( 1.110 -0.903 -1.533) 2.097 12.435 ( 3.868 -9.880 1.977) 10.793 12.623 ( -0.649 -9.327 1.483) 9.467 12.957 ( -2.132 -3.724 0.252) 4.298 13.190 ( 1.920 -5.496 -2.608) 6.379 13.229 ( 2.262 -2.189 6.172) 6.928 13.513 ( -2.790 1.705 2.234) 3.960 13.697 ( 1.502 3.757 0.080) 4.046 14.024 ( 0.751 -0.190 -3.793) 3.872 14.476 ( 0.473 -3.399 -6.592) 7.431 14.896 ( -4.622 -7.347 7.472) 11.453 15.023 ( 4.324 -6.221 -1.574) 7.738 15.782 ( 1.219 10.485 4.048) 11.305 16.012 ( 2.842 -7.196 -3.857) 8.645 16.515 ( -17.479 4.394 -3.327) 18.328 16.754 ( 6.019 7.394 -5.234) 10.876 17.321 ( 1.415 3.663 11.802) 12.438 17.945 ( 5.467 17.069 0.381) 17.927 18.164 ( 2.833 15.778 -0.938) 16.058 18.575 ( -3.307 19.865 -4.857) 20.716 19.225 ( 4.134 5.861 0.175) 7.175 20.081 ( -3.213 -13.994 12.683) 19.158 20.507 ( -10.789 -9.482 2.848) 14.644 20.599 ( -0.026 -7.835 -8.165) 11.317 20.829 ( 3.541 -1.608 13.886) 14.420 21.261 ( 2.529 -2.868 -4.312) 5.763 22.018 ( 0.497 -18.714 -8.789) 20.681 ======================= Grid point 124 (63/125) ======================= q-point: ( 0.56 0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.709 ( -4.041 16.935 0.332) 17.413 2.623 ( 9.484 0.244 -4.514) 10.506 3.103 ( -3.898 15.778 -4.126) 16.768 3.181 ( 1.355 15.260 6.463) 16.628 3.561 ( -0.420 -1.810 7.004) 7.246 3.703 ( 5.688 3.396 0.476) 6.642 3.788 ( 0.733 -3.063 -6.096) 6.862 4.108 ( 0.805 -5.470 8.287) 9.962 4.190 ( -5.857 1.221 -7.681) 9.736 4.376 ( -0.814 -3.727 5.623) 6.795 4.501 ( 3.920 1.600 -1.475) 4.483 4.584 ( -2.671 -0.734 -2.458) 3.703 4.704 ( -3.987 -5.267 1.410) 6.754 4.926 ( -6.123 -1.843 -5.232) 8.262 5.163 ( 8.283 8.200 8.399) 14.366 5.515 ( 7.781 2.017 1.134) 8.118 5.758 ( -3.057 2.930 -6.711) 7.935 5.862 ( -1.603 0.457 5.725) 5.962 5.943 ( -6.181 -2.995 3.862) 7.880 6.142 ( 2.998 -3.066 0.047) 4.288 6.371 ( 8.780 3.575 -7.125) 11.859 6.442 ( -8.498 0.335 2.620) 8.899 6.616 ( 5.277 -8.920 1.025) 10.415 6.853 ( 2.601 5.067 -4.809) 7.454 7.009 ( -3.956 -4.092 -4.254) 7.106 7.303 ( -0.777 4.610 -0.529) 4.705 7.418 ( 3.076 -3.133 -7.587) 8.766 7.717 ( -7.398 -3.261 15.787) 17.737 8.079 ( 2.074 4.545 -6.029) 7.830 8.285 ( 1.049 2.140 0.114) 2.386 8.441 ( 4.929 1.964 -5.068) 7.337 8.531 ( 1.845 5.831 -8.052) 10.111 8.748 ( -3.027 -8.354 6.073) 10.762 8.836 ( -2.233 -0.820 0.446) 2.421 8.971 ( -3.127 3.066 0.674) 4.431 9.035 ( 4.358 -8.156 -2.493) 9.578 9.203 ( -6.268 -9.160 -1.588) 11.212 9.482 ( 6.072 -2.273 3.601) 7.416 9.782 ( -4.547 -3.311 -3.098) 6.421 9.897 ( -4.785 -2.360 0.982) 5.425 10.071 ( -0.435 -1.590 1.617) 2.309 10.413 ( 2.362 7.022 3.155) 8.052 10.572 ( 3.049 -0.662 4.236) 5.261 10.989 ( 3.022 -4.573 -2.319) 5.952 11.348 ( 0.992 1.385 -0.420) 1.754 11.429 ( 2.578 14.212 0.595) 14.456 11.576 ( -1.340 0.201 0.005) 1.355 11.906 ( -1.781 5.341 1.867) 5.932 12.022 ( -7.359 -3.878 -3.499) 9.024 12.400 ( 6.818 -11.918 -2.796) 14.012 12.488 ( -4.079 -8.758 -0.398) 9.670 12.856 ( -5.057 -7.080 -0.534) 8.717 13.091 ( -4.368 -7.812 -1.880) 9.146 13.305 ( 1.590 3.775 6.279) 7.497 13.547 ( 2.740 4.275 2.158) 5.518 13.757 ( 2.546 2.705 -1.785) 4.121 14.027 ( 1.306 -0.675 -2.018) 2.496 14.423 ( -0.614 -2.348 -4.178) 4.832 14.739 ( -8.703 -3.907 7.838) 12.347 15.037 ( 3.635 -3.994 -4.620) 7.107 15.864 ( -10.626 2.297 -1.001) 10.918 15.982 ( 7.583 -4.198 11.515) 14.412 16.400 ( 1.815 14.201 -15.121) 20.823 16.965 ( 10.967 3.036 0.073) 11.379 17.507 ( 9.306 4.131 7.970) 12.931 18.039 ( -9.098 8.930 1.943) 12.896 18.433 ( 9.414 14.130 -3.193) 17.276 18.774 ( 7.191 10.553 -3.266) 13.181 19.088 ( -14.147 -4.157 1.272) 14.800 20.140 ( 5.034 0.572 8.705) 10.072 20.303 ( -3.255 -11.987 8.167) 14.865 20.447 ( -2.479 -3.000 -11.429) 12.074 20.888 ( 0.201 -2.843 10.658) 11.032 21.215 ( -2.936 -1.088 -4.032) 5.105 21.782 ( -3.990 -13.890 -6.531) 15.859 ======================= Grid point 125 (64/125) ======================= q-point: ( 0.67 0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.898 ( 6.640 11.617 1.757) 13.496 2.765 ( 2.590 9.840 2.560) 10.492 3.127 ( -0.269 -1.777 5.277) 5.575 3.333 ( -3.852 10.650 -9.819) 14.989 3.511 ( -2.240 -3.057 -0.350) 3.806 3.783 ( 3.770 -0.983 2.527) 4.643 3.864 ( 3.785 1.719 2.226) 4.715 4.025 ( 2.065 -5.885 2.996) 6.919 4.144 ( 4.017 -1.374 -6.266) 7.569 4.337 ( -8.318 -1.050 4.121) 9.342 4.436 ( -1.745 -10.401 1.555) 10.661 4.556 ( -2.142 4.676 -1.548) 5.371 4.660 ( -3.388 -0.606 -3.578) 4.965 4.828 ( 1.270 5.869 -3.236) 6.821 5.317 ( 4.456 -6.783 -5.413) 9.756 5.520 ( -2.786 -12.634 1.957) 13.085 5.762 ( 3.860 4.188 0.966) 5.777 5.865 ( -3.488 0.476 5.111) 6.206 5.913 ( -2.943 12.444 4.551) 13.573 6.200 ( 3.351 -3.245 3.819) 6.028 6.275 ( -7.166 1.850 -2.610) 7.848 6.489 ( 0.255 3.072 -1.074) 3.265 6.704 ( 12.815 -5.788 4.280) 14.698 6.919 ( 0.219 9.055 -4.723) 10.215 7.031 ( 5.529 3.163 -8.402) 10.543 7.246 ( -4.976 -2.493 -0.550) 5.592 7.450 ( 4.436 0.191 -3.658) 5.753 7.689 ( 1.476 -5.046 17.666) 18.432 8.057 ( -8.235 6.026 -7.600) 12.723 8.240 ( -4.193 -4.581 -2.917) 6.861 8.522 ( 2.427 0.742 -1.125) 2.776 8.586 ( 1.804 5.795 -8.207) 10.207 8.622 ( -2.060 -6.987 6.069) 9.481 8.756 ( -5.003 -1.674 -3.305) 6.226 8.835 ( 0.127 -6.699 -0.436) 6.715 9.071 ( -1.013 -3.955 1.412) 4.320 9.173 ( 4.539 5.549 -1.604) 7.346 9.534 ( 3.360 -4.947 4.005) 7.197 9.620 ( -7.886 -3.392 1.056) 8.650 9.888 ( 2.243 3.171 -2.398) 4.565 10.065 ( -0.194 1.372 1.426) 1.988 10.530 ( -0.575 10.090 0.243) 10.110 10.695 ( 6.799 -1.363 10.525) 12.604 10.951 ( -1.787 -3.577 -4.421) 5.961 11.403 ( 3.085 -0.637 -0.256) 3.161 11.515 ( -0.199 -2.179 -3.738) 4.331 11.625 ( 2.477 7.736 1.019) 8.186 11.848 ( -4.940 1.911 0.594) 5.330 11.937 ( -1.374 3.351 1.721) 4.010 12.262 ( -5.337 -10.536 -3.557) 12.335 12.465 ( 7.299 -3.457 -3.971) 9.000 12.665 ( -5.617 -8.887 0.421) 10.521 12.880 ( -10.637 -5.479 -0.398) 11.972 13.391 ( 1.202 3.760 3.697) 5.408 13.690 ( 6.186 4.567 3.157) 8.312 13.833 ( 5.521 0.446 -5.419) 7.749 14.028 ( -1.654 1.449 1.718) 2.790 14.378 ( -0.121 -2.319 -2.496) 3.409 14.602 ( -6.918 -1.481 5.119) 8.733 15.021 ( 1.475 -4.710 -4.214) 6.490 15.669 ( -11.161 3.893 2.967) 12.187 16.135 ( 8.475 -5.837 3.132) 10.757 16.614 ( 6.486 18.818 -12.257) 23.376 17.179 ( 10.887 -4.884 11.532) 16.594 17.729 ( 11.822 -4.527 -6.924) 14.429 17.897 ( -14.672 11.948 3.720) 19.284 18.597 ( -4.085 -7.824 -2.228) 9.103 18.803 ( 4.653 7.600 1.312) 9.008 19.083 ( 2.906 7.169 2.155) 8.031 20.073 ( -7.738 -3.589 -10.815) 13.774 20.145 ( -3.876 -5.371 6.821) 9.508 20.540 ( 3.941 0.642 12.601) 13.219 20.900 ( 7.887 -6.256 -10.080) 14.246 21.121 ( -7.510 3.556 3.452) 8.998 21.588 ( -4.323 -4.981 -1.750) 6.824 ======================= Grid point 126 (65/125) ======================= q-point: (-0.22 0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.118 ( 8.939 2.541 0.927) 9.339 2.874 ( -14.590 -0.606 0.847) 14.628 2.988 ( -3.913 13.169 -5.037) 14.632 3.386 ( 10.355 -5.049 -0.662) 11.539 3.503 ( -0.280 3.873 6.423) 7.505 3.767 ( 1.978 -10.576 -1.832) 10.914 3.876 ( 1.270 -2.691 1.458) 3.314 4.070 ( -14.409 -4.593 0.363) 15.128 4.193 ( 3.217 10.650 3.134) 11.558 4.247 ( 12.358 -1.422 -2.900) 12.773 4.352 ( -11.736 -4.610 -11.961) 17.379 4.403 ( 1.667 -6.455 6.885) 9.584 4.669 ( -1.308 3.905 2.426) 4.780 5.000 ( 5.599 11.819 -1.426) 13.155 5.223 ( 4.632 -20.764 4.162) 21.678 5.416 ( 4.057 -4.071 -2.940) 6.456 5.756 ( -13.874 10.402 -0.215) 17.342 5.878 ( -6.973 1.035 0.358) 7.058 5.917 ( 0.735 0.882 -0.025) 1.148 6.158 ( 3.624 -0.444 0.717) 3.721 6.370 ( 1.808 9.426 -1.945) 9.792 6.501 ( -0.487 -0.249 3.719) 3.759 6.816 ( -1.909 -5.427 -7.195) 9.212 6.975 ( 8.048 -4.154 4.414) 10.075 7.089 ( 3.202 1.769 0.232) 3.666 7.178 ( -3.938 2.505 0.430) 4.687 7.563 ( 4.767 5.968 -5.963) 9.690 7.761 ( 6.066 -7.391 14.033) 16.980 7.885 ( -10.202 4.084 -7.651) 13.390 8.135 ( -0.774 -3.999 -0.149) 4.076 8.440 ( -3.484 -1.581 0.494) 3.858 8.581 ( -3.563 -2.020 -1.339) 4.310 8.676 ( 6.253 -1.843 -1.131) 6.617 8.732 ( 3.186 1.363 2.433) 4.234 8.874 ( 5.168 3.888 -5.488) 8.482 9.010 ( -0.765 -5.652 4.122) 7.037 9.235 ( -1.710 4.228 2.728) 5.314 9.552 ( 3.180 1.181 -13.557) 13.975 9.594 ( 2.863 1.238 10.755) 11.198 9.904 ( -3.818 0.874 0.814) 4.001 10.092 ( 0.797 1.375 -0.237) 1.607 10.611 ( -1.904 11.302 0.245) 11.464 10.760 ( -4.962 -6.734 -3.415) 9.034 10.843 ( 0.241 -0.638 3.507) 3.573 11.365 ( 1.938 -7.068 -2.055) 7.612 11.595 ( 4.667 -3.036 2.125) 5.959 11.609 ( -3.827 2.759 0.313) 4.728 11.843 ( -1.193 4.052 -1.092) 4.362 12.034 ( -10.344 2.541 -0.297) 10.655 12.091 ( 10.632 -0.941 0.493) 10.685 12.528 ( 1.828 -11.693 1.601) 11.942 12.566 ( 2.428 0.358 -1.638) 2.950 12.705 ( -1.080 4.569 -0.112) 4.697 13.435 ( -1.153 1.855 0.928) 2.373 13.812 ( 0.710 0.467 0.252) 0.886 13.905 ( 6.170 -1.791 -3.577) 7.353 14.027 ( -2.721 7.610 2.252) 8.390 14.351 ( 0.441 -3.595 0.184) 3.627 14.525 ( -2.114 1.193 0.091) 2.430 14.972 ( 0.079 -4.999 1.262) 5.156 15.594 ( -3.183 2.876 -2.834) 5.142 16.152 ( -0.883 -4.599 1.316) 4.865 16.824 ( 1.211 11.685 2.523) 12.016 17.214 ( -0.175 -14.237 -2.983) 14.547 17.647 ( -7.757 -1.994 0.483) 8.023 18.017 ( 7.887 7.449 0.321) 10.854 18.465 ( 1.519 0.815 -0.047) 1.724 19.019 ( 6.404 -4.827 -0.292) 8.025 19.042 ( -9.867 5.523 0.332) 11.312 19.968 ( 1.464 2.240 -2.722) 3.817 20.074 ( -4.226 0.159 2.850) 5.100 20.500 ( -3.120 -11.735 0.901) 12.176 20.863 ( -4.588 -3.401 -1.950) 6.034 21.204 ( 6.423 9.752 1.002) 11.720 21.548 ( 3.083 1.305 -0.135) 3.350 ======================= Grid point 127 (66/125) ======================= q-point: (-0.11 0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.236 ( -3.059 6.320 -10.777) 12.863 2.483 ( -11.786 -8.512 -2.138) 14.695 3.116 ( 2.507 3.243 4.587) 6.151 3.294 ( -16.233 4.770 2.935) 17.172 3.680 ( -0.171 -8.578 -0.964) 8.634 3.716 ( 7.081 -4.500 -1.146) 8.468 3.839 ( -3.561 2.754 -3.206) 5.527 3.929 ( 4.417 4.197 8.128) 10.158 4.044 ( -12.147 -2.719 -4.987) 13.410 4.320 ( 1.723 5.018 5.247) 7.462 4.392 ( 3.374 -5.491 3.812) 7.488 4.497 ( 11.916 0.499 -0.165) 11.928 4.660 ( 1.291 -1.169 -4.701) 5.014 5.050 ( -4.995 -5.350 10.725) 12.984 5.274 ( 7.086 3.201 -5.015) 9.252 5.459 ( -8.331 -1.897 1.193) 8.627 5.581 ( -4.585 8.460 5.638) 11.153 5.769 ( 0.167 -3.960 -0.730) 4.030 5.992 ( 4.705 3.702 -5.754) 8.304 6.235 ( 1.710 0.985 -1.166) 2.292 6.323 ( -7.864 -0.226 -9.521) 12.351 6.535 ( -0.510 2.164 11.553) 11.765 6.702 ( 5.101 -5.659 -10.359) 12.858 7.034 ( -1.554 -5.627 -3.964) 7.056 7.106 ( -2.637 -4.986 5.094) 7.600 7.181 ( 7.587 -2.679 2.887) 8.548 7.576 ( -8.781 12.369 -2.406) 15.359 7.792 ( -4.142 2.797 0.156) 5.000 7.889 ( 6.100 -1.285 -1.680) 6.457 8.113 ( 2.697 -3.507 4.777) 6.511 8.474 ( 5.921 -2.253 -0.782) 6.383 8.526 ( 0.972 0.832 3.484) 3.711 8.696 ( -0.427 -7.467 4.960) 8.974 8.794 ( 4.381 2.003 -3.142) 5.751 8.897 ( -0.107 2.629 -5.927) 6.485 9.161 ( 9.156 7.264 6.243) 13.250 9.301 ( 2.440 6.116 4.275) 7.851 9.563 ( 3.724 -3.839 -10.900) 12.141 9.695 ( 1.652 5.343 -2.548) 6.146 9.806 ( -4.924 -2.359 4.863) 7.312 10.095 ( -1.260 -1.094 0.517) 1.748 10.490 ( -10.370 -7.121 -10.594) 16.446 10.713 ( 0.937 11.011 -0.887) 11.086 10.896 ( 2.863 -2.164 5.635) 6.681 11.328 ( -1.469 -3.225 2.617) 4.405 11.504 ( -2.026 -4.559 0.193) 4.992 11.668 ( -1.839 4.939 4.716) 7.072 11.796 ( -10.398 -3.537 -2.478) 11.259 11.948 ( 6.519 4.335 -5.614) 9.634 12.296 ( 7.525 0.915 3.188) 8.224 12.427 ( 3.080 -14.357 1.566) 14.767 12.643 ( 5.955 5.588 3.692) 8.962 12.961 ( 14.224 10.428 0.576) 17.646 13.382 ( -6.149 1.028 -2.188) 6.607 13.744 ( -5.822 -1.011 -2.324) 6.349 13.892 ( -3.809 -2.044 1.359) 4.531 14.162 ( 5.386 8.419 -2.529) 10.309 14.347 ( 2.790 -0.952 5.793) 6.500 14.543 ( 2.465 1.150 -4.813) 5.528 14.959 ( 1.634 -3.116 6.789) 7.646 15.502 ( -1.081 -9.714 -14.726) 17.675 16.101 ( -6.094 4.324 12.457) 14.527 16.878 ( -5.068 -2.041 14.107) 15.128 16.963 ( -6.538 -9.255 -21.525) 24.326 17.464 ( -9.280 -2.735 7.018) 11.952 18.202 ( 3.042 8.019 -3.802) 9.381 18.584 ( -6.499 -4.685 2.559) 8.411 18.800 ( 4.671 4.513 -2.320) 6.897 19.130 ( -2.098 5.426 -0.073) 5.818 19.938 ( -10.656 -0.365 13.734) 17.387 20.145 ( 9.886 4.831 -7.399) 13.260 20.304 ( 0.580 -15.066 -9.810) 17.988 20.756 ( -3.715 -4.220 8.781) 10.427 21.373 ( -0.890 12.214 0.949) 12.283 21.724 ( 15.810 -0.186 -4.808) 16.526 ======================= Grid point 130 (67/125) ======================= q-point: ( 0.22 0.56 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.032 ( -6.386 8.138 -8.495) 13.386 2.533 ( -9.697 15.880 1.131) 18.640 2.888 ( -2.722 4.597 0.402) 5.358 3.321 ( -3.152 2.563 7.324) 8.375 3.521 ( 0.566 0.662 -2.776) 2.909 3.733 ( -2.887 -0.889 -0.619) 3.083 3.869 ( 0.753 2.787 -3.809) 4.779 3.940 ( -8.261 2.497 -0.247) 8.634 4.082 ( 8.289 7.095 13.143) 17.082 4.351 ( -4.149 4.524 -2.365) 6.578 4.380 ( -4.031 -4.446 3.573) 6.985 4.527 ( 11.363 -12.749 5.815) 18.041 4.581 ( -2.038 -7.518 1.009) 7.854 5.009 ( 1.966 -6.056 -3.282) 7.163 5.239 ( -14.506 9.199 4.196) 17.681 5.520 ( 2.853 -3.375 -5.292) 6.895 5.613 ( 6.944 2.111 1.924) 7.509 5.878 ( -4.162 4.619 7.942) 10.086 6.209 ( 5.879 -1.674 -4.577) 7.636 6.282 ( -1.197 -2.653 -4.177) 5.091 6.351 ( 2.835 9.691 7.196) 12.399 6.587 ( 6.981 -3.608 -14.398) 16.403 6.629 ( -6.509 5.078 -8.232) 11.659 6.731 ( 9.659 -0.368 4.177) 10.530 6.864 ( -2.514 -4.156 0.182) 4.861 7.223 ( 4.185 -2.132 2.513) 5.327 7.529 ( -2.688 -0.420 -13.208) 13.485 7.819 ( -7.894 2.589 7.114) 10.937 7.893 ( 0.222 2.471 7.329) 7.738 8.207 ( -7.804 -2.531 6.537) 10.490 8.351 ( 1.572 5.205 1.499) 5.640 8.533 ( 2.364 -3.092 -11.557) 12.194 8.737 ( 0.214 -9.481 5.794) 11.113 8.900 ( -1.149 -2.175 0.081) 2.461 9.031 ( 4.129 -4.797 -1.200) 6.443 9.158 ( -6.271 -5.602 -10.101) 13.144 9.225 ( -0.928 -1.934 -3.891) 4.443 9.589 ( 2.711 1.793 6.167) 6.971 9.689 ( 1.786 -1.080 -6.499) 6.826 9.908 ( 0.856 -0.532 3.264) 3.416 10.085 ( 5.070 -2.725 -1.213) 5.882 10.304 ( 1.779 11.612 3.029) 12.132 10.870 ( 2.836 -1.311 1.601) 3.510 10.956 ( -0.250 2.932 -7.170) 7.750 11.316 ( -4.024 -2.286 0.599) 4.667 11.409 ( 1.157 -5.121 8.653) 10.121 11.567 ( -6.573 11.769 -1.638) 13.579 11.886 ( 1.312 -1.415 -1.224) 2.285 11.990 ( -4.591 3.370 2.277) 6.133 12.264 ( 1.023 -10.652 5.692) 12.121 12.354 ( 13.374 -4.340 -3.680) 14.535 12.920 ( 5.903 -9.327 -2.282) 11.271 13.113 ( 0.454 -8.085 -2.061) 8.356 13.461 ( -4.158 -1.227 1.343) 4.539 13.640 ( -0.905 6.914 -1.003) 7.045 13.746 ( -5.784 3.476 -1.639) 6.944 14.097 ( -2.423 1.279 -7.589) 8.068 14.459 ( 0.799 -4.290 -3.563) 5.634 14.724 ( 3.160 -5.671 5.928) 8.791 14.909 ( 2.765 -5.849 1.081) 6.559 15.456 ( 6.191 11.938 21.714) 25.541 16.164 ( -2.890 -8.974 -13.204) 16.224 16.458 ( -0.120 13.471 -7.274) 15.310 17.035 ( 10.650 11.162 3.879) 15.908 17.440 ( -3.006 0.819 4.025) 5.090 18.034 ( -20.331 6.504 4.848) 21.889 18.388 ( -9.884 10.916 -1.200) 14.775 18.797 ( -4.019 5.818 -4.677) 8.478 19.114 ( -10.796 -3.462 -0.495) 11.348 20.124 ( 11.367 -1.245 5.352) 12.626 20.234 ( 11.479 -7.856 -2.987) 14.228 20.488 ( 4.452 -5.159 22.979) 23.968 20.696 ( 11.206 1.180 -7.789) 13.698 21.401 ( -13.551 -1.106 -3.040) 13.932 21.853 ( 10.401 -11.733 -9.198) 18.179 ======================= Grid point 131 (68/125) ======================= q-point: ( 0.33 0.56 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.044 ( 3.557 6.032 -4.980) 8.593 2.471 ( -17.631 17.563 -5.619) 25.512 2.900 ( -6.227 16.969 -1.445) 18.133 3.243 ( 0.303 -8.918 -3.716) 9.666 3.536 ( -0.278 2.484 -0.390) 2.530 3.746 ( -1.704 1.261 3.147) 3.794 3.836 ( -7.127 6.000 0.934) 9.363 3.912 ( 4.437 1.877 10.428) 11.487 4.230 ( -2.661 -2.630 9.389) 10.107 4.395 ( -1.443 4.738 -4.800) 6.897 4.459 ( 10.626 8.031 10.921) 17.225 4.508 ( 1.142 -0.978 -2.565) 2.973 4.619 ( 9.049 -9.927 4.015) 14.019 4.892 ( -1.257 -9.421 -10.212) 13.951 5.157 ( -5.888 6.980 10.287) 13.755 5.433 ( -2.306 -5.807 -0.852) 6.306 5.800 ( 1.347 7.283 4.081) 8.456 5.909 ( 2.626 0.570 3.413) 4.344 6.154 ( -3.614 -6.919 -2.998) 8.362 6.212 ( -0.695 -1.104 -13.290) 13.354 6.361 ( -14.017 9.798 -6.436) 18.273 6.486 ( 4.003 -4.033 -6.862) 8.909 6.676 ( -0.292 -8.259 4.791) 9.553 6.845 ( 1.558 9.782 -2.883) 10.316 7.017 ( 17.349 3.049 2.976) 17.865 7.284 ( 5.149 -2.833 0.047) 5.877 7.392 ( -6.788 -1.725 -8.661) 11.139 7.701 ( -8.146 -5.343 8.561) 12.970 8.005 ( 6.364 3.732 4.665) 8.729 8.167 ( -0.575 4.667 4.144) 6.268 8.405 ( -2.824 5.314 -1.080) 6.114 8.454 ( -2.736 -0.284 -7.171) 7.680 8.716 ( 2.175 -5.276 0.936) 5.783 8.829 ( -1.491 -4.699 2.550) 5.550 8.931 ( -0.736 -6.219 -0.824) 6.316 9.094 ( 4.263 -5.906 -2.835) 7.816 9.224 ( 1.141 2.636 -2.659) 3.914 9.545 ( -4.164 -6.101 2.376) 7.759 9.761 ( 5.708 -3.077 2.660) 7.009 9.946 ( 2.923 -0.959 -3.315) 4.523 10.092 ( -0.181 -1.912 -1.279) 2.307 10.416 ( -1.225 7.539 -2.477) 8.030 10.843 ( -5.526 -0.295 0.302) 5.542 10.983 ( 3.164 0.608 -3.563) 4.804 11.249 ( -2.563 -1.854 5.469) 6.318 11.419 ( -0.279 2.604 1.948) 3.264 11.559 ( -4.317 7.907 -1.992) 9.226 11.883 ( 3.316 -6.290 -0.992) 7.180 11.990 ( -1.124 8.637 -1.215) 8.795 12.225 ( 4.520 -11.217 6.365) 13.666 12.565 ( 10.685 -1.257 0.606) 10.776 12.828 ( 2.026 -16.124 0.977) 16.280 13.090 ( 6.926 -9.671 0.665) 11.914 13.374 ( -6.400 1.681 -2.486) 7.069 13.639 ( -5.209 5.683 1.544) 7.862 13.693 ( -3.787 4.495 -1.064) 5.973 14.060 ( -1.430 1.259 -4.765) 5.132 14.427 ( 1.715 -3.954 -2.573) 5.020 14.724 ( 4.605 -7.687 1.738) 9.128 14.968 ( 4.830 -1.823 5.611) 7.625 15.726 ( 3.027 8.736 15.335) 17.906 15.978 ( -1.452 -7.086 -15.369) 16.986 16.587 ( 0.042 15.209 -8.893) 17.618 17.248 ( -5.417 2.364 20.433) 21.271 17.526 ( 5.723 17.349 -12.650) 22.221 17.637 ( -18.448 -6.673 1.962) 19.715 18.392 ( -10.447 19.941 2.749) 22.679 18.862 ( 2.982 -6.164 -0.801) 6.894 18.923 ( -7.192 17.858 -2.393) 19.400 20.139 ( 2.837 -15.110 -3.118) 15.687 20.462 ( 13.106 0.074 0.429) 13.113 20.533 ( 4.003 -10.057 21.127) 23.739 20.941 ( 10.277 0.799 -0.160) 10.309 21.089 ( -13.931 -3.662 -6.613) 15.850 21.844 ( 8.033 -14.506 -8.648) 18.702 ======================= Grid point 132 (69/125) ======================= q-point: ( 0.44 0.56 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.205 ( 10.431 0.805 -2.219) 10.695 2.233 ( -21.820 15.297 -7.092) 27.576 3.058 ( 2.249 18.113 5.852) 19.167 3.235 ( 5.613 2.301 -8.304) 10.284 3.496 ( -2.716 -4.298 -3.072) 5.940 3.698 ( -5.113 3.995 0.236) 6.493 3.816 ( -3.682 7.823 -0.298) 8.651 4.097 ( 2.771 -3.558 16.834) 17.428 4.225 ( 3.050 -0.244 2.879) 4.201 4.323 ( 0.318 -5.392 -0.843) 5.467 4.526 ( -3.567 7.595 -10.762) 13.646 4.644 ( 5.046 -8.639 1.107) 10.066 4.728 ( -0.087 0.564 2.668) 2.728 4.817 ( 10.640 -0.474 3.176) 11.113 5.255 ( -3.714 8.682 14.149) 17.010 5.317 ( -2.883 -2.371 0.423) 3.757 5.859 ( -0.252 0.965 6.944) 7.015 5.939 ( -0.424 -2.429 -7.552) 7.944 6.046 ( -1.356 -2.977 -2.850) 4.338 6.093 ( -0.321 -4.640 -4.880) 6.742 6.204 ( -7.529 6.965 -11.497) 15.407 6.524 ( 5.024 -2.109 -5.259) 7.572 6.561 ( -4.860 -4.444 7.076) 9.666 6.957 ( -2.626 7.369 -2.535) 8.224 7.164 ( -3.143 -7.162 -6.617) 10.245 7.311 ( 4.032 -1.031 11.650) 12.371 7.361 ( 3.607 1.055 -10.545) 11.195 7.591 ( 2.703 -2.348 6.994) 7.857 8.173 ( 3.811 5.070 1.643) 6.552 8.251 ( 2.584 4.815 -5.213) 7.553 8.303 ( -8.474 -0.834 2.779) 8.957 8.466 ( 1.990 6.772 0.432) 7.072 8.691 ( 1.558 -0.344 -2.228) 2.741 8.858 ( 3.488 -3.286 6.775) 8.298 8.912 ( 1.083 -3.130 4.125) 5.290 9.078 ( 1.462 -4.414 -4.247) 6.298 9.285 ( 3.029 1.771 -3.322) 4.832 9.400 ( -3.886 -9.480 3.189) 10.730 9.830 ( 7.569 -4.482 2.424) 9.125 9.925 ( -1.013 -3.360 -3.676) 5.083 10.060 ( -2.325 0.105 1.276) 2.654 10.396 ( -2.904 2.679 -8.420) 9.301 10.712 ( -8.194 -1.821 2.443) 8.742 10.959 ( -1.069 -4.891 -1.209) 5.150 11.317 ( 1.104 11.794 3.006) 12.221 11.424 ( -1.438 0.217 1.310) 1.957 11.603 ( -0.176 7.989 -0.292) 7.996 11.884 ( 2.979 -3.359 0.293) 4.499 12.062 ( 2.604 3.668 -4.835) 6.604 12.230 ( 5.532 -11.291 2.550) 12.830 12.574 ( -2.422 -8.382 2.670) 9.125 12.831 ( 9.411 -8.436 2.167) 12.823 13.117 ( 2.541 -5.125 2.282) 6.159 13.280 ( -4.620 3.811 -0.547) 6.013 13.607 ( -4.618 2.294 2.680) 5.811 13.701 ( 0.614 3.679 -0.251) 3.738 14.025 ( -1.226 0.084 -3.261) 3.485 14.411 ( 1.023 -1.992 -1.884) 2.927 14.769 ( 8.068 -5.874 -2.560) 10.303 15.018 ( -1.889 -1.358 9.199) 9.489 15.843 ( 3.601 -5.815 -11.666) 13.523 15.888 ( -0.265 6.904 3.799) 7.884 16.642 ( -3.362 6.694 -4.872) 8.936 17.066 ( -23.976 7.853 -0.886) 25.245 17.352 ( -0.245 -6.496 12.111) 13.745 17.914 ( 13.426 16.887 -5.599) 22.289 18.414 ( -9.075 15.659 2.968) 18.340 18.780 ( -2.506 4.839 -3.533) 6.495 19.157 ( 8.045 7.387 2.340) 11.170 19.999 ( 0.031 -11.924 -0.143) 11.925 20.447 ( 0.830 -11.257 -4.425) 12.124 20.690 ( -15.737 -5.889 0.081) 16.803 20.765 ( 9.378 -1.390 18.343) 20.649 21.149 ( 7.038 2.026 -7.048) 10.165 21.777 ( 4.186 -13.173 -5.984) 15.062 ======================= Grid point 133 (70/125) ======================= q-point: ( 0.56 0.56 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.049 ( -13.972 16.982 -2.724) 22.159 2.381 ( 12.169 -4.986 2.019) 13.305 3.284 ( 0.272 5.801 3.018) 6.544 3.360 ( -2.786 15.003 0.613) 15.272 3.438 ( 10.821 -2.418 -4.490) 11.962 3.638 ( -2.812 -4.463 -2.961) 6.050 3.859 ( -1.396 11.761 -1.833) 11.985 4.031 ( -1.708 -12.262 0.073) 12.380 4.191 ( -0.846 -7.550 0.677) 7.627 4.393 ( -1.383 0.909 -4.088) 4.410 4.481 ( 1.021 3.968 -1.237) 4.280 4.602 ( -2.733 -2.914 -3.529) 5.331 4.735 ( 1.578 1.593 8.454) 8.747 5.056 ( -8.428 -3.076 0.485) 8.985 5.091 ( 7.985 2.083 2.641) 8.664 5.455 ( 2.096 5.849 6.145) 8.739 5.786 ( -4.806 -6.080 -6.665) 10.222 5.866 ( -0.794 -5.850 6.649) 8.892 6.014 ( 1.440 1.436 -1.833) 2.738 6.096 ( 1.046 -3.840 4.557) 6.050 6.222 ( 5.617 8.420 -5.733) 11.632 6.517 ( -0.405 1.431 0.899) 1.738 6.551 ( 0.548 0.683 -3.217) 3.334 6.849 ( -4.102 -3.692 -0.412) 5.534 7.076 ( -4.456 0.773 -3.407) 5.662 7.321 ( -0.455 2.835 -6.860) 7.437 7.345 ( 0.100 -2.985 1.472) 3.330 7.785 ( 8.919 0.364 5.991) 10.750 8.086 ( -8.624 -0.285 3.305) 9.240 8.291 ( 2.113 3.766 -2.539) 5.010 8.353 ( 4.299 2.093 -5.611) 7.372 8.573 ( 0.799 5.859 -1.780) 6.176 8.750 ( 0.721 -0.428 8.719) 8.760 8.878 ( -0.265 0.078 3.216) 3.228 8.906 ( 0.032 -3.360 2.004) 3.912 9.032 ( -1.743 0.614 -3.485) 3.945 9.160 ( -3.094 -14.881 0.660) 15.214 9.407 ( 3.135 2.787 0.692) 4.251 9.826 ( -3.787 -0.877 -1.570) 4.193 9.958 ( 3.616 -1.802 -0.939) 4.148 10.026 ( -1.340 -0.263 2.179) 2.571 10.376 ( 4.869 2.197 -7.480) 9.192 10.598 ( -3.609 -1.513 7.413) 8.383 10.903 ( 0.134 -2.578 -2.480) 3.580 11.360 ( -1.211 -0.094 1.285) 1.768 11.535 ( 2.684 12.450 3.493) 13.206 11.614 ( -3.447 0.473 -2.006) 4.017 11.930 ( 2.980 -0.636 0.866) 3.167 12.105 ( -2.121 4.188 -4.968) 6.835 12.177 ( 2.976 -9.844 -1.516) 10.395 12.443 ( -2.133 -10.040 1.488) 10.371 12.865 ( -1.124 -2.195 -1.535) 2.905 13.090 ( -1.212 -1.950 0.189) 2.304 13.313 ( 2.588 1.049 6.738) 7.294 13.572 ( -1.573 0.880 3.222) 3.692 13.744 ( 0.577 1.411 -0.925) 1.783 14.007 ( 0.396 0.672 -1.293) 1.510 14.408 ( -0.008 0.166 -0.608) 0.631 14.826 ( 4.468 -4.123 -4.981) 7.859 14.956 ( -6.106 -1.047 6.506) 8.983 15.835 ( 7.422 -3.627 -9.926) 12.914 15.968 ( -0.928 4.001 5.710) 7.034 16.585 ( -8.193 4.456 -1.784) 9.495 16.835 ( -2.732 5.720 -8.841) 10.878 17.414 ( 5.429 -4.087 10.698) 12.674 18.224 ( 5.876 8.921 -2.755) 11.032 18.419 ( -2.965 7.136 2.018) 7.987 18.846 ( 0.276 11.022 -2.344) 11.271 19.210 ( -3.585 -6.577 3.274) 8.175 20.019 ( 8.911 1.402 0.884) 9.064 20.260 ( -3.928 -13.245 -3.114) 14.161 20.453 ( -7.209 -0.554 -5.932) 9.352 20.891 ( 1.126 -5.908 10.881) 12.432 21.229 ( 2.086 3.344 -2.401) 4.615 21.697 ( -0.091 -5.558 -1.218) 5.690 ======================= Grid point 134 (71/125) ======================= q-point: (-0.33 -0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.042 ( -6.357 14.165 1.546) 15.603 2.594 ( 17.685 -4.728 6.144) 19.309 3.220 ( -4.794 -0.852 -1.365) 5.056 3.461 ( -5.846 -4.509 -6.981) 10.161 3.516 ( 1.325 2.823 9.179) 9.694 3.648 ( 9.263 4.080 -1.048) 10.175 3.826 ( -4.337 -14.353 -7.734) 16.871 3.967 ( -0.450 6.615 -3.908) 7.696 4.102 ( 0.547 0.747 -0.886) 1.281 4.302 ( 0.603 -7.556 -1.328) 7.696 4.510 ( -4.833 -0.327 -2.096) 5.278 4.602 ( 3.965 6.017 0.364) 7.215 4.722 ( -9.612 0.198 -5.859) 11.258 4.911 ( -1.353 3.816 8.848) 9.730 5.239 ( -0.602 -3.986 -1.696) 4.374 5.404 ( 0.512 -13.012 -0.827) 13.048 5.730 ( 3.103 -0.835 0.325) 3.230 5.824 ( -0.263 3.495 -5.744) 6.729 6.095 ( -0.471 -2.925 7.198) 7.784 6.141 ( 5.328 8.597 6.567) 12.059 6.368 ( 6.287 -1.352 -4.333) 7.755 6.509 ( -2.170 0.851 2.925) 3.741 6.562 ( -2.831 4.222 5.690) 7.630 6.891 ( 9.661 5.758 -4.708) 12.193 7.005 ( -3.971 4.234 -5.583) 8.054 7.266 ( -2.898 -4.175 -3.223) 6.018 7.376 ( 4.099 2.408 -4.098) 6.277 7.781 ( -7.370 -6.843 16.608) 19.416 8.108 ( 4.757 4.617 -5.378) 8.536 8.274 ( -5.208 -2.863 -2.925) 6.624 8.405 ( 4.965 -2.010 -3.567) 6.436 8.620 ( 1.319 4.643 -3.000) 5.683 8.672 ( -7.685 -4.976 5.106) 10.482 8.797 ( -5.528 -5.186 -0.132) 7.581 8.850 ( -3.901 0.750 2.744) 4.828 9.060 ( -0.885 -1.990 3.094) 3.784 9.141 ( 7.140 9.114 -2.368) 11.818 9.456 ( 2.068 -4.027 3.475) 5.707 9.755 ( -8.446 0.627 -0.193) 8.471 9.904 ( -0.804 3.917 0.734) 4.065 10.050 ( 2.770 -1.110 -1.077) 3.173 10.550 ( 8.696 7.044 -3.793) 11.816 10.626 ( 3.854 -2.956 11.160) 12.171 10.881 ( 1.103 -2.020 -3.804) 4.446 11.373 ( 1.229 0.822 0.562) 1.582 11.479 ( -4.122 -6.992 -4.405) 9.235 11.714 ( 2.109 7.966 2.655) 8.658 11.875 ( -3.648 -9.497 -2.795) 10.550 12.040 ( -5.263 7.805 3.950) 10.209 12.212 ( 1.803 0.253 -2.064) 2.752 12.347 ( 2.008 -3.703 -4.934) 6.488 12.729 ( -9.960 -1.789 -2.236) 10.363 13.030 ( -5.558 0.872 0.349) 5.636 13.404 ( 2.857 0.074 7.539) 8.062 13.621 ( 5.309 -0.240 1.779) 5.605 13.741 ( 0.680 -1.197 -1.835) 2.294 14.049 ( 2.493 1.983 1.437) 3.495 14.395 ( -2.771 1.351 0.843) 3.196 14.756 ( -7.394 -0.252 0.912) 7.455 14.909 ( 1.959 -2.773 -4.559) 5.685 15.867 ( -4.922 -1.089 0.812) 5.106 15.995 ( 4.600 -0.387 2.615) 5.306 16.574 ( 3.619 11.773 -11.451) 16.818 16.960 ( 13.402 -2.637 -1.827) 13.780 17.493 ( 5.999 -8.224 4.978) 11.332 18.199 ( -9.410 -0.377 5.074) 10.697 18.521 ( 8.154 -2.928 -3.974) 9.532 18.853 ( -8.211 3.819 2.556) 9.409 19.151 ( 0.585 3.459 1.047) 3.661 20.026 ( -1.401 -12.089 -4.697) 13.045 20.230 ( -2.085 5.410 -0.951) 5.875 20.423 ( 10.322 4.441 -3.749) 11.846 20.795 ( -4.939 -7.343 -2.215) 9.123 21.251 ( -2.769 0.109 4.433) 5.228 21.672 ( -3.796 6.237 3.973) 8.312 ======================= Grid point 135 (72/125) ======================= q-point: (-0.22 -0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.093 ( -0.164 5.454 3.963) 6.744 2.954 ( 21.971 -4.255 7.916) 23.738 3.104 ( -1.401 -7.879 -1.309) 8.108 3.205 ( -16.265 -0.480 -5.927) 17.318 3.580 ( -2.440 -1.878 0.112) 3.082 3.620 ( -0.121 -2.920 0.516) 2.968 3.786 ( 6.589 -3.241 -3.247) 8.029 3.982 ( 7.295 -1.810 -5.578) 9.360 4.235 ( 6.606 -3.237 -0.145) 7.358 4.258 ( -1.534 2.767 3.171) 4.480 4.391 ( -9.789 4.988 -0.452) 10.996 4.440 ( -8.667 -7.569 -9.271) 14.777 4.793 ( 0.443 11.978 4.638) 12.852 4.977 ( -1.862 -21.274 3.658) 21.666 5.046 ( 2.947 9.892 -1.043) 10.374 5.363 ( -1.304 -1.874 0.952) 2.474 5.743 ( 6.387 -6.824 -9.415) 13.266 5.900 ( 0.607 5.963 -2.858) 6.641 6.086 ( 1.021 -2.585 4.777) 5.527 6.244 ( -13.366 11.345 -2.502) 17.709 6.431 ( 3.929 10.037 4.221) 11.575 6.486 ( 1.869 -6.090 2.317) 6.778 6.693 ( 8.837 0.608 8.408) 12.213 6.923 ( -5.323 -2.666 -3.283) 6.799 7.102 ( 0.651 7.763 -3.806) 8.670 7.205 ( 3.324 -1.869 -1.014) 3.946 7.442 ( 5.266 0.177 -1.421) 5.457 7.692 ( 0.950 -8.330 12.432) 14.995 8.036 ( -10.461 -3.798 -4.183) 11.889 8.165 ( -2.798 1.461 -4.830) 5.770 8.482 ( 1.626 -2.377 0.072) 2.881 8.515 ( 1.225 -3.974 -0.813) 4.238 8.662 ( -4.168 1.910 1.921) 4.971 8.749 ( 1.795 6.327 3.537) 7.468 8.842 ( 0.959 4.060 -2.443) 4.834 9.038 ( -3.956 -0.236 4.520) 6.011 9.256 ( 1.400 2.295 -3.720) 4.590 9.520 ( 4.122 -0.661 5.578) 6.968 9.611 ( -4.080 2.530 -0.616) 4.840 9.982 ( -1.010 5.655 1.092) 5.847 10.082 ( 1.627 -0.009 -0.224) 1.643 10.657 ( 0.302 -4.410 5.149) 6.786 10.753 ( 5.973 4.439 0.051) 7.442 10.846 ( -2.273 -0.507 -6.084) 6.514 11.268 ( -2.546 -7.056 -2.548) 7.922 11.470 ( 4.711 -3.429 -0.034) 5.827 11.723 ( -3.404 6.017 -2.004) 7.197 11.835 ( 7.910 -9.996 0.477) 12.755 12.008 ( -8.428 6.000 2.221) 10.581 12.171 ( -1.793 -3.830 0.970) 4.338 12.473 ( 9.440 10.013 -4.463) 14.467 12.531 ( -11.230 1.403 0.839) 11.349 12.923 ( -9.900 6.264 0.813) 11.744 13.455 ( 0.353 -0.385 3.538) 3.576 13.717 ( 7.199 -4.687 -2.560) 8.963 13.779 ( 5.366 -1.121 2.066) 5.859 14.125 ( 1.418 3.390 4.343) 5.689 14.349 ( -3.679 2.005 -1.381) 4.412 14.631 ( -7.244 1.250 0.627) 7.377 14.903 ( 2.124 -1.979 -3.485) 4.535 15.684 ( -9.973 -4.277 -3.488) 11.398 16.127 ( 5.063 1.628 8.312) 9.868 16.758 ( 11.114 5.625 -19.428) 23.078 17.091 ( 3.135 -11.570 11.142) 16.365 17.544 ( 9.517 -1.915 -6.944) 11.935 18.030 ( -6.793 -9.590 10.600) 15.826 18.561 ( 1.445 2.575 -2.420) 3.818 18.826 ( 2.159 -2.651 1.795) 3.862 19.160 ( -1.383 -3.056 -0.358) 3.373 19.928 ( 1.768 0.998 -10.967) 11.153 20.193 ( -5.514 3.207 6.000) 8.757 20.511 ( -8.939 -6.240 -2.588) 11.205 20.780 ( 12.030 5.385 -7.937) 15.386 21.197 ( -2.126 -1.718 5.312) 5.974 21.702 ( -6.831 12.766 5.889) 15.630 ======================= Grid point 136 (73/125) ======================= q-point: (-0.11 -0.44 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.196 ( 5.179 2.074 6.182) 8.327 2.775 ( -21.924 -0.365 -5.806) 22.682 2.995 ( 6.277 -16.718 -4.269) 18.360 3.357 ( 12.472 -5.370 -2.221) 13.759 3.543 ( 4.713 3.501 2.694) 6.460 3.648 ( -2.022 2.242 4.441) 5.370 3.829 ( 4.058 -2.307 -5.872) 7.502 4.076 ( -5.483 3.119 5.855) 8.607 4.136 ( 6.840 -9.471 -1.693) 11.805 4.198 ( -9.228 1.010 -7.403) 11.873 4.359 ( 4.656 0.730 2.530) 5.349 4.407 ( 1.447 6.758 1.940) 7.179 4.668 ( -5.384 -11.480 1.148) 12.732 4.992 ( 4.356 -0.990 6.580) 7.954 5.298 ( 3.359 14.509 2.684) 15.133 5.314 ( 5.955 -3.132 -4.140) 7.900 5.769 ( 5.793 -8.454 -7.360) 12.617 5.837 ( -4.589 -2.008 1.272) 5.168 6.059 ( -15.602 15.376 -2.467) 22.044 6.176 ( 2.606 1.597 -1.114) 3.253 6.390 ( -4.445 -3.778 -7.269) 9.321 6.608 ( -1.397 -2.213 -1.016) 2.807 6.683 ( -4.985 3.904 8.102) 10.283 6.954 ( 6.705 -1.589 5.932) 9.092 7.066 ( -0.544 -7.462 5.757) 9.440 7.161 ( -5.795 -2.237 -0.942) 6.283 7.655 ( 13.157 4.456 -4.882) 14.724 7.722 ( 3.785 -3.105 4.388) 6.574 7.847 ( -4.873 -0.765 -3.681) 6.155 8.127 ( 0.400 0.763 -0.967) 1.295 8.380 ( -2.972 -3.346 -0.771) 4.542 8.597 ( -0.884 2.161 1.149) 2.603 8.646 ( 1.398 1.347 6.543) 6.825 8.814 ( -2.113 3.483 3.167) 5.160 8.933 ( -2.673 4.713 -4.264) 6.894 9.067 ( 11.011 7.864 1.972) 13.674 9.323 ( 4.647 0.211 3.448) 5.791 9.466 ( -4.486 1.727 -7.634) 9.021 9.717 ( 3.984 2.446 4.275) 6.335 9.944 ( -7.402 1.515 0.727) 7.590 10.081 ( -0.814 -1.731 0.033) 1.913 10.508 ( -7.204 -12.123 -4.298) 14.742 10.788 ( -0.768 2.416 -4.215) 4.919 10.871 ( 2.019 5.953 -2.100) 6.628 11.260 ( 5.430 -2.891 3.528) 7.091 11.450 ( 0.390 -7.346 0.806) 7.400 11.799 ( -1.332 6.891 0.531) 7.039 11.831 ( 3.077 -7.225 0.583) 7.875 11.935 ( -3.040 4.471 -3.573) 6.481 12.155 ( 4.127 -4.229 0.315) 5.918 12.370 ( -8.018 0.525 4.739) 9.328 12.742 ( 2.255 11.699 2.719) 12.220 12.905 ( 2.030 12.787 -0.263) 12.950 13.440 ( -1.524 -1.096 -1.419) 2.353 13.751 ( 2.303 -4.227 -1.861) 5.161 13.855 ( 3.790 -3.784 2.013) 5.722 14.206 ( 0.837 5.802 4.297) 7.269 14.326 ( 0.393 2.838 -2.900) 4.077 14.551 ( -3.550 2.090 -1.741) 4.472 14.925 ( 2.125 -0.527 3.306) 3.965 15.416 ( -8.079 -11.783 -9.364) 17.082 16.256 ( 0.262 5.216 14.565) 15.473 16.799 ( 3.410 -8.320 -22.853) 24.558 16.994 ( -5.145 -7.141 13.777) 16.348 17.568 ( -4.483 -5.509 -0.383) 7.113 18.030 ( 13.495 -2.946 -0.808) 13.836 18.628 ( 2.096 -2.633 0.084) 3.366 18.806 ( -0.683 1.401 1.758) 2.350 19.135 ( 3.027 -0.665 -1.445) 3.420 19.975 ( 5.631 0.702 -13.684) 14.814 20.168 ( -6.021 4.247 14.692) 16.436 20.241 ( -9.829 -5.842 -7.861) 13.876 20.842 ( -5.751 -1.702 3.962) 7.188 21.326 ( 13.806 3.663 -4.563) 14.994 21.727 ( -7.869 12.999 4.864) 15.955 ======================= Grid point 139 (74/125) ======================= q-point: ( 0.22 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.176 ( -8.350 2.515 -6.867) 11.100 2.762 ( 15.831 2.131 4.516) 16.600 2.839 ( -6.015 8.138 7.707) 12.720 3.504 ( 0.697 4.953 0.562) 5.033 3.518 ( -2.658 -1.577 2.571) 4.021 3.680 ( 7.627 -6.839 4.534) 11.203 3.813 ( -0.819 3.064 -12.364) 12.765 3.907 ( 5.776 -4.583 -2.236) 7.705 4.142 ( -3.932 6.483 -2.480) 7.978 4.272 ( 7.086 -5.598 5.170) 10.406 4.392 ( -0.827 -4.296 2.893) 5.245 4.522 ( -4.637 3.092 4.340) 7.064 4.646 ( -8.770 -0.596 1.475) 8.913 4.975 ( -5.010 -3.175 2.651) 6.497 5.340 ( 6.584 -1.976 -7.542) 10.205 5.440 ( 5.592 -5.149 -2.597) 8.033 5.646 ( -8.837 7.534 5.493) 12.846 5.776 ( 13.400 -11.544 -2.408) 17.850 6.134 ( -1.898 2.344 3.364) 4.519 6.261 ( 3.491 3.143 2.311) 5.235 6.406 ( 6.380 1.108 -3.920) 7.569 6.417 ( -3.839 3.129 2.826) 5.703 6.697 ( 0.287 4.156 5.974) 7.283 6.815 ( -9.020 7.923 -9.666) 15.413 6.961 ( -6.867 2.336 -2.151) 7.566 7.146 ( 3.266 -0.835 5.363) 6.335 7.507 ( 0.300 1.384 -12.708) 12.787 7.932 ( 2.207 -3.168 8.712) 9.529 8.009 ( -7.059 1.543 0.976) 7.291 8.177 ( 5.935 -7.807 3.669) 10.470 8.405 ( 5.359 2.793 -5.800) 8.376 8.472 ( -5.852 4.266 6.848) 9.967 8.666 ( -3.095 -9.015 1.630) 9.670 8.870 ( 0.203 -2.589 -0.483) 2.642 9.010 ( -5.627 -1.625 0.638) 5.891 9.152 ( -4.985 -6.703 -11.361) 14.102 9.210 ( -1.344 2.059 -8.633) 8.976 9.583 ( 6.922 5.231 -5.247) 10.139 9.704 ( -7.016 -2.950 4.045) 8.619 9.873 ( -2.257 -2.453 2.915) 4.428 10.027 ( 2.861 2.742 0.375) 3.981 10.419 ( 4.230 13.991 7.203) 16.295 10.788 ( 3.465 -1.298 -2.653) 4.553 10.931 ( 1.669 -0.947 -5.713) 6.027 11.338 ( 0.088 -8.038 5.625) 9.811 11.396 ( -1.137 3.241 -0.580) 3.483 11.727 ( 4.811 3.729 2.799) 6.699 11.811 ( -1.255 -8.414 -0.212) 8.510 12.090 ( 0.010 12.541 3.279) 12.963 12.199 ( -3.562 -8.373 1.691) 9.255 12.242 ( -4.026 1.278 -4.008) 5.823 12.730 ( 0.235 -8.288 -2.127) 8.560 13.091 ( -5.343 -5.403 -3.680) 8.443 13.500 ( -1.415 -4.040 3.679) 5.644 13.651 ( 5.490 5.287 -4.052) 8.632 13.805 ( 0.626 1.468 -4.166) 4.461 14.120 ( -1.737 2.886 -6.072) 6.944 14.430 ( -3.878 -4.776 -0.455) 6.169 14.667 ( 2.167 -1.563 3.864) 4.698 14.869 ( -3.065 -3.767 1.193) 5.001 15.600 ( 5.890 17.245 24.540) 30.566 16.054 ( -2.640 -13.361 -10.488) 17.189 16.540 ( -1.280 7.428 -7.534) 10.657 16.975 ( 12.307 13.886 2.360) 18.704 17.457 ( 1.756 -3.748 4.417) 6.053 18.309 ( -2.547 -0.416 -1.680) 3.079 18.491 ( 6.335 1.381 -1.185) 6.591 18.885 ( -11.908 -1.640 -0.591) 12.034 19.193 ( -0.157 -1.874 -1.457) 2.379 19.879 ( 11.758 -8.710 -0.694) 14.649 20.165 ( -0.497 11.230 6.397) 12.934 20.469 ( 4.769 1.920 6.752) 8.487 20.552 ( -1.349 -5.026 1.794) 5.504 21.479 ( 2.573 -7.048 -10.344) 12.779 21.745 ( -12.326 1.716 -0.140) 12.446 ======================= Grid point 140 (75/125) ======================= q-point: ( 0.33 0.67 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.066 ( -3.260 4.598 -6.854) 8.874 2.820 ( -7.860 8.972 0.350) 11.933 3.076 ( 6.915 13.113 2.214) 14.989 3.244 ( -14.352 -11.378 -6.025) 19.281 3.568 ( -1.430 0.020 0.812) 1.645 3.707 ( 4.533 -0.712 12.158) 12.995 3.875 ( 5.907 3.626 -3.543) 7.785 4.053 ( 0.519 4.577 -2.767) 5.373 4.113 ( 7.410 -0.309 0.129) 7.418 4.347 ( -1.284 -5.607 5.878) 8.225 4.409 ( -7.397 -9.398 0.092) 11.960 4.454 ( 10.624 1.013 4.942) 11.761 4.645 ( 0.621 13.260 0.209) 13.276 4.832 ( -7.045 -2.216 -3.474) 8.162 5.216 ( -0.701 -8.584 -0.030) 8.612 5.480 ( -2.782 0.391 5.613) 6.277 5.769 ( 6.787 5.347 -1.252) 8.730 5.913 ( 9.687 -4.482 -0.451) 10.683 6.057 ( -1.869 -5.124 -1.206) 5.586 6.219 ( -8.124 -3.875 2.152) 9.254 6.334 ( 2.260 -3.807 -9.433) 10.420 6.619 ( -4.457 1.409 -5.253) 7.031 6.700 ( -1.405 9.873 3.819) 10.678 6.812 ( 4.775 6.901 5.540) 10.055 6.934 ( 1.096 7.130 -4.628) 8.571 7.205 ( 1.762 -1.682 1.699) 2.970 7.478 ( -2.993 4.188 -7.730) 9.287 7.841 ( -10.126 -6.125 8.347) 14.482 7.974 ( 2.459 0.519 3.124) 4.009 8.172 ( 2.895 -4.657 -1.141) 5.600 8.463 ( -2.171 1.916 3.171) 4.294 8.506 ( 0.888 6.682 -2.209) 7.094 8.619 ( 2.563 -2.846 2.954) 4.837 8.831 ( 2.176 -7.656 -6.669) 10.384 8.856 ( -3.934 -2.981 -0.173) 4.938 9.001 ( -2.620 -4.147 2.239) 5.393 9.226 ( 1.222 3.636 -4.538) 5.942 9.555 ( -4.333 -6.883 -1.928) 8.359 9.745 ( 1.639 5.923 4.415) 7.567 9.821 ( 2.275 -4.287 -5.346) 7.220 10.081 ( 0.462 1.017 -0.020) 1.117 10.547 ( -3.772 8.954 -0.384) 9.724 10.853 ( 2.712 -3.192 1.943) 4.617 10.930 ( 3.005 -2.350 -3.316) 5.054 11.277 ( -0.879 -0.687 5.723) 5.831 11.447 ( 0.854 4.631 0.970) 4.808 11.718 ( 0.005 -5.009 -4.096) 6.471 11.822 ( -4.720 10.610 1.087) 11.663 12.038 ( -1.503 -7.689 -3.538) 8.597 12.159 ( -2.772 -0.827 4.493) 5.343 12.329 ( 11.686 3.582 3.517) 12.718 12.691 ( 4.322 -9.766 -1.241) 10.752 12.892 ( -2.453 -11.472 -1.160) 11.789 13.458 ( -2.817 -0.167 0.476) 2.861 13.738 ( 0.198 4.053 -1.685) 4.394 13.812 ( -2.352 5.709 -3.482) 7.088 14.085 ( -3.788 0.440 -3.082) 4.903 14.357 ( 1.818 -3.454 0.223) 3.910 14.633 ( -1.232 -6.734 2.404) 7.255 14.899 ( 5.255 2.048 3.603) 6.692 15.779 ( -1.715 -7.639 3.230) 8.469 15.969 ( -0.352 9.945 3.728) 10.627 16.644 ( 4.987 12.636 -10.998) 17.478 17.360 ( 5.862 8.472 16.071) 19.089 17.448 ( 6.393 0.496 -5.774) 8.629 18.009 ( -22.990 -1.804 -2.858) 23.238 18.606 ( 3.029 -4.642 -2.131) 5.939 18.796 ( -1.621 8.653 1.383) 8.912 19.136 ( -4.490 3.334 -1.442) 5.775 19.928 ( 4.873 -8.894 -2.282) 10.395 20.308 ( 5.317 3.712 -2.269) 6.871 20.464 ( 1.795 -10.195 20.058) 22.572 20.745 ( 13.225 7.828 -3.313) 15.721 21.291 ( -12.511 -5.454 -7.562) 15.603 21.606 ( 0.456 -6.356 -2.732) 6.933 ======================= Grid point 141 (76/125) ======================= q-point: ( 0.44 0.67 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.096 ( 2.798 1.767 0.722) 3.388 2.698 ( -18.381 12.912 -10.280) 24.703 2.961 ( 4.572 -12.800 -1.090) 13.636 3.299 ( 0.873 17.701 0.348) 17.726 3.523 ( -2.055 -1.729 -0.442) 2.722 3.793 ( -2.948 -1.179 -0.767) 3.266 4.002 ( -6.038 9.753 -1.651) 11.589 4.057 ( 6.986 -1.850 17.882) 19.287 4.168 ( -3.665 -10.846 -4.486) 12.296 4.279 ( 0.672 -1.740 3.658) 4.106 4.342 ( 12.836 -5.194 -3.849) 14.372 4.638 ( 3.978 -5.722 -4.503) 8.297 4.708 ( 1.669 0.750 -2.267) 2.913 4.745 ( -3.048 13.153 1.129) 13.549 5.286 ( 7.790 2.840 11.604) 14.262 5.443 ( -6.465 0.835 6.274) 9.048 5.836 ( 3.379 -8.534 -4.241) 10.111 5.896 ( -0.169 -2.392 -2.480) 3.450 6.028 ( 0.279 -5.520 -8.765) 10.362 6.087 ( -5.962 3.471 2.094) 7.209 6.285 ( 0.753 -3.980 -9.874) 10.672 6.478 ( -6.144 5.475 0.477) 8.244 6.692 ( -6.863 -1.525 9.877) 12.123 7.032 ( 2.490 10.965 -1.163) 11.304 7.082 ( 6.195 0.774 -5.450) 8.287 7.206 ( 5.780 0.419 -3.949) 7.013 7.374 ( -8.427 -2.653 4.547) 9.936 7.658 ( -6.767 -4.452 7.090) 10.765 8.103 ( 8.223 3.164 -0.680) 8.837 8.210 ( 4.189 1.903 -3.900) 6.032 8.465 ( -5.700 -0.081 -0.330) 5.710 8.509 ( -0.131 4.171 2.877) 5.069 8.652 ( 2.005 1.782 -0.181) 2.689 8.812 ( 2.055 2.469 -2.946) 4.359 8.856 ( 4.936 -5.297 4.222) 8.381 8.989 ( 1.413 -1.462 7.167) 7.449 9.268 ( -0.432 4.777 -9.305) 10.469 9.394 ( -3.128 -8.758 4.497) 10.330 9.736 ( -0.257 -3.572 3.144) 4.766 9.878 ( 3.390 1.013 -2.949) 4.606 10.067 ( -1.258 -0.970 -1.997) 2.552 10.490 ( -7.312 3.157 -6.666) 10.386 10.783 ( -2.897 -9.006 2.908) 9.898 10.940 ( -0.443 1.056 -2.633) 2.871 11.377 ( 3.955 3.432 6.948) 8.700 11.480 ( -2.121 4.711 0.747) 5.220 11.731 ( 5.183 2.245 -0.626) 5.683 11.794 ( -7.213 6.904 -2.014) 10.186 11.947 ( 2.840 -8.819 -4.259) 10.198 12.170 ( 1.327 1.009 1.602) 2.312 12.557 ( -3.387 -10.227 1.410) 10.865 12.592 ( 10.335 2.807 4.380) 11.570 12.924 ( 13.076 -6.896 1.118) 14.826 13.391 ( -4.835 0.666 -1.118) 5.007 13.722 ( -4.500 0.724 2.090) 5.015 13.799 ( -5.489 7.023 -0.632) 8.936 14.012 ( -0.485 -2.003 -3.463) 4.030 14.393 ( 1.687 0.899 2.055) 2.807 14.586 ( 3.910 -6.061 -1.731) 7.417 15.034 ( 4.032 1.651 5.451) 6.978 15.683 ( 2.297 -5.157 -10.582) 11.994 16.017 ( -5.492 4.333 7.632) 10.353 16.788 ( -2.494 12.934 -12.231) 17.975 17.279 ( -1.040 -17.308 18.164) 25.111 17.588 ( -24.990 7.677 -6.386) 26.911 17.808 ( 13.670 13.174 -1.973) 19.087 18.622 ( 7.773 -5.726 2.336) 9.933 18.777 ( -10.658 8.049 -2.410) 13.572 19.161 ( 2.269 1.911 -0.239) 2.976 19.900 ( 1.164 -1.795 -2.450) 3.253 20.301 ( 1.389 -8.186 -7.555) 11.225 20.618 ( 11.201 -6.183 19.144) 23.025 20.942 ( -17.109 -3.626 -5.742) 18.407 21.014 ( 9.444 7.013 -2.699) 12.069 21.589 ( 4.674 -4.539 -1.157) 6.617 ======================= Grid point 142 (77/125) ======================= q-point: (-0.44 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.154 ( 5.535 -8.488 9.724) 14.044 2.479 ( -16.291 13.365 -4.823) 21.617 3.075 ( 16.111 -2.635 -8.048) 18.201 3.380 ( -2.989 -3.233 1.289) 4.588 3.551 ( 1.047 9.827 -3.042) 10.340 3.616 ( -7.497 -4.981 -2.195) 9.265 3.933 ( -2.416 -8.992 -2.182) 9.564 4.040 ( -3.585 11.514 -5.038) 13.069 4.128 ( -0.839 -10.001 7.865) 12.751 4.356 ( 4.604 -2.221 -1.692) 5.385 4.486 ( 3.274 4.668 -3.624) 6.756 4.610 ( -2.968 -2.257 -4.843) 6.112 4.687 ( 8.800 -2.462 10.216) 13.706 4.944 ( 5.989 6.546 2.950) 9.350 5.241 ( -12.253 -4.231 -4.811) 13.827 5.491 ( 2.864 -0.720 6.073) 6.753 5.755 ( -1.527 -3.461 1.220) 3.975 5.910 ( -0.492 -1.652 3.982) 4.339 5.971 ( 2.392 0.652 -6.131) 6.614 6.026 ( -2.162 -0.913 3.004) 3.812 6.250 ( 4.320 3.812 -11.892) 13.215 6.485 ( -1.766 0.818 1.494) 2.453 6.631 ( -3.473 5.317 8.105) 10.297 6.922 ( -9.464 -5.012 -1.114) 10.767 7.131 ( -2.457 2.586 -2.431) 4.317 7.295 ( 1.313 -0.954 -2.831) 3.264 7.367 ( 3.830 3.552 -1.177) 5.355 7.614 ( 5.189 -3.571 7.911) 10.112 8.226 ( 2.466 1.447 -8.922) 9.369 8.292 ( -3.338 -5.194 4.879) 7.869 8.322 ( -1.557 7.577 -1.793) 7.941 8.572 ( 1.291 1.179 -1.364) 2.217 8.783 ( 5.065 10.356 2.329) 11.761 8.845 ( 0.959 -4.633 4.856) 6.780 8.926 ( 2.944 -0.195 6.327) 6.981 9.050 ( 1.000 3.914 4.888) 6.341 9.118 ( -6.726 -6.923 -5.072) 10.904 9.408 ( 0.837 3.246 1.900) 3.853 9.788 ( 8.435 -1.606 0.690) 8.615 9.889 ( -2.499 0.881 2.403) 3.577 10.036 ( 1.697 -1.406 -3.144) 3.839 10.342 ( -5.675 -0.537 -9.833) 11.366 10.661 ( -3.197 -5.380 4.673) 7.811 10.913 ( -2.525 1.631 -2.812) 4.116 11.389 ( -1.924 -1.473 2.358) 3.381 11.570 ( 2.516 1.534 1.959) 3.539 11.687 ( -4.362 -4.951 0.264) 6.604 11.867 ( 2.725 5.824 -2.911) 7.058 11.993 ( 9.520 1.233 0.011) 9.600 12.204 ( -1.553 5.967 -2.625) 6.701 12.404 ( -3.615 -6.898 0.418) 7.799 12.807 ( 7.265 2.879 2.154) 8.106 13.072 ( 5.453 -1.508 3.059) 6.432 13.318 ( -2.051 -1.026 1.283) 2.628 13.641 ( -4.718 -2.054 4.363) 6.746 13.773 ( -2.784 2.851 0.228) 3.991 14.002 ( 0.645 0.746 -1.484) 1.781 14.433 ( -0.420 3.105 3.391) 4.617 14.631 ( 7.886 -4.255 -4.665) 10.102 15.078 ( -1.988 -0.203 3.688) 4.195 15.655 ( 2.766 0.594 -17.263) 17.493 16.017 ( 1.261 -0.236 9.437) 9.524 16.665 ( -8.934 -0.486 -3.117) 9.475 17.202 ( -23.555 5.155 -3.608) 24.381 17.292 ( 5.610 -6.350 6.703) 10.804 18.083 ( 10.512 0.939 -3.943) 11.266 18.618 ( -10.666 1.691 1.077) 10.853 18.822 ( 11.740 4.938 2.129) 12.913 19.151 ( 0.712 -9.299 1.150) 9.397 19.951 ( 2.400 7.078 -3.809) 8.389 20.162 ( -1.809 -10.345 -9.410) 14.101 20.624 ( -12.718 0.185 -1.232) 12.779 20.796 ( 7.047 -6.344 7.410) 12.034 21.184 ( 5.382 3.312 -0.575) 6.346 21.674 ( 3.691 5.727 3.903) 7.852 ======================= Grid point 143 (78/125) ======================= q-point: (-0.33 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.207 ( 8.854 -16.709 5.848) 19.794 2.386 ( -7.641 13.767 5.546) 16.694 3.162 ( 0.135 -13.399 -11.576) 17.708 3.398 ( 12.929 -0.516 1.542) 13.031 3.440 ( -1.322 -2.287 1.253) 2.924 3.668 ( -1.784 5.694 0.278) 5.974 3.761 ( -3.868 -10.000 -7.209) 12.921 3.995 ( -3.947 -8.678 -2.402) 9.831 4.117 ( -0.303 5.056 -5.170) 7.238 4.292 ( -4.024 0.958 -3.104) 5.172 4.485 ( 0.992 -0.421 -3.385) 3.552 4.643 ( 2.787 4.193 -1.592) 5.281 4.844 ( -3.499 -3.742 5.873) 7.794 4.964 ( 0.557 -3.974 6.789) 7.886 5.150 ( 5.022 4.142 -0.633) 6.540 5.330 ( -7.875 -12.424 -3.722) 15.173 5.739 ( -3.182 2.350 -0.865) 4.049 5.899 ( -3.517 4.811 -3.025) 6.683 6.027 ( 4.423 -0.530 0.932) 4.551 6.115 ( 8.044 5.336 9.329) 13.424 6.320 ( -1.261 2.830 0.509) 3.140 6.485 ( 4.974 -0.577 -7.414) 8.947 6.703 ( -3.907 -0.230 12.183) 12.797 6.818 ( 4.186 8.376 -2.448) 9.679 7.072 ( -2.655 0.135 -3.035) 4.035 7.268 ( -2.103 -0.406 -4.764) 5.224 7.399 ( -3.463 5.968 0.412) 6.912 7.765 ( 8.050 -7.540 5.535) 12.340 8.078 ( -4.243 -2.524 0.422) 4.955 8.283 ( 0.605 -2.718 -5.551) 6.210 8.353 ( -1.802 0.326 -3.787) 4.206 8.596 ( 2.159 1.909 -1.156) 3.105 8.784 ( -5.050 -3.641 5.411) 8.249 8.881 ( -4.936 0.594 6.157) 7.913 8.957 ( -4.888 -1.167 7.441) 8.979 9.063 ( 6.532 6.557 -0.008) 9.255 9.136 ( 0.193 9.845 0.184) 9.848 9.426 ( -1.304 -2.007 2.474) 3.442 9.884 ( -1.501 5.344 2.236) 5.984 9.925 ( 5.226 -0.254 -2.402) 5.757 10.008 ( -4.059 -0.619 0.142) 4.109 10.335 ( 12.523 -0.556 -8.731) 15.276 10.629 ( -0.127 -0.092 7.353) 7.355 10.880 ( -1.672 1.947 -2.568) 3.631 11.370 ( 0.090 -0.037 0.994) 0.998 11.479 ( -5.679 -8.283 -0.773) 10.072 11.632 ( 3.264 -7.590 -1.723) 8.440 11.922 ( -1.890 1.709 0.552) 2.607 12.162 ( 4.272 -0.056 1.990) 4.713 12.243 ( -1.231 15.021 -7.037) 16.634 12.300 ( -3.699 -0.159 0.207) 3.708 12.878 ( -3.963 4.824 -1.179) 6.354 13.100 ( -1.978 1.852 1.639) 3.167 13.337 ( 4.943 -4.697 7.378) 10.047 13.574 ( -1.399 -3.177 2.427) 4.236 13.748 ( -1.717 -0.993 0.076) 1.985 14.034 ( 1.204 2.641 1.578) 3.304 14.475 ( -1.182 4.583 3.545) 5.914 14.700 ( 5.413 -1.530 -6.733) 8.773 15.009 ( -7.269 1.248 2.687) 7.850 15.698 ( 11.509 -0.362 -15.072) 18.967 16.060 ( -4.088 -0.388 7.839) 8.849 16.631 ( 7.751 -1.489 2.415) 8.254 16.837 ( -16.987 3.980 -11.011) 20.631 17.350 ( 5.342 -9.182 7.172) 12.818 18.157 ( 6.444 -11.101 -6.042) 14.187 18.441 ( -6.913 -6.677 2.870) 10.031 19.003 ( -0.587 -6.056 9.555) 11.328 19.125 ( 3.812 6.148 -3.554) 8.059 19.882 ( -1.082 -12.376 -9.859) 15.860 20.202 ( 9.288 11.086 -5.219) 15.375 20.467 ( -8.138 5.564 -3.517) 10.467 20.807 ( -1.814 -3.846 0.737) 4.315 21.271 ( 1.813 -0.229 3.693) 4.120 21.839 ( 0.098 14.133 7.290) 15.903 ======================= Grid point 144 (79/125) ======================= q-point: (-0.22 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.164 ( 1.538 -8.140 2.231) 8.579 2.514 ( 12.140 -9.555 4.979) 16.232 2.949 ( 0.602 -14.917 -4.444) 15.577 3.454 ( -8.801 -2.730 -0.335) 9.221 3.557 ( 4.059 -2.985 -8.152) 9.584 3.592 ( 3.180 -1.627 -1.984) 4.086 3.657 ( 1.951 2.230 4.546) 5.426 3.865 ( 1.015 -7.135 0.846) 7.256 4.066 ( 2.891 -5.638 -8.623) 10.700 4.351 ( 0.184 6.251 1.212) 6.370 4.423 ( -5.200 -0.138 -5.456) 7.538 4.636 ( -9.900 3.003 -2.925) 10.751 4.709 ( 4.249 -13.214 -1.254) 13.937 5.029 ( -4.886 -1.024 10.708) 11.814 5.080 ( -1.299 2.519 1.437) 3.178 5.328 ( 7.032 4.618 -1.192) 8.497 5.650 ( -5.698 -0.288 -6.872) 8.932 5.921 ( 1.033 3.364 -3.691) 5.099 6.091 ( 1.537 1.369 1.880) 2.787 6.253 ( 4.555 -4.705 2.225) 6.916 6.442 ( 3.431 12.279 2.540) 13.000 6.556 ( 4.650 2.341 -2.649) 5.842 6.657 ( -1.631 -1.481 11.749) 11.954 7.008 ( -3.618 -1.003 0.158) 3.758 7.066 ( 7.773 7.655 -1.518) 11.015 7.193 ( -3.343 4.189 -3.215) 6.250 7.419 ( -1.253 4.760 -1.916) 5.282 7.643 ( -4.420 -14.652 5.630) 16.307 8.120 ( -6.458 -6.308 -6.072) 10.879 8.184 ( 3.452 2.855 -1.186) 4.634 8.311 ( 5.155 -4.059 -0.940) 6.628 8.633 ( -8.636 -1.496 7.636) 11.624 8.714 ( 2.590 6.817 -2.411) 7.681 8.830 ( -3.473 2.544 5.302) 6.829 8.911 ( -3.930 1.785 7.276) 8.460 9.161 ( -3.743 7.137 4.116) 9.049 9.264 ( -0.951 4.339 -6.572) 7.933 9.397 ( 7.592 -3.957 5.044) 9.937 9.775 ( -9.901 2.576 -1.547) 10.347 9.990 ( 3.059 -3.755 -1.277) 5.009 10.089 ( 2.782 10.790 3.977) 11.831 10.519 ( 10.745 -6.682 -3.633) 13.165 10.710 ( 2.452 5.958 5.532) 8.492 10.872 ( -0.686 3.476 -4.957) 6.093 11.283 ( -6.542 -6.723 -1.365) 9.480 11.385 ( 1.497 -2.079 0.078) 2.563 11.604 ( 4.726 -9.004 -0.782) 10.199 11.857 ( -4.176 2.753 -3.392) 6.044 12.133 ( -1.927 -5.912 2.937) 6.877 12.234 ( -8.296 3.221 0.000) 8.900 12.437 ( 6.098 16.121 -4.099) 17.716 12.809 ( -10.177 9.876 0.208) 14.183 13.091 ( -2.904 4.137 1.746) 5.347 13.432 ( 6.891 -5.035 9.073) 12.456 13.526 ( 0.790 -5.638 -5.634) 8.010 13.715 ( 0.788 -2.570 2.290) 3.531 14.106 ( 2.951 1.803 3.582) 4.979 14.488 ( -5.117 5.905 2.336) 8.155 14.722 ( -0.541 1.989 -5.945) 6.292 14.920 ( -5.404 4.006 1.588) 6.911 15.798 ( -5.778 -7.719 1.582) 9.771 16.003 ( 9.630 2.168 -8.571) 13.073 16.630 ( -3.957 2.505 -7.270) 8.648 16.856 ( 14.818 -6.744 0.805) 16.300 17.379 ( 5.593 -4.332 1.719) 7.280 18.040 ( -2.042 -17.050 4.431) 17.734 18.321 ( 5.222 -13.368 -2.019) 14.493 18.953 ( 0.570 -6.542 9.090) 11.214 19.104 ( -7.666 -3.718 -1.544) 8.659 19.816 ( 6.067 1.080 -16.306) 17.431 20.376 ( -6.498 7.278 2.489) 10.069 20.531 ( 11.921 9.935 -6.262) 16.733 20.688 ( -6.832 1.345 -3.823) 7.944 21.264 ( -3.590 -1.553 5.100) 6.428 21.991 ( -4.776 16.922 7.634) 19.168 ======================= Grid point 145 (80/125) ======================= q-point: (-0.11 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.152 ( 3.244 -7.712 7.868) 11.485 2.530 ( 14.825 -26.835 -8.012) 31.688 2.983 ( 11.251 -4.683 3.267) 12.617 3.169 ( -15.127 3.605 -8.582) 17.761 3.488 ( 5.802 -12.400 -8.678) 16.209 3.715 ( -0.164 3.224 7.681) 8.332 3.746 ( 0.857 1.377 6.215) 6.423 3.876 ( 7.570 -8.789 -0.278) 11.604 4.119 ( 6.045 3.435 -3.753) 7.901 4.219 ( -1.312 -6.790 -4.559) 8.283 4.455 ( -5.884 8.799 -3.534) 11.160 4.497 ( -1.886 -0.864 0.754) 2.207 4.566 ( -3.162 -10.052 2.977) 10.950 5.061 ( -1.161 10.559 -0.137) 10.624 5.141 ( 4.270 -4.674 7.150) 9.550 5.486 ( -6.954 6.264 -2.007) 9.572 5.544 ( 8.511 2.917 -5.563) 10.578 5.894 ( -2.925 -4.864 0.750) 5.725 6.146 ( 1.115 3.221 -0.133) 3.411 6.281 ( 2.839 -1.120 -5.912) 6.653 6.474 ( -7.310 2.317 -0.224) 7.671 6.595 ( -1.217 2.913 -5.942) 6.728 6.812 ( 1.923 8.427 6.873) 11.043 6.945 ( -1.716 -1.750 8.003) 8.370 7.021 ( -3.516 -9.785 11.045) 15.169 7.275 ( -7.280 1.833 -1.242) 7.609 7.445 ( 11.400 7.057 -6.941) 15.098 7.592 ( 5.661 -4.425 -0.339) 7.193 7.941 ( -4.119 -2.893 -0.885) 5.111 8.093 ( -5.381 -5.153 -0.602) 7.475 8.441 ( -1.992 -4.562 2.766) 5.695 8.556 ( 4.504 6.972 2.342) 8.624 8.778 ( -4.068 4.688 7.325) 9.601 8.901 ( -2.118 2.514 5.530) 6.433 8.953 ( 8.875 9.468 -3.599) 13.467 9.086 ( -8.241 4.023 -2.816) 9.593 9.267 ( 1.447 1.121 1.983) 2.699 9.573 ( 4.559 1.165 6.249) 7.822 9.661 ( -3.102 3.549 -4.491) 6.510 9.961 ( 0.297 -6.582 0.271) 6.594 10.199 ( -4.657 9.101 1.164) 10.289 10.476 ( -3.454 -12.312 0.135) 12.788 10.786 ( -0.965 3.190 -4.087) 5.274 10.898 ( 0.848 6.729 -8.397) 10.794 11.190 ( 1.546 -0.370 3.592) 3.928 11.365 ( 1.216 -5.704 0.225) 5.836 11.639 ( 7.636 -7.715 3.517) 11.411 11.829 ( 0.474 0.398 -8.434) 8.457 12.049 ( -4.905 -1.408 7.888) 9.395 12.145 ( -3.415 4.741 -2.114) 6.214 12.591 ( -5.739 4.685 2.081) 7.696 12.828 ( -0.143 18.184 1.307) 18.232 13.097 ( -5.275 9.401 1.540) 10.889 13.422 ( -1.418 -3.041 -5.846) 6.741 13.566 ( 10.432 -7.958 2.660) 13.388 13.744 ( 4.400 -4.428 2.389) 6.684 14.195 ( 4.470 -0.216 5.926) 7.426 14.446 ( -7.311 8.592 -3.414) 11.787 14.668 ( -6.325 4.041 -2.110) 7.797 14.936 ( -0.193 5.950 1.783) 6.215 15.465 ( -14.032 -13.446 -1.773) 19.515 16.260 ( 13.436 4.060 -1.985) 14.175 16.570 ( 0.192 -6.841 -6.548) 9.471 16.975 ( 5.960 -6.537 5.311) 10.318 17.459 ( 6.441 -3.283 -11.472) 13.560 17.864 ( -1.804 -13.828 11.581) 18.127 18.329 ( 14.201 -16.556 -0.800) 21.827 18.921 ( -2.171 -8.661 1.143) 9.002 18.995 ( 4.888 -0.305 5.425) 7.309 19.860 ( 2.336 4.529 -21.641) 22.233 20.332 ( -7.495 2.018 5.628) 9.587 20.461 ( -12.353 6.247 -0.456) 13.850 20.874 ( 7.449 7.996 -5.841) 12.391 21.199 ( -0.653 -0.863 3.707) 3.861 22.064 ( -9.402 16.421 5.906) 19.822 ======================= Grid point 148 (81/125) ======================= q-point: ( 0.22 -0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.210 ( 11.888 1.887 -3.964) 12.673 2.476 ( 14.535 -5.989 11.009) 19.192 2.915 ( 7.072 0.142 -0.151) 7.075 3.349 ( -1.367 -12.036 9.827) 15.598 3.504 ( 14.231 -0.611 -1.209) 14.295 3.628 ( -2.655 12.316 -2.902) 12.929 3.777 ( -0.026 2.372 -10.840) 11.096 3.898 ( 4.079 -1.507 -4.149) 6.010 3.960 ( 9.116 -2.251 7.964) 12.313 4.350 ( 0.868 -7.967 1.557) 8.164 4.406 ( -10.059 4.733 -2.599) 11.416 4.576 ( -1.358 -6.340 4.924) 8.141 4.716 ( 6.341 -1.771 -2.461) 7.029 5.021 ( -5.754 -5.931 5.336) 9.836 5.228 ( 3.351 -1.965 -14.859) 15.358 5.278 ( 2.078 11.866 6.828) 13.847 5.601 ( -3.925 -8.061 1.477) 9.087 5.885 ( -6.830 3.689 2.057) 8.030 6.102 ( 3.571 3.379 0.980) 5.013 6.256 ( 1.341 -4.513 -0.128) 4.710 6.407 ( 0.652 5.147 8.779) 10.198 6.541 ( -4.417 5.202 -0.754) 6.866 6.756 ( -2.164 5.587 -4.435) 7.455 7.017 ( -1.178 -1.342 -0.161) 1.793 7.073 ( -10.262 10.571 -0.660) 14.748 7.172 ( -2.623 0.740 -1.606) 3.164 7.450 ( -0.628 -1.841 -6.909) 7.178 7.667 ( 15.173 -11.994 1.351) 19.388 8.033 ( 3.145 -5.785 7.411) 9.914 8.171 ( -4.539 0.837 0.679) 4.665 8.318 ( 7.014 6.910 -2.449) 10.146 8.662 ( -6.651 5.122 4.651) 9.597 8.693 ( -6.616 -6.133 -2.823) 9.453 8.890 ( -3.978 -0.102 -3.386) 5.224 9.057 ( -4.453 -5.804 -10.859) 13.093 9.164 ( -4.704 -2.987 3.293) 6.472 9.254 ( -5.654 1.734 -7.392) 9.466 9.460 ( 8.595 4.820 -4.799) 10.960 9.764 ( -7.683 -7.580 0.079) 10.793 9.981 ( 5.278 2.426 0.051) 5.809 10.078 ( -10.215 6.555 6.852) 13.938 10.438 ( 10.088 9.517 8.003) 16.012 10.777 ( -4.368 2.750 -4.604) 6.917 10.859 ( 0.512 -3.773 -2.910) 4.792 11.260 ( 1.470 -6.090 2.144) 6.622 11.401 ( 2.530 -0.625 -2.155) 3.381 11.593 ( 8.953 1.784 0.605) 9.149 11.797 ( -2.290 -4.986 5.793) 7.979 12.145 ( 1.631 -1.376 2.889) 3.592 12.241 ( -1.700 -2.711 -3.490) 4.735 12.426 ( -13.566 10.766 -1.529) 17.386 12.815 ( -13.809 -2.099 -0.769) 13.988 13.131 ( -4.924 -0.902 -4.375) 6.649 13.441 ( 6.162 -5.448 7.080) 10.852 13.540 ( 6.734 2.490 -7.179) 10.153 13.752 ( 3.815 -0.300 -3.152) 4.958 14.165 ( -2.093 3.292 -6.035) 7.186 14.495 ( -8.035 -3.464 1.384) 8.859 14.663 ( -1.334 1.501 3.384) 3.935 14.936 ( -7.485 -1.862 -1.045) 7.784 15.760 ( 10.546 21.407 19.841) 31.035 15.883 ( -0.562 -19.701 -3.887) 20.088 16.603 ( -3.959 0.266 -2.551) 4.717 16.885 ( 12.770 9.767 -2.049) 16.207 17.362 ( 5.141 -2.718 3.708) 6.897 18.092 ( 19.089 -0.933 -3.780) 19.482 18.317 ( 10.349 -6.820 -1.163) 12.449 19.028 ( 15.224 -4.128 -0.279) 15.776 19.128 ( -16.443 -6.527 -7.248) 19.119 19.634 ( 9.908 1.052 10.321) 14.345 20.402 ( -8.195 11.045 3.431) 14.175 20.465 ( -0.777 3.869 1.551) 4.240 20.626 ( -9.013 -3.723 4.156) 10.600 21.336 ( 1.192 -4.778 -6.097) 7.838 22.056 ( -17.786 4.356 -2.496) 18.481 ======================= Grid point 149 (82/125) ======================= q-point: ( 0.33 -0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.169 ( -5.579 3.230 -7.604) 9.969 2.906 ( 12.985 -0.408 20.155) 23.979 3.040 ( 4.493 8.793 -3.859) 10.602 3.231 ( 2.117 -14.016 -2.059) 14.324 3.558 ( -4.474 -3.205 -2.403) 6.005 3.675 ( 4.204 1.739 -3.031) 5.467 3.813 ( 6.588 0.066 -6.909) 9.546 3.912 ( -1.217 9.890 5.270) 11.272 4.199 ( 13.854 -1.828 5.791) 15.127 4.297 ( -5.490 3.713 -1.373) 6.768 4.323 ( 0.280 -6.093 2.760) 6.695 4.436 ( -5.041 -6.395 -2.821) 8.618 4.809 ( -10.211 5.621 2.526) 11.927 4.936 ( 9.991 -3.576 3.157) 11.072 5.138 ( -5.441 1.872 -9.657) 11.241 5.409 ( 1.733 -4.545 -6.119) 7.816 5.620 ( 14.043 -0.309 9.709) 17.075 5.853 ( -5.297 5.409 4.338) 8.726 6.139 ( -1.525 -4.599 0.701) 4.895 6.187 ( -5.538 -3.128 0.782) 6.408 6.415 ( -8.237 -1.248 1.759) 8.514 6.564 ( 7.456 5.988 0.260) 9.567 6.771 ( 0.534 2.022 -7.292) 7.586 6.917 ( -4.922 2.190 -1.435) 5.576 7.058 ( -7.238 7.740 2.219) 10.827 7.191 ( 2.505 2.657 1.437) 3.924 7.469 ( 4.513 2.810 -6.262) 8.214 7.801 ( 11.699 -7.521 -3.874) 14.437 7.970 ( -6.482 -8.700 5.876) 12.338 8.113 ( -0.997 -0.957 3.176) 3.464 8.485 ( 3.445 4.458 -0.667) 5.673 8.501 ( -2.092 -4.661 1.233) 5.255 8.703 ( -2.084 10.073 2.480) 10.581 8.759 ( -6.245 -2.863 -5.647) 8.893 8.887 ( -4.084 -2.403 -7.871) 9.188 9.047 ( -3.813 -4.534 3.130) 6.700 9.234 ( 0.401 4.216 -0.722) 4.296 9.558 ( -5.618 -6.476 -2.315) 8.880 9.654 ( 6.688 4.715 -5.464) 9.840 9.954 ( -9.609 1.757 6.057) 11.494 10.077 ( 1.995 1.865 0.160) 2.735 10.700 ( -4.342 5.362 -0.298) 6.906 10.737 ( 12.247 -1.214 1.804) 12.439 10.797 ( -1.410 -7.171 1.534) 7.468 11.257 ( 3.278 -1.316 -1.209) 3.733 11.476 ( 4.913 3.065 -1.117) 5.897 11.682 ( -4.599 -0.708 4.099) 6.201 11.835 ( 10.761 3.111 0.594) 11.217 12.034 ( -8.063 -7.469 -1.046) 11.040 12.187 ( 1.089 -3.511 -2.023) 4.195 12.430 ( -5.113 17.253 2.097) 18.117 12.555 ( -6.679 -7.014 -2.778) 10.076 12.938 ( -10.937 -6.266 -1.340) 12.676 13.466 ( 1.048 -2.206 2.403) 3.426 13.708 ( 6.784 3.469 -2.180) 7.925 13.819 ( 3.955 3.582 -3.759) 6.527 14.172 ( -2.898 4.023 -2.980) 5.785 14.325 ( -4.041 -4.885 2.723) 6.900 14.625 ( -3.152 -4.956 1.415) 6.041 14.873 ( 1.073 2.894 1.012) 3.248 15.681 ( -0.306 -15.091 -2.578) 15.313 16.134 ( 1.475 15.110 9.150) 17.726 16.612 ( 4.694 4.651 0.739) 6.649 17.224 ( 14.354 2.324 -9.747) 17.506 17.428 ( 2.218 3.933 11.625) 12.471 18.147 ( 2.441 -9.729 -7.678) 12.632 18.541 ( 1.825 3.291 0.425) 3.787 18.840 ( -1.048 -0.348 -0.239) 1.130 19.152 ( 2.440 -3.761 0.944) 4.581 19.804 ( 4.922 0.927 5.919) 7.753 20.311 ( -4.170 1.174 -9.918) 10.823 20.419 ( -1.754 -12.176 11.005) 16.506 20.701 ( 4.062 15.384 4.969) 16.669 21.264 ( 0.405 -6.042 -5.645) 8.278 21.759 ( -16.865 0.578 -2.836) 17.111 ======================= Grid point 150 (83/125) ======================= q-point: ( 0.44 -0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.132 ( -1.935 4.738 -0.425) 5.136 2.794 ( -3.767 -16.858 5.214) 18.043 3.048 ( -12.278 5.190 -7.382) 15.238 3.389 ( 6.054 10.713 -1.295) 12.373 3.534 ( 1.316 0.463 4.467) 4.680 3.746 ( 7.516 -1.497 -1.180) 7.754 3.886 ( 5.755 -4.499 1.323) 7.424 4.090 ( -0.913 -7.632 -1.871) 7.911 4.164 ( 2.412 0.848 5.323) 5.906 4.244 ( -5.361 9.522 -3.661) 11.525 4.263 ( -0.468 -6.369 2.204) 6.756 4.476 ( 8.155 -1.814 -4.101) 9.307 4.690 ( -3.228 -1.159 0.311) 3.444 5.000 ( -10.886 10.747 -1.647) 15.386 5.203 ( 12.686 4.824 5.867) 14.786 5.430 ( 10.370 -4.590 -3.842) 11.974 5.754 ( -12.457 -3.279 0.077) 12.882 5.873 ( 4.214 -0.541 0.870) 4.337 5.914 ( -2.601 -8.659 0.217) 9.044 6.183 ( 2.762 0.922 -2.052) 3.563 6.305 ( -7.683 1.860 4.325) 9.011 6.605 ( -3.372 2.184 -6.176) 7.368 6.732 ( 0.311 -7.642 2.108) 7.933 7.013 ( 6.434 6.345 -0.092) 9.037 7.065 ( 1.766 6.534 1.990) 7.055 7.196 ( -3.401 -0.548 -0.842) 3.546 7.527 ( -5.883 4.398 -1.060) 7.422 7.769 ( -8.211 -6.146 9.171) 13.759 7.918 ( 11.161 -1.680 -8.136) 13.914 8.135 ( 3.665 0.797 -0.135) 3.753 8.450 ( 2.128 -2.753 -0.321) 3.494 8.570 ( -2.005 -0.019 -0.501) 2.066 8.659 ( 2.126 0.916 0.419) 2.353 8.795 ( -2.142 1.105 4.048) 4.711 8.807 ( 0.842 7.595 -6.273) 9.886 9.015 ( 0.958 0.521 3.569) 3.732 9.302 ( -0.410 5.520 -5.706) 7.950 9.395 ( -3.709 -5.307 8.885) 10.993 9.719 ( -0.170 -0.159 -7.964) 7.968 9.875 ( -2.303 0.815 4.751) 5.343 10.092 ( -1.327 0.488 -0.215) 1.430 10.639 ( -8.516 3.284 -4.128) 10.018 10.687 ( 1.680 -13.146 5.771) 14.455 10.904 ( 5.420 1.302 -2.723) 6.204 11.341 ( 4.904 1.972 0.420) 5.302 11.601 ( 2.214 -4.891 0.733) 5.419 11.612 ( -1.348 9.133 0.740) 9.261 11.842 ( -3.413 -5.387 -0.995) 6.454 12.033 ( -1.107 -10.823 -0.185) 10.881 12.098 ( 0.476 13.380 -0.170) 13.390 12.530 ( 7.835 0.064 1.732) 8.025 12.562 ( 2.060 5.295 -1.538) 5.886 12.705 ( -4.945 -1.802 -0.075) 5.264 13.444 ( -2.205 -1.877 0.115) 2.898 13.781 ( -0.597 -0.248 2.320) 2.409 13.911 ( 2.699 5.430 -2.778) 6.670 14.048 ( -8.917 -0.768 -0.306) 8.955 14.348 ( 4.447 1.181 0.482) 4.627 14.525 ( -2.153 -3.788 0.115) 4.359 14.977 ( 5.267 2.023 0.842) 5.705 15.568 ( 1.831 -7.918 -0.266) 8.131 16.185 ( -5.866 3.660 -2.068) 7.216 16.818 ( 6.966 7.800 3.214) 10.940 17.193 ( -1.769 -14.718 -1.037) 14.860 17.661 ( 7.819 2.743 -0.920) 8.337 18.017 ( -10.188 4.210 0.360) 11.029 18.463 ( -0.223 2.210 0.103) 2.224 19.022 ( 8.757 1.067 -0.712) 8.851 19.040 ( -9.286 -5.466 0.641) 10.794 19.908 ( 1.692 6.596 2.774) 7.353 20.192 ( -1.739 -5.745 -10.541) 12.130 20.416 ( 8.980 -10.424 10.821) 17.504 20.897 ( 4.356 2.194 -4.927) 6.933 21.194 ( -7.509 5.274 2.145) 9.423 21.549 ( -3.306 1.760 -0.247) 3.753 ======================= Grid point 151 (84/125) ======================= q-point: (-0.44 -0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.106 ( -4.318 -8.903 15.864) 18.697 2.709 ( 6.709 -7.730 -3.037) 10.677 2.889 ( -8.934 13.111 -10.096) 18.805 3.330 ( -3.768 -14.224 -1.273) 14.769 3.627 ( -3.888 3.718 0.931) 5.459 3.747 ( -3.935 6.473 -0.399) 7.586 3.847 ( -2.576 -11.525 -7.464) 13.970 4.063 ( 4.576 -8.580 10.891) 14.600 4.150 ( 9.531 -5.831 -2.035) 11.357 4.206 ( -4.290 8.348 -3.806) 10.128 4.444 ( 2.375 3.097 -5.420) 6.679 4.568 ( 9.109 4.195 2.905) 10.441 4.628 ( -2.730 -0.807 -0.950) 3.001 5.000 ( -0.860 8.490 3.622) 9.271 5.327 ( -11.857 -19.072 -3.914) 22.796 5.465 ( 0.780 4.885 -3.354) 5.977 5.666 ( 16.991 2.850 -2.072) 17.353 5.823 ( 2.427 -2.979 1.333) 4.067 5.913 ( -1.215 0.960 2.867) 3.258 6.196 ( -6.830 1.921 2.691) 7.588 6.198 ( -3.773 1.162 -2.180) 4.509 6.554 ( -2.356 0.137 -6.658) 7.064 6.736 ( 2.095 0.959 12.629) 12.838 7.045 ( -6.203 -0.446 1.570) 6.414 7.202 ( 6.067 3.964 -3.674) 8.125 7.235 ( 5.595 3.739 -0.211) 6.733 7.305 ( -12.474 -5.730 3.585) 14.188 7.660 ( -5.652 -0.293 5.393) 7.817 8.079 ( 10.090 -0.502 -8.141) 12.974 8.220 ( 3.802 -2.631 -3.368) 5.720 8.441 ( -2.418 4.918 -4.034) 6.805 8.567 ( 1.766 0.102 1.936) 2.623 8.766 ( 3.877 3.894 3.176) 6.347 8.808 ( 3.853 2.706 2.212) 5.202 8.898 ( 3.532 0.027 3.198) 4.765 9.091 ( 2.190 5.083 -0.517) 5.559 9.170 ( -7.722 -0.074 -3.667) 8.549 9.496 ( -0.206 8.864 12.121) 15.018 9.673 ( 2.391 -2.452 -1.881) 3.908 9.886 ( 2.961 -1.735 -2.632) 4.325 10.047 ( -4.687 0.660 1.502) 4.966 10.448 ( -10.299 -1.946 -4.427) 11.378 10.633 ( 0.478 -6.244 4.666) 7.809 10.951 ( 0.263 2.413 -5.538) 6.046 11.391 ( 0.780 -3.282 1.712) 3.783 11.545 ( -1.426 -2.370 -2.345) 3.626 11.656 ( -0.896 -5.723 1.118) 5.900 11.848 ( 3.038 -1.066 1.402) 3.512 11.920 ( 2.985 2.651 0.291) 4.003 12.265 ( 1.795 9.855 -4.758) 11.090 12.473 ( -6.139 2.837 -0.589) 6.789 12.735 ( 9.368 4.463 4.131) 11.169 12.881 ( 12.894 5.671 -0.146) 14.087 13.357 ( -3.977 -3.964 0.382) 5.628 13.715 ( -4.791 -4.194 4.728) 7.931 13.889 ( -7.087 -2.406 -0.351) 7.493 14.005 ( 1.067 7.375 0.881) 7.503 14.449 ( 6.743 -0.345 -3.427) 7.572 14.499 ( -0.433 2.152 3.403) 4.050 15.047 ( 2.763 -1.387 -3.698) 4.820 15.585 ( 3.118 1.792 -4.928) 6.101 16.057 ( -5.699 -4.881 3.420) 8.246 16.843 ( -10.614 2.138 -12.256) 16.353 17.093 ( 6.938 -14.217 19.472) 25.088 17.555 ( -10.138 -6.367 -13.313) 17.904 17.982 ( -3.442 5.112 3.557) 7.116 18.671 ( 12.982 11.300 1.135) 17.249 18.773 ( -9.657 -11.444 0.779) 14.994 19.054 ( -1.689 -5.848 0.462) 6.105 20.008 ( -2.046 2.926 -8.048) 8.804 20.057 ( 0.499 -1.708 -4.923) 5.235 20.577 ( 13.258 -7.340 10.768) 18.590 20.807 ( -7.223 -2.075 -8.937) 11.677 21.174 ( -1.756 5.769 2.512) 6.533 21.699 ( 6.829 12.648 5.453) 15.374 ======================= Grid point 152 (85/125) ======================= q-point: (-0.33 -0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.958 ( -1.337 -22.255 16.532) 27.756 2.639 ( -5.760 -2.951 -4.219) 7.725 2.988 ( 0.627 1.624 -7.628) 7.824 3.153 ( 9.497 -6.810 -0.257) 11.689 3.501 ( -6.650 -3.108 -0.441) 7.353 3.661 ( -1.854 -11.747 -0.493) 11.902 3.782 ( -4.570 6.133 -3.381) 8.363 3.947 ( -2.362 -10.226 -0.300) 10.500 4.162 ( -6.722 -0.223 -11.771) 13.557 4.357 ( 7.162 0.588 3.963) 8.207 4.439 ( -0.715 2.594 -2.919) 3.970 4.519 ( 4.004 -4.951 -5.419) 8.361 4.808 ( 2.494 -3.250 3.261) 5.236 4.992 ( -1.929 -2.735 3.971) 5.194 5.117 ( 3.887 5.964 1.719) 7.324 5.386 ( -6.854 -2.874 -8.311) 11.149 5.763 ( -2.644 -2.655 -0.600) 3.795 6.007 ( 10.646 -1.717 11.393) 15.687 6.035 ( 0.787 6.669 4.738) 8.218 6.086 ( -3.438 7.099 -1.088) 7.962 6.226 ( 6.500 3.873 -3.949) 8.535 6.478 ( -3.175 1.464 -5.670) 6.661 6.829 ( -6.103 -0.996 15.589) 16.771 6.902 ( -5.898 6.071 -1.342) 8.570 7.086 ( -2.057 -2.474 -1.063) 3.388 7.272 ( 0.195 -0.509 -3.516) 3.558 7.480 ( 11.880 6.899 1.063) 13.779 7.591 ( -2.502 -3.338 4.432) 6.086 8.118 ( -3.214 -9.116 -3.394) 10.245 8.167 ( 3.277 0.385 -10.618) 11.119 8.417 ( -5.703 2.032 -3.450) 6.968 8.604 ( 0.840 2.809 2.556) 3.890 8.839 ( -0.718 1.654 6.497) 6.743 8.948 ( 3.669 -3.036 -0.547) 4.793 8.971 ( 0.442 0.040 4.462) 4.484 9.052 ( 3.023 7.274 0.153) 7.879 9.243 ( 1.228 9.628 1.548) 9.828 9.529 ( -7.419 2.496 8.678) 11.687 9.787 ( 7.263 2.073 1.215) 7.651 9.934 ( 6.173 -1.748 -3.329) 7.228 10.019 ( 0.697 4.830 2.522) 5.493 10.235 ( -8.323 -1.498 -5.892) 10.307 10.643 ( 1.993 0.515 5.549) 5.918 10.932 ( -2.294 2.828 -4.976) 6.166 11.361 ( -0.126 -3.787 0.188) 3.794 11.482 ( -0.053 -5.204 -2.796) 5.908 11.536 ( -4.417 -6.356 2.555) 8.151 11.878 ( 4.544 -4.831 -1.120) 6.726 12.094 ( 6.275 3.819 2.914) 7.903 12.282 ( -1.597 4.392 -11.444) 12.361 12.497 ( -3.724 14.405 2.011) 15.014 12.931 ( 4.191 5.425 2.989) 7.478 13.122 ( 5.881 5.786 0.810) 8.290 13.261 ( -0.763 -5.471 2.611) 6.110 13.603 ( -4.378 -5.252 4.750) 8.325 13.765 ( -3.199 -3.965 -0.119) 5.096 14.098 ( -0.914 7.698 5.212) 9.342 14.528 ( 3.621 1.874 -2.096) 4.584 14.586 ( 4.083 4.762 1.084) 6.366 15.048 ( 1.927 -0.804 -4.460) 4.924 15.555 ( -2.969 3.208 -19.154) 19.646 16.049 ( 6.612 -6.401 13.460) 16.305 16.614 ( -9.634 -2.196 -0.268) 9.885 17.143 ( 4.876 -14.251 13.553) 20.262 17.207 ( -16.360 -0.270 -13.735) 21.363 17.936 ( -0.113 -7.831 -5.714) 9.695 18.493 ( -7.206 -13.630 0.291) 15.421 18.902 ( -2.756 -15.833 4.860) 16.790 19.082 ( 14.156 16.014 2.845) 21.562 19.768 ( -6.209 -14.440 -13.428) 20.673 20.188 ( 4.018 12.687 -2.677) 13.575 20.643 ( -6.296 3.617 -8.494) 11.175 20.770 ( 5.518 -0.190 9.614) 11.087 21.238 ( 2.886 2.373 0.606) 3.785 21.989 ( 4.822 17.398 7.046) 19.381 ======================= Grid point 153 (86/125) ======================= q-point: (-0.22 -0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.798 ( 8.657 -27.254 4.634) 28.969 2.407 ( -4.389 -23.469 -4.556) 24.307 2.892 ( -4.658 0.591 3.789) 6.034 3.277 ( -0.534 -21.053 -10.700) 23.622 3.459 ( 12.580 3.834 -5.297) 14.178 3.578 ( 0.790 1.562 1.600) 2.371 3.676 ( -4.990 -3.746 4.894) 7.930 3.819 ( -1.903 -5.409 -1.059) 5.831 3.978 ( -2.697 -1.267 -10.148) 10.576 4.365 ( -0.903 -13.815 -6.077) 15.120 4.446 ( -0.119 4.948 2.304) 5.459 4.585 ( 4.269 0.548 3.046) 5.273 4.783 ( -3.981 0.480 4.242) 5.837 5.068 ( -0.645 4.648 4.653) 6.608 5.194 ( -5.115 1.217 -8.225) 9.761 5.272 ( 5.053 7.117 0.764) 8.762 5.727 ( -0.260 -0.737 -4.539) 4.606 5.912 ( -6.127 -4.563 9.278) 12.018 6.105 ( 0.165 7.878 -0.448) 7.893 6.281 ( -2.912 -0.796 2.693) 4.045 6.358 ( 13.140 -1.095 -8.800) 15.852 6.515 ( 2.229 12.147 0.882) 12.382 6.689 ( -2.505 -4.670 9.754) 11.100 6.970 ( 0.830 -2.552 6.830) 7.339 7.119 ( 0.804 7.904 0.085) 7.946 7.269 ( 1.519 5.072 -3.500) 6.347 7.490 ( -3.365 -2.442 0.325) 4.171 7.673 ( -5.381 3.134 -3.903) 7.349 8.044 ( 9.100 -0.046 1.400) 9.207 8.119 ( -3.159 -4.075 -10.649) 11.832 8.276 ( -4.709 -3.972 -1.515) 6.344 8.699 ( 3.423 5.401 3.408) 7.246 8.807 ( -5.285 -0.977 3.762) 6.560 8.922 ( -2.671 1.277 3.565) 4.634 9.040 ( -1.345 1.807 13.232) 13.423 9.207 ( 7.140 3.250 -4.132) 8.867 9.325 ( -1.883 7.563 3.156) 8.408 9.380 ( -9.724 -4.357 3.055) 11.084 9.888 ( 1.866 -1.178 -0.828) 2.357 9.966 ( -6.097 3.605 -0.275) 7.088 10.092 ( 8.147 -0.317 -3.999) 9.081 10.288 ( 8.921 9.468 1.609) 13.108 10.757 ( 3.580 6.238 7.151) 10.142 10.904 ( -1.695 3.705 -6.002) 7.254 11.299 ( -2.351 -5.093 -0.706) 5.653 11.401 ( -4.512 -2.073 3.589) 6.127 11.463 ( 2.735 -5.047 -3.602) 6.777 11.860 ( -0.043 -6.490 -2.365) 6.908 12.169 ( -1.244 1.245 2.583) 3.125 12.271 ( 1.186 2.376 -10.113) 10.455 12.590 ( -2.954 13.913 1.239) 14.277 13.002 ( -0.895 4.023 1.905) 4.540 13.182 ( -1.659 3.408 2.642) 4.620 13.270 ( 1.415 -2.822 2.578) 4.076 13.515 ( -1.860 -2.869 1.707) 3.822 13.689 ( -0.662 -4.800 0.443) 4.866 14.153 ( -2.723 3.672 7.686) 8.942 14.608 ( 0.467 6.482 0.426) 6.512 14.712 ( 3.446 8.233 -3.794) 9.698 15.072 ( -1.733 5.284 0.319) 5.571 15.544 ( 11.948 -1.670 -17.191) 21.002 16.037 ( -8.345 -8.313 2.895) 12.129 16.555 ( 8.029 -5.252 -0.290) 9.599 16.864 ( -16.927 2.271 1.129) 17.116 17.202 ( 10.169 -8.091 3.651) 13.498 17.792 ( 2.260 -17.050 -8.208) 19.058 18.238 ( -6.564 -15.062 3.247) 16.749 18.726 ( 3.675 -22.858 4.567) 23.597 19.300 ( -10.573 -4.449 9.046) 14.609 19.610 ( 12.329 6.710 -20.213) 24.609 20.423 ( 9.226 14.179 -4.697) 17.556 20.561 ( -5.962 5.220 -2.402) 8.280 20.831 ( -4.156 4.836 2.243) 6.760 21.299 ( 0.970 0.510 1.945) 2.232 22.244 ( 0.010 18.365 6.448) 19.465 ======================= Grid point 154 (87/125) ======================= q-point: (-0.11 -0.22 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.816 ( 22.053 -23.770 0.873) 32.436 2.015 ( -1.351 -33.842 -8.946) 35.030 2.864 ( 6.211 -11.852 0.447) 13.388 3.064 ( 5.349 -15.109 -6.798) 17.410 3.413 ( -7.241 1.089 -1.483) 7.471 3.604 ( 3.942 -11.329 3.358) 12.457 3.767 ( -0.238 -0.538 -0.957) 1.124 3.890 ( -0.283 8.812 5.936) 10.629 3.971 ( 12.788 6.397 -3.451) 14.709 4.159 ( -3.484 -12.269 -5.483) 13.883 4.435 ( -4.849 -4.466 1.064) 6.677 4.612 ( -3.516 5.383 -0.221) 6.433 4.717 ( -5.935 6.986 3.419) 9.784 5.084 ( -1.112 -2.068 7.510) 7.868 5.186 ( 0.409 7.681 -6.704) 10.203 5.456 ( 5.797 6.094 -3.552) 9.130 5.642 ( -5.376 2.256 -2.353) 6.287 5.857 ( 0.228 -6.718 8.939) 11.184 6.195 ( -2.374 6.044 -2.911) 7.116 6.209 ( 1.838 -0.153 -1.803) 2.579 6.421 ( 3.414 -3.984 -11.293) 12.453 6.614 ( 3.977 -0.853 1.323) 4.277 6.811 ( 3.962 -5.538 16.079) 17.462 6.957 ( 1.704 3.325 4.402) 5.774 7.156 ( -3.524 1.910 6.522) 7.655 7.383 ( -5.735 1.240 -6.525) 8.775 7.447 ( -0.315 9.902 -7.904) 12.674 7.500 ( -2.717 4.904 -0.672) 5.647 7.942 ( -4.710 -3.604 -6.360) 8.696 8.183 ( -4.504 -2.691 2.991) 6.040 8.332 ( 12.625 4.058 3.698) 13.767 8.651 ( -8.964 -3.678 6.309) 11.562 8.856 ( 4.688 8.016 -3.544) 9.940 8.914 ( -0.187 0.193 7.041) 7.046 9.033 ( -7.587 0.738 8.979) 11.778 9.213 ( -3.748 1.511 -3.846) 5.579 9.290 ( 3.054 -2.597 1.594) 4.315 9.453 ( 6.018 6.497 5.337) 10.340 9.803 ( -5.454 -3.799 -0.462) 6.663 9.926 ( -3.539 2.916 -0.981) 4.689 10.219 ( 7.121 -1.461 -6.437) 9.710 10.494 ( -1.500 9.108 7.454) 11.865 10.865 ( -2.081 4.835 -0.733) 5.315 10.925 ( -0.154 8.041 -7.376) 10.913 11.211 ( -1.783 -0.083 1.260) 2.185 11.325 ( -2.204 -3.171 1.221) 4.050 11.478 ( 5.127 -4.756 2.376) 7.387 11.757 ( -0.526 -6.368 -6.696) 9.256 12.157 ( -3.520 2.470 5.464) 6.954 12.230 ( -2.680 -1.247 -3.648) 4.695 12.687 ( -0.364 7.961 0.949) 8.025 13.073 ( -1.329 14.209 -0.232) 14.273 13.195 ( -1.868 -2.434 -2.150) 3.746 13.260 ( 6.680 -3.246 3.079) 8.040 13.490 ( -2.049 1.404 1.155) 2.739 13.651 ( 1.598 -5.180 1.541) 5.636 14.157 ( 0.296 -2.548 6.684) 7.159 14.645 ( -4.998 8.358 -0.311) 9.743 14.823 ( -3.032 13.117 -3.714) 13.965 15.087 ( -5.815 10.779 2.664) 12.534 15.574 ( -11.009 -16.149 3.812) 19.913 15.874 ( 17.099 -2.218 -21.703) 27.719 16.655 ( -8.429 0.850 6.697) 10.799 16.710 ( 13.478 -6.884 -1.552) 15.213 17.315 ( 2.248 -2.409 -8.212) 8.848 17.708 ( 12.713 -17.498 8.420) 23.209 18.000 ( -1.614 -17.209 1.153) 17.323 18.608 ( 8.504 -24.912 0.669) 26.332 19.073 ( -4.754 -9.393 12.244) 16.148 19.812 ( 2.916 14.771 -24.432) 28.699 20.507 ( -6.163 3.956 3.050) 7.933 20.694 ( 0.074 10.835 -6.346) 12.556 20.799 ( 1.463 9.730 -1.360) 9.933 21.277 ( -4.348 -1.347 4.238) 6.220 22.395 ( -6.016 17.023 4.601) 18.632 ======================= Grid point 184 (88/125) ======================= q-point: ( 0.22 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.015 ( -0.000 0.000 39.209) 39.209 1.015 ( -0.000 0.000 39.209) 39.209 1.858 ( -0.000 0.000 72.830) 72.830 2.905 ( 0.000 -0.000 -16.696) 16.696 2.905 ( 0.000 -0.000 -16.696) 16.696 3.797 ( -0.000 0.000 0.447) 0.447 3.797 ( 0.000 0.000 0.447) 0.447 3.944 ( 0.000 -0.000 -2.194) 2.194 4.066 ( 0.000 -0.000 -0.342) 0.342 4.373 ( 0.000 -0.000 -1.413) 1.413 4.373 ( 0.000 -0.000 -1.413) 1.413 4.664 ( -0.000 -0.000 -2.492) 2.492 4.664 ( 0.000 -0.000 -2.492) 2.492 5.331 ( 0.000 -0.000 -0.989) 0.989 5.331 ( 0.000 -0.000 -0.989) 0.989 5.356 ( 0.000 -0.000 -8.638) 8.638 5.704 ( 0.000 -0.000 -12.210) 12.210 5.908 ( -0.000 0.000 3.790) 3.790 5.908 ( -0.000 0.000 3.790) 3.790 5.966 ( 0.000 -0.000 -24.384) 24.384 6.269 ( 0.000 -0.000 -1.022) 1.022 6.528 ( -0.000 0.000 2.215) 2.215 6.528 ( -0.000 0.000 2.215) 2.215 7.116 ( -0.000 0.000 4.368) 4.368 7.416 ( 0.000 -0.000 -3.969) 3.969 7.416 ( 0.000 -0.000 -3.969) 3.969 7.896 ( -0.000 0.000 6.917) 6.917 8.137 ( 0.000 -0.000 -10.452) 10.452 8.137 ( 0.000 -0.000 -10.452) 10.452 8.211 ( -0.000 0.000 3.972) 3.972 8.346 ( 0.000 -0.000 -2.180) 2.180 8.537 ( -0.000 0.000 4.773) 4.773 8.537 ( -0.000 0.000 4.773) 4.773 8.772 ( 0.000 -0.000 -1.603) 1.603 9.176 ( -0.000 0.000 6.365) 6.365 9.176 ( -0.000 0.000 6.365) 6.365 9.413 ( -0.000 0.000 6.920) 6.920 9.425 ( -0.000 0.000 12.330) 12.330 9.425 ( -0.000 0.000 12.330) 12.330 10.342 ( -0.000 0.000 6.217) 6.217 10.342 ( -0.000 0.000 6.217) 6.217 10.568 ( 0.000 -0.000 -18.114) 18.114 10.980 ( 0.000 -0.000 -17.404) 17.404 10.980 ( 0.000 -0.000 -17.404) 17.404 11.124 ( 0.000 -0.000 -4.307) 4.307 11.124 ( 0.000 -0.000 -4.307) 4.307 11.610 ( -0.000 0.000 10.034) 10.034 11.716 ( -0.000 0.000 5.704) 5.704 11.716 ( -0.000 0.000 5.704) 5.704 12.430 ( -0.000 0.000 8.021) 8.021 12.956 ( -0.000 0.000 1.760) 1.760 12.956 ( -0.000 0.000 1.760) 1.760 13.277 ( -0.000 0.000 9.935) 9.935 13.513 ( 0.000 -0.000 -4.487) 4.487 13.723 ( -0.000 0.000 3.166) 3.166 13.784 ( -0.000 0.000 1.873) 1.873 13.784 ( -0.000 0.000 1.873) 1.873 14.734 ( 0.000 -0.000 -15.017) 15.017 14.934 ( 0.000 -0.000 -0.941) 0.941 15.873 ( -0.000 0.000 1.841) 1.841 15.873 ( 0.000 0.000 1.841) 1.841 16.185 ( 0.000 -0.000 -5.719) 5.719 16.185 ( 0.000 -0.000 -5.719) 5.719 16.824 ( -0.000 0.000 0.332) 0.332 17.319 ( 0.000 -0.000 -0.715) 0.715 17.319 ( 0.000 -0.000 -0.715) 0.715 17.527 ( -0.000 0.000 1.475) 1.475 17.527 ( -0.000 0.000 1.475) 1.475 17.761 ( -0.000 0.000 4.841) 4.841 20.739 ( -0.000 0.000 0.722) 0.722 20.739 ( -0.000 0.000 0.722) 0.722 21.074 ( 0.000 -0.000 -0.297) 0.297 21.074 ( 0.000 0.000 -0.297) 0.297 21.634 ( 0.000 -0.000 -4.075) 4.075 23.025 ( -0.000 0.000 2.688) 2.688 ======================= Grid point 185 (89/125) ======================= q-point: ( 0.33 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.121 ( 9.481 -12.887 34.852) 38.349 1.419 ( 11.832 19.369 30.832) 38.286 2.504 ( 22.672 16.247 51.983) 58.994 2.778 ( -0.949 0.011 -16.693) 16.720 2.962 ( 9.822 2.217 -15.684) 18.638 3.703 ( -4.106 -2.880 -0.921) 5.099 3.829 ( -1.072 4.053 -0.031) 4.193 3.934 ( -6.523 -6.305 1.431) 9.185 4.015 ( 2.917 -2.112 3.058) 4.724 4.331 ( -0.781 -1.384 0.523) 1.673 4.394 ( -3.032 3.605 1.024) 4.821 4.507 ( 2.514 -0.271 -7.386) 7.807 4.876 ( 3.440 5.706 -5.064) 8.369 5.243 ( -2.112 -2.616 -3.773) 5.054 5.294 ( -1.305 -1.251 0.504) 1.877 5.448 ( 5.451 2.857 -3.251) 6.960 5.666 ( 2.089 3.780 -14.390) 15.024 5.685 ( -7.738 -9.775 2.371) 12.690 5.925 ( 4.000 0.634 -12.639) 13.272 6.118 ( 4.176 4.233 -4.135) 7.242 6.291 ( 2.816 3.364 0.492) 4.414 6.417 ( -3.601 -4.946 1.717) 6.354 6.588 ( -0.848 2.951 1.911) 3.617 7.120 ( 0.212 -0.259 5.216) 5.226 7.374 ( 0.949 -7.185 -3.019) 7.851 7.431 ( -0.653 8.893 -2.691) 9.314 7.829 ( -9.287 -7.025 -6.049) 13.122 7.921 ( -8.105 -7.441 2.571) 11.299 8.020 ( -14.721 -6.692 10.106) 19.069 8.179 ( -2.216 -4.572 -0.454) 5.101 8.319 ( 3.796 5.989 -11.276) 13.320 8.456 ( -1.727 7.119 -5.629) 9.238 8.727 ( 7.010 -5.411 4.073) 9.747 8.869 ( 7.091 9.472 -1.819) 11.971 9.168 ( -2.497 -1.594 3.289) 4.427 9.212 ( -0.876 -3.167 7.505) 8.192 9.314 ( -3.858 6.786 2.888) 8.323 9.561 ( 4.154 -1.492 8.202) 9.315 9.663 ( 6.472 6.085 10.698) 13.905 10.246 ( -8.092 -4.731 5.307) 10.772 10.285 ( -6.334 -2.071 -0.103) 6.664 10.515 ( -2.381 -2.663 -11.624) 12.161 10.910 ( 3.141 -5.083 -15.452) 16.567 10.958 ( 0.627 6.775 -15.356) 16.795 11.092 ( 2.469 -4.734 -3.338) 6.297 11.204 ( 5.329 4.687 -4.453) 8.379 11.542 ( -2.542 -3.361 5.719) 7.104 11.717 ( -1.038 0.447 5.016) 5.142 11.913 ( 6.499 6.490 4.880) 10.400 12.478 ( 0.245 1.663 8.489) 8.654 12.842 ( -6.292 -3.618 5.304) 8.989 12.993 ( 2.845 -1.156 1.782) 3.550 13.373 ( 3.659 1.394 6.072) 7.225 13.459 ( -2.566 -1.984 -2.185) 3.911 13.657 ( -5.932 -3.746 1.784) 7.239 13.709 ( -6.953 -2.880 0.856) 7.575 13.873 ( 3.997 6.928 -0.337) 8.005 14.674 ( -0.327 -0.395 -14.697) 14.706 15.056 ( 8.497 6.470 -0.204) 10.682 15.505 ( -17.654 -8.359 2.060) 19.641 15.683 ( -16.676 -12.037 -0.304) 20.569 16.148 ( -1.922 -0.975 4.383) 4.884 16.374 ( 1.910 -2.902 -0.336) 3.490 16.814 ( 8.728 5.070 1.476) 10.201 17.028 ( -3.377 -13.501 4.758) 14.708 17.340 ( -4.109 6.766 -0.437) 7.928 17.618 ( 8.084 20.056 -0.922) 21.643 17.659 ( 18.973 0.382 0.153) 18.977 18.425 ( 25.721 17.483 -3.325) 31.278 20.634 ( -5.946 -4.941 0.920) 7.786 20.776 ( -1.029 0.093 6.131) 6.217 20.943 ( -7.348 -5.348 -1.153) 9.161 21.032 ( -2.156 -12.465 1.983) 12.805 21.440 ( -11.763 -0.283 4.116) 12.465 22.842 ( -13.653 -7.674 0.184) 15.663 ======================= Grid point 186 (90/125) ======================= q-point: ( 0.44 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( 18.668 -7.029 18.531) 27.227 1.989 ( 16.541 19.384 18.175) 31.300 2.610 ( -0.845 2.714 -20.537) 20.733 3.114 ( 16.181 1.905 -15.468) 22.466 3.341 ( 16.215 11.773 30.954) 36.874 3.641 ( 0.709 1.150 6.510) 6.649 3.750 ( -5.144 -5.635 6.744) 10.184 3.855 ( -0.350 2.911 -0.189) 2.938 4.013 ( -2.885 -3.131 -0.519) 4.289 4.372 ( 1.472 1.784 12.021) 12.242 4.405 ( 0.001 5.651 -4.029) 6.940 4.598 ( 11.038 1.599 -2.706) 11.476 4.863 ( -8.221 4.858 -0.335) 9.555 5.134 ( -4.804 -1.935 -11.279) 12.411 5.224 ( -8.542 0.594 0.398) 8.572 5.454 ( 0.968 -15.744 0.615) 15.786 5.609 ( 5.610 0.113 5.028) 7.534 5.740 ( 4.459 5.444 -4.755) 8.493 5.989 ( 6.634 4.107 -18.768) 20.326 6.150 ( 3.795 1.100 -3.915) 5.563 6.291 ( -2.006 -4.706 3.533) 6.217 6.445 ( 2.949 1.140 -0.729) 3.244 6.623 ( 0.732 6.496 -1.539) 6.716 7.103 ( -7.763 0.245 -2.495) 8.157 7.262 ( -1.042 -6.195 1.269) 6.409 7.438 ( -11.607 -9.204 -6.231) 16.071 7.605 ( -6.021 8.754 -0.119) 10.626 7.682 ( -1.301 -5.677 2.121) 6.198 7.805 ( -5.966 -7.832 11.164) 14.885 8.206 ( 4.504 -0.178 -0.189) 4.512 8.327 ( -5.601 7.909 -0.995) 9.742 8.519 ( 4.001 6.459 -17.373) 18.962 8.823 ( 6.094 -1.780 5.515) 8.409 9.000 ( -0.329 1.091 -6.249) 6.352 9.060 ( -6.925 -1.466 8.037) 10.710 9.209 ( 5.243 -4.377 -3.583) 7.713 9.333 ( -5.207 7.809 -3.050) 9.869 9.613 ( 1.153 -3.243 9.668) 10.262 9.835 ( 1.292 6.877 7.753) 10.444 10.020 ( -13.360 -6.052 5.386) 15.625 10.169 ( -1.558 -4.406 -2.099) 5.123 10.337 ( -6.698 -6.183 -5.943) 10.882 10.854 ( 2.351 -3.571 -11.714) 12.469 10.976 ( -1.923 3.516 -3.731) 5.476 11.106 ( 8.140 -2.080 -7.969) 11.580 11.308 ( 2.229 3.487 0.286) 4.149 11.534 ( 1.533 -2.315 5.384) 6.058 11.740 ( 1.663 -0.076 3.251) 3.653 12.042 ( -0.645 5.358 3.055) 6.201 12.513 ( -3.181 2.553 6.498) 7.672 12.715 ( -7.619 -3.350 1.676) 8.490 13.049 ( 4.314 -2.572 0.005) 5.023 13.349 ( -4.148 -6.589 3.814) 8.670 13.502 ( 2.768 0.533 -1.616) 3.249 13.507 ( -5.700 0.588 0.144) 5.732 13.571 ( -1.947 -1.596 2.369) 3.457 14.001 ( 2.788 7.060 -4.442) 8.795 14.585 ( -2.449 -1.183 -11.287) 11.610 15.094 ( -14.170 -2.493 1.457) 14.461 15.276 ( -5.879 -2.514 2.607) 6.905 15.368 ( -4.750 -2.176 6.933) 8.682 16.002 ( 1.248 -12.731 5.035) 13.747 16.425 ( 0.836 4.792 -0.574) 4.898 16.889 ( 0.255 -8.078 -8.087) 11.433 17.223 ( 24.145 4.425 5.410) 25.136 17.419 ( -2.180 15.197 5.462) 16.295 17.897 ( 14.021 8.142 -2.795) 16.453 18.160 ( 22.475 14.097 -3.089) 26.710 18.915 ( 13.015 15.597 0.466) 20.320 20.442 ( -9.265 -8.486 2.827) 12.878 20.693 ( -5.599 -17.202 17.282) 25.018 20.739 ( -10.936 -7.965 -1.167) 13.579 20.847 ( -2.637 -3.245 -0.895) 4.276 21.348 ( -4.243 5.393 -0.824) 6.911 22.462 ( -17.549 -9.410 -6.427) 20.924 ======================= Grid point 187 (91/125) ======================= q-point: ( 0.56 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.739 ( 19.639 0.808 1.757) 19.734 2.350 ( 5.804 4.335 -1.504) 7.398 2.772 ( 15.425 13.778 1.206) 20.718 3.351 ( 11.409 1.593 -7.833) 13.931 3.403 ( -4.469 -2.395 3.759) 6.312 3.711 ( -0.552 0.286 3.250) 3.309 3.777 ( -1.582 -8.184 -7.010) 10.892 3.950 ( 8.731 3.138 18.074) 20.316 4.011 ( 1.644 5.578 5.089) 7.727 4.382 ( -3.359 5.381 -3.714) 7.351 4.462 ( -0.967 2.633 2.619) 3.838 4.740 ( -8.229 1.328 -1.039) 8.400 4.869 ( -18.022 1.071 1.207) 18.094 4.981 ( 18.855 5.488 13.814) 24.010 5.115 ( -1.265 -0.314 -3.160) 3.418 5.351 ( 3.924 -11.664 -5.170) 13.348 5.721 ( 2.999 -1.411 7.149) 7.879 5.818 ( -0.716 6.885 -0.516) 6.942 6.083 ( 9.802 -1.535 -12.975) 16.334 6.206 ( 0.057 -6.575 1.364) 6.715 6.286 ( 4.480 3.864 -0.785) 5.968 6.449 ( 2.060 -2.214 -10.768) 11.185 6.658 ( -3.307 0.103 1.071) 3.477 6.870 ( -11.866 -2.317 1.941) 12.245 7.055 ( -13.260 -1.852 -5.414) 14.442 7.258 ( -1.860 -2.315 2.719) 4.027 7.542 ( -4.382 4.406 -8.602) 10.611 7.753 ( 6.822 -0.192 4.294) 8.064 7.832 ( 5.889 -0.927 10.323) 11.921 8.264 ( 2.041 -0.586 -2.779) 3.498 8.350 ( -1.971 9.904 6.485) 12.002 8.533 ( -0.902 3.463 -15.411) 15.822 8.880 ( -0.432 -4.085 -0.319) 4.120 8.924 ( -1.670 -1.244 3.745) 4.285 8.978 ( 0.586 -6.849 -0.114) 6.875 9.267 ( -2.248 5.751 -11.085) 12.689 9.279 ( -1.973 5.503 -1.486) 6.031 9.550 ( -4.979 -11.799 0.971) 12.843 9.777 ( -7.729 3.394 4.486) 9.560 9.939 ( -0.826 0.440 4.866) 4.955 10.127 ( 3.918 -6.590 1.369) 7.788 10.163 ( -6.024 -2.189 -0.531) 6.432 10.828 ( 2.791 -2.628 -8.895) 9.686 10.929 ( -3.114 -1.059 0.364) 3.309 11.280 ( 11.664 5.544 -5.709) 14.120 11.366 ( 1.863 1.800 1.363) 2.927 11.562 ( -0.614 -0.523 7.422) 7.465 11.809 ( 5.309 -0.107 2.403) 5.829 12.040 ( -3.805 1.024 1.862) 4.358 12.468 ( -7.423 0.923 1.542) 7.637 12.483 ( -12.631 -4.250 1.595) 13.422 13.026 ( -5.469 -3.937 -1.007) 6.813 13.190 ( -3.110 -5.087 -1.861) 6.246 13.472 ( 2.152 -0.206 -3.087) 3.769 13.534 ( 2.674 0.588 4.199) 5.012 13.678 ( 5.694 3.761 -0.495) 6.842 14.062 ( 0.902 4.018 -8.245) 9.216 14.490 ( -2.283 -0.722 -6.944) 7.345 14.854 ( -8.886 -4.722 3.476) 10.646 15.094 ( -9.628 1.556 2.640) 10.104 15.377 ( -0.628 -6.954 18.821) 20.074 16.060 ( 11.070 -2.217 -5.586) 12.596 16.461 ( -5.067 11.884 -1.747) 13.036 16.798 ( 4.081 -11.269 -6.091) 13.444 17.510 ( -0.311 4.555 9.660) 10.684 17.767 ( 23.183 10.291 1.539) 25.411 18.222 ( 14.228 7.530 -3.028) 16.380 18.615 ( 14.959 12.205 -5.199) 19.994 19.201 ( 4.321 10.236 1.618) 11.228 20.177 ( -10.323 -10.991 4.191) 15.651 20.409 ( -14.496 -9.378 0.499) 17.272 20.506 ( -2.483 -14.666 9.568) 17.686 20.802 ( -6.107 2.527 8.042) 10.410 21.377 ( 3.850 4.383 -6.208) 8.519 22.033 ( -16.131 -8.621 -9.269) 20.505 ======================= Grid point 188 (92/125) ======================= q-point: ( 0.67 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.083 ( 13.110 10.958 -4.344) 17.630 2.462 ( 10.000 -5.922 -3.326) 12.088 3.055 ( -10.069 4.719 14.295) 18.111 3.326 ( 11.694 -3.460 2.010) 12.360 3.505 ( 0.415 0.466 0.107) 0.633 3.652 ( 3.879 -4.005 -11.828) 13.076 3.835 ( 5.958 4.885 1.054) 7.776 3.992 ( -8.396 -7.124 5.390) 12.260 4.084 ( -1.171 6.236 3.824) 7.408 4.388 ( -5.092 -1.829 -2.963) 6.169 4.452 ( 1.449 1.558 -0.832) 2.285 4.536 ( -7.379 0.643 4.147) 8.488 4.774 ( -3.298 11.179 4.462) 12.480 5.021 ( 0.544 -5.524 6.963) 8.905 5.222 ( 0.562 -7.833 -10.824) 13.373 5.503 ( 11.344 8.070 10.859) 17.656 5.677 ( -9.861 6.620 -5.455) 13.070 5.912 ( 2.875 -3.956 3.769) 6.174 6.064 ( -6.484 -3.595 -6.728) 10.012 6.119 ( 4.396 -10.049 2.903) 11.346 6.307 ( 3.504 -8.932 2.841) 10.006 6.449 ( -0.486 4.684 -10.984) 11.951 6.632 ( 5.369 3.689 -4.189) 7.745 6.760 ( -3.978 4.235 5.662) 8.113 6.959 ( -0.011 3.957 2.525) 4.694 7.205 ( -2.647 -1.645 2.978) 4.311 7.475 ( -2.972 3.154 -10.246) 11.125 7.912 ( 7.606 -1.226 -2.613) 8.135 7.969 ( 4.154 0.772 10.563) 11.377 8.249 ( -0.457 -2.507 2.441) 3.529 8.423 ( -7.067 -0.804 -8.428) 11.028 8.476 ( 1.729 7.161 6.009) 9.507 8.848 ( -3.823 1.403 2.786) 4.935 8.881 ( 1.774 -1.644 -0.517) 2.473 8.965 ( 3.591 -4.652 -0.296) 5.884 9.192 ( -7.538 -1.722 -3.932) 8.675 9.225 ( -2.378 7.394 -15.630) 17.453 9.452 ( 4.710 -4.430 -3.456) 7.332 9.773 ( -1.752 7.504 3.181) 8.336 9.910 ( 0.832 -5.286 2.559) 5.932 10.063 ( -6.332 2.652 0.396) 6.877 10.180 ( 7.396 -8.986 6.297) 13.232 10.788 ( -1.384 -2.977 -5.714) 6.590 10.882 ( 0.075 -0.555 -3.611) 3.654 11.380 ( -0.400 1.679 0.749) 1.881 11.522 ( -2.732 2.824 5.944) 7.125 11.599 ( 10.127 3.347 -0.146) 10.667 11.927 ( 3.736 2.633 4.885) 6.690 11.956 ( -2.481 -7.011 0.544) 7.457 12.229 ( -5.599 -0.799 -4.227) 7.061 12.382 ( -8.085 1.762 3.829) 9.118 12.852 ( -5.420 -2.419 -0.472) 5.954 13.146 ( -1.253 1.988 -3.636) 4.330 13.494 ( 4.037 -5.275 -5.076) 8.360 13.605 ( -0.362 3.791 3.290) 5.032 13.767 ( 1.998 1.231 -3.310) 4.057 14.060 ( 0.719 1.332 -8.524) 8.657 14.459 ( 0.934 1.762 -3.599) 4.115 14.709 ( -4.225 -4.907 3.003) 7.138 15.010 ( -5.638 4.440 4.249) 8.340 15.398 ( 4.840 -11.758 20.945) 24.502 16.181 ( 3.289 4.305 -9.576) 11.002 16.525 ( -2.671 16.683 1.783) 16.990 16.741 ( 3.390 -11.245 -1.362) 11.823 17.530 ( -3.126 0.089 3.539) 4.723 18.170 ( 12.855 -1.843 -0.400) 12.993 18.470 ( 6.274 5.592 -1.782) 8.591 18.860 ( 6.416 6.891 -2.532) 9.750 19.269 ( -3.995 1.751 -0.717) 4.421 20.003 ( 2.286 -7.078 2.320) 7.792 20.081 ( -14.632 -6.852 3.636) 16.561 20.405 ( -1.013 -4.034 3.315) 5.319 20.756 ( -6.539 3.410 12.311) 14.351 21.475 ( 3.830 0.123 -13.680) 14.206 21.736 ( -3.206 -1.338 -2.911) 4.532 ======================= Grid point 189 (93/125) ======================= q-point: (-0.22 0.22 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.240 ( -8.362 -4.155 -0.452) 9.348 2.504 ( 5.354 2.381 -11.216) 12.654 2.971 ( -2.586 -3.960 17.456) 18.085 3.368 ( -1.829 -10.217 2.384) 10.650 3.498 ( -0.090 -3.443 -3.741) 5.086 3.691 ( -0.862 1.908 -1.264) 2.446 3.710 ( -7.610 0.651 -0.643) 7.665 3.938 ( -5.582 2.512 4.639) 7.680 4.072 ( -7.916 -5.143 1.660) 9.585 4.284 ( 5.622 3.990 -1.044) 6.973 4.470 ( 0.205 1.571 -0.021) 1.584 4.591 ( 2.925 -2.912 5.207) 6.644 4.843 ( -6.547 9.420 2.386) 11.717 5.066 ( 6.723 -12.723 4.595) 15.106 5.122 ( 2.297 3.483 -5.174) 6.647 5.337 ( -18.196 -2.748 -6.058) 19.374 5.728 ( -0.786 2.343 2.136) 3.267 5.872 ( 0.810 10.891 -0.125) 10.922 6.026 ( 2.526 -4.657 1.874) 5.619 6.233 ( 13.286 -1.772 -7.528) 15.373 6.322 ( 4.338 -5.946 1.154) 7.451 6.391 ( -3.415 -0.160 4.030) 5.285 6.748 ( -0.744 1.206 4.778) 4.984 6.875 ( 10.628 7.165 -10.266) 16.422 7.033 ( 1.025 2.368 2.270) 3.437 7.195 ( -0.204 1.715 6.774) 6.991 7.444 ( 0.621 4.770 -7.085) 8.564 7.844 ( -5.874 -11.106 -5.977) 13.913 8.039 ( -0.223 -0.567 6.922) 6.949 8.219 ( -6.017 -2.373 3.747) 7.475 8.303 ( -1.354 0.641 3.759) 4.047 8.581 ( 4.293 2.671 1.251) 5.208 8.826 ( -3.409 5.972 -2.017) 7.166 8.895 ( -0.380 2.309 1.518) 2.789 9.059 ( 10.097 -2.722 1.060) 10.511 9.110 ( -0.433 -0.562 -10.485) 10.509 9.199 ( 1.598 6.648 -12.529) 14.274 9.462 ( -1.758 1.586 -2.796) 3.663 9.881 ( 4.060 -1.749 2.788) 5.226 9.913 ( 1.142 5.487 -0.326) 5.614 10.012 ( -0.569 3.241 -0.518) 3.331 10.219 ( 6.507 -14.183 9.419) 18.227 10.717 ( 0.230 -0.810 -6.451) 6.506 10.873 ( 0.059 0.416 -2.008) 2.051 11.372 ( -1.886 -0.796 1.270) 2.409 11.463 ( -6.488 3.292 2.150) 7.586 11.604 ( -6.477 -7.006 1.736) 9.698 11.930 ( -1.801 2.127 -0.236) 2.797 12.103 ( 10.458 2.644 10.874) 15.316 12.199 ( -0.443 -3.307 -2.437) 4.132 12.338 ( 3.723 7.532 -3.383) 9.058 12.862 ( 2.932 7.130 1.027) 7.777 13.136 ( -0.067 2.263 -3.833) 4.452 13.427 ( -1.122 -9.218 -6.217) 11.175 13.593 ( -5.257 2.699 -0.070) 5.910 13.762 ( -1.699 0.105 -2.300) 2.862 14.079 ( 4.002 1.884 -6.571) 7.921 14.513 ( 2.932 3.368 -2.214) 4.984 14.639 ( 0.450 -3.746 3.295) 5.009 15.008 ( -1.669 4.659 2.635) 5.607 15.473 ( 7.740 -13.186 20.151) 25.296 16.170 ( -6.004 6.681 -9.303) 12.932 16.661 ( 1.169 -11.407 -0.615) 11.483 16.708 ( -0.477 18.547 6.600) 19.692 17.423 ( -6.309 -6.037 -3.155) 9.284 18.099 ( -7.975 -14.274 2.328) 16.516 18.476 ( -8.485 2.048 -2.536) 9.090 19.077 ( 3.449 -2.028 4.012) 5.666 19.127 ( 0.157 1.291 -9.496) 9.585 19.769 ( -15.266 -6.818 6.727) 18.022 20.135 ( 13.704 -1.910 5.010) 14.716 20.439 ( 2.264 5.923 1.685) 6.562 20.764 ( -2.234 5.252 6.720) 8.817 21.357 ( -2.522 -4.110 -9.181) 10.370 21.912 ( 13.981 7.717 -3.964) 16.454 ======================= Grid point 194 (94/125) ======================= q-point: ( 0.33 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.238 ( -12.295 -0.858 34.527) 36.661 1.599 ( 8.488 20.151 31.493) 38.339 2.602 ( 5.641 5.250 9.988) 12.615 2.827 ( -8.600 8.503 -14.494) 18.877 2.863 ( 2.959 15.883 19.223) 25.111 3.724 ( -1.432 -4.917 -2.631) 5.757 3.802 ( 3.430 1.046 2.675) 4.473 4.016 ( -2.338 5.683 1.952) 6.448 4.035 ( -2.369 -0.893 1.959) 3.201 4.294 ( 3.656 -7.307 -0.089) 8.171 4.387 ( -2.809 -5.772 -4.803) 8.017 4.434 ( 2.564 3.464 3.348) 5.457 4.877 ( 2.201 6.897 -9.232) 11.732 5.246 ( 3.938 -0.303 -9.414) 10.209 5.274 ( -2.512 -1.818 -4.175) 5.201 5.409 ( -2.992 2.492 3.190) 5.034 5.543 ( -0.467 -0.704 -18.106) 18.125 5.767 ( -0.841 0.531 -3.806) 3.934 5.889 ( -3.253 -1.697 -0.797) 3.755 6.117 ( 2.516 8.749 -3.061) 9.604 6.273 ( 2.287 3.021 -2.724) 4.667 6.460 ( -3.557 -3.302 3.246) 5.839 6.579 ( 3.408 -1.074 1.998) 4.094 7.127 ( 1.086 -1.728 0.636) 2.137 7.266 ( -2.930 -6.553 2.493) 7.599 7.483 ( 2.049 4.127 -4.602) 6.512 7.915 ( -2.624 -8.925 -3.358) 9.890 7.930 ( -3.035 -4.449 2.334) 5.869 8.042 ( 6.561 -9.232 -8.351) 14.072 8.134 ( -2.065 -3.663 3.222) 5.297 8.302 ( -1.556 5.321 -6.612) 8.629 8.502 ( 13.425 -5.410 5.648) 15.537 8.632 ( -12.287 1.145 -1.784) 12.469 8.873 ( 2.632 9.041 1.096) 9.480 9.132 ( -1.242 -6.355 4.892) 8.116 9.243 ( 6.058 -5.968 4.683) 9.708 9.413 ( 2.044 2.459 4.088) 5.190 9.463 ( -3.250 0.458 14.242) 14.615 9.779 ( 1.262 9.384 7.337) 11.978 10.260 ( 0.199 -7.283 -4.110) 8.365 10.330 ( 3.538 -6.895 5.072) 9.262 10.435 ( -4.335 -3.776 -5.037) 7.643 10.793 ( -2.287 -2.926 -15.279) 15.723 10.934 ( 1.577 6.282 -14.883) 16.232 11.100 ( -3.442 1.107 -3.983) 5.379 11.188 ( 0.726 9.048 -4.712) 10.228 11.545 ( -1.266 -5.361 4.739) 7.267 11.763 ( 1.261 -0.183 3.294) 3.532 11.927 ( 0.933 10.163 3.530) 10.799 12.521 ( 1.382 1.039 10.017) 10.165 12.899 ( 3.138 -5.826 2.616) 7.116 12.945 ( -5.377 -1.692 3.646) 6.713 13.381 ( -0.064 0.867 6.986) 7.040 13.433 ( -0.043 -4.323 -1.463) 4.564 13.678 ( -0.451 -5.547 1.301) 5.715 13.700 ( 1.173 -7.819 2.144) 8.192 13.906 ( 2.942 7.500 -0.756) 8.092 14.608 ( -0.355 0.013 -15.342) 15.346 15.058 ( 0.674 11.123 -0.866) 11.177 15.538 ( 2.959 -15.244 1.385) 15.590 15.658 ( -2.129 -23.761 -0.943) 23.875 16.193 ( -1.615 6.786 2.406) 7.379 16.408 ( -1.272 6.467 -2.443) 7.030 16.736 ( -2.417 -8.410 5.233) 10.196 17.020 ( -6.033 -6.567 3.237) 9.487 17.410 ( 10.426 4.507 -1.542) 11.462 17.608 ( -6.120 22.682 -0.994) 23.514 17.643 ( 5.356 8.789 0.515) 10.305 18.422 ( 1.872 32.291 -2.022) 32.408 20.658 ( -1.187 -6.243 3.069) 7.057 20.768 ( 0.304 -0.980 -1.253) 1.620 20.949 ( -1.860 -12.036 5.328) 13.293 21.011 ( -5.859 -6.472 0.323) 8.736 21.474 ( 3.696 -7.926 1.176) 8.824 22.843 ( 0.169 -17.013 0.663) 17.027 ======================= Grid point 195 (95/125) ======================= q-point: ( 0.44 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.265 ( 1.244 -0.987 29.146) 29.190 2.073 ( 8.330 22.090 23.213) 33.110 2.654 ( -7.849 6.506 -21.046) 23.385 2.774 ( 14.985 1.434 -19.839) 24.903 3.376 ( 12.151 17.022 34.322) 40.192 3.640 ( -1.465 -1.918 -3.049) 3.889 3.841 ( -3.059 0.625 8.886) 9.418 3.975 ( -4.197 5.364 2.004) 7.099 4.025 ( -3.890 1.408 2.648) 4.912 4.352 ( 5.913 -0.175 0.308) 5.924 4.372 ( 9.427 -2.167 4.615) 10.718 4.511 ( -1.153 4.300 4.062) 6.027 4.935 ( 2.949 3.387 -10.923) 11.810 5.133 ( -6.843 -5.344 -2.501) 9.035 5.305 ( 0.632 -9.417 -3.023) 9.911 5.389 ( -1.305 1.959 -2.150) 3.188 5.444 ( 2.718 2.812 -16.206) 16.671 5.768 ( -1.315 7.335 0.103) 7.452 5.881 ( 5.344 1.509 -6.120) 8.264 6.171 ( -1.730 5.059 0.070) 5.347 6.309 ( -4.022 -6.207 0.121) 7.397 6.421 ( 1.404 4.732 1.090) 5.055 6.650 ( 3.818 4.878 -3.206) 6.975 7.150 ( 2.124 -2.846 -2.636) 4.423 7.196 ( 0.104 -7.307 5.099) 8.911 7.397 ( -5.883 -8.510 -5.395) 11.667 7.722 ( -4.299 -7.169 -0.980) 8.417 7.819 ( -5.452 -0.211 2.650) 6.065 7.893 ( -12.302 -7.892 3.061) 14.933 8.137 ( 4.859 2.659 0.309) 5.548 8.371 ( 4.481 5.875 -12.325) 14.370 8.526 ( -1.924 5.461 -6.350) 8.593 8.676 ( 7.301 -4.215 5.890) 10.284 8.996 ( 1.199 3.796 -3.586) 5.358 9.065 ( 1.870 -5.160 1.390) 5.662 9.200 ( -5.905 -5.812 7.472) 11.157 9.409 ( -0.061 -0.279 -5.581) 5.588 9.583 ( 2.610 -1.442 14.407) 14.712 9.925 ( 1.239 6.907 6.045) 9.262 10.130 ( -1.921 -9.062 -3.369) 9.857 10.221 ( -8.728 -5.616 3.377) 10.914 10.312 ( -3.307 -5.798 -2.024) 6.975 10.692 ( 2.401 -5.007 -10.090) 11.517 10.996 ( 3.666 7.523 -10.181) 13.179 11.059 ( -2.990 2.145 -2.571) 4.489 11.276 ( 3.568 4.394 -1.567) 5.873 11.511 ( 0.040 -1.425 3.549) 3.825 11.768 ( -1.614 0.833 2.806) 3.343 12.064 ( 2.983 4.745 0.125) 5.606 12.588 ( -0.377 0.478 6.333) 6.362 12.809 ( -5.147 -3.469 2.932) 6.865 12.954 ( 4.450 -1.946 2.412) 5.422 13.359 ( -3.425 -6.757 5.572) 9.404 13.447 ( 3.185 0.165 1.055) 3.360 13.569 ( -5.068 -7.833 -1.089) 9.393 13.606 ( -2.950 -1.697 0.284) 3.415 14.018 ( 2.474 5.582 -3.743) 7.162 14.542 ( -0.167 -0.979 -12.396) 12.436 15.194 ( 1.315 -4.414 -2.268) 5.134 15.295 ( -8.108 -13.210 3.252) 15.838 15.467 ( -1.703 3.344 4.019) 5.498 16.108 ( -17.387 -3.078 0.629) 17.669 16.318 ( 5.722 -6.257 5.366) 10.035 16.833 ( 10.191 -1.255 3.353) 10.802 17.037 ( 1.688 10.579 0.249) 10.715 17.626 ( 0.690 17.884 -4.467) 18.446 17.704 ( 10.465 8.992 -0.093) 13.798 18.047 ( 14.392 21.054 -0.697) 25.512 18.851 ( 11.406 21.836 -3.677) 24.909 20.519 ( -7.161 -8.480 4.176) 11.859 20.632 ( -5.630 -21.298 14.772) 26.524 20.786 ( -3.303 -4.209 -4.927) 7.273 20.902 ( -4.176 -3.336 5.657) 7.782 21.419 ( -2.261 -3.442 -1.777) 4.485 22.556 ( -10.387 -18.205 -3.796) 21.301 ======================= Grid point 196 (96/125) ======================= q-point: ( 0.56 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.494 ( 12.963 2.263 17.006) 21.503 2.376 ( -2.002 10.411 -6.749) 12.567 2.703 ( 10.079 16.570 4.631) 19.940 3.015 ( 18.094 3.333 -15.531) 24.077 3.556 ( -5.732 -0.640 6.523) 8.707 3.663 ( 2.434 -1.003 0.052) 2.633 3.864 ( -10.539 0.621 -3.109) 11.006 3.959 ( 4.132 5.652 19.661) 20.870 4.047 ( 2.248 6.168 2.665) 7.085 4.438 ( 2.815 2.228 -4.687) 5.904 4.499 ( -1.836 -0.153 -0.949) 2.072 4.738 ( 13.535 2.036 16.375) 21.342 4.895 ( -4.983 0.270 -0.104) 4.992 4.977 ( 0.036 -5.586 -10.060) 11.507 5.118 ( -0.442 -9.278 3.894) 10.072 5.326 ( -8.502 8.174 0.760) 11.818 5.599 ( 11.338 0.535 -8.510) 14.187 5.842 ( 1.280 4.459 3.946) 6.091 6.006 ( 3.615 9.051 -11.414) 15.009 6.129 ( -2.567 -6.148 0.384) 6.673 6.269 ( 2.174 4.268 2.523) 5.414 6.408 ( -2.737 -3.257 -2.653) 5.014 6.724 ( -1.493 2.811 -1.117) 3.373 7.015 ( -7.325 -5.725 -1.544) 9.424 7.134 ( -4.236 -5.495 -8.294) 10.813 7.251 ( 0.507 -5.575 4.583) 7.235 7.614 ( 3.011 -3.260 -4.285) 6.169 7.695 ( -5.981 -1.108 5.129) 7.957 7.824 ( -1.446 4.021 6.217) 7.544 8.236 ( 2.514 2.989 -0.267) 3.915 8.441 ( 2.555 5.326 -8.977) 10.746 8.552 ( -0.417 8.280 -8.741) 12.047 8.730 ( 3.717 -7.091 -1.644) 8.173 8.916 ( -2.205 -4.367 2.143) 5.341 8.985 ( -5.419 -10.411 4.413) 12.539 9.219 ( 4.650 4.914 -4.832) 8.314 9.338 ( -1.652 -2.685 -7.703) 8.323 9.582 ( -5.473 -5.976 7.808) 11.253 9.933 ( -1.922 -1.922 -0.952) 2.880 10.015 ( -6.027 -6.364 8.871) 12.471 10.042 ( -4.438 -3.739 -0.634) 5.838 10.229 ( -2.190 2.163 0.197) 3.084 10.703 ( 5.486 -2.618 -2.957) 6.760 10.998 ( -4.823 1.260 -1.161) 5.119 11.141 ( 7.823 9.697 -7.194) 14.387 11.373 ( 3.482 1.030 2.583) 4.456 11.538 ( 1.694 0.452 1.939) 2.614 11.778 ( 0.621 1.069 3.891) 4.083 12.087 ( -1.699 -2.544 -0.921) 3.195 12.557 ( -3.408 -3.161 0.988) 4.752 12.648 ( -9.516 -4.418 0.545) 10.505 13.072 ( 5.535 3.971 2.050) 7.114 13.151 ( -9.947 -11.745 1.012) 15.425 13.417 ( -2.221 -7.442 -2.893) 8.288 13.509 ( 4.044 0.039 3.330) 5.239 13.637 ( 3.181 5.292 -0.204) 6.177 14.060 ( 0.335 2.398 -6.362) 6.807 14.478 ( -0.928 -1.228 -7.637) 7.790 14.924 ( -7.954 -13.437 2.282) 15.780 15.203 ( -2.349 -4.629 1.509) 5.406 15.524 ( -9.094 3.933 11.445) 15.138 15.940 ( 2.021 7.520 -2.420) 8.154 16.422 ( 10.257 -6.417 -0.242) 12.101 16.863 ( -7.986 11.351 1.901) 14.008 17.349 ( 18.388 3.521 7.113) 20.028 17.779 ( -1.348 14.878 -8.211) 17.046 18.033 ( 14.564 12.562 0.523) 19.240 18.513 ( 13.921 19.730 -2.279) 24.254 19.125 ( 8.257 2.204 -5.528) 10.178 20.285 ( -10.871 -10.094 4.706) 15.563 20.471 ( -2.457 -10.865 21.906) 24.575 20.561 ( -11.130 -8.411 -2.561) 14.184 20.889 ( 0.259 0.868 4.002) 4.103 21.330 ( -1.333 -3.682 -6.402) 7.504 22.141 ( -13.480 -15.616 -7.597) 21.984 ======================= Grid point 197 (97/125) ======================= q-point: ( 0.67 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.887 ( 19.226 8.230 8.739) 22.666 2.377 ( -1.460 5.935 -6.381) 8.836 3.109 ( 12.757 9.171 3.856) 16.178 3.276 ( 8.656 -2.528 -6.610) 11.181 3.393 ( -6.660 2.353 0.588) 7.088 3.656 ( -3.265 0.528 1.805) 3.768 3.793 ( 1.474 5.911 0.387) 6.104 4.078 ( -2.956 -2.390 11.970) 12.559 4.180 ( 1.636 6.857 5.494) 8.938 4.421 ( -1.660 3.081 -9.113) 9.762 4.454 ( -2.734 -4.620 -0.446) 5.387 4.648 ( -6.016 -5.073 -0.614) 7.893 4.849 ( 4.852 -13.845 -0.755) 14.690 4.892 ( 0.960 -3.329 -4.242) 5.477 5.254 ( -9.584 7.198 1.647) 12.099 5.462 ( 13.469 14.353 15.040) 24.771 5.721 ( 6.587 -2.515 0.164) 7.053 5.922 ( 5.510 -3.045 1.447) 6.459 5.945 ( -8.373 0.011 -3.384) 9.031 6.120 ( 2.602 -1.465 -0.605) 3.047 6.219 ( -9.346 -7.473 -8.356) 14.595 6.412 ( 5.211 7.874 -3.596) 10.104 6.687 ( -3.730 2.220 2.662) 5.092 6.905 ( -3.284 1.537 5.635) 6.701 6.989 ( -1.369 0.452 -5.045) 5.247 7.228 ( -1.661 -2.580 1.897) 3.608 7.598 ( -7.760 5.511 -7.925) 12.385 7.706 ( 8.720 -3.840 -3.759) 10.243 7.922 ( 6.082 -0.473 13.201) 14.542 8.258 ( -1.466 0.629 -0.581) 1.697 8.474 ( -1.539 2.132 -5.523) 6.117 8.580 ( -2.291 6.970 -4.971) 8.862 8.702 ( 6.816 -6.038 -6.855) 11.397 8.849 ( 0.224 -7.373 3.022) 7.972 8.917 ( 0.979 -0.734 7.256) 7.359 9.221 ( -1.139 -1.624 -10.450) 10.637 9.261 ( -1.473 -10.358 -4.756) 11.493 9.434 ( -6.380 6.110 -0.682) 8.860 9.839 ( -1.972 -8.150 1.437) 8.508 9.935 ( -5.084 3.846 6.079) 8.809 9.996 ( 4.260 -6.544 -1.483) 7.948 10.232 ( -4.010 5.838 3.728) 8.003 10.760 ( 1.479 1.684 -1.514) 2.705 10.912 ( -4.546 -0.794 -0.426) 4.634 11.396 ( 8.320 5.084 -0.328) 9.756 11.440 ( 4.337 8.398 -1.652) 9.595 11.581 ( 2.272 -1.877 2.479) 3.851 11.850 ( 4.877 0.185 5.234) 7.156 11.970 ( -4.974 -6.920 -0.872) 8.566 12.331 ( -10.219 -6.612 -4.891) 13.117 12.534 ( -6.391 -0.035 4.511) 7.823 12.880 ( -5.404 -10.481 -0.884) 11.825 13.165 ( -0.840 2.587 -2.218) 3.510 13.339 ( 4.265 -7.482 -1.510) 8.744 13.625 ( 4.372 4.072 2.440) 6.453 13.739 ( 2.274 4.435 -3.347) 6.003 14.038 ( -0.619 0.193 -6.903) 6.934 14.439 ( 0.531 0.264 -3.888) 3.933 14.717 ( -4.152 -9.918 2.592) 11.060 15.131 ( -3.514 -1.088 2.072) 4.223 15.417 ( -6.024 -2.537 16.057) 17.337 16.121 ( 4.491 11.201 -9.326) 15.251 16.525 ( 8.374 -5.663 2.255) 10.357 16.902 ( -8.295 22.440 6.087) 24.686 17.590 ( -0.085 -2.495 4.716) 5.336 17.906 ( 13.077 4.705 -10.300) 17.299 18.400 ( 10.152 12.809 2.861) 16.593 18.806 ( 4.613 5.966 -4.495) 8.779 19.217 ( 8.243 -6.082 -1.906) 10.420 20.006 ( -9.842 -6.757 -0.886) 11.971 20.265 ( -12.068 -7.547 5.329) 15.199 20.482 ( -3.292 2.548 16.600) 17.114 20.910 ( -3.228 0.574 7.953) 8.602 21.280 ( 6.567 -5.074 -15.566) 17.640 21.775 ( -8.467 -9.695 -5.078) 13.837 ======================= Grid point 198 (98/125) ======================= q-point: (-0.22 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.280 ( 6.260 -3.697 -9.200) 11.726 2.416 ( 3.681 17.543 4.793) 18.555 2.990 ( -4.974 -14.641 4.751) 16.176 3.383 ( -3.711 0.210 3.582) 5.162 3.536 ( 5.009 4.085 -3.553) 7.376 3.596 ( -0.484 5.057 0.540) 5.109 3.896 ( -12.245 -5.645 3.464) 13.922 3.990 ( 8.836 8.536 2.882) 12.619 4.181 ( -9.603 -1.069 -1.169) 9.732 4.334 ( -2.131 -1.034 4.040) 4.683 4.421 ( 1.409 -3.080 1.557) 3.728 4.585 ( -1.110 0.355 1.396) 1.819 4.800 ( 7.216 -14.441 -1.891) 16.254 4.972 ( 7.090 4.465 -5.547) 10.048 5.161 ( -9.759 5.352 6.709) 12.996 5.572 ( -13.026 -6.102 -6.652) 15.848 5.755 ( 2.472 3.637 2.187) 4.911 5.876 ( 5.801 -3.334 5.212) 8.482 6.002 ( -1.361 0.638 -7.775) 7.919 6.070 ( 3.870 2.905 2.486) 5.440 6.131 ( 3.747 -5.260 1.705) 6.680 6.489 ( -2.424 2.394 0.114) 3.409 6.730 ( 4.423 9.024 -6.709) 12.084 6.902 ( -5.098 5.930 1.615) 7.986 7.067 ( 2.940 4.224 5.681) 7.666 7.214 ( 1.989 -0.931 5.747) 6.153 7.464 ( -4.290 0.794 -10.655) 11.514 7.711 ( 0.527 -7.835 -7.853) 11.106 8.075 ( 4.470 -1.360 13.617) 14.396 8.278 ( 1.563 -0.826 2.617) 3.159 8.362 ( -6.714 0.844 -1.705) 6.978 8.579 ( -0.672 2.158 -2.379) 3.281 8.814 ( 11.412 -2.440 -3.176) 12.095 8.867 ( 2.320 -1.448 0.468) 2.775 8.945 ( 1.278 -0.656 5.143) 5.340 9.084 ( -3.614 -1.284 -3.181) 4.983 9.170 ( -0.594 -1.072 -11.848) 11.911 9.455 ( 2.918 4.895 -4.123) 7.034 9.785 ( 3.197 -7.247 0.461) 7.934 9.937 ( -1.330 6.852 -3.041) 7.613 9.985 ( 1.732 -7.437 3.205) 8.281 10.235 ( -5.132 6.400 7.077) 10.834 10.722 ( -4.771 -0.336 -4.909) 6.854 10.877 ( 0.422 1.252 1.938) 2.345 11.412 ( -2.399 1.750 -0.842) 3.086 11.560 ( -2.141 -4.043 4.272) 6.259 11.694 ( -3.521 4.421 -0.748) 5.701 11.841 ( 5.761 -2.010 0.413) 6.115 11.988 ( 9.754 -2.964 1.563) 10.314 12.179 ( -1.073 0.797 0.733) 1.524 12.403 ( -6.304 0.033 0.583) 6.331 12.820 ( 5.188 -2.287 -0.186) 5.672 13.114 ( 0.796 -5.612 -3.604) 6.717 13.345 ( 0.327 -2.312 -2.304) 3.280 13.695 ( -3.224 3.757 -2.589) 5.587 13.782 ( 0.545 3.832 -2.049) 4.380 14.013 ( 1.834 -0.133 -4.437) 4.802 14.477 ( 3.270 2.770 -3.444) 5.498 14.587 ( -0.972 -8.735 2.717) 9.200 15.074 ( -2.581 -1.937 4.236) 5.325 15.434 ( 0.315 0.765 17.245) 17.265 16.169 ( 0.116 1.022 -14.467) 14.504 16.610 ( 0.586 2.040 5.365) 5.769 17.065 ( -6.166 24.974 12.069) 28.414 17.439 ( -7.091 -7.292 -9.783) 14.112 18.053 ( 2.867 -7.116 0.061) 7.672 18.609 ( -1.294 8.272 1.944) 8.596 18.866 ( 9.974 -5.862 -4.099) 12.273 19.173 ( -6.580 -6.492 -2.310) 9.528 19.923 ( 1.899 0.306 0.628) 2.024 20.045 ( -7.908 -3.324 8.074) 11.780 20.539 ( -2.611 8.390 10.777) 13.905 20.846 ( -3.950 -2.570 1.220) 4.867 21.256 ( 3.061 -6.646 -11.791) 13.877 21.723 ( 9.849 0.866 -3.243) 10.406 ======================= Grid point 203 (99/125) ======================= q-point: ( 0.33 0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.709 ( -22.259 6.133 22.030) 31.913 1.748 ( 10.097 19.823 21.237) 30.756 2.498 ( 0.217 2.061 -22.584) 22.679 2.990 ( -10.055 10.452 -18.755) 23.709 3.345 ( -11.193 16.275 35.596) 40.709 3.648 ( 1.093 -3.269 2.820) 4.453 3.810 ( 0.158 -2.313 2.122) 3.143 3.931 ( 8.656 3.217 3.224) 9.781 4.133 ( 5.201 4.789 6.575) 9.655 4.254 ( -6.912 -4.628 2.111) 8.582 4.423 ( 0.594 0.299 4.480) 4.529 4.501 ( -9.717 9.155 0.439) 13.358 4.795 ( 2.726 -4.972 -5.668) 8.017 5.096 ( 3.252 -4.611 -12.708) 13.905 5.250 ( 6.432 -8.910 1.774) 11.131 5.477 ( -6.920 0.756 -1.204) 7.065 5.600 ( -6.999 10.633 -23.716) 26.916 5.798 ( 2.826 5.154 7.851) 9.807 5.913 ( -1.495 1.566 -1.380) 2.568 6.110 ( 0.916 4.781 -9.879) 11.013 6.337 ( -4.025 1.915 1.628) 4.746 6.451 ( 3.273 1.582 1.017) 3.775 6.538 ( -1.814 -0.338 -0.575) 1.933 7.053 ( 0.917 -8.909 -0.325) 8.962 7.331 ( -2.622 -2.227 3.235) 4.722 7.443 ( 1.289 -0.909 -3.388) 3.737 7.634 ( 15.511 -12.290 -1.540) 19.849 7.833 ( 7.115 3.269 -4.142) 8.858 7.917 ( 0.455 -10.937 5.315) 12.169 8.173 ( -1.736 2.598 -1.732) 3.573 8.296 ( 6.255 -1.660 6.660) 9.286 8.361 ( -4.577 1.478 -9.879) 10.988 8.799 ( -7.724 -3.056 1.919) 8.526 8.944 ( -0.129 6.006 -2.431) 6.480 9.089 ( 2.360 -5.682 5.039) 7.953 9.120 ( -2.344 -8.124 0.598) 8.476 9.376 ( 5.584 0.900 0.157) 5.658 9.625 ( -5.194 -1.588 13.041) 14.127 9.822 ( 1.584 3.228 5.723) 6.759 10.149 ( 5.021 -7.581 1.940) 9.298 10.181 ( 4.209 -3.281 -4.590) 7.039 10.401 ( 2.696 -4.208 -1.319) 5.168 10.776 ( -4.107 -1.798 -10.536) 11.450 10.928 ( 0.046 5.369 -9.294) 10.734 11.147 ( -3.797 1.684 -5.797) 7.132 11.268 ( 0.723 6.985 -1.605) 7.204 11.555 ( -2.236 -1.198 2.891) 3.846 11.762 ( -0.200 1.839 2.246) 2.910 12.012 ( 1.000 3.175 4.066) 5.255 12.522 ( 2.328 -2.583 8.501) 9.185 12.775 ( 4.678 -5.614 1.817) 7.530 13.077 ( -5.408 4.729 -0.688) 7.217 13.366 ( 0.412 -7.380 2.953) 7.960 13.409 ( -0.997 -8.897 3.789) 9.722 13.535 ( 3.263 -1.834 1.501) 4.033 13.639 ( 3.904 -3.338 0.561) 5.167 13.935 ( -0.690 5.002 -1.651) 5.312 14.547 ( 0.626 -1.276 -11.661) 11.747 15.113 ( 4.348 -5.932 0.407) 7.366 15.338 ( 7.830 -10.056 0.694) 12.764 15.418 ( 0.326 -0.738 4.478) 4.550 16.274 ( 0.634 -9.012 -7.852) 11.969 16.327 ( 7.944 6.855 7.663) 12.993 16.928 ( -15.649 3.683 5.790) 17.087 17.085 ( -1.773 7.202 -9.053) 11.703 17.417 ( -0.587 10.712 5.919) 12.252 17.701 ( -7.829 10.464 -0.176) 13.070 18.064 ( -13.547 23.091 -1.142) 26.795 18.733 ( -7.316 14.689 1.729) 16.501 20.560 ( 5.318 -6.494 2.010) 8.631 20.761 ( -0.661 -3.368 -5.694) 6.649 20.829 ( 6.642 -7.225 9.583) 13.716 21.051 ( -4.402 -5.335 -0.863) 6.970 21.252 ( 10.257 -8.611 4.071) 13.997 22.544 ( 10.830 -18.948 -3.601) 22.120 ======================= Grid point 204 (100/125) ======================= q-point: ( 0.44 0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.527 ( -14.809 5.126 20.612) 25.892 2.233 ( 12.738 17.232 14.602) 25.931 2.502 ( 4.723 7.927 -16.469) 18.878 2.841 ( -9.867 12.413 -18.650) 24.480 3.526 ( 0.382 10.539 21.081) 23.572 3.614 ( -0.271 -2.806 -1.980) 3.445 3.854 ( 5.214 -3.030 3.162) 6.809 4.079 ( -2.357 4.810 -0.616) 5.392 4.164 ( 4.371 -3.645 7.448) 9.374 4.313 ( 1.000 -0.273 -1.104) 1.514 4.331 ( -9.705 18.079 17.755) 27.135 4.579 ( 1.618 4.060 9.165) 10.154 4.799 ( 6.329 -3.976 -6.593) 9.966 5.090 ( 5.577 -5.741 -9.822) 12.670 5.202 ( -4.167 -5.730 -2.851) 7.637 5.360 ( -2.467 -0.381 -11.605) 11.871 5.560 ( -2.503 13.115 -9.536) 16.407 5.811 ( -0.842 -1.705 -2.698) 3.301 5.873 ( -3.648 4.770 2.802) 6.626 6.217 ( 4.545 2.771 -4.186) 6.772 6.288 ( -2.667 -0.667 0.423) 2.782 6.510 ( -1.314 0.425 -2.208) 2.604 6.570 ( 5.052 7.398 0.537) 8.974 6.986 ( 3.141 -11.746 2.147) 12.347 7.226 ( -4.729 -3.598 -1.198) 6.062 7.418 ( -3.902 -5.675 2.021) 7.178 7.639 ( -2.849 -15.082 -4.830) 16.091 7.789 ( 7.193 -2.145 -0.349) 7.514 8.013 ( 2.852 5.061 -0.694) 5.850 8.123 ( -5.514 -0.196 -1.680) 5.767 8.309 ( 1.069 1.669 -7.564) 7.819 8.433 ( 6.873 -2.923 2.335) 7.825 8.683 ( -1.530 3.470 2.653) 4.628 9.006 ( -0.760 -0.948 -0.420) 1.286 9.057 ( -1.675 -0.465 2.821) 3.313 9.127 ( 6.724 -6.653 5.534) 10.959 9.374 ( -0.812 -4.377 -5.393) 6.993 9.630 ( -0.500 -1.551 14.174) 14.267 9.936 ( 4.909 2.564 6.303) 8.391 10.038 ( -3.814 -7.188 -7.125) 10.815 10.195 ( 1.500 -9.418 0.584) 9.555 10.361 ( -1.547 -1.816 -1.166) 2.655 10.640 ( -4.593 -2.426 -4.894) 7.137 10.988 ( 2.488 9.379 -8.054) 12.611 11.066 ( -0.615 -1.839 -2.897) 3.487 11.339 ( -2.662 6.722 -1.708) 7.429 11.521 ( -0.159 -0.108 3.166) 3.171 11.790 ( 0.575 1.936 0.697) 2.137 12.092 ( 0.427 3.950 0.131) 3.975 12.586 ( 2.434 -3.075 6.093) 7.246 12.775 ( 2.138 -7.504 -0.493) 7.818 12.967 ( -5.583 1.265 3.486) 6.702 13.342 ( 0.452 -6.007 3.504) 6.969 13.377 ( 4.775 -8.408 3.842) 10.405 13.536 ( -1.480 -3.952 0.673) 4.273 13.638 ( -0.600 0.423 0.262) 0.780 13.987 ( 2.250 2.448 -3.708) 4.980 14.492 ( -0.294 -0.967 -9.557) 9.610 15.108 ( 1.767 -8.832 0.558) 9.024 15.240 ( -2.453 -16.067 2.669) 16.471 15.520 ( 3.106 13.070 1.118) 13.480 16.165 ( 2.347 -7.924 -3.654) 9.036 16.459 ( -14.179 0.998 -0.599) 14.227 16.669 ( 2.124 -1.438 4.102) 4.838 17.170 ( -0.878 14.349 3.600) 14.820 17.618 ( 6.951 14.383 -0.731) 15.991 17.846 ( 3.201 13.302 -1.235) 13.737 18.100 ( -3.425 24.980 -1.660) 25.268 18.949 ( 4.868 20.684 -0.252) 21.250 20.494 ( -1.138 -16.903 7.922) 18.702 20.624 ( -6.821 -6.048 -5.280) 10.535 20.793 ( -6.498 -10.311 3.451) 12.667 20.922 ( 2.327 -2.886 9.138) 9.861 21.338 ( 4.237 -6.058 -3.085) 8.010 22.412 ( 0.546 -22.900 -4.300) 23.306 ======================= Grid point 205 (101/125) ======================= q-point: ( 0.56 0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.502 ( -1.561 5.093 16.518) 17.356 2.513 ( 1.479 7.911 -9.253) 12.263 2.701 ( 7.283 16.204 -6.957) 19.079 2.862 ( 2.838 18.243 1.734) 18.544 3.601 ( 0.603 -0.072 0.786) 0.994 3.659 ( 0.369 1.311 7.106) 7.235 3.894 ( 3.139 -4.963 -3.532) 6.852 4.093 ( -1.125 4.702 4.503) 6.607 4.136 ( -5.507 2.897 -0.580) 6.250 4.361 ( 3.570 5.897 4.728) 8.359 4.507 ( 0.809 2.744 2.973) 4.126 4.640 ( 4.470 -6.122 3.655) 8.416 4.897 ( -1.507 -4.801 2.874) 5.795 4.942 ( -3.324 -4.314 -1.837) 5.747 5.082 ( 0.403 -1.066 4.709) 4.845 5.401 ( 7.561 8.707 -14.338) 18.400 5.584 ( -8.135 9.887 0.867) 12.833 5.839 ( 7.044 -0.759 -0.122) 7.086 5.952 ( 3.767 9.524 -3.127) 10.709 6.159 ( -4.580 -6.753 -1.197) 8.247 6.323 ( 0.805 5.257 3.797) 6.535 6.451 ( -4.900 -0.398 -2.074) 5.336 6.719 ( 3.953 2.376 -2.726) 5.358 6.922 ( 3.445 -13.425 -0.450) 13.868 7.102 ( -3.340 -5.478 -4.499) 7.836 7.255 ( -4.839 -3.269 3.102) 6.613 7.493 ( 0.859 -7.715 -5.364) 9.436 7.822 ( -4.817 -1.947 9.306) 10.658 7.956 ( -4.062 6.007 -1.981) 7.517 8.201 ( 5.554 4.399 -1.504) 7.243 8.355 ( 5.139 2.980 -9.871) 11.521 8.475 ( 3.219 -2.399 -7.943) 8.900 8.767 ( -0.771 6.495 5.174) 8.339 8.916 ( -3.512 -5.776 3.816) 7.763 9.012 ( -3.945 -5.930 1.638) 7.308 9.166 ( 2.602 -2.024 -1.037) 3.456 9.281 ( -1.639 -3.996 -6.880) 8.123 9.628 ( -1.211 -6.890 11.201) 13.206 9.868 ( -1.672 -6.931 -7.915) 10.653 9.997 ( -2.372 -6.044 3.880) 7.563 10.127 ( -0.664 -3.077 0.465) 3.182 10.316 ( -2.713 2.996 2.310) 4.655 10.595 ( 3.226 -0.479 1.922) 3.786 11.046 ( 0.421 -0.919 -4.874) 4.978 11.141 ( 4.325 11.771 -0.919) 12.574 11.327 ( -0.448 1.788 -0.705) 1.973 11.559 ( -0.101 2.039 3.161) 3.763 11.819 ( -0.498 3.162 1.473) 3.524 12.079 ( -2.608 -2.183 -2.647) 4.310 12.555 ( -0.927 -5.290 0.394) 5.385 12.679 ( -2.262 -9.327 -3.528) 10.225 12.984 ( 1.625 -3.114 4.064) 5.372 13.269 ( -4.635 -2.658 3.771) 6.540 13.335 ( -0.617 -12.026 -0.375) 12.048 13.486 ( -0.021 2.217 3.664) 4.283 13.662 ( 0.494 5.058 -1.081) 5.196 14.023 ( 2.393 0.105 -5.061) 5.599 14.444 ( -0.269 -1.313 -5.481) 5.643 14.931 ( -7.606 -12.208 4.004) 14.931 15.134 ( 2.069 -7.188 -0.897) 7.533 15.730 ( 1.003 11.933 2.402) 12.213 16.103 ( -13.514 5.776 -6.542) 16.087 16.182 ( 6.854 -9.693 3.748) 12.450 16.908 ( 13.864 3.532 5.078) 15.181 17.322 ( 0.013 14.517 3.887) 15.029 17.836 ( 1.302 11.151 -4.107) 11.954 18.057 ( 5.763 20.280 -2.131) 21.190 18.449 ( 14.473 18.922 -0.410) 23.826 19.096 ( -5.036 5.992 -6.204) 9.987 20.340 ( -2.956 -14.177 12.281) 18.988 20.468 ( -0.147 -5.799 6.670) 8.839 20.598 ( -5.747 -10.426 -2.305) 12.126 20.944 ( -3.192 0.893 10.030) 10.564 21.274 ( -0.908 -6.628 -7.779) 10.260 22.107 ( -6.687 -20.397 -5.864) 22.251 ======================= Grid point 206 (102/125) ======================= q-point: ( 0.67 0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.726 ( 11.897 6.932 13.974) 19.617 2.523 ( -4.918 13.277 -7.047) 15.816 2.994 ( 14.405 10.721 -8.011) 19.663 3.127 ( 1.820 10.002 4.841) 11.260 3.553 ( -6.570 -2.389 1.186) 7.090 3.698 ( 1.687 5.767 2.187) 6.394 3.861 ( -0.708 0.214 -0.849) 1.126 4.102 ( 3.453 -1.244 2.257) 4.309 4.223 ( 2.833 3.907 7.303) 8.753 4.418 ( -5.444 -5.226 0.412) 7.558 4.480 ( -1.271 3.509 -6.050) 7.109 4.606 ( 1.754 -8.536 -2.537) 9.076 4.694 ( -1.981 -10.377 0.726) 10.590 4.810 ( -3.242 -4.290 -7.485) 9.216 5.352 ( 8.375 3.202 6.245) 10.927 5.530 ( 4.393 4.406 -9.068) 10.997 5.612 ( -1.133 15.078 10.157) 18.215 5.934 ( 1.531 -1.438 6.688) 7.011 5.952 ( -5.639 -11.057 4.579) 13.229 6.119 ( 1.595 8.824 -7.266) 11.542 6.309 ( -8.007 -2.487 -1.569) 8.529 6.411 ( 2.129 4.588 0.581) 5.092 6.752 ( 0.599 2.662 2.826) 3.928 6.867 ( 4.149 -6.893 -0.165) 8.047 6.984 ( 0.196 -3.332 -6.786) 7.563 7.250 ( -1.951 1.371 2.057) 3.149 7.457 ( 6.114 -3.686 -8.882) 11.395 7.806 ( -2.710 2.435 11.506) 12.069 7.925 ( -3.943 2.566 0.029) 4.705 8.282 ( -0.993 -0.054 -1.892) 2.137 8.450 ( 5.890 3.915 -8.566) 11.108 8.472 ( 4.566 0.142 -9.586) 10.619 8.727 ( -6.747 1.837 -0.777) 7.036 8.807 ( -4.573 -8.949 3.012) 10.491 8.953 ( -0.197 1.688 7.331) 7.525 9.132 ( 1.216 -6.893 -6.764) 9.734 9.188 ( -1.419 -5.169 -2.967) 6.126 9.559 ( -3.702 -0.956 0.409) 3.845 9.838 ( 3.384 -9.375 2.618) 10.306 9.843 ( -4.031 -3.657 -1.213) 5.576 10.059 ( -3.855 -0.094 2.899) 4.824 10.362 ( -1.280 7.505 2.425) 7.990 10.723 ( 6.354 1.871 7.006) 9.642 10.988 ( -3.985 -1.262 -3.286) 5.317 11.335 ( 4.396 10.399 -2.174) 11.497 11.416 ( 7.954 5.071 1.542) 9.559 11.546 ( -2.051 -1.177 -1.265) 2.682 11.855 ( -1.283 2.252 4.904) 5.547 11.957 ( -2.911 -6.661 -2.492) 7.685 12.402 ( -8.826 -7.002 -6.352) 12.934 12.588 ( 2.811 -5.148 0.403) 5.880 12.842 ( -7.735 -12.448 -0.403) 14.661 13.136 ( -2.444 -14.742 -2.584) 15.165 13.295 ( -0.381 6.881 4.720) 8.353 13.592 ( 4.925 5.302 3.685) 8.121 13.740 ( 2.557 5.496 -3.614) 7.057 14.023 ( -0.175 -0.392 -3.097) 3.127 14.411 ( 0.260 -1.547 -2.422) 2.885 14.720 ( -6.376 -8.241 3.602) 11.025 15.105 ( 2.152 -5.065 -2.803) 6.176 15.640 ( -12.939 0.780 9.318) 15.964 16.148 ( 2.716 11.549 -18.159) 21.691 16.320 ( 12.998 -0.246 12.015) 17.702 17.203 ( 7.581 9.741 11.793) 17.071 17.516 ( 5.028 12.204 1.896) 13.335 17.818 ( -5.235 0.955 -13.421) 14.438 18.411 ( 10.191 19.487 1.100) 22.018 18.852 ( -1.293 10.913 0.444) 10.998 18.940 ( 8.646 -8.275 -4.122) 12.658 20.125 ( -10.888 -7.557 -0.609) 13.268 20.364 ( -7.067 -10.305 2.425) 12.728 20.604 ( 6.153 -0.064 21.564) 22.425 20.943 ( 0.184 2.049 1.038) 2.304 21.117 ( -4.314 -7.226 -12.180) 14.805 21.777 ( -7.512 -13.819 -4.000) 16.230 ======================= Grid point 207 (103/125) ======================= q-point: ( 0.78 0.44 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.070 ( 13.373 2.477 4.415) 14.300 2.611 ( -1.519 18.710 3.909) 19.175 2.997 ( -12.121 -8.717 -6.820) 16.414 3.329 ( 15.758 6.852 -3.887) 17.617 3.488 ( -3.638 1.601 4.657) 6.123 3.769 ( -4.053 4.173 2.606) 6.374 3.960 ( 6.807 10.269 3.016) 12.685 4.091 ( -12.023 -3.836 7.625) 14.745 4.234 ( 2.023 -10.631 -2.701) 11.154 4.311 ( 7.631 -6.280 -0.316) 9.888 4.346 ( -9.256 -0.620 -10.343) 13.894 4.570 ( 0.105 -6.533 4.937) 8.189 4.658 ( -0.629 -0.532 3.415) 3.513 4.812 ( 9.170 3.001 -6.874) 11.847 5.389 ( 0.590 0.562 -3.577) 3.669 5.550 ( -0.991 1.391 -10.749) 10.884 5.734 ( -5.554 -12.525 11.246) 17.726 5.861 ( 1.449 1.438 4.113) 4.592 5.922 ( -1.559 -1.273 6.289) 6.604 6.125 ( -2.130 6.326 -1.672) 6.881 6.203 ( -3.791 3.441 0.873) 5.194 6.496 ( 3.128 2.942 -1.043) 4.419 6.793 ( -3.883 5.614 -5.681) 8.881 6.989 ( 9.259 3.949 5.292) 11.372 7.017 ( 5.374 1.561 1.972) 5.933 7.178 ( -2.345 -3.173 0.463) 3.972 7.484 ( -0.983 -1.000 -10.777) 10.868 7.736 ( -8.639 5.254 -4.646) 11.128 7.986 ( 6.896 -5.798 14.659) 17.206 8.214 ( 1.313 -3.086 -2.913) 4.442 8.474 ( -4.590 0.040 -0.519) 4.619 8.563 ( 4.199 1.683 -5.697) 7.274 8.670 ( 0.847 2.174 -2.643) 3.526 8.757 ( 5.972 -3.006 3.416) 7.508 8.896 ( -0.983 -7.911 -2.137) 8.254 9.096 ( -1.071 -3.062 -2.946) 4.382 9.169 ( 1.482 3.973 1.394) 4.463 9.468 ( -4.128 0.667 -6.923) 8.088 9.709 ( -1.176 -6.103 6.067) 8.686 9.890 ( 3.068 -1.316 -3.038) 4.514 10.037 ( -2.046 2.909 2.061) 4.110 10.417 ( -3.403 8.621 4.888) 10.479 10.823 ( -6.495 1.162 -2.280) 6.982 10.879 ( 1.050 -1.756 4.769) 5.190 11.466 ( -2.082 -1.809 -5.150) 5.842 11.488 ( 6.522 2.215 -1.037) 6.966 11.700 ( 10.598 7.400 3.971) 13.522 11.792 ( -2.211 -2.077 -1.820) 3.537 11.889 ( -3.394 -2.165 4.525) 6.057 12.200 ( -3.133 -3.034 -3.183) 5.399 12.556 ( -10.720 -0.388 1.539) 10.836 12.644 ( 7.519 -8.183 -3.570) 11.673 12.946 ( 1.270 -17.361 -2.151) 17.539 13.372 ( -0.607 4.890 1.873) 5.272 13.749 ( 2.250 5.582 0.757) 6.066 13.805 ( 1.955 6.308 -4.399) 7.935 13.990 ( -1.785 -0.928 -0.351) 2.042 14.416 ( 3.116 -1.335 -1.628) 3.761 14.566 ( -4.586 -5.786 1.862) 7.614 15.075 ( 0.762 -4.474 -0.650) 4.585 15.543 ( -4.250 2.182 10.555) 11.586 16.153 ( -1.683 2.745 -13.751) 14.123 16.633 ( 9.046 8.460 12.532) 17.619 17.434 ( -0.994 0.987 5.344) 5.524 17.490 ( -14.121 12.088 -3.147) 18.853 17.848 ( 13.527 0.574 -7.544) 15.499 18.652 ( -1.114 -13.534 -2.140) 13.748 18.742 ( 3.213 16.584 2.695) 17.106 19.156 ( 3.416 -1.698 0.488) 3.846 19.908 ( -2.941 -0.672 -3.793) 4.847 20.185 ( -7.203 -5.997 9.281) 13.190 20.714 ( -2.381 -2.800 15.139) 15.579 20.896 ( -7.887 -2.735 -10.710) 13.579 21.046 ( 9.370 1.656 -5.860) 11.175 21.594 ( 0.680 -5.580 -1.545) 5.829 ======================= Grid point 212 (104/125) ======================= q-point: ( 0.33 0.56 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.822 ( 3.547 12.150 -2.237) 12.854 2.223 ( -17.878 7.879 10.609) 22.232 2.572 ( -9.664 12.401 -8.443) 17.845 3.213 ( -11.499 9.189 -15.336) 21.257 3.513 ( 4.889 0.079 8.641) 9.929 3.738 ( 0.749 -2.679 -1.270) 3.058 3.805 ( -6.747 1.540 6.939) 9.800 3.952 ( 2.228 -1.078 8.147) 8.514 4.090 ( 1.843 13.780 6.716) 15.440 4.335 ( -2.245 -1.841 4.904) 5.699 4.421 ( 2.512 -0.293 7.235) 7.664 4.677 ( 1.030 -9.055 -0.850) 9.153 4.871 ( 0.898 -6.062 3.056) 6.848 4.938 ( -7.660 9.026 5.371) 13.000 5.034 ( 2.375 -6.980 -5.479) 9.186 5.525 ( 1.536 -0.394 -7.392) 7.560 5.694 ( -1.695 0.768 -4.677) 5.034 5.836 ( -0.731 8.442 3.628) 9.217 5.989 ( -3.266 11.302 -16.012) 19.869 6.217 ( -9.418 3.968 0.219) 10.222 6.306 ( 2.859 -4.310 3.835) 6.439 6.450 ( 1.324 2.557 -6.681) 7.275 6.657 ( -3.678 5.963 2.406) 7.408 6.892 ( 4.767 -10.301 -0.613) 11.367 7.146 ( 17.229 -11.265 -4.050) 20.980 7.318 ( 3.744 -2.942 5.065) 6.952 7.421 ( -1.037 -4.195 -8.721) 9.733 7.820 ( 0.080 0.295 8.236) 8.242 7.890 ( -0.482 4.706 4.260) 6.366 8.197 ( -2.517 -2.266 4.319) 5.489 8.293 ( -0.667 3.418 1.557) 3.815 8.403 ( -3.673 1.105 -13.790) 14.313 8.871 ( -4.143 -6.852 4.097) 8.994 8.931 ( 1.724 -2.440 2.364) 3.810 9.055 ( 0.356 1.136 -5.284) 5.416 9.085 ( -2.187 -8.002 -0.623) 8.319 9.263 ( 4.135 -2.187 -2.309) 5.217 9.669 ( -0.082 -3.939 7.594) 8.555 9.822 ( 8.600 -3.984 -1.741) 9.636 9.961 ( 3.342 -0.858 6.768) 7.597 10.136 ( -0.154 -1.632 -4.156) 4.468 10.301 ( 4.703 2.050 0.891) 5.207 10.797 ( -2.705 2.339 -9.605) 10.249 10.947 ( 0.143 0.427 0.222) 0.502 11.247 ( -4.666 9.845 -7.244) 13.083 11.298 ( -1.891 -0.245 1.178) 2.241 11.584 ( -0.690 -2.830 4.296) 5.191 11.830 ( -2.076 6.077 0.772) 6.468 11.993 ( 1.104 -4.448 3.121) 5.544 12.455 ( 2.912 -7.604 6.967) 10.716 12.615 ( 9.968 -4.583 0.651) 10.991 13.071 ( 5.727 -4.729 -2.330) 7.784 13.277 ( 6.233 -8.134 1.414) 10.345 13.367 ( -7.711 -3.804 -1.747) 8.774 13.571 ( -0.199 1.504 1.729) 2.301 13.601 ( -4.230 3.876 0.280) 5.744 13.993 ( -1.702 2.942 -3.276) 4.720 14.471 ( 1.339 -2.045 -6.526) 6.968 14.914 ( 5.800 -9.435 3.274) 11.549 15.092 ( 7.128 -8.736 2.298) 11.507 15.578 ( -0.674 10.524 14.710) 18.099 16.096 ( 1.202 -5.803 -11.458) 12.900 16.328 ( 2.116 4.243 -1.873) 5.098 17.062 ( 8.909 16.982 -4.608) 19.723 17.321 ( -16.027 0.113 2.336) 16.197 17.675 ( -13.498 9.834 7.738) 18.406 18.033 ( -14.625 12.331 -0.162) 19.130 18.492 ( -9.891 21.063 -3.247) 23.495 18.965 ( -10.861 -1.914 3.415) 11.545 20.385 ( 8.025 -6.715 2.947) 10.871 20.521 ( 13.906 -7.630 -3.545) 16.253 20.771 ( 1.980 -4.950 1.546) 5.551 20.918 ( 16.516 0.374 12.687) 20.830 21.179 ( -10.545 -7.047 -5.626) 13.875 22.122 ( 13.111 -16.129 -7.098) 21.964 ======================= Grid point 213 (105/125) ======================= q-point: ( 0.44 0.56 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.958 ( -15.435 7.441 -4.730) 17.776 2.087 ( 7.912 8.235 2.412) 11.672 2.652 ( -0.487 21.309 4.241) 21.733 3.064 ( -8.749 11.318 -15.230) 20.895 3.599 ( 0.958 0.224 1.229) 1.574 3.688 ( 2.109 -9.053 0.980) 9.347 3.729 ( -5.974 3.918 8.013) 10.735 4.107 ( 4.941 6.457 8.002) 11.408 4.199 ( -1.294 6.410 -5.642) 8.637 4.286 ( -1.144 -1.925 6.403) 6.783 4.561 ( 1.402 -5.384 -2.104) 5.948 4.669 ( 5.150 4.741 7.242) 10.073 4.784 ( -5.316 0.898 11.248) 12.473 4.934 ( 3.711 -6.571 0.238) 7.550 5.097 ( 2.992 5.826 5.101) 8.302 5.412 ( -5.459 -5.680 -1.791) 8.079 5.662 ( -2.694 15.999 -26.097) 30.729 5.849 ( -3.477 2.861 0.893) 4.590 6.035 ( -9.772 -0.139 1.303) 9.860 6.110 ( 6.749 1.747 -4.275) 8.178 6.284 ( 0.138 -7.207 3.630) 8.070 6.469 ( 0.759 3.836 -8.410) 9.275 6.681 ( -3.261 6.301 3.220) 7.792 6.852 ( 2.107 -8.494 4.990) 10.074 7.209 ( -0.242 -5.022 -11.058) 12.148 7.396 ( 3.697 -3.145 7.270) 8.741 7.438 ( 11.824 -6.731 -3.912) 14.157 7.692 ( -5.940 -7.305 3.235) 9.955 8.006 ( 3.201 9.585 -2.230) 10.349 8.220 ( -2.891 -0.184 1.838) 3.431 8.307 ( -1.732 1.190 -0.511) 2.163 8.368 ( 2.963 3.284 2.474) 5.068 8.722 ( -3.197 -3.774 -1.243) 5.100 8.973 ( 5.568 -5.316 3.937) 8.647 9.003 ( -0.216 -2.227 4.267) 4.817 9.082 ( 0.688 0.580 -2.212) 2.388 9.284 ( 3.028 -4.034 -2.526) 5.641 9.625 ( -0.498 -8.871 6.987) 11.303 9.905 ( 5.010 -0.271 -0.342) 5.029 10.011 ( 1.360 -6.656 0.887) 6.851 10.087 ( -1.527 -2.504 0.950) 3.083 10.329 ( -0.207 -0.140 -5.485) 5.490 10.719 ( -5.557 0.869 -1.886) 5.932 10.995 ( 2.833 4.091 -3.848) 6.290 11.116 ( -7.205 3.312 -2.943) 8.458 11.397 ( 2.335 5.172 0.445) 5.692 11.540 ( -1.144 -1.166 1.679) 2.342 11.839 ( -2.225 4.854 -1.267) 5.488 12.057 ( 5.487 -1.593 1.448) 5.894 12.476 ( 5.499 -9.263 6.089) 12.374 12.677 ( 1.902 -4.102 -0.525) 4.551 13.121 ( 2.802 -16.304 3.323) 16.873 13.150 ( -3.984 3.459 -4.054) 6.654 13.286 ( 1.862 -5.290 5.879) 8.124 13.577 ( -2.152 0.941 2.182) 3.206 13.623 ( 2.087 3.362 -1.172) 4.127 13.993 ( -0.967 2.037 -1.788) 2.878 14.443 ( 0.526 -1.869 -4.949) 5.317 14.924 ( 6.521 -10.062 0.523) 12.002 15.140 ( 2.626 -7.485 6.278) 10.116 15.688 ( -4.089 14.006 4.217) 15.188 15.970 ( 3.435 -11.323 -11.449) 16.465 16.472 ( 5.914 6.631 -1.879) 9.082 16.964 ( -24.912 0.802 -2.530) 25.053 17.364 ( 1.548 17.460 5.889) 18.492 17.614 ( 3.381 4.496 1.245) 5.762 18.035 ( -6.722 20.814 1.173) 21.904 18.504 ( -13.084 20.283 -2.008) 24.220 18.996 ( 8.432 9.134 3.989) 13.055 20.334 ( 1.648 -16.850 0.655) 16.943 20.603 ( 1.842 -6.431 -6.540) 9.355 20.840 ( -8.367 -7.697 -3.640) 11.937 20.862 ( 3.454 -2.373 13.736) 14.361 21.153 ( 9.071 -4.975 -0.731) 10.372 22.093 ( 7.231 -20.201 -4.787) 21.984 ======================= Grid point 214 (106/125) ======================= q-point: ( 0.56 0.56 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.756 ( -12.822 9.589 2.811) 16.256 2.347 ( 12.399 5.560 -6.385) 15.014 2.925 ( -2.363 23.337 1.209) 23.488 3.052 ( -1.265 17.036 0.051) 17.083 3.602 ( 0.893 0.450 -2.169) 2.388 3.640 ( 4.308 -9.106 3.305) 10.602 3.747 ( 0.317 0.342 -1.801) 1.860 4.166 ( -3.763 5.390 -9.295) 11.385 4.219 ( -2.223 0.954 7.870) 8.233 4.338 ( 5.873 -0.058 -1.452) 6.051 4.496 ( 1.570 -5.446 -4.003) 6.939 4.637 ( -6.230 0.190 4.270) 7.555 4.834 ( 0.500 -9.701 1.317) 9.803 5.061 ( 7.262 6.556 19.696) 21.992 5.095 ( -10.165 -1.762 -1.699) 10.456 5.359 ( 2.914 7.444 -1.525) 8.139 5.744 ( -0.387 3.853 -9.617) 10.368 5.814 ( -2.999 14.758 -1.599) 15.145 5.936 ( 2.522 2.518 -5.417) 6.484 6.161 ( -1.454 -7.238 5.348) 9.117 6.267 ( 6.452 -5.255 2.156) 8.596 6.486 ( -0.000 3.434 -8.336) 9.016 6.643 ( 0.631 -8.976 3.323) 9.592 6.846 ( -3.263 1.164 2.495) 4.270 7.089 ( -2.066 -3.244 -9.303) 10.066 7.327 ( -6.657 -8.010 1.047) 10.468 7.410 ( -0.292 -2.609 0.480) 2.668 7.784 ( 10.443 1.095 1.827) 10.658 8.083 ( -7.480 0.384 -4.306) 8.639 8.159 ( 3.628 7.461 1.199) 8.382 8.299 ( 0.752 1.713 -1.953) 2.704 8.453 ( -0.853 3.851 0.637) 3.996 8.766 ( 7.156 1.564 3.128) 7.965 8.961 ( -3.110 -2.653 4.615) 6.165 8.995 ( -0.219 -6.264 4.444) 7.684 9.078 ( 1.102 -5.845 -2.121) 6.315 9.300 ( -1.344 4.123 -3.189) 5.383 9.523 ( 2.049 -15.653 4.363) 16.379 9.878 ( -6.775 -5.025 -3.321) 9.065 10.022 ( 4.301 -4.971 -2.040) 6.883 10.030 ( 0.004 1.246 5.280) 5.425 10.314 ( 2.516 0.472 -6.954) 7.410 10.633 ( -4.128 0.447 5.628) 6.994 10.974 ( 0.604 -4.385 -3.015) 5.356 11.200 ( 2.464 14.740 -0.344) 14.948 11.397 ( -3.077 0.869 -0.279) 3.209 11.590 ( 1.096 2.850 2.976) 4.264 11.858 ( -0.085 4.910 -1.387) 5.103 12.092 ( 0.195 -2.166 -1.991) 2.949 12.447 ( 1.911 -13.561 0.280) 13.698 12.611 ( -2.240 -6.642 -3.143) 7.682 12.977 ( -2.267 -5.618 2.427) 6.526 13.169 ( 3.081 -7.729 -0.642) 8.345 13.321 ( 1.850 -0.106 7.937) 8.151 13.553 ( -2.612 1.824 3.820) 4.974 13.687 ( 1.262 3.529 -1.748) 4.135 13.984 ( -0.046 0.836 -2.068) 2.231 14.417 ( 0.140 -1.254 -2.371) 2.686 14.925 ( 2.479 -7.576 -2.096) 8.242 15.056 ( -4.662 -6.626 5.575) 9.834 15.797 ( 3.123 9.845 -5.450) 11.678 15.941 ( 6.970 -5.862 -3.146) 9.635 16.474 ( -20.312 3.032 -2.800) 20.727 16.720 ( 8.206 3.480 -0.311) 8.919 17.467 ( -1.590 4.999 10.723) 11.937 17.901 ( 10.132 18.131 -6.478) 21.757 18.170 ( -0.953 16.752 1.389) 16.837 18.540 ( -3.051 18.954 -0.512) 19.205 19.227 ( 0.520 7.095 -0.034) 7.114 20.188 ( 3.530 -16.029 4.934) 17.138 20.474 ( -4.476 -6.288 -7.885) 11.034 20.557 ( -5.457 -12.945 2.319) 14.238 21.041 ( 1.518 1.094 18.114) 18.211 21.162 ( 2.443 -4.155 -11.750) 12.700 21.940 ( 0.155 -18.552 -3.091) 18.809 ======================= Grid point 215 (107/125) ======================= q-point: ( 0.67 0.56 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.773 ( -1.122 11.978 9.015) 15.033 2.574 ( 9.599 6.220 -2.915) 11.804 3.015 ( -3.670 18.514 -8.169) 20.567 3.293 ( -0.609 13.661 10.030) 16.959 3.584 ( -1.665 -3.555 -6.918) 7.954 3.701 ( 10.239 -6.266 2.510) 12.263 3.756 ( 1.118 5.684 1.652) 6.024 4.075 ( -4.112 0.542 -10.074) 10.895 4.186 ( 0.611 -12.092 4.752) 13.006 4.416 ( 4.270 0.319 -1.805) 4.647 4.482 ( 1.424 -0.600 -1.773) 2.352 4.552 ( -3.942 -1.482 -0.671) 4.264 4.696 ( -6.836 -3.113 -4.331) 8.671 4.887 ( -8.821 -0.802 1.366) 8.962 5.282 ( 3.992 -0.504 8.048) 8.997 5.503 ( 3.524 7.765 -3.025) 9.049 5.679 ( 3.028 -1.676 -5.457) 6.462 5.944 ( -1.382 5.973 8.810) 10.733 6.018 ( -3.956 -6.838 1.794) 8.101 6.126 ( 4.872 8.678 4.283) 10.834 6.346 ( 4.357 -3.998 0.309) 5.921 6.447 ( -2.917 3.615 0.129) 4.647 6.626 ( 6.225 -8.343 -0.932) 10.451 6.804 ( 0.917 2.510 -2.662) 3.772 6.946 ( -5.514 -3.123 -5.552) 8.425 7.299 ( 4.206 3.518 -0.644) 5.521 7.343 ( -2.948 -3.864 -2.905) 5.662 7.900 ( -1.356 -0.013 10.868) 10.953 8.003 ( -1.430 3.449 -5.327) 6.505 8.282 ( 0.485 1.043 0.165) 1.163 8.347 ( 5.311 3.887 -6.757) 9.432 8.454 ( -1.587 6.933 -4.859) 8.614 8.834 ( -5.356 -7.507 4.040) 10.068 8.866 ( -6.338 -0.667 4.983) 8.090 8.983 ( -2.413 -8.131 -0.505) 8.496 8.998 ( 5.925 2.620 -0.735) 6.520 9.187 ( -5.097 -6.563 -0.790) 8.347 9.533 ( 5.410 -4.829 4.621) 8.599 9.732 ( -1.914 -0.682 -4.552) 4.985 9.919 ( -6.755 -3.698 1.875) 7.926 10.080 ( 0.832 -2.287 0.003) 2.434 10.401 ( 5.515 5.784 -3.353) 8.667 10.683 ( 3.919 2.037 11.484) 12.304 10.945 ( 2.297 -4.776 -3.824) 6.535 11.342 ( 0.822 2.087 -0.835) 2.394 11.448 ( 2.434 15.265 1.799) 15.562 11.574 ( -3.115 -2.490 0.110) 3.990 11.927 ( 1.128 4.132 0.229) 4.289 11.979 ( -8.157 -1.843 -1.936) 8.584 12.361 ( 6.698 -14.523 -3.110) 16.293 12.443 ( -6.195 -6.473 -6.168) 10.878 12.868 ( -4.531 -9.344 1.856) 10.549 13.077 ( -4.707 -6.927 -0.152) 8.377 13.390 ( -0.269 3.852 6.761) 7.786 13.597 ( 2.767 3.758 5.016) 6.851 13.722 ( 1.313 2.274 -3.329) 4.240 14.010 ( 1.769 1.785 -0.296) 2.531 14.396 ( -0.960 -1.001 -0.086) 1.389 14.804 ( -7.486 -4.277 1.609) 8.771 14.980 ( 2.096 -5.792 -3.766) 7.219 15.879 ( -4.600 1.470 2.074) 5.256 16.012 ( 6.527 -1.757 -9.250) 11.456 16.284 ( -0.566 10.920 1.124) 10.992 16.990 ( 17.577 0.207 3.418) 17.908 17.559 ( 3.589 4.055 0.117) 5.416 18.055 ( -10.649 12.911 1.007) 16.767 18.402 ( 9.893 13.937 -1.795) 17.185 18.747 ( 6.887 9.233 -0.959) 11.559 19.101 ( -13.094 1.220 0.846) 13.178 20.187 ( -2.389 -7.181 0.330) 7.575 20.298 ( 1.078 -9.967 -7.461) 12.497 20.458 ( 6.933 -7.074 10.610) 14.515 20.958 ( -5.263 -9.916 -5.290) 12.410 21.189 ( -2.817 7.299 5.165) 9.374 21.736 ( -4.201 -11.597 -0.767) 12.358 ======================= Grid point 216 (108/125) ======================= q-point: (-0.22 -0.44 -0.78) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.967 ( 5.774 7.510 8.031) 12.419 2.805 ( 4.512 14.964 3.056) 15.925 3.147 ( 8.780 5.123 -7.138) 12.421 3.197 ( -16.951 -0.123 -1.160) 16.991 3.557 ( -0.491 1.862 3.397) 3.905 3.798 ( 0.260 -4.111 -0.631) 4.167 3.875 ( 9.865 -2.730 -2.116) 10.452 4.048 ( 3.639 5.043 -4.191) 7.499 4.082 ( 4.661 -13.539 3.844) 14.826 4.369 ( -12.103 -1.436 1.799) 12.320 4.467 ( 1.217 -7.115 -0.273) 7.223 4.478 ( -4.678 0.679 -7.145) 8.567 4.644 ( 4.927 2.636 0.533) 5.613 4.813 ( -3.045 9.094 -0.000) 9.590 5.248 ( -0.409 -7.208 -4.781) 8.659 5.528 ( -1.008 -5.575 -1.531) 5.868 5.763 ( 3.556 0.168 -0.073) 3.561 5.890 ( 2.386 -8.427 1.775) 8.937 6.015 ( -6.996 9.865 7.026) 13.987 6.242 ( -6.425 -4.919 0.677) 8.120 6.247 ( 0.647 5.994 1.695) 6.263 6.521 ( -0.353 6.284 5.997) 8.694 6.746 ( 13.476 -4.976 0.946) 14.397 6.885 ( 0.803 4.238 -2.121) 4.807 6.919 ( 6.256 5.667 -7.173) 11.077 7.230 ( -3.391 -2.672 -2.005) 4.760 7.424 ( 5.012 2.712 0.848) 5.762 7.908 ( 0.021 -5.145 14.205) 15.108 7.950 ( -8.573 5.869 -8.888) 13.673 8.186 ( -3.813 -3.658 -4.471) 6.922 8.494 ( 6.581 3.395 -2.476) 7.808 8.516 ( 0.128 4.660 -3.264) 5.691 8.658 ( -1.959 -3.820 -1.759) 4.639 8.747 ( -6.248 -3.627 4.082) 8.298 8.847 ( -2.726 -6.197 1.670) 6.972 9.070 ( -1.440 -1.318 -5.273) 5.623 9.164 ( 4.647 4.142 3.550) 7.166 9.540 ( -4.021 -0.449 0.280) 4.056 9.698 ( -0.628 -7.633 7.850) 10.967 9.842 ( 0.962 5.155 -4.651) 7.010 10.078 ( 0.230 0.477 0.576) 0.782 10.537 ( 1.854 8.253 0.900) 8.507 10.833 ( 4.899 -0.741 10.306) 11.435 10.895 ( -2.350 -4.393 -3.949) 6.357 11.361 ( 0.111 -2.179 -6.222) 6.593 11.471 ( 2.518 -0.063 -2.830) 3.789 11.663 ( 0.028 4.473 4.285) 6.194 11.842 ( 0.669 5.734 -1.527) 5.972 11.978 ( -4.044 0.905 4.743) 6.298 12.214 ( -5.605 -6.270 -4.059) 9.339 12.397 ( 8.605 -5.557 -6.350) 12.052 12.677 ( -5.014 -9.900 1.121) 11.154 12.880 ( -10.704 -4.092 0.541) 11.473 13.440 ( -0.780 3.460 3.364) 4.888 13.736 ( 5.421 3.019 2.003) 6.520 13.773 ( 4.036 1.929 -1.284) 4.654 14.053 ( -1.300 3.823 2.243) 4.619 14.360 ( -0.638 -2.356 -0.545) 2.501 14.643 ( -7.556 -2.173 1.150) 7.946 14.960 ( 4.046 -5.044 -5.374) 8.408 15.721 ( -10.926 -0.233 5.880) 12.410 16.102 ( 6.184 2.494 -9.488) 11.596 16.549 ( 12.982 8.692 2.499) 15.822 17.316 ( 15.442 -5.118 10.197) 19.200 17.584 ( 0.898 -4.458 -14.568) 15.261 17.960 ( -12.702 17.901 4.916) 22.494 18.587 ( -2.922 -6.925 0.547) 7.536 18.809 ( 5.852 6.605 -0.401) 8.834 19.112 ( 1.996 6.941 2.324) 7.587 19.955 ( -7.311 -6.256 -6.461) 11.591 20.240 ( -1.368 -4.823 7.407) 8.944 20.676 ( 6.287 -7.386 6.670) 11.772 20.715 ( 3.471 -5.844 -16.881) 18.198 21.192 ( -7.691 6.991 7.323) 12.715 21.584 ( -4.696 -2.242 0.887) 5.279 ======================= Grid point 221 (109/125) ======================= q-point: ( 0.33 0.67 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.906 ( -6.732 6.691 -11.195) 14.677 2.550 ( -5.999 14.018 1.349) 15.307 2.924 ( -13.577 6.229 5.646) 15.969 3.392 ( -7.851 -2.412 -1.236) 8.306 3.487 ( 2.098 5.597 2.420) 6.449 3.731 ( 4.103 3.192 -0.780) 5.257 3.799 ( 1.693 3.877 -5.003) 6.552 3.967 ( -5.322 -2.510 5.823) 8.278 4.214 ( 15.765 -4.158 3.111) 16.598 4.350 ( -6.980 11.300 4.636) 14.068 4.443 ( -1.838 -1.768 4.795) 5.431 4.562 ( 4.756 -8.294 -0.745) 9.590 4.619 ( 0.842 -10.656 6.206) 12.360 4.946 ( -3.717 -7.567 -6.252) 10.496 5.307 ( -5.477 3.010 4.505) 7.704 5.476 ( -2.393 4.055 -0.993) 4.812 5.634 ( 7.332 1.201 2.044) 7.706 5.969 ( -2.122 4.099 6.162) 7.699 6.085 ( 0.620 -1.049 -12.386) 12.446 6.243 ( -4.995 2.360 -6.933) 8.865 6.373 ( 5.937 -0.880 -7.697) 9.761 6.443 ( -4.737 9.141 2.001) 10.488 6.604 ( 6.762 -0.966 0.601) 6.857 6.776 ( 6.104 -1.061 2.631) 6.731 6.887 ( -2.200 -4.423 3.395) 5.994 7.261 ( 3.287 -0.563 3.657) 4.949 7.387 ( -2.209 -0.805 -8.423) 8.745 7.906 ( -3.727 2.826 6.180) 7.750 7.970 ( -2.562 1.435 3.691) 4.717 8.271 ( -3.545 -3.676 3.255) 6.056 8.347 ( -0.497 5.096 -4.135) 6.581 8.418 ( -3.503 1.792 -2.236) 4.526 8.816 ( 1.930 -10.892 5.470) 12.340 8.907 ( -0.825 -0.607 0.394) 1.097 8.997 ( 1.664 -9.239 -4.305) 10.327 9.042 ( -0.780 1.399 -6.839) 7.024 9.190 ( 1.762 -4.047 -1.440) 4.643 9.598 ( 8.318 2.739 -5.461) 10.320 9.672 ( -1.965 -1.875 4.780) 5.498 9.931 ( 0.661 -5.667 0.297) 5.713 10.078 ( 3.033 -1.098 0.012) 3.225 10.352 ( -0.284 10.506 4.231) 11.330 10.825 ( -0.083 4.656 -10.250) 11.258 10.908 ( 4.036 -0.902 1.706) 4.473 11.328 ( -2.437 0.277 1.222) 2.740 11.460 ( -6.870 3.691 0.374) 7.808 11.573 ( -2.162 1.315 1.040) 2.736 11.897 ( 0.763 -3.015 2.854) 4.222 11.991 ( -5.645 1.348 -1.684) 6.043 12.334 ( 15.537 -2.507 0.636) 15.751 12.352 ( 1.953 -10.239 7.768) 13.000 12.893 ( 6.389 -9.229 -2.055) 11.411 13.088 ( 2.001 -7.671 -1.701) 8.109 13.456 ( -4.945 -0.013 -3.000) 5.784 13.632 ( 0.080 5.031 -0.077) 5.033 13.714 ( -4.214 2.445 -2.839) 5.639 14.028 ( -1.259 2.720 -3.378) 4.516 14.416 ( 0.072 -2.099 -2.898) 3.579 14.782 ( 2.722 -5.794 3.899) 7.495 14.943 ( 3.268 -5.539 2.949) 7.075 15.736 ( 4.321 12.838 21.822) 25.685 16.013 ( -4.899 -10.283 -9.828) 15.044 16.361 ( -1.757 8.188 -8.006) 11.585 17.034 ( 11.510 16.556 -2.862) 20.366 17.515 ( -3.948 0.039 6.325) 7.456 18.063 ( -19.385 1.329 0.211) 19.432 18.386 ( -7.997 14.499 0.758) 16.576 18.753 ( -3.934 7.932 -2.088) 9.097 19.109 ( -10.243 -6.645 -0.475) 12.219 20.171 ( 7.688 -12.538 2.563) 14.929 20.232 ( 12.076 3.476 2.689) 12.851 20.586 ( 12.587 2.536 -9.418) 15.923 20.772 ( 4.878 -8.972 20.637) 23.025 21.314 ( -11.346 -0.591 -10.487) 15.462 21.762 ( 8.297 -10.060 -4.830) 13.906 ======================= Grid point 222 (110/125) ======================= q-point: ( 0.44 0.67 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.920 ( 4.395 9.936 -14.712) 18.289 2.454 ( -18.073 8.336 3.064) 20.137 2.913 ( -3.577 19.634 3.926) 20.340 3.189 ( -5.545 -3.852 -4.692) 8.222 3.547 ( 0.080 -2.154 1.508) 2.630 3.733 ( -5.532 5.662 -2.953) 8.449 3.856 ( -3.026 0.906 0.717) 3.239 4.047 ( 10.702 4.326 9.919) 15.220 4.310 ( -3.511 6.743 -6.120) 9.760 4.363 ( -5.028 -4.423 8.258) 10.632 4.470 ( 1.254 -7.191 -3.351) 8.032 4.562 ( 11.937 -1.139 5.146) 13.049 4.672 ( 6.952 -1.898 4.383) 8.434 4.789 ( -0.973 -8.032 -4.708) 9.360 5.322 ( 1.779 2.894 12.994) 13.431 5.429 ( -5.705 2.226 1.399) 6.281 5.764 ( -2.591 10.065 -9.562) 14.123 5.966 ( 1.198 -3.744 2.343) 4.576 6.027 ( -1.657 4.716 -7.444) 8.967 6.114 ( -4.833 -4.637 -7.622) 10.146 6.297 ( -6.912 -2.451 -1.173) 7.427 6.438 ( 0.969 -0.510 -2.814) 3.020 6.778 ( 0.490 -1.776 10.335) 10.497 6.800 ( -0.314 6.440 -4.263) 7.730 6.997 ( 14.246 0.482 -4.882) 15.067 7.286 ( -0.580 -4.946 -2.936) 5.781 7.354 ( 1.675 4.023 5.659) 7.143 7.799 ( -9.504 -5.585 6.625) 12.861 8.019 ( 3.960 4.945 -6.010) 8.733 8.222 ( 0.739 -3.314 5.907) 6.813 8.389 ( -0.840 7.805 -0.982) 7.911 8.404 ( -2.444 4.806 2.159) 5.808 8.725 ( -3.080 -7.225 0.259) 7.858 8.835 ( 3.349 -6.617 -1.553) 7.577 9.002 ( 3.139 -4.494 9.476) 10.947 9.042 ( 0.045 0.990 -4.488) 4.596 9.191 ( 3.333 -2.338 -2.117) 4.588 9.563 ( -1.460 -7.382 0.252) 7.529 9.793 ( 4.605 0.872 2.908) 5.515 9.899 ( 4.890 -6.052 -3.846) 8.680 10.084 ( -0.250 -2.024 -1.005) 2.274 10.389 ( -5.007 4.781 -1.998) 7.206 10.812 ( -3.188 4.605 -5.831) 8.085 10.957 ( 1.963 -1.804 0.753) 2.770 11.304 ( -5.659 4.334 3.280) 7.847 11.427 ( -1.097 7.717 -0.326) 7.802 11.542 ( -0.846 -0.312 -0.636) 1.103 11.886 ( 1.368 -5.074 0.466) 5.276 11.956 ( 1.229 3.090 -2.951) 4.446 12.315 ( 2.749 -11.381 7.445) 13.875 12.580 ( 9.481 0.016 1.399) 9.583 12.837 ( 4.204 -14.545 0.485) 15.148 13.106 ( 9.497 -9.640 1.968) 13.675 13.344 ( -7.249 2.229 -3.001) 8.156 13.637 ( -3.379 5.987 -2.441) 7.296 13.695 ( -2.836 3.978 2.467) 5.473 14.016 ( -1.001 0.681 -1.826) 2.191 14.403 ( 1.086 -1.272 -0.933) 1.915 14.738 ( 3.142 -9.209 0.276) 9.734 15.047 ( 6.299 -0.711 6.141) 8.826 15.786 ( -2.515 -10.082 -13.484) 17.023 15.932 ( -3.578 9.227 16.335) 19.099 16.463 ( 3.244 12.697 -10.778) 16.967 17.355 ( -7.064 11.648 -12.004) 18.157 17.473 ( 1.197 14.370 10.658) 17.931 17.678 ( -12.509 -10.670 6.487) 17.675 18.415 ( -10.399 19.648 0.716) 22.242 18.860 ( -6.677 -6.856 -0.282) 9.575 18.906 ( 4.524 17.185 0.586) 17.780 20.118 ( 3.183 -15.877 -0.178) 16.194 20.415 ( 7.284 -5.986 -4.964) 10.655 20.770 ( 9.484 4.685 6.298) 12.312 20.907 ( 6.921 -6.950 -1.096) 9.869 21.025 ( -11.349 -4.268 -0.517) 12.136 21.769 ( 7.719 -13.312 -2.818) 15.644 ======================= Grid point 223 (111/125) ======================= q-point: ( 0.56 0.67 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.037 ( -2.082 14.022 -14.229) 20.086 2.293 ( -5.510 5.705 6.653) 10.352 3.155 ( 5.983 2.922 3.100) 7.345 3.157 ( 2.242 19.876 2.095) 20.112 3.448 ( -4.613 -7.108 -4.994) 9.836 3.685 ( -3.973 2.598 -2.006) 5.154 3.803 ( -3.860 3.908 -1.257) 5.635 4.189 ( -1.167 -10.489 -4.331) 11.408 4.262 ( -4.335 1.965 -4.329) 6.434 4.308 ( 2.726 4.994 6.657) 8.757 4.445 ( 1.021 -1.226 -0.473) 1.664 4.647 ( 1.447 -4.729 -0.516) 4.972 4.754 ( 4.348 -3.271 6.131) 8.197 4.888 ( 13.458 -0.000 3.098) 13.810 5.279 ( -10.501 -3.119 -2.243) 11.181 5.484 ( -0.686 7.358 14.530) 16.301 5.785 ( 1.152 8.654 -13.882) 16.399 5.916 ( -4.139 2.267 2.188) 5.201 5.975 ( -0.385 -0.671 -6.307) 6.354 6.089 ( 5.602 -1.787 2.220) 6.285 6.144 ( -5.168 -7.001 2.055) 8.941 6.447 ( 1.677 1.695 -6.154) 6.600 6.663 ( -6.761 -4.493 6.983) 10.708 6.933 ( -0.468 6.050 -1.062) 6.160 7.034 ( -1.051 -1.997 -10.679) 10.915 7.271 ( 3.077 -3.384 -4.830) 6.652 7.466 ( -1.643 -3.065 12.269) 12.752 7.661 ( 2.612 1.049 4.236) 5.086 8.096 ( 2.666 5.473 -13.461) 14.774 8.233 ( -0.207 0.885 3.232) 3.358 8.373 ( -6.265 1.192 7.780) 10.060 8.513 ( 1.944 5.441 5.845) 8.219 8.669 ( 3.801 0.837 -0.830) 3.979 8.878 ( 6.037 -3.882 -1.200) 7.277 9.006 ( 0.338 -1.321 -6.354) 6.499 9.050 ( -2.232 -0.939 13.917) 14.126 9.254 ( 7.904 -4.558 -1.404) 9.231 9.425 ( -5.873 -7.263 0.980) 9.392 9.848 ( 6.199 -3.935 0.060) 7.343 9.920 ( -1.366 -3.024 2.705) 4.281 10.048 ( 1.548 -1.341 -3.839) 4.351 10.297 ( -5.153 1.123 -6.851) 8.646 10.740 ( -5.634 0.123 1.959) 5.966 10.927 ( -0.765 -4.026 -2.664) 4.888 11.365 ( -1.600 16.575 4.023) 17.132 11.430 ( -2.006 -0.943 0.017) 2.217 11.600 ( 2.338 4.969 -0.541) 5.518 11.886 ( 1.894 0.149 -0.429) 1.948 11.995 ( 4.185 -2.881 -4.921) 7.073 12.274 ( 2.545 -11.709 4.179) 12.690 12.576 ( -2.524 -6.623 -2.027) 7.372 12.860 ( 7.847 -9.236 2.227) 12.322 13.141 ( -1.040 -2.598 1.706) 3.277 13.305 ( 2.327 1.855 3.345) 4.477 13.641 ( -3.002 3.674 1.249) 4.906 13.700 ( -0.594 3.587 1.313) 3.866 13.998 ( -0.601 -0.236 -0.237) 0.688 14.407 ( -0.181 0.296 1.184) 1.234 14.741 ( 6.596 -7.746 -1.848) 10.340 15.114 ( -1.091 -1.756 5.051) 5.458 15.637 ( 2.993 -6.119 -18.139) 19.376 15.992 ( -3.082 7.155 10.051) 12.717 16.578 ( 2.216 6.117 -5.174) 8.313 16.991 ( -25.736 6.601 -7.867) 27.709 17.539 ( -1.584 -8.192 13.041) 15.482 17.854 ( 12.212 18.706 -2.563) 22.486 18.427 ( -8.172 15.889 -0.913) 17.891 18.767 ( -2.845 5.603 1.357) 6.428 19.188 ( 9.087 6.279 2.529) 11.331 19.998 ( 1.808 -13.364 0.276) 13.489 20.354 ( 0.841 -11.747 -8.462) 14.502 20.641 ( -13.027 -4.309 -8.045) 15.906 21.005 ( 3.999 -9.294 3.544) 10.721 21.063 ( 8.811 8.268 7.810) 14.387 21.741 ( 4.080 -11.123 0.153) 11.849 ======================= Grid point 224 (112/125) ======================= q-point: (-0.33 -0.33 -0.78) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.044 ( -8.925 17.222 1.633) 19.466 2.416 ( 10.493 0.751 3.544) 11.101 3.236 ( -8.382 2.555 -12.125) 14.960 3.358 ( 14.257 0.238 -2.855) 14.542 3.442 ( 2.768 12.481 8.351) 15.270 3.597 ( -1.291 -6.676 -2.383) 7.205 3.843 ( -0.606 11.670 -0.595) 11.701 4.026 ( -1.076 -15.575 -0.853) 15.636 4.151 ( -6.043 -1.643 -6.061) 8.715 4.358 ( 0.214 -2.957 0.653) 3.036 4.470 ( 1.956 2.536 -2.430) 4.020 4.573 ( -2.947 -3.263 -1.733) 4.726 4.806 ( -5.617 3.876 1.201) 6.930 5.052 ( -7.939 -0.183 1.341) 8.053 5.135 ( 13.903 -4.079 2.735) 14.745 5.541 ( -3.963 0.151 6.109) 7.284 5.687 ( -5.444 2.698 -8.150) 10.165 5.951 ( -2.683 -13.245 1.805) 13.634 5.978 ( 5.434 3.892 1.886) 6.945 6.145 ( 9.606 -3.107 -1.073) 10.153 6.224 ( 3.450 10.851 9.866) 15.066 6.461 ( 1.554 0.760 -7.750) 7.941 6.576 ( -2.232 2.588 4.959) 6.023 6.825 ( -5.090 -2.491 -3.794) 6.820 7.012 ( -3.460 2.312 -5.796) 7.136 7.248 ( 0.471 -0.038 -4.162) 4.188 7.381 ( -3.640 -2.360 4.689) 6.388 7.859 ( 9.219 1.478 5.464) 10.818 8.083 ( -3.941 3.088 -5.989) 7.806 8.284 ( 2.834 3.458 -2.521) 5.133 8.316 ( -2.914 -1.850 5.569) 6.552 8.541 ( -1.587 3.668 -3.813) 5.524 8.844 ( 5.630 3.848 5.077) 8.501 8.878 ( -2.193 -3.824 -1.239) 4.579 8.982 ( 0.621 1.224 -2.172) 2.570 9.029 ( -5.792 -1.648 13.429) 14.717 9.166 ( -2.808 -12.935 0.791) 13.260 9.422 ( 4.680 2.934 1.672) 5.771 9.806 ( -6.176 1.001 -1.985) 6.563 9.939 ( 4.918 -2.209 -1.987) 5.746 10.052 ( -3.057 -2.277 1.670) 4.162 10.275 ( 8.702 2.066 -8.238) 12.160 10.697 ( -0.053 -1.346 8.090) 8.201 10.872 ( -0.361 -2.285 -1.527) 2.772 11.377 ( -2.085 0.156 0.993) 2.315 11.562 ( 0.387 13.239 -0.357) 13.249 11.598 ( -1.426 -1.540 -0.141) 2.104 11.939 ( 2.529 -0.944 0.484) 2.742 12.023 ( 2.059 1.857 -7.281) 7.791 12.185 ( -1.588 -7.007 2.398) 7.574 12.429 ( -3.753 -8.694 -3.154) 9.981 12.852 ( -1.634 -4.104 -0.537) 4.450 13.106 ( -1.997 -0.919 2.420) 3.270 13.411 ( 4.391 0.477 7.908) 9.058 13.616 ( -2.144 0.573 2.352) 3.234 13.735 ( -0.254 1.982 0.542) 2.070 14.002 ( 0.855 1.242 1.294) 1.987 14.419 ( -0.607 1.854 2.312) 3.025 14.757 ( 3.983 -5.911 -4.985) 8.698 15.022 ( -7.875 -1.633 2.643) 8.465 15.653 ( 13.012 -2.410 -18.531) 22.771 16.062 ( -2.180 4.154 8.952) 10.107 16.556 ( -14.653 7.268 -2.837) 16.601 16.751 ( 4.914 0.445 -3.669) 6.149 17.522 ( 1.907 -4.441 5.214) 7.110 18.183 ( 9.063 9.106 -2.694) 13.127 18.446 ( -3.863 7.671 2.050) 8.830 18.838 ( -1.030 11.391 0.815) 11.466 19.248 ( -3.515 -5.207 2.595) 6.797 20.019 ( 9.942 -1.775 -0.614) 10.118 20.169 ( -2.125 -13.381 -9.217) 16.386 20.421 ( -5.593 -2.724 -0.366) 6.232 20.910 ( -2.949 -7.286 -9.083) 12.012 21.290 ( 3.444 3.910 13.213) 14.204 21.706 ( -0.324 -1.953 1.994) 2.810 ======================= Grid point 225 (113/125) ======================= q-point: (-0.22 -0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.092 ( -4.457 11.397 5.953) 13.608 2.686 ( 17.335 -0.677 8.175) 19.178 3.068 ( -2.813 -2.148 -19.544) 19.862 3.458 ( -6.249 1.344 4.141) 7.616 3.591 ( 3.767 6.468 -3.308) 8.183 3.651 ( 7.384 -3.559 7.737) 11.272 3.765 ( -3.377 -14.381 -3.807) 15.255 3.901 ( -2.635 -3.208 -3.440) 5.392 4.111 ( 2.580 8.083 2.095) 8.739 4.299 ( 1.906 -9.527 -0.051) 9.716 4.457 ( -2.601 -3.661 -5.888) 7.405 4.580 ( -0.297 4.649 -3.887) 6.067 4.670 ( -7.133 6.312 -2.677) 9.894 4.984 ( -5.500 6.639 2.119) 8.878 5.258 ( -3.426 -6.765 4.843) 8.997 5.407 ( 4.304 -11.856 1.646) 12.720 5.728 ( 2.882 9.714 -5.663) 11.608 5.753 ( -3.093 -13.009 -0.076) 13.372 6.160 ( 5.603 -0.335 0.935) 5.691 6.221 ( -1.964 4.507 6.356) 8.035 6.343 ( 4.588 0.187 1.604) 4.864 6.499 ( 3.466 -0.102 -4.490) 5.673 6.661 ( -1.951 7.806 9.156) 12.189 6.811 ( 6.883 6.621 -7.103) 11.902 6.960 ( -2.696 5.138 -1.730) 6.055 7.210 ( -1.050 -3.157 -5.025) 6.027 7.386 ( 2.374 0.722 5.732) 6.246 7.940 ( -2.855 -6.874 7.512) 10.575 8.053 ( 0.281 5.328 -4.540) 7.005 8.220 ( -5.209 -4.185 -4.195) 7.890 8.370 ( 5.986 -0.999 -0.717) 6.111 8.559 ( 0.856 6.758 -6.392) 9.341 8.693 ( -8.863 -5.184 -1.797) 10.423 8.837 ( -5.047 -3.138 4.422) 7.407 8.936 ( -7.957 1.302 10.767) 13.451 9.090 ( 0.062 3.911 -0.743) 3.981 9.128 ( 4.388 2.090 3.995) 6.292 9.510 ( 4.739 -3.441 5.277) 7.883 9.746 ( -6.672 2.071 -1.841) 7.224 9.900 ( -2.063 4.275 -1.394) 4.947 10.036 ( 3.465 -1.679 -1.009) 3.981 10.496 ( 11.669 6.013 -5.078) 14.075 10.744 ( 3.707 -5.704 6.154) 9.173 10.864 ( 0.459 -0.663 2.591) 2.713 11.377 ( -1.705 1.133 -0.168) 2.054 11.421 ( -3.494 -5.976 -4.661) 8.346 11.744 ( 4.623 3.389 1.194) 5.856 11.830 ( -7.721 -6.195 -3.536) 10.511 12.089 ( 1.477 9.428 2.917) 9.978 12.195 ( 1.198 2.351 0.447) 2.677 12.272 ( -2.067 -5.257 -6.445) 8.570 12.716 ( -8.596 -3.074 0.112) 9.130 13.050 ( -6.204 1.158 2.640) 6.841 13.495 ( -0.496 0.975 5.509) 5.616 13.626 ( 5.429 -3.466 -0.729) 6.482 13.749 ( 0.913 0.424 3.673) 3.808 14.071 ( 3.405 2.687 2.368) 4.941 14.414 ( -4.312 2.188 1.858) 5.180 14.719 ( -0.845 -2.968 -4.793) 5.700 14.888 ( -4.877 -0.674 -0.852) 4.996 15.855 ( 15.325 1.074 -10.378) 18.540 15.966 ( -11.323 -1.271 -0.036) 11.394 16.486 ( 0.777 7.933 -0.418) 7.982 16.970 ( 18.909 -3.867 1.870) 19.391 17.508 ( -0.029 -5.586 -2.338) 6.056 18.263 ( -5.008 0.360 4.953) 7.053 18.489 ( 6.583 -4.331 -1.090) 7.955 18.877 ( -7.998 8.635 1.095) 11.821 19.170 ( -0.116 0.107 1.920) 1.927 19.927 ( -3.082 -12.817 -7.788) 15.311 20.225 ( 5.334 5.775 -2.384) 8.215 20.426 ( 9.789 -1.448 4.121) 10.720 20.700 ( -8.502 -5.121 -12.242) 15.760 21.346 ( -3.062 -2.425 10.153) 10.878 21.722 ( -4.336 10.209 3.382) 11.596 ======================= Grid point 275 (114/125) ======================= q-point: ( 0.33 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.488 ( -0.000 0.000 36.493) 36.493 1.488 ( -0.000 0.000 36.493) 36.493 2.655 ( 0.000 -0.000 -23.210) 23.210 2.655 ( 0.000 -0.000 -23.210) 23.210 2.746 ( -0.000 0.000 69.223) 69.223 3.800 ( -0.000 -0.000 0.032) 0.032 3.800 ( 0.000 0.000 0.032) 0.032 3.925 ( 0.000 -0.000 -0.790) 0.790 4.050 ( 0.000 -0.000 -2.045) 2.045 4.369 ( -0.000 0.000 0.680) 0.680 4.369 ( 0.000 0.000 0.680) 0.680 4.599 ( 0.000 -0.000 -6.625) 6.625 4.599 ( 0.000 -0.000 -6.625) 6.625 5.130 ( 0.000 -0.000 -40.308) 40.308 5.372 ( 0.000 -0.000 -15.291) 15.291 5.384 ( -0.000 0.000 7.831) 7.831 5.384 ( -0.000 0.000 7.831) 7.831 5.904 ( 0.000 -0.000 -3.641) 3.641 5.904 ( 0.000 -0.000 -3.641) 3.641 5.913 ( -0.000 0.000 3.355) 3.355 6.257 ( 0.000 -0.000 -0.938) 0.938 6.566 ( -0.000 0.000 3.294) 3.294 6.566 ( -0.000 0.000 3.294) 3.294 7.143 ( -0.000 0.000 0.633) 0.633 7.361 ( 0.000 -0.000 -4.307) 4.307 7.361 ( 0.000 -0.000 -4.307) 4.307 7.980 ( -0.000 0.000 6.524) 6.524 8.022 ( 0.000 -0.000 -7.419) 7.419 8.022 ( 0.000 -0.000 -7.419) 7.419 8.255 ( 0.000 -0.000 -2.538) 2.538 8.308 ( -0.000 0.000 1.757) 1.757 8.589 ( -0.000 0.000 3.363) 3.363 8.589 ( -0.000 0.000 3.363) 3.363 8.787 ( -0.000 0.000 2.920) 2.920 9.256 ( -0.000 0.000 5.651) 5.651 9.256 ( -0.000 0.000 5.651) 5.651 9.473 ( -0.000 0.000 2.686) 2.686 9.588 ( -0.000 0.000 13.323) 13.323 9.588 ( -0.000 0.000 13.323) 13.323 10.370 ( 0.000 -0.000 -12.833) 12.833 10.424 ( -0.000 0.000 6.451) 6.451 10.424 ( -0.000 0.000 6.451) 6.451 10.753 ( 0.000 -0.000 -17.699) 17.699 10.753 ( 0.000 -0.000 -17.699) 17.699 11.075 ( 0.000 -0.000 -3.683) 3.683 11.075 ( 0.000 -0.000 -3.683) 3.683 11.689 ( -0.000 0.000 3.285) 3.285 11.772 ( -0.000 0.000 3.229) 3.229 11.772 ( -0.000 0.000 3.229) 3.229 12.559 ( -0.000 0.000 11.496) 11.496 12.979 ( -0.000 0.000 1.796) 1.796 12.979 ( -0.000 0.000 1.796) 1.796 13.374 ( -0.000 0.000 2.105) 2.105 13.488 ( -0.000 0.000 3.271) 3.271 13.770 ( -0.000 0.000 4.646) 4.646 13.807 ( -0.000 0.000 1.710) 1.710 13.807 ( -0.000 0.000 1.710) 1.710 14.526 ( 0.000 -0.000 -17.448) 17.448 14.923 ( 0.000 -0.000 -0.834) 0.834 15.903 ( -0.000 0.000 3.044) 3.044 15.903 ( 0.000 0.000 3.044) 3.044 16.106 ( 0.000 -0.000 -6.613) 6.613 16.106 ( 0.000 -0.000 -6.613) 6.613 16.828 ( -0.000 0.000 0.288) 0.288 17.313 ( 0.000 -0.000 -0.347) 0.347 17.313 ( 0.000 -0.000 -0.347) 0.347 17.542 ( -0.000 0.000 0.853) 0.853 17.542 ( -0.000 0.000 0.853) 0.853 17.819 ( -0.000 0.000 4.111) 4.111 20.750 ( -0.000 0.000 0.968) 0.968 20.750 ( -0.000 0.000 0.968) 0.968 21.068 ( -0.000 -0.000 -0.521) 0.521 21.068 ( 0.000 -0.000 -0.521) 0.521 21.587 ( 0.000 -0.000 -3.254) 3.254 23.056 ( -0.000 0.000 2.071) 2.071 ======================= Grid point 276 (115/125) ======================= q-point: ( 0.44 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.562 ( 3.668 -12.221 35.045) 37.295 1.804 ( 5.933 15.479 30.284) 34.524 2.451 ( -6.835 2.691 -25.978) 26.997 2.693 ( 12.283 -0.164 -22.325) 25.482 3.258 ( 15.732 9.816 52.058) 55.262 3.694 ( -3.331 -4.008 -0.182) 5.215 3.822 ( -0.342 2.725 -0.523) 2.795 3.949 ( -3.440 -2.992 0.544) 4.591 4.067 ( 4.327 -1.257 6.331) 7.771 4.317 ( -1.133 1.963 -1.720) 2.845 4.425 ( 1.711 0.704 -5.723) 6.015 4.452 ( -1.077 1.862 7.403) 7.709 4.743 ( 4.652 4.387 -14.715) 16.044 5.110 ( 10.321 7.508 -31.917) 34.374 5.263 ( -2.623 -3.032 -4.249) 5.841 5.391 ( 0.165 -1.453 -1.334) 1.980 5.462 ( -0.482 0.706 -0.837) 1.196 5.751 ( -1.376 -6.839 5.862) 9.111 5.905 ( 0.023 -1.784 2.615) 3.166 6.045 ( 1.766 6.615 -6.966) 9.767 6.292 ( 4.515 4.362 -0.719) 6.319 6.460 ( -4.460 -6.109 4.747) 8.930 6.592 ( -2.391 1.383 -1.478) 3.133 7.147 ( -0.738 1.046 0.043) 1.280 7.349 ( 1.654 -5.495 -1.193) 5.861 7.393 ( 2.060 5.273 -2.865) 6.345 7.781 ( -9.899 -6.047 -0.902) 11.635 7.948 ( -11.851 -3.969 2.946) 12.841 8.114 ( -1.126 -5.311 -4.196) 6.861 8.155 ( -4.957 -0.866 -2.137) 5.467 8.188 ( 1.905 1.092 -1.283) 2.543 8.449 ( -6.979 0.188 2.646) 7.466 8.775 ( 9.442 -3.015 0.622) 9.932 8.847 ( 2.590 7.043 0.667) 7.533 9.205 ( -3.878 -4.519 2.327) 6.394 9.303 ( -3.740 6.643 4.234) 8.720 9.351 ( -4.617 -5.292 3.761) 7.966 9.683 ( 3.844 0.076 11.684) 12.300 9.786 ( 4.295 5.708 7.870) 10.629 10.217 ( -5.958 -1.604 -7.900) 10.024 10.330 ( -9.112 -4.081 5.880) 11.587 10.442 ( -1.937 -5.491 -1.709) 6.068 10.722 ( 4.000 -1.876 -13.474) 14.180 10.779 ( 4.712 6.761 -11.766) 14.365 11.060 ( 1.720 -2.655 -1.990) 3.737 11.157 ( 6.400 5.363 -3.008) 8.875 11.587 ( -3.140 -3.235 1.785) 4.849 11.766 ( -1.253 0.294 2.816) 3.096 11.952 ( 7.307 4.877 1.628) 8.935 12.599 ( -1.318 0.633 9.478) 9.590 12.895 ( -6.423 -2.513 3.371) 7.677 13.004 ( 2.385 -1.545 0.030) 2.842 13.404 ( 2.144 1.525 -2.133) 3.387 13.495 ( -0.887 -1.217 7.780) 7.924 13.681 ( -7.165 -5.153 2.165) 9.087 13.714 ( -7.308 -4.261 -0.129) 8.461 13.878 ( 2.276 5.258 1.012) 5.818 14.487 ( 1.800 0.543 -13.979) 14.105 15.052 ( 9.354 6.282 -0.320) 11.272 15.538 ( -16.665 -7.031 3.169) 18.363 15.654 ( -16.884 -10.295 -3.728) 20.124 16.200 ( 6.860 -3.822 4.428) 9.015 16.346 ( 1.386 4.220 -3.585) 5.708 16.823 ( 8.454 5.772 0.058) 10.237 17.076 ( -12.624 -15.160 2.599) 19.898 17.340 ( 1.967 5.242 0.596) 5.631 17.608 ( 8.977 21.035 -0.593) 22.879 17.658 ( 16.431 -1.981 -0.284) 16.553 18.407 ( 26.393 16.647 -0.201) 31.204 20.651 ( -5.845 -4.866 1.995) 7.863 20.786 ( -0.196 1.170 -2.707) 2.955 20.966 ( -6.268 -3.448 3.469) 7.951 21.048 ( -1.503 -7.558 0.524) 7.724 21.464 ( -8.919 -1.993 0.325) 9.145 22.850 ( -16.353 -9.299 0.860) 18.831 ======================= Grid point 277 (116/125) ======================= q-point: ( 0.56 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.647 ( 4.620 -8.376 20.583) 22.697 2.179 ( 6.288 8.802 5.542) 12.154 2.394 ( 8.327 12.881 -6.065) 16.493 2.886 ( 18.106 2.657 -19.582) 26.802 3.564 ( -1.990 0.702 5.910) 6.275 3.736 ( 3.563 -1.589 3.728) 5.396 3.842 ( -3.960 -1.560 0.181) 4.260 3.921 ( 6.569 5.822 15.007) 17.386 4.048 ( -3.253 -4.635 9.819) 11.334 4.364 ( 0.362 2.509 -2.461) 3.533 4.485 ( -1.399 1.872 3.658) 4.341 4.665 ( 19.736 8.639 16.171) 26.938 4.790 ( -0.290 7.023 -10.988) 13.044 5.037 ( -8.626 -3.176 -0.927) 9.238 5.234 ( -12.593 -0.717 -0.667) 12.631 5.350 ( 9.359 -1.607 -28.234) 29.788 5.501 ( 13.862 -1.025 -6.431) 15.316 5.771 ( 3.802 -1.813 8.153) 9.177 5.874 ( -5.123 1.992 -1.491) 5.695 6.137 ( 6.155 4.207 1.115) 7.538 6.355 ( -2.244 -6.113 6.110) 8.929 6.404 ( 0.856 1.206 -5.681) 5.870 6.608 ( 3.537 6.032 -0.977) 7.060 7.066 ( -9.220 -1.545 -3.078) 9.842 7.249 ( -6.465 -6.878 -3.966) 10.239 7.408 ( -2.062 -5.018 2.285) 5.887 7.568 ( -11.569 2.639 -2.535) 12.134 7.758 ( -1.599 -2.783 5.775) 6.607 7.926 ( -2.831 -8.150 8.492) 12.105 8.173 ( 1.675 3.178 -5.236) 6.350 8.285 ( 4.749 4.522 -6.995) 9.588 8.393 ( -3.365 4.460 0.028) 5.587 8.853 ( 4.409 -4.540 -4.775) 7.928 8.952 ( 1.347 3.286 2.003) 4.077 9.121 ( -2.494 1.690 0.675) 3.087 9.203 ( -4.647 -8.089 2.652) 9.699 9.287 ( -5.161 3.056 -3.657) 7.025 9.735 ( -1.738 -4.035 8.859) 9.889 9.905 ( -0.186 5.052 2.960) 5.859 10.086 ( -10.848 -3.572 2.591) 11.711 10.126 ( -3.225 -2.503 -2.350) 4.710 10.304 ( -4.098 -6.910 0.178) 8.036 10.719 ( 2.197 -0.204 -9.273) 9.532 10.916 ( 6.713 5.271 -3.886) 9.378 11.051 ( 2.756 -3.179 -1.870) 4.604 11.311 ( 3.709 5.377 0.510) 6.551 11.567 ( 2.787 -1.708 0.295) 3.282 11.772 ( 1.035 0.219 1.959) 2.227 12.073 ( 0.570 3.346 1.827) 3.855 12.589 ( -4.228 0.438 5.135) 6.667 12.744 ( -9.270 -4.147 2.363) 10.426 13.037 ( 2.854 -1.299 -1.886) 3.659 13.392 ( -5.867 -6.778 2.543) 9.319 13.454 ( -4.783 -1.967 -4.337) 6.750 13.556 ( 1.039 0.428 5.666) 5.777 13.581 ( -1.495 -0.644 -0.858) 1.840 13.959 ( 1.099 4.351 -2.151) 4.976 14.459 ( -0.067 -0.235 -7.729) 7.733 15.107 ( -10.773 -3.449 0.477) 11.322 15.285 ( -10.862 -2.984 -0.241) 11.267 15.461 ( 6.659 2.402 6.634) 9.702 16.049 ( -4.736 -12.842 3.157) 14.047 16.426 ( -0.785 6.601 0.849) 6.702 16.804 ( -3.031 -7.302 -5.819) 9.816 17.251 ( 22.688 11.028 -0.679) 25.235 17.499 ( 4.481 6.937 6.983) 10.815 17.863 ( 13.152 7.119 -2.366) 15.142 18.123 ( 21.106 13.566 -2.735) 25.239 18.929 ( 15.581 13.241 1.362) 20.493 20.475 ( -8.256 -8.060 3.399) 12.028 20.665 ( -9.968 -4.402 -5.732) 12.312 20.830 ( -9.417 -7.430 0.093) 11.995 20.937 ( 1.884 -7.821 13.240) 15.492 21.319 ( -6.894 2.290 -3.312) 7.983 22.399 ( -20.672 -11.393 -3.366) 23.842 ======================= Grid point 278 (117/125) ======================= q-point: ( 0.67 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.767 ( 7.452 5.545 1.486) 9.407 2.316 ( 9.506 -1.670 -1.626) 9.788 2.840 ( 16.105 18.032 8.464) 25.616 3.184 ( 18.770 4.413 -14.563) 24.164 3.517 ( -6.515 -5.042 10.009) 12.963 3.691 ( -0.971 -6.393 -5.322) 8.375 3.740 ( -2.429 0.282 0.492) 2.494 4.060 ( 1.349 6.039 6.845) 9.227 4.192 ( 7.269 -0.731 15.629) 17.252 4.316 ( -5.214 0.380 -5.051) 7.269 4.487 ( -0.830 0.822 0.035) 1.168 4.705 ( -7.961 -0.205 -4.637) 9.215 4.857 ( -8.853 -0.301 -2.729) 9.269 5.069 ( -4.909 3.583 -0.427) 6.092 5.181 ( 10.874 1.924 11.056) 15.627 5.310 ( 8.202 -0.783 -1.702) 8.413 5.751 ( -3.374 -0.065 -5.667) 6.595 5.825 ( 12.669 4.734 -1.172) 13.575 5.885 ( 8.865 3.820 -4.788) 10.775 6.216 ( -1.760 -7.005 -0.816) 7.268 6.321 ( -3.337 -4.231 -7.662) 9.367 6.367 ( 4.278 0.620 9.128) 10.100 6.674 ( -5.477 -0.657 -0.374) 5.529 6.876 ( -5.864 1.535 -1.432) 6.228 7.012 ( -7.000 -2.963 1.095) 7.680 7.304 ( -6.287 -2.901 3.787) 7.892 7.452 ( -5.477 5.363 -5.619) 9.505 7.790 ( 7.592 -5.422 1.257) 9.414 7.968 ( 3.382 1.056 11.001) 11.557 8.217 ( 3.011 1.816 -4.303) 5.557 8.355 ( 0.941 3.734 -11.165) 11.810 8.427 ( 0.335 7.533 4.724) 8.898 8.825 ( 3.895 -6.956 -5.726) 9.815 8.971 ( 0.189 -2.056 1.632) 2.632 9.011 ( -7.596 -4.798 3.445) 9.622 9.130 ( -4.242 2.444 -9.892) 11.037 9.272 ( 1.524 5.827 0.736) 6.067 9.553 ( -10.539 -13.127 -0.685) 16.848 9.834 ( -8.736 5.121 4.092) 10.922 9.989 ( -1.417 -3.265 3.262) 4.829 10.091 ( 0.379 -1.031 -4.392) 4.527 10.223 ( 0.739 -4.248 6.986) 8.209 10.720 ( 1.570 0.705 -8.047) 8.229 10.941 ( -3.225 -2.108 1.806) 4.256 11.220 ( 14.300 5.731 -3.376) 15.772 11.385 ( 0.085 3.130 1.435) 3.444 11.611 ( 1.961 -0.565 0.447) 2.090 11.837 ( 4.706 1.470 2.011) 5.324 12.065 ( -3.201 -0.491 2.196) 3.913 12.450 ( -12.476 -6.230 -0.636) 13.959 12.554 ( -7.754 -0.235 5.627) 9.583 13.006 ( -6.069 -2.206 -2.082) 6.785 13.172 ( -4.726 -6.318 -0.925) 7.944 13.413 ( 1.772 -0.751 -6.320) 6.606 13.578 ( 1.791 1.452 1.367) 2.680 13.669 ( 4.133 2.610 -0.132) 4.890 13.988 ( 0.433 1.813 -3.100) 3.617 14.423 ( -0.684 -0.332 -3.264) 3.352 14.890 ( -7.321 -5.893 2.864) 9.825 15.106 ( -8.504 2.544 -1.505) 9.003 15.621 ( 3.216 -6.320 18.962) 20.245 15.980 ( 6.433 -1.844 -6.365) 9.235 16.452 ( -7.106 15.657 0.482) 17.201 16.739 ( 5.977 -9.410 -3.244) 11.610 17.560 ( -1.097 7.627 -2.657) 8.151 17.812 ( 25.041 1.519 6.442) 25.901 18.191 ( 14.196 8.971 -1.961) 16.907 18.560 ( 14.630 12.018 -3.353) 19.228 19.220 ( 5.373 7.151 1.184) 9.022 20.211 ( -10.229 -12.762 1.025) 16.387 20.408 ( -12.442 -3.022 1.906) 12.945 20.573 ( -9.047 -7.866 0.729) 12.011 20.974 ( -2.455 -2.105 16.777) 17.086 21.250 ( 1.763 2.195 -14.007) 14.287 21.946 ( -16.072 -8.830 -4.070) 18.784 ======================= Grid point 285 (118/125) ======================= q-point: ( 0.44 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.667 ( -8.682 -5.220 33.620) 35.113 1.986 ( 6.997 14.662 29.746) 33.893 2.367 ( 9.123 -2.857 -27.275) 28.902 2.550 ( -9.163 7.361 -24.325) 27.015 3.436 ( 0.792 9.535 42.817) 43.873 3.696 ( -1.409 -5.961 -1.498) 6.306 3.843 ( 1.895 4.550 4.877) 6.934 4.000 ( -0.318 2.545 -4.057) 4.799 4.105 ( -5.227 9.621 10.681) 15.296 4.300 ( 3.522 -5.504 0.992) 6.609 4.344 ( -0.467 -3.893 -1.506) 4.200 4.504 ( 2.489 5.032 7.371) 9.265 4.722 ( 3.421 6.287 -14.985) 16.606 4.886 ( -2.841 13.071 -39.995) 42.172 5.315 ( 4.383 -2.340 -1.832) 5.295 5.329 ( -5.168 -4.580 2.056) 7.205 5.469 ( 1.083 -2.741 -0.656) 3.019 5.815 ( -6.478 1.932 7.057) 9.773 5.894 ( -0.621 -3.537 0.333) 3.606 6.044 ( 5.377 9.257 -7.729) 13.204 6.260 ( 0.851 2.173 0.532) 2.393 6.506 ( -2.879 -3.352 3.836) 5.851 6.576 ( 2.628 -3.395 -2.421) 4.929 7.128 ( 1.176 -2.501 0.398) 2.792 7.298 ( -2.389 -1.894 2.313) 3.827 7.424 ( 0.457 4.726 -4.324) 6.422 7.870 ( -4.518 -10.033 -4.882) 12.038 7.944 ( 5.861 0.546 -0.220) 5.890 7.974 ( 1.693 -11.563 1.149) 11.742 8.171 ( -4.597 -2.895 -1.314) 5.590 8.238 ( 1.700 -0.411 -1.821) 2.525 8.530 ( 4.357 -6.463 -1.197) 7.886 8.659 ( -4.925 2.439 5.336) 7.660 8.887 ( 0.892 6.596 0.784) 6.702 9.190 ( -1.984 -7.527 3.845) 8.682 9.295 ( 7.299 -4.349 3.259) 9.100 9.418 ( -2.903 -2.684 -1.485) 4.224 9.669 ( -0.332 2.012 15.867) 15.997 9.865 ( 1.681 7.747 4.745) 9.238 10.163 ( 0.904 -8.457 -7.756) 11.511 10.386 ( 2.121 -8.038 2.939) 8.817 10.428 ( -4.059 -3.759 0.541) 5.558 10.632 ( -1.996 0.557 -8.880) 9.119 10.767 ( 1.864 9.552 -10.609) 14.397 11.059 ( -1.844 0.908 -2.376) 3.141 11.145 ( 0.415 8.965 -2.274) 9.258 11.583 ( -0.701 -5.269 1.768) 5.602 11.789 ( 0.959 -0.533 0.968) 1.463 11.955 ( -0.128 9.239 1.165) 9.313 12.641 ( 0.919 -0.513 7.626) 7.698 12.923 ( 2.109 -6.160 1.259) 6.631 12.978 ( -3.289 -0.879 1.627) 3.773 13.388 ( 0.178 1.608 -1.805) 2.424 13.506 ( 0.059 -3.410 8.079) 8.770 13.693 ( -0.280 -7.631 0.949) 7.695 13.719 ( -0.403 -8.131 0.629) 8.165 13.901 ( 2.339 4.668 -0.142) 5.224 14.430 ( -0.498 2.526 -11.499) 11.784 15.051 ( 0.343 11.141 -0.340) 11.151 15.562 ( 2.754 -15.517 2.565) 15.967 15.630 ( -1.256 -20.948 -3.285) 21.241 16.223 ( -5.758 5.470 2.841) 8.435 16.357 ( 3.687 9.116 -5.072) 11.064 16.789 ( -1.437 1.216 3.075) 3.606 17.062 ( -4.183 -16.449 3.065) 17.247 17.384 ( 8.293 6.359 -2.370) 10.715 17.602 ( -9.834 21.015 -0.089) 23.202 17.648 ( 7.510 9.000 0.330) 11.726 18.411 ( 0.811 31.763 -0.244) 31.775 20.693 ( -2.795 -4.555 2.584) 5.936 20.735 ( 2.722 -4.302 -3.039) 5.929 21.008 ( -1.624 -6.309 2.518) 6.984 21.016 ( -2.190 -4.334 1.286) 5.024 21.471 ( 1.670 -7.440 -0.835) 7.671 22.854 ( 0.089 -19.382 0.713) 19.395 ======================= Grid point 286 (119/125) ======================= q-point: ( 0.56 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.646 ( -1.151 -8.028 30.131) 31.203 2.249 ( -4.157 11.637 -7.583) 14.499 2.447 ( 6.133 9.656 -10.345) 15.423 2.539 ( 12.996 10.256 -5.063) 17.312 3.609 ( -1.216 -1.195 -0.138) 1.711 3.678 ( 3.967 0.167 10.306) 11.044 3.934 ( 0.563 -0.186 1.318) 1.445 3.972 ( -3.972 7.635 -0.907) 8.654 4.108 ( -4.016 -0.268 10.774) 11.502 4.332 ( 3.250 -0.589 0.129) 3.305 4.454 ( 7.127 4.424 7.431) 11.207 4.650 ( 2.535 7.155 11.018) 13.380 4.802 ( 3.722 9.229 -1.009) 10.003 5.000 ( 14.230 14.130 -36.054) 41.255 5.136 ( -8.371 -8.598 -3.605) 12.530 5.278 ( 0.600 -12.255 -1.316) 12.340 5.443 ( -4.751 4.667 2.383) 7.073 5.794 ( -1.035 3.574 4.459) 5.808 5.901 ( 3.704 -1.990 5.050) 6.571 6.147 ( 0.339 7.576 -5.657) 9.461 6.321 ( 1.175 -3.676 2.159) 4.422 6.426 ( -3.787 1.593 0.366) 4.125 6.596 ( 3.624 3.952 -4.753) 7.165 7.110 ( -0.605 -4.952 -3.380) 6.026 7.254 ( -1.837 -6.862 3.888) 8.098 7.371 ( -3.669 -4.599 1.530) 6.079 7.693 ( -3.941 -10.465 -3.498) 11.717 7.840 ( -2.950 -0.713 0.396) 3.060 7.921 ( -8.874 -4.270 1.650) 9.985 8.146 ( 5.823 0.775 1.738) 6.126 8.252 ( 1.151 3.828 -6.052) 7.253 8.467 ( -0.868 0.269 -4.519) 4.609 8.739 ( 2.746 -0.715 4.402) 5.237 8.966 ( 0.973 4.250 -1.428) 4.588 9.084 ( -1.930 -6.708 1.429) 7.125 9.267 ( -5.935 -5.413 0.631) 8.058 9.334 ( -0.210 -3.395 -3.525) 4.899 9.757 ( -0.046 -1.260 12.310) 12.374 9.937 ( -0.799 0.123 -5.725) 5.782 10.077 ( 1.534 -2.546 -1.969) 3.565 10.241 ( -6.453 -8.101 -0.653) 10.378 10.341 ( -5.030 -3.725 3.940) 7.396 10.610 ( 3.724 -0.839 -1.500) 4.102 10.881 ( 3.119 9.391 -6.683) 11.941 11.054 ( -1.083 1.673 1.195) 2.324 11.261 ( 5.471 5.146 -0.785) 7.552 11.545 ( -0.628 -0.537 2.041) 2.202 11.788 ( -0.707 0.692 0.427) 1.078 12.062 ( 2.798 3.452 -0.548) 4.477 12.641 ( -1.717 -2.731 1.385) 3.510 12.823 ( -4.530 -6.334 -0.615) 7.811 12.997 ( 2.768 1.570 4.280) 5.333 13.392 ( -1.413 -4.272 0.291) 4.509 13.494 ( -4.127 -2.636 2.889) 5.685 13.554 ( -2.287 -8.778 0.923) 9.118 13.605 ( -2.805 -1.511 -0.631) 3.247 13.972 ( 2.007 3.069 -3.732) 5.232 14.423 ( 0.823 1.104 -5.221) 5.399 15.161 ( -1.391 -3.813 -2.745) 4.900 15.328 ( -4.593 -12.225 1.903) 13.197 15.493 ( -0.190 4.721 -0.084) 4.726 16.111 ( -10.316 -6.314 1.980) 12.256 16.383 ( 1.251 -4.678 3.492) 5.970 16.889 ( 9.015 -1.030 5.723) 10.727 17.031 ( 0.642 12.868 -1.519) 12.974 17.562 ( 4.059 13.915 -5.633) 15.551 17.702 ( 7.923 10.901 -0.238) 13.478 18.044 ( 13.464 21.264 0.137) 25.168 18.807 ( 10.593 18.959 -3.411) 21.984 20.553 ( -6.784 -6.564 3.280) 9.993 20.709 ( -0.374 -5.948 -4.139) 7.257 20.820 ( -3.330 -14.769 10.097) 18.198 20.972 ( -5.684 -0.754 5.325) 7.825 21.375 ( -2.984 -5.683 -4.822) 8.029 22.522 ( -12.172 -21.164 -1.581) 24.466 ======================= Grid point 287 (120/125) ======================= q-point: ( 0.67 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.748 ( 6.259 -0.103 21.748) 22.631 2.224 ( -0.742 9.647 -14.134) 17.128 2.754 ( 17.296 10.707 -6.475) 21.347 2.905 ( 12.131 13.255 6.122) 18.982 3.601 ( -0.744 1.033 0.897) 1.557 3.680 ( -4.799 -5.713 1.986) 7.721 3.811 ( -5.599 2.654 -5.158) 8.062 4.089 ( 4.606 7.402 5.626) 10.375 4.157 ( 4.296 -0.777 7.496) 8.674 4.369 ( -0.793 3.061 -5.998) 6.780 4.491 ( -2.583 -2.545 2.435) 4.368 4.772 ( 0.377 -0.828 -8.304) 8.354 4.878 ( -3.899 -9.250 -4.267) 10.907 4.954 ( 0.344 -10.403 2.702) 10.754 5.214 ( 10.680 13.602 1.471) 17.357 5.359 ( -6.276 11.683 6.554) 14.793 5.430 ( 16.020 1.454 -5.596) 17.031 5.883 ( 2.016 7.945 -3.115) 8.769 5.952 ( -3.446 3.089 7.569) 8.872 6.127 ( -0.191 -6.130 -1.398) 6.290 6.349 ( -5.044 -2.229 -6.104) 8.226 6.355 ( 2.672 2.052 9.097) 9.700 6.712 ( 3.074 4.537 -1.363) 5.647 6.945 ( -6.658 -5.413 -8.984) 12.424 7.104 ( -6.244 -5.248 4.546) 9.338 7.331 ( 0.845 -7.355 7.553) 10.576 7.530 ( 1.441 -6.811 -8.658) 11.109 7.715 ( -9.604 3.696 -0.623) 10.309 7.939 ( 5.353 0.540 9.181) 10.641 8.231 ( -0.527 4.081 -0.363) 4.131 8.319 ( 4.315 4.822 -6.781) 9.373 8.462 ( 2.620 0.235 -8.035) 8.455 8.714 ( -3.363 -2.481 -0.203) 4.184 8.962 ( -0.298 -2.274 3.853) 4.484 9.013 ( -1.521 -8.151 0.781) 8.328 9.156 ( -2.392 -0.615 -8.007) 8.379 9.265 ( -0.060 -1.874 -1.295) 2.279 9.657 ( -9.687 -6.889 2.662) 12.181 9.902 ( 2.337 -4.682 -1.745) 5.516 10.026 ( -4.672 -4.599 -1.360) 6.695 10.096 ( -4.577 -1.376 1.992) 5.178 10.260 ( -2.431 1.872 4.693) 5.608 10.696 ( 3.109 2.357 1.394) 4.143 10.979 ( 0.268 1.308 -1.127) 1.747 11.095 ( 4.227 8.952 -0.284) 9.904 11.395 ( 5.000 1.086 0.996) 5.213 11.549 ( 0.358 0.239 -0.016) 0.431 11.817 ( 1.888 2.789 2.385) 4.127 12.074 ( -0.627 -4.343 -1.188) 4.546 12.537 ( -6.088 -7.512 -3.498) 10.282 12.664 ( -5.170 -3.612 1.438) 6.469 13.104 ( 3.173 3.022 3.145) 5.394 13.151 ( -12.096 -10.140 -1.226) 15.832 13.361 ( -2.403 -5.440 -5.719) 8.251 13.563 ( 2.800 -0.883 4.323) 5.226 13.626 ( 2.705 3.849 -1.575) 4.961 13.999 ( 0.128 1.690 -2.928) 3.383 14.418 ( -0.309 -0.280 -1.388) 1.449 14.932 ( -7.216 -11.009 -0.435) 13.171 15.198 ( -2.875 -5.134 -2.595) 6.431 15.666 ( 0.523 7.437 9.114) 11.775 15.898 ( -2.733 -1.321 -1.530) 3.399 16.442 ( 8.829 -5.560 2.609) 10.755 16.908 ( -10.941 17.770 4.919) 21.440 17.406 ( 24.006 4.745 1.038) 24.492 17.669 ( -3.239 6.727 -7.902) 10.871 18.040 ( 14.519 15.662 0.308) 21.359 18.494 ( 11.876 20.663 -0.443) 23.837 19.056 ( 10.625 -1.118 -5.350) 11.948 20.324 ( -12.433 -9.907 2.258) 16.057 20.549 ( -7.745 -5.856 1.478) 9.822 20.721 ( -6.370 -4.393 15.599) 17.413 20.928 ( 3.586 -1.696 1.479) 4.234 21.222 ( -4.419 -6.348 -9.876) 12.544 22.077 ( -14.170 -16.580 -2.172) 21.918 ======================= Grid point 294 (121/125) ======================= q-point: ( 0.44 0.56 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.919 ( 11.198 -2.441 -3.497) 11.983 2.003 ( -14.274 1.936 23.208) 27.315 2.285 ( -1.130 15.037 -0.809) 15.101 2.735 ( -11.334 12.735 -21.269) 27.258 3.595 ( 0.932 -0.006 4.168) 4.271 3.706 ( -4.114 0.578 4.796) 6.344 3.873 ( -0.626 -3.781 7.599) 8.511 3.966 ( 2.939 5.568 1.750) 6.534 4.177 ( 5.016 -2.938 -0.713) 5.856 4.332 ( -1.863 0.131 4.220) 4.615 4.533 ( 0.664 7.344 13.401) 15.295 4.583 ( -14.762 15.542 15.070) 26.202 4.651 ( 0.114 2.986 -10.547) 10.962 5.004 ( -4.142 -0.035 -9.495) 10.359 5.198 ( 1.366 -1.340 -21.029) 21.116 5.277 ( 3.977 -1.577 -2.659) 5.037 5.468 ( -4.860 0.646 -1.752) 5.207 5.842 ( 0.869 -3.750 -1.972) 4.325 5.979 ( 7.815 8.145 -4.568) 12.177 6.030 ( -9.099 3.876 8.871) 13.286 6.346 ( -4.332 3.355 -0.759) 5.531 6.443 ( 4.063 -5.812 -2.143) 7.408 6.546 ( -2.135 4.037 2.737) 5.324 7.070 ( 2.566 -6.659 2.731) 7.640 7.306 ( 1.270 -5.546 -4.519) 7.266 7.410 ( 2.285 0.386 -3.357) 4.079 7.645 ( 12.240 -11.845 3.320) 17.354 7.828 ( 1.723 0.829 1.784) 2.615 7.937 ( -3.977 -10.326 -0.844) 11.097 8.172 ( 3.804 5.276 0.159) 6.506 8.238 ( -3.033 2.262 -5.723) 6.861 8.396 ( 4.461 -2.505 6.779) 8.493 8.790 ( -6.409 -1.639 -3.391) 7.434 8.946 ( -0.227 5.110 1.861) 5.444 9.099 ( 3.525 -7.045 -0.884) 7.927 9.192 ( 0.132 -7.018 8.079) 10.703 9.356 ( 5.068 -2.708 -2.981) 6.473 9.788 ( -3.083 -2.979 10.990) 11.797 9.874 ( 3.644 2.341 1.224) 4.500 10.087 ( -1.495 -1.145 -4.537) 4.912 10.210 ( 7.910 -9.297 3.598) 12.726 10.382 ( 2.376 -4.886 -2.290) 5.896 10.658 ( -1.648 2.536 -7.897) 8.457 10.850 ( -4.471 7.028 -2.137) 8.599 11.086 ( -2.468 0.984 -3.840) 4.669 11.257 ( -0.998 7.751 -0.238) 7.819 11.564 ( -1.472 -0.792 -0.785) 1.847 11.783 ( -0.436 0.673 1.093) 1.355 12.048 ( -0.424 3.365 1.789) 3.835 12.615 ( 2.924 -3.334 5.406) 6.992 12.803 ( 4.396 -7.009 2.284) 8.583 13.049 ( -2.993 3.621 -3.606) 5.922 13.387 ( 0.920 -3.463 0.907) 3.696 13.469 ( 1.051 -11.778 4.516) 12.658 13.564 ( 2.464 -1.336 2.398) 3.689 13.622 ( 3.964 -3.643 -3.315) 6.323 13.934 ( -0.659 3.542 1.720) 3.993 14.429 ( -0.649 1.018 -5.929) 6.051 15.130 ( 2.894 -4.946 2.074) 6.094 15.341 ( 8.622 -9.691 -0.297) 12.975 15.469 ( -3.471 2.524 3.405) 5.479 16.170 ( 4.080 -10.411 -7.100) 13.245 16.393 ( 3.485 1.946 2.065) 4.494 16.968 ( 4.555 14.437 -4.778) 15.874 17.002 ( -15.582 -2.091 1.137) 15.763 17.490 ( -5.126 11.064 5.801) 13.503 17.700 ( -6.985 11.340 0.065) 13.319 18.051 ( -12.676 22.274 -0.906) 25.644 18.765 ( -8.953 16.398 3.198) 18.955 20.583 ( 4.918 -7.466 0.198) 8.943 20.688 ( 1.216 -4.322 -2.833) 5.308 20.892 ( 8.382 -4.509 -0.722) 9.545 21.027 ( -4.281 -5.248 -3.118) 7.456 21.310 ( 6.855 -8.474 5.202) 12.077 22.517 ( 12.419 -21.537 -0.780) 24.874 ======================= Grid point 295 (122/125) ======================= q-point: ( 0.56 0.56 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( -7.972 -6.494 9.859) 14.245 2.182 ( 12.388 6.060 -10.251) 17.183 2.487 ( -6.054 18.677 -3.588) 19.959 2.685 ( 0.283 18.702 4.291) 19.190 3.595 ( -0.066 -1.455 -0.973) 1.751 3.705 ( -0.967 2.121 8.158) 8.485 3.860 ( 3.589 -6.921 -1.762) 7.992 4.025 ( 0.501 4.768 -5.878) 7.585 4.189 ( -1.609 -1.390 -5.278) 5.690 4.331 ( 1.669 1.911 3.442) 4.276 4.524 ( -3.263 2.187 2.574) 4.696 4.637 ( -1.188 4.785 3.599) 6.104 4.914 ( 3.291 17.601 27.832) 33.095 4.959 ( 1.134 14.940 -16.010) 21.928 5.099 ( -0.770 -8.827 -12.469) 15.296 5.216 ( -6.073 -7.283 0.553) 9.499 5.493 ( 6.370 5.661 -1.848) 8.720 5.819 ( 0.538 -2.004 0.212) 2.086 5.890 ( -5.473 -0.781 -1.414) 5.706 6.167 ( 3.167 7.832 -3.331) 9.081 6.326 ( -1.510 -0.586 5.415) 5.652 6.439 ( 3.141 -3.527 -7.032) 8.470 6.592 ( -0.528 8.643 1.785) 8.841 7.025 ( -0.083 -10.365 3.533) 10.951 7.213 ( -0.932 -9.229 0.528) 9.291 7.437 ( -2.313 -0.362 -0.326) 2.363 7.574 ( -3.666 -13.762 -3.950) 14.779 7.792 ( 5.220 -3.547 -0.110) 6.312 8.010 ( 8.294 2.111 -3.202) 9.137 8.104 ( -9.131 -0.052 2.307) 9.418 8.247 ( 0.318 3.005 -1.528) 3.387 8.427 ( -0.812 -1.306 -2.851) 3.239 8.758 ( 2.339 1.232 8.181) 8.598 8.989 ( 0.324 2.580 -2.184) 3.396 9.100 ( -2.238 -1.989 3.136) 4.336 9.196 ( 5.456 -7.549 4.803) 10.479 9.299 ( -3.164 -5.470 -5.751) 8.544 9.769 ( 1.490 -5.524 5.847) 8.180 9.943 ( -3.446 -0.238 -5.228) 6.265 10.032 ( 1.835 -0.608 6.479) 6.761 10.168 ( -0.221 -11.423 -4.407) 12.246 10.328 ( 1.355 -4.326 -3.035) 5.455 10.635 ( -2.943 1.312 3.666) 4.881 10.911 ( 2.001 10.761 -3.350) 11.447 11.044 ( 1.210 -0.924 -0.650) 1.655 11.321 ( -3.065 7.249 -1.106) 7.948 11.553 ( 1.352 0.901 2.088) 2.645 11.789 ( 0.530 1.188 -0.765) 1.509 12.089 ( -0.953 2.985 -0.726) 3.217 12.625 ( -0.235 -4.405 -0.142) 4.413 12.766 ( 0.385 -9.522 -1.173) 9.602 13.006 ( -1.167 1.610 2.836) 3.464 13.388 ( -0.487 -2.415 3.729) 4.469 13.416 ( 5.019 -13.626 1.545) 14.603 13.555 ( -2.342 -1.155 2.461) 3.588 13.620 ( 0.229 0.205 -3.531) 3.544 13.953 ( -0.339 1.825 -1.287) 2.259 14.417 ( -0.095 0.833 -1.541) 1.755 15.109 ( 0.876 -9.179 -0.058) 9.221 15.272 ( -3.790 -13.143 1.988) 13.822 15.517 ( 2.797 12.115 -2.108) 12.611 16.099 ( 4.460 -10.729 -5.225) 12.740 16.444 ( -8.146 1.859 -1.642) 8.515 16.735 ( 1.217 -6.078 5.533) 8.309 17.219 ( 0.013 21.046 3.763) 21.380 17.579 ( 3.069 11.759 -5.252) 13.239 17.843 ( 1.448 13.878 0.730) 13.972 18.097 ( -2.168 24.359 1.086) 24.480 18.943 ( 0.623 20.661 -0.778) 20.685 20.526 ( 3.112 -12.500 -3.739) 13.413 20.599 ( -3.500 -8.362 3.879) 9.860 20.821 ( -5.444 -11.741 1.374) 13.015 21.015 ( 4.778 1.308 2.180) 5.412 21.299 ( -0.146 -8.535 -1.530) 8.672 22.381 ( 0.074 -24.963 -0.545) 24.969 ======================= Grid point 296 (123/125) ======================= q-point: (-0.33 -0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.713 ( 3.139 -1.681 14.901) 15.320 2.365 ( 0.385 11.660 -12.043) 16.767 2.572 ( 5.808 18.827 -8.183) 21.334 3.011 ( 4.182 18.389 16.091) 24.790 3.594 ( 1.373 -0.139 -3.082) 3.376 3.717 ( -2.617 -1.356 2.060) 3.597 3.844 ( 2.750 -3.535 -2.413) 5.087 4.052 ( 2.008 -2.689 -7.331) 8.063 4.142 ( -0.241 8.418 -0.940) 8.474 4.398 ( 0.420 3.207 -1.862) 3.733 4.531 ( 5.785 -3.734 -7.373) 10.089 4.614 ( -4.486 -2.675 5.519) 7.599 4.864 ( -6.605 -11.561 -2.224) 13.499 4.979 ( -8.792 -8.285 1.946) 12.236 5.159 ( 8.033 19.291 -20.288) 29.125 5.315 ( 7.656 6.014 24.440) 26.308 5.614 ( -6.336 10.518 4.310) 13.014 5.826 ( 8.853 2.210 0.456) 9.137 5.940 ( 5.796 1.494 -0.908) 6.054 6.196 ( -5.929 0.600 4.437) 7.430 6.357 ( 1.799 2.962 -0.778) 3.551 6.398 ( -1.212 -0.724 -2.057) 2.494 6.691 ( 2.724 4.517 -2.392) 5.792 6.902 ( -1.174 -10.184 -2.025) 10.449 7.089 ( -1.838 -12.773 2.898) 13.226 7.314 ( -4.780 -4.887 5.776) 8.950 7.414 ( -0.686 -6.355 -6.682) 9.247 7.889 ( 5.053 3.202 -0.906) 6.050 7.929 ( -7.776 1.665 -1.896) 8.175 8.208 ( 7.381 4.635 1.832) 8.906 8.284 ( -0.120 1.987 1.063) 2.257 8.369 ( -0.210 -0.875 -8.205) 8.254 8.839 ( -3.326 3.352 5.522) 7.266 8.978 ( -1.847 -1.983 5.497) 6.129 9.002 ( -4.821 -3.426 -3.543) 6.894 9.125 ( -2.100 -6.137 -5.803) 8.703 9.237 ( 0.244 -2.670 0.921) 2.835 9.749 ( -7.367 -8.563 4.138) 12.030 9.774 ( 3.741 -6.342 -3.752) 8.264 10.020 ( -3.034 -6.592 -1.198) 7.355 10.116 ( 1.479 0.031 -0.969) 1.769 10.316 ( 1.082 0.253 -1.225) 1.654 10.673 ( 2.846 2.648 9.293) 10.073 10.977 ( 0.116 1.785 -4.513) 4.854 11.172 ( 4.981 9.830 4.677) 11.971 11.314 ( -0.154 1.718 -1.289) 2.153 11.592 ( -1.627 1.233 1.829) 2.741 11.832 ( 1.959 4.017 0.503) 4.498 12.039 ( -3.273 -3.476 -3.703) 6.042 12.529 ( -3.144 -6.018 -4.425) 8.105 12.638 ( -0.591 -10.964 -2.833) 11.339 13.033 ( 0.136 -5.712 3.616) 6.762 13.294 ( -3.725 -10.341 -0.614) 11.009 13.339 ( -4.655 0.240 2.073) 5.101 13.546 ( 0.206 1.902 4.721) 5.094 13.633 ( 0.822 4.283 -3.502) 5.594 13.978 ( 2.047 1.329 -1.373) 2.801 14.418 ( -0.228 -0.619 1.394) 1.542 14.947 ( -6.668 -9.657 -1.247) 11.801 15.117 ( -0.192 -9.348 -1.622) 9.490 15.724 ( 6.788 12.923 -6.307) 15.901 16.011 ( -8.558 -3.981 -0.392) 9.447 16.276 ( 2.366 -5.249 6.408) 8.615 16.984 ( 18.452 2.338 6.744) 19.785 17.345 ( -4.855 15.874 -0.341) 16.604 17.765 ( -0.298 13.799 -6.716) 15.350 18.039 ( 6.134 19.307 -0.925) 20.279 18.458 ( 14.251 18.548 1.865) 23.465 19.022 ( -7.019 7.198 -5.523) 11.471 20.412 ( -8.199 -10.082 0.750) 13.016 20.485 ( 6.016 -13.329 0.084) 14.624 20.684 ( 1.122 -8.554 10.642) 13.700 21.067 ( -5.600 5.552 7.078) 10.596 21.136 ( -2.912 -10.750 -12.337) 16.620 22.072 ( -7.370 -20.670 0.594) 21.952 ======================= Grid point 367 (124/125) ======================= q-point: ( 0.44 0.44 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.917 ( -0.000 0.000 31.134) 31.134 1.917 ( -0.000 0.000 31.134) 31.134 2.336 ( 0.000 -0.000 -26.755) 26.755 2.336 ( 0.000 -0.000 -26.755) 26.755 3.561 ( -0.000 0.000 58.505) 58.505 3.799 ( 0.000 -0.000 -0.087) 0.087 3.799 ( 0.000 0.000 -0.087) 0.087 3.917 ( 0.000 -0.000 -1.668) 1.668 4.018 ( 0.000 -0.000 -3.963) 3.963 4.385 ( -0.000 0.000 1.396) 1.396 4.385 ( -0.000 0.000 1.396) 1.396 4.513 ( 0.000 -0.000 -47.873) 47.873 4.527 ( 0.000 -0.000 -3.872) 3.872 4.527 ( 0.000 -0.000 -3.872) 3.872 5.294 ( 0.000 -0.000 -2.135) 2.135 5.481 ( -0.000 0.000 5.631) 5.631 5.481 ( -0.000 0.000 5.631) 5.631 5.847 ( 0.000 -0.000 -3.816) 3.816 5.847 ( 0.000 -0.000 -3.816) 3.816 5.949 ( -0.000 0.000 1.717) 1.717 6.248 ( 0.000 -0.000 -0.422) 0.422 6.597 ( -0.000 0.000 1.374) 1.374 6.597 ( -0.000 0.000 1.374) 1.374 7.144 ( 0.000 -0.000 -0.101) 0.101 7.320 ( 0.000 -0.000 -1.837) 1.837 7.320 ( 0.000 -0.000 -1.837) 1.837 7.959 ( 0.000 -0.000 -2.596) 2.596 7.959 ( 0.000 -0.000 -2.596) 2.596 8.061 ( -0.000 0.000 6.105) 6.105 8.173 ( 0.000 -0.000 -6.867) 6.867 8.361 ( -0.000 0.000 3.046) 3.046 8.617 ( -0.000 0.000 1.131) 1.131 8.617 ( -0.000 0.000 1.131) 1.131 8.820 ( -0.000 0.000 1.725) 1.725 9.305 ( -0.000 0.000 2.076) 2.076 9.305 ( -0.000 0.000 2.076) 2.076 9.487 ( -0.000 0.000 0.058) 0.058 9.729 ( -0.000 0.000 7.381) 7.381 9.729 ( -0.000 0.000 7.381) 7.381 10.261 ( 0.000 -0.000 -4.467) 4.467 10.490 ( -0.000 0.000 3.815) 3.815 10.490 ( -0.000 0.000 3.815) 3.815 10.572 ( 0.000 -0.000 -9.748) 9.748 10.572 ( 0.000 -0.000 -9.748) 9.748 11.039 ( 0.000 -0.000 -1.742) 1.742 11.039 ( 0.000 -0.000 -1.742) 1.742 11.709 ( -0.000 0.000 0.498) 0.498 11.798 ( -0.000 0.000 1.025) 1.025 11.798 ( -0.000 0.000 1.025) 1.025 12.677 ( -0.000 0.000 5.740) 5.740 12.996 ( -0.000 0.000 0.782) 0.782 12.996 ( -0.000 0.000 0.782) 0.782 13.352 ( 0.000 -0.000 -2.214) 2.214 13.555 ( -0.000 0.000 3.902) 3.902 13.823 ( -0.000 0.000 0.691) 0.691 13.823 ( -0.000 0.000 0.691) 0.691 13.838 ( -0.000 0.000 4.987) 4.987 14.336 ( 0.000 -0.000 -10.393) 10.393 14.915 ( 0.000 -0.000 -0.330) 0.330 15.949 ( -0.000 0.000 4.064) 4.064 15.949 ( 0.000 0.000 4.064) 4.064 16.027 ( 0.000 -0.000 -5.522) 5.522 16.027 ( 0.000 -0.000 -5.522) 5.522 16.831 ( -0.000 0.000 0.113) 0.113 17.310 ( 0.000 -0.000 -0.081) 0.081 17.310 ( 0.000 0.000 -0.081) 0.081 17.549 ( -0.000 0.000 0.244) 0.244 17.549 ( -0.000 0.000 0.244) 0.244 17.856 ( -0.000 0.000 1.588) 1.588 20.760 ( -0.000 0.000 0.483) 0.483 20.760 ( -0.000 0.000 0.483) 0.483 21.063 ( 0.000 -0.000 -0.288) 0.288 21.063 ( 0.000 -0.000 -0.288) 0.288 21.558 ( 0.000 -0.000 -1.208) 1.208 23.074 ( -0.000 0.000 0.750) 0.750 ======================= Grid point 368 (125/125) ======================= q-point: ( 0.56 0.44 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.43e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 365 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.971 ( -4.366 -8.281 22.805) 24.652 2.072 ( 1.936 -0.697 -9.833) 10.046 2.189 ( -1.238 12.675 9.570) 15.931 2.397 ( 14.208 2.036 -20.174) 24.759 3.655 ( -4.620 -2.012 3.727) 6.268 3.723 ( -1.610 -1.247 -0.291) 2.057 3.885 ( 3.275 2.323 12.768) 13.385 3.932 ( 0.973 -0.220 -3.184) 3.337 4.239 ( 6.593 -5.231 20.623) 22.274 4.289 ( 0.365 6.729 -5.570) 8.743 4.375 ( 4.955 4.122 -1.144) 6.546 4.479 ( 3.790 5.549 -15.478) 16.874 4.594 ( 6.154 5.920 8.539) 12.076 4.690 ( 14.069 3.966 -20.874) 25.483 5.270 ( -4.556 -2.493 2.355) 5.702 5.408 ( -7.540 -2.169 -3.282) 8.504 5.438 ( -0.457 -2.259 1.270) 2.632 5.835 ( 1.275 -4.027 5.701) 7.095 5.935 ( -2.919 2.839 -3.283) 5.231 5.965 ( 7.755 4.310 0.433) 8.882 6.276 ( 3.695 2.298 -1.589) 4.633 6.521 ( -4.365 -4.671 4.341) 7.727 6.559 ( -3.279 -0.015 -3.042) 4.473 7.138 ( -1.139 -0.272 -1.038) 1.564 7.327 ( -0.705 -0.652 -2.448) 2.630 7.384 ( 4.557 2.253 1.709) 5.363 7.804 ( -9.804 -4.350 4.233) 11.531 7.970 ( -7.966 -4.486 -1.636) 9.287 8.015 ( -0.370 -2.750 -5.485) 6.147 8.133 ( -0.018 1.460 0.997) 1.768 8.228 ( -5.679 -3.345 2.156) 6.934 8.494 ( -6.596 -3.005 3.857) 8.211 8.731 ( 5.300 1.969 -5.546) 7.920 8.880 ( 3.999 2.684 2.271) 5.324 9.218 ( -6.485 -3.508 -0.520) 7.391 9.319 ( -0.799 -1.376 -0.577) 1.693 9.392 ( -5.956 -2.182 2.429) 6.792 9.807 ( 3.289 -0.471 -2.669) 4.262 9.839 ( 4.218 5.022 7.477) 9.946 10.133 ( -6.087 -3.002 -3.668) 7.714 10.385 ( -7.838 -5.498 2.592) 9.919 10.431 ( -4.825 -2.553 -0.327) 5.468 10.604 ( 3.035 1.500 -4.460) 5.599 10.698 ( 8.569 5.056 -0.366) 9.956 11.045 ( 1.003 -0.402 -0.165) 1.093 11.134 ( 7.523 5.178 -0.565) 9.150 11.595 ( -4.046 -2.632 -0.197) 4.831 11.789 ( -0.761 -0.418 0.881) 1.237 11.962 ( 7.586 4.616 0.054) 8.880 12.679 ( -1.542 -0.574 2.164) 2.719 12.925 ( -5.707 -2.923 1.190) 6.521 12.995 ( 0.404 -0.456 -1.290) 1.426 13.381 ( 2.318 1.439 -0.807) 2.846 13.560 ( -0.776 -0.632 0.691) 1.216 13.704 ( -9.069 -5.291 -0.624) 10.519 13.711 ( -7.156 -4.866 1.550) 8.791 13.894 ( 2.293 2.545 1.241) 3.644 14.369 ( 3.469 1.851 -3.001) 4.946 15.049 ( 9.709 5.815 -0.104) 11.318 15.583 ( -16.451 -7.853 3.870) 18.636 15.603 ( -14.607 -9.663 -3.897) 17.942 16.248 ( 2.042 -1.912 1.208) 3.047 16.310 ( 8.550 6.836 0.043) 10.947 16.815 ( 6.200 4.763 -1.265) 7.920 17.088 ( -17.475 -10.711 -0.781) 20.511 17.356 ( 7.318 0.535 1.895) 7.579 17.603 ( 10.460 20.632 -0.232) 23.133 17.653 ( 13.985 -2.830 -0.454) 14.276 18.409 ( 27.000 15.838 0.228) 31.303 20.684 ( -5.395 -4.011 3.042) 7.379 20.743 ( -2.654 -0.718 -3.498) 4.449 21.001 ( -5.827 -1.343 1.820) 6.251 21.044 ( -0.761 -3.388 -1.279) 3.701 21.464 ( -6.965 -3.518 0.177) 7.805 22.857 ( -17.251 -9.937 0.169) 19.910 =================== 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 3/54675 10.0 353.389 353.389 2117.756 0.000 -0.000 0.000 3/54675 20.0 161.509 161.509 289.503 0.000 -0.000 0.000 3/54675 30.0 69.873 69.873 105.730 0.000 -0.000 0.000 3/54675 40.0 38.918 38.918 56.775 0.000 -0.000 0.000 3/54675 50.0 25.043 25.043 36.212 0.000 -0.000 0.000 3/54675 60.0 17.689 17.689 25.551 0.000 -0.000 0.000 3/54675 70.0 13.340 13.340 19.296 0.000 -0.000 0.000 3/54675 80.0 10.557 10.557 15.298 0.000 -0.000 0.000 3/54675 90.0 8.665 8.665 12.576 0.000 -0.000 0.000 3/54675 100.0 7.316 7.316 10.629 0.000 -0.000 0.000 3/54675 110.0 6.316 6.316 9.182 0.000 -0.000 0.000 3/54675 120.0 5.552 5.552 8.070 0.000 -0.000 0.000 3/54675 130.0 4.953 4.953 7.195 0.000 -0.000 0.000 3/54675 140.0 4.473 4.473 6.490 0.000 -0.000 0.000 3/54675 150.0 4.080 4.080 5.911 0.000 -0.000 0.000 3/54675 160.0 3.754 3.754 5.428 0.000 -0.000 0.000 3/54675 170.0 3.478 3.478 5.021 0.000 -0.000 0.000 3/54675 180.0 3.244 3.244 4.671 0.000 -0.000 0.000 3/54675 190.0 3.041 3.041 4.369 0.000 -0.000 0.000 3/54675 200.0 2.864 2.864 4.105 0.000 -0.000 0.000 3/54675 210.0 2.708 2.708 3.873 0.000 -0.000 0.000 3/54675 220.0 2.570 2.570 3.666 0.000 -0.000 0.000 3/54675 230.0 2.447 2.447 3.482 0.000 -0.000 0.000 3/54675 240.0 2.336 2.336 3.316 0.000 -0.000 0.000 3/54675 250.0 2.235 2.235 3.166 0.000 -0.000 0.000 3/54675 260.0 2.143 2.143 3.030 0.000 -0.000 0.000 3/54675 270.0 2.060 2.060 2.905 0.000 -0.000 0.000 3/54675 280.0 1.983 1.983 2.791 0.000 -0.000 0.000 3/54675 290.0 1.912 1.912 2.685 0.000 -0.000 0.000 3/54675 300.0 1.846 1.846 2.588 0.000 -0.000 0.000 3/54675 310.0 1.785 1.785 2.498 0.000 -0.000 0.000 3/54675 320.0 1.728 1.728 2.414 0.000 -0.000 0.000 3/54675 330.0 1.675 1.675 2.336 0.000 -0.000 0.000 3/54675 340.0 1.625 1.625 2.263 0.000 -0.000 0.000 3/54675 350.0 1.578 1.578 2.194 0.000 -0.000 0.000 3/54675 360.0 1.534 1.534 2.130 0.000 -0.000 0.000 3/54675 370.0 1.492 1.492 2.070 0.000 -0.000 0.000 3/54675 380.0 1.453 1.453 2.013 0.000 -0.000 0.000 3/54675 390.0 1.416 1.416 1.959 0.000 -0.000 0.000 3/54675 400.0 1.380 1.380 1.908 0.000 -0.000 0.000 3/54675 410.0 1.347 1.347 1.859 0.000 -0.000 0.000 3/54675 420.0 1.315 1.315 1.813 0.000 -0.000 0.000 3/54675 430.0 1.284 1.284 1.770 0.000 -0.000 0.000 3/54675 440.0 1.255 1.255 1.728 0.000 -0.000 0.000 3/54675 450.0 1.228 1.228 1.689 0.000 -0.000 0.000 3/54675 460.0 1.201 1.201 1.651 0.000 -0.000 0.000 3/54675 470.0 1.176 1.176 1.615 0.000 -0.000 0.000 3/54675 480.0 1.152 1.152 1.580 0.000 -0.000 0.000 3/54675 490.0 1.128 1.128 1.547 0.000 -0.000 0.000 3/54675 500.0 1.106 1.106 1.515 0.000 -0.000 0.000 3/54675 510.0 1.085 1.085 1.485 0.000 -0.000 0.000 3/54675 520.0 1.064 1.064 1.456 0.000 -0.000 0.000 3/54675 530.0 1.044 1.044 1.428 0.000 -0.000 0.000 3/54675 540.0 1.025 1.025 1.401 0.000 -0.000 0.000 3/54675 550.0 1.006 1.006 1.375 0.000 -0.000 0.000 3/54675 560.0 0.989 0.989 1.350 0.000 -0.000 0.000 3/54675 570.0 0.972 0.972 1.326 0.000 -0.000 0.000 3/54675 580.0 0.955 0.955 1.303 0.000 -0.000 0.000 3/54675 590.0 0.939 0.939 1.280 0.000 -0.000 0.000 3/54675 600.0 0.924 0.924 1.259 0.000 -0.000 0.000 3/54675 610.0 0.909 0.909 1.238 0.000 -0.000 0.000 3/54675 620.0 0.894 0.894 1.217 0.000 -0.000 0.000 3/54675 630.0 0.880 0.880 1.198 0.000 -0.000 0.000 3/54675 640.0 0.866 0.866 1.179 0.000 -0.000 0.000 3/54675 650.0 0.853 0.853 1.161 0.000 -0.000 0.000 3/54675 660.0 0.840 0.840 1.143 0.000 -0.000 0.000 3/54675 670.0 0.828 0.828 1.126 0.000 -0.000 0.000 3/54675 680.0 0.816 0.816 1.109 0.000 -0.000 0.000 3/54675 690.0 0.804 0.804 1.093 0.000 -0.000 0.000 3/54675 700.0 0.793 0.793 1.077 0.000 -0.000 0.000 3/54675 710.0 0.782 0.782 1.062 0.000 -0.000 0.000 3/54675 720.0 0.771 0.771 1.047 0.000 -0.000 0.000 3/54675 730.0 0.761 0.761 1.032 0.000 -0.000 0.000 3/54675 740.0 0.750 0.750 1.018 0.000 -0.000 0.000 3/54675 750.0 0.741 0.741 1.004 0.000 -0.000 0.000 3/54675 760.0 0.731 0.731 0.991 0.000 -0.000 0.000 3/54675 770.0 0.721 0.721 0.978 0.000 -0.000 0.000 3/54675 780.0 0.712 0.712 0.965 0.000 -0.000 0.000 3/54675 790.0 0.703 0.703 0.953 0.000 -0.000 0.000 3/54675 800.0 0.695 0.695 0.941 0.000 -0.000 0.000 3/54675 810.0 0.686 0.686 0.929 0.000 -0.000 0.000 3/54675 820.0 0.678 0.678 0.918 0.000 -0.000 0.000 3/54675 830.0 0.670 0.670 0.907 0.000 -0.000 0.000 3/54675 840.0 0.662 0.662 0.896 0.000 -0.000 0.000 3/54675 850.0 0.654 0.654 0.885 0.000 -0.000 0.000 3/54675 860.0 0.647 0.647 0.875 0.000 -0.000 0.000 3/54675 870.0 0.639 0.639 0.865 0.000 -0.000 0.000 3/54675 880.0 0.632 0.632 0.855 0.000 -0.000 0.000 3/54675 890.0 0.625 0.625 0.845 0.000 -0.000 0.000 3/54675 900.0 0.618 0.618 0.836 0.000 -0.000 0.000 3/54675 910.0 0.611 0.611 0.827 0.000 -0.000 0.000 3/54675 920.0 0.605 0.605 0.818 0.000 -0.000 0.000 3/54675 930.0 0.598 0.598 0.809 0.000 -0.000 0.000 3/54675 940.0 0.592 0.592 0.800 0.000 -0.000 0.000 3/54675 950.0 0.586 0.586 0.792 0.000 -0.000 0.000 3/54675 960.0 0.580 0.580 0.784 0.000 -0.000 0.000 3/54675 970.0 0.574 0.574 0.775 0.000 -0.000 0.000 3/54675 980.0 0.568 0.568 0.767 0.000 -0.000 0.000 3/54675 990.0 0.562 0.562 0.760 0.000 -0.000 0.000 3/54675 1000.0 0.557 0.557 0.752 0.000 -0.000 0.000 3/54675 Thermal conductivity related properties were written into "kappa-m999.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 02:12:30]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|