----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-09 00:05:33]------------------------- 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 3.166334945945258 1.828084333386010 8.832884879999993 b -3.166334945945252 1.828084333386010 8.832884879999993 c 0.000000000000003 -3.656168666772026 8.832884879999993 Atomic positions (fractional): *1 Sr 0.33365412633647 0.33365412633647 0.33365412633647 87.620 2 Sr 0.66634587366353 0.66634587366354 0.66634587366353 87.620 *3 Hf 0.00000000000000 0.00000000000000 0.00000000000000 178.490 *4 Hf 0.88674072551517 0.51324259082681 0.25384331353759 178.490 5 Hf 0.48675740917319 0.74615668646241 0.11325927448483 178.490 6 Hf 0.74615668646241 0.11325927448483 0.48675740917319 178.490 7 Hf 0.25384331353759 0.88674072551517 0.51324259082681 178.490 8 Hf 0.51324259082681 0.25384331353759 0.88674072551517 178.490 9 Hf 0.11325927448483 0.48675740917319 0.74615668646241 178.490 *10 O 0.23633566058649 0.23633566058649 0.23633566058649 15.999 *11 O 0.96244003033171 0.67899888551463 0.23070872302588 15.999 *12 O 0.84940256518966 0.41147578150563 0.14891440310360 15.999 13 O 0.58852421849437 0.85108559689641 0.15059743481033 15.999 14 O 0.32100111448537 0.76929127697412 0.03755996966829 15.999 15 O 0.76929127697412 0.03755996966829 0.32100111448537 15.999 16 O 0.85108559689641 0.15059743481034 0.58852421849437 15.999 *17 O 0.57052954905183 0.57052954905183 0.57052954905183 15.999 18 O 0.42947045094817 0.42947045094817 0.42947045094817 15.999 19 O 0.14891440310360 0.84940256518966 0.41147578150563 15.999 20 O 0.23070872302588 0.96244003033171 0.67899888551463 15.999 21 O 0.67899888551463 0.23070872302588 0.96244003033171 15.999 22 O 0.41147578150563 0.14891440310360 0.84940256518966 15.999 23 O 0.15059743481033 0.58852421849437 0.85108559689640 15.999 24 O 0.03755996966829 0.32100111448537 0.76929127697412 15.999 25 O 0.76366433941351 0.76366433941351 0.76366433941351 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.332669891890510 0.000000000000000 0.000000000000000 b -3.166334945945255 5.484253000158036 0.000000000000000 c 0.000000000000000 0.000000000000000 26.498654640000005 Atomic positions (fractional): *1 Sr 0.33333333333333 0.66666666666667 0.00032079300313 87.620 > 1 2 Sr 0.33333333333333 0.66666666666667 0.33301254033020 87.620 > 2 3 Sr 0.00000000000000 0.00000000000000 0.33365412633647 87.620 > 1 4 Sr 0.00000000000000 0.00000000000000 0.66634587366353 87.620 > 2 5 Sr 0.66666666666667 0.33333333333333 0.66698745966980 87.620 > 1 6 Sr 0.66666666666667 0.33333333333333 0.99967920699687 87.620 > 2 *7 Hf 0.00000000000000 0.00000000000000 0.00000000000000 178.490 > 3 *8 Hf 0.66879851555531 0.96409889642227 0.21794220995986 178.490 > 4 9 Hf 0.37136628579971 0.00213184888865 0.11539112337347 178.490 > 5 10 Hf 0.63076556308893 0.62863371420029 0.11539112337347 178.490 > 6 11 Hf 0.03590110357773 0.70469961913305 0.21794220995986 178.490 > 7 12 Hf 0.29530038086695 0.33120148444469 0.21794220995986 178.490 > 8 13 Hf 0.99786815111135 0.36923443691107 0.11539112337347 178.490 > 9 14 Hf 0.66666666666667 0.33333333333333 0.33333333333333 178.490 > 3 15 Hf 0.33546518222198 0.29743222975560 0.55127554329319 178.490 > 4 16 Hf 0.03803295246638 0.33546518222198 0.44872445670681 178.490 > 5 17 Hf 0.29743222975560 0.96196704753362 0.44872445670681 178.490 > 6 18 Hf 0.70256777024440 0.03803295246638 0.55127554329319 178.490 > 7 19 Hf 0.96196704753362 0.66453481777802 0.55127554329319 178.490 > 8 20 Hf 0.66453481777802 0.70256777024440 0.44872445670681 178.490 > 9 21 Hf 0.33333333333333 0.66666666666667 0.66666666666667 178.490 > 3 22 Hf 0.00213184888865 0.63076556308893 0.88460887662652 178.490 > 4 23 Hf 0.70469961913305 0.66879851555531 0.78205779004014 178.490 > 5 24 Hf 0.96409889642227 0.29530038086695 0.78205779004014 178.490 > 6 25 Hf 0.36923443691107 0.37136628579971 0.88460887662652 178.490 > 7 26 Hf 0.62863371420029 0.99786815111135 0.88460887662652 178.490 > 8 27 Hf 0.33120148444469 0.03590110357773 0.78205779004014 178.490 > 9 *28 O 0.00000000000000 0.00000000000000 0.23633566058649 15.999 > 10 *29 O 0.67172415070764 0.06000715659819 0.29071587962408 15.999 > 11 *30 O 0.71280498192337 0.98768318016270 0.13659758326630 15.999 > 12 31 O 0.39178846842734 0.04613831525670 0.19673575006704 15.999 > 13 32 O 0.27838366077611 0.00505748404097 0.04261745370926 15.999 > 14 33 O 0.72667382326486 0.72161633922389 0.04261745370926 15.999 > 15 34 O 0.65434984682937 0.60821153157266 0.19673575006704 15.999 > 16 *35 O 0.33333333333333 0.66666666666667 0.23719621571849 15.999 > 17 36 O 0.33333333333333 0.66666666666667 0.09613711761484 15.999 > 18 37 O 0.01231681983730 0.72512180176067 0.13659758326630 15.999 > 19 38 O 0.93999284340181 0.61171699410945 0.29071587962408 15.999 > 20 39 O 0.38828300589055 0.32827584929236 0.29071587962408 15.999 > 21 40 O 0.27487819823933 0.28719501807663 0.13659758326630 15.999 > 22 41 O 0.95386168474330 0.34565015317063 0.19673575006704 15.999 > 23 42 O 0.99494251595903 0.27332617673514 0.04261745370926 15.999 > 24 43 O 0.66666666666667 0.33333333333333 0.09699767274684 15.999 > 25 44 O 0.66666666666667 0.33333333333333 0.56966899391982 15.999 > 10 45 O 0.33839081737430 0.39334048993152 0.62404921295741 15.999 > 11 46 O 0.37947164859004 0.32101651349603 0.46993091659963 15.999 > 12 47 O 0.05845513509400 0.37947164859004 0.53006908340037 15.999 > 13 48 O 0.94505032744278 0.33839081737430 0.37595078704259 15.999 > 14 49 O 0.39334048993152 0.05494967255722 0.37595078704259 15.999 > 15 50 O 0.32101651349603 0.94154486490600 0.53006908340037 15.999 > 16 51 O 0.00000000000000 0.00000000000000 0.57052954905183 15.999 > 17 52 O 0.00000000000000 0.00000000000000 0.42947045094817 15.999 > 18 53 O 0.67898348650397 0.05845513509400 0.46993091659963 15.999 > 19 54 O 0.60665951006848 0.94505032744278 0.62404921295741 15.999 > 20 55 O 0.05494967255722 0.66160918262570 0.62404921295741 15.999 > 21 56 O 0.94154486490600 0.62052835140996 0.46993091659963 15.999 > 22 57 O 0.62052835140996 0.67898348650397 0.53006908340037 15.999 > 23 58 O 0.66160918262570 0.60665951006848 0.37595078704259 15.999 > 24 59 O 0.33333333333333 0.66666666666667 0.43033100608018 15.999 > 25 60 O 0.33333333333333 0.66666666666667 0.90300232725316 15.999 > 10 61 O 0.00505748404097 0.72667382326486 0.95738254629074 15.999 > 11 62 O 0.04613831525670 0.65434984682937 0.80326424993296 15.999 > 12 63 O 0.72512180176067 0.71280498192337 0.86340241673370 15.999 > 13 64 O 0.61171699410945 0.67172415070764 0.70928412037593 15.999 > 14 65 O 0.06000715659819 0.38828300589055 0.70928412037593 15.999 > 15 66 O 0.98768318016270 0.27487819823933 0.86340241673370 15.999 > 16 67 O 0.66666666666667 0.33333333333333 0.90386288238516 15.999 > 17 68 O 0.66666666666667 0.33333333333333 0.76280378428151 15.999 > 18 69 O 0.34565015317063 0.39178846842734 0.80326424993296 15.999 > 19 70 O 0.27332617673514 0.27838366077611 0.95738254629074 15.999 > 20 71 O 0.72161633922389 0.99494251595903 0.95738254629074 15.999 > 21 72 O 0.60821153157266 0.95386168474330 0.80326424993296 15.999 > 22 73 O 0.28719501807663 0.01231681983730 0.86340241673370 15.999 > 23 74 O 0.32827584929236 0.93999284340181 0.70928412037593 15.999 > 24 75 O 0.00000000000000 0.00000000000000 0.76366433941351 15.999 > 25 -------------------------------- super cell -------------------------------- Lattice vectors: a 6.332669891890510 0.000000000000000 0.000000000000000 b -3.166334945945255 5.484253000158036 0.000000000000000 c 0.000000000000000 0.000000000000000 26.498654640000005 Atomic positions (fractional): *1 Sr 0.33333333333333 0.66666666666667 0.00032079300313 87.620 > 1 2 Sr 0.33333333333333 0.66666666666667 0.33301254033020 87.620 > 2 3 Sr 0.00000000000000 0.00000000000000 0.33365412633647 87.620 > 1 4 Sr 0.00000000000000 0.00000000000000 0.66634587366353 87.620 > 2 5 Sr 0.66666666666667 0.33333333333333 0.66698745966980 87.620 > 1 6 Sr 0.66666666666667 0.33333333333333 0.99967920699687 87.620 > 2 *7 Hf 0.00000000000000 0.00000000000000 0.00000000000000 178.490 > 3 *8 Hf 0.66879851555531 0.96409889642227 0.21794220995986 178.490 > 4 9 Hf 0.37136628579971 0.00213184888865 0.11539112337347 178.490 > 5 10 Hf 0.63076556308893 0.62863371420029 0.11539112337347 178.490 > 6 11 Hf 0.03590110357773 0.70469961913305 0.21794220995986 178.490 > 7 12 Hf 0.29530038086695 0.33120148444469 0.21794220995986 178.490 > 8 13 Hf 0.99786815111135 0.36923443691107 0.11539112337347 178.490 > 9 14 Hf 0.66666666666667 0.33333333333333 0.33333333333333 178.490 > 3 15 Hf 0.33546518222198 0.29743222975560 0.55127554329319 178.490 > 4 16 Hf 0.03803295246638 0.33546518222198 0.44872445670681 178.490 > 5 17 Hf 0.29743222975560 0.96196704753362 0.44872445670681 178.490 > 6 18 Hf 0.70256777024440 0.03803295246638 0.55127554329319 178.490 > 7 19 Hf 0.96196704753362 0.66453481777802 0.55127554329319 178.490 > 8 20 Hf 0.66453481777802 0.70256777024440 0.44872445670681 178.490 > 9 21 Hf 0.33333333333333 0.66666666666667 0.66666666666667 178.490 > 3 22 Hf 0.00213184888865 0.63076556308893 0.88460887662652 178.490 > 4 23 Hf 0.70469961913305 0.66879851555531 0.78205779004014 178.490 > 5 24 Hf 0.96409889642227 0.29530038086695 0.78205779004014 178.490 > 6 25 Hf 0.36923443691107 0.37136628579971 0.88460887662652 178.490 > 7 26 Hf 0.62863371420029 0.99786815111135 0.88460887662652 178.490 > 8 27 Hf 0.33120148444469 0.03590110357773 0.78205779004014 178.490 > 9 *28 O 0.00000000000000 0.00000000000000 0.23633566058649 15.999 > 10 *29 O 0.67172415070764 0.06000715659819 0.29071587962408 15.999 > 11 *30 O 0.71280498192337 0.98768318016270 0.13659758326630 15.999 > 12 31 O 0.39178846842734 0.04613831525670 0.19673575006704 15.999 > 13 32 O 0.27838366077611 0.00505748404097 0.04261745370926 15.999 > 14 33 O 0.72667382326486 0.72161633922389 0.04261745370926 15.999 > 15 34 O 0.65434984682937 0.60821153157266 0.19673575006704 15.999 > 16 *35 O 0.33333333333333 0.66666666666667 0.23719621571849 15.999 > 17 36 O 0.33333333333333 0.66666666666667 0.09613711761484 15.999 > 18 37 O 0.01231681983730 0.72512180176067 0.13659758326630 15.999 > 19 38 O 0.93999284340181 0.61171699410945 0.29071587962408 15.999 > 20 39 O 0.38828300589055 0.32827584929236 0.29071587962408 15.999 > 21 40 O 0.27487819823933 0.28719501807663 0.13659758326630 15.999 > 22 41 O 0.95386168474330 0.34565015317063 0.19673575006704 15.999 > 23 42 O 0.99494251595903 0.27332617673514 0.04261745370926 15.999 > 24 43 O 0.66666666666667 0.33333333333333 0.09699767274684 15.999 > 25 44 O 0.66666666666667 0.33333333333333 0.56966899391982 15.999 > 10 45 O 0.33839081737430 0.39334048993152 0.62404921295741 15.999 > 11 46 O 0.37947164859004 0.32101651349603 0.46993091659963 15.999 > 12 47 O 0.05845513509400 0.37947164859004 0.53006908340037 15.999 > 13 48 O 0.94505032744278 0.33839081737430 0.37595078704259 15.999 > 14 49 O 0.39334048993152 0.05494967255722 0.37595078704259 15.999 > 15 50 O 0.32101651349603 0.94154486490600 0.53006908340037 15.999 > 16 51 O 0.00000000000000 0.00000000000000 0.57052954905183 15.999 > 17 52 O 0.00000000000000 0.00000000000000 0.42947045094817 15.999 > 18 53 O 0.67898348650397 0.05845513509400 0.46993091659963 15.999 > 19 54 O 0.60665951006848 0.94505032744278 0.62404921295741 15.999 > 20 55 O 0.05494967255722 0.66160918262570 0.62404921295741 15.999 > 21 56 O 0.94154486490600 0.62052835140996 0.46993091659963 15.999 > 22 57 O 0.62052835140996 0.67898348650397 0.53006908340037 15.999 > 23 58 O 0.66160918262570 0.60665951006848 0.37595078704259 15.999 > 24 59 O 0.33333333333333 0.66666666666667 0.43033100608018 15.999 > 25 60 O 0.33333333333333 0.66666666666667 0.90300232725316 15.999 > 10 61 O 0.00505748404097 0.72667382326486 0.95738254629074 15.999 > 11 62 O 0.04613831525670 0.65434984682937 0.80326424993296 15.999 > 12 63 O 0.72512180176067 0.71280498192337 0.86340241673370 15.999 > 13 64 O 0.61171699410945 0.67172415070764 0.70928412037593 15.999 > 14 65 O 0.06000715659819 0.38828300589055 0.70928412037593 15.999 > 15 66 O 0.98768318016270 0.27487819823933 0.86340241673370 15.999 > 16 67 O 0.66666666666667 0.33333333333333 0.90386288238516 15.999 > 17 68 O 0.66666666666667 0.33333333333333 0.76280378428151 15.999 > 18 69 O 0.34565015317063 0.39178846842734 0.80326424993296 15.999 > 19 70 O 0.27332617673514 0.27838366077611 0.95738254629074 15.999 > 20 71 O 0.72161633922389 0.99494251595903 0.95738254629074 15.999 > 21 72 O 0.60821153157266 0.95386168474330 0.80326424993296 15.999 > 22 73 O 0.28719501807663 0.01231681983730 0.86340241673370 15.999 > 23 74 O 0.32827584929236 0.93999284340181 0.70928412037593 15.999 > 24 75 O 0.00000000000000 0.00000000000000 0.76366433941351 15.999 > 25 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.5148461 0.0000008 0.0000000 -0.0000008 4.5148461 0.0000000 0.0000000 0.0000000 4.6420724 -------------------------- Born effective charges -------------------------- 1 Sr 2.3684830 -0.0009306 -0.0000000 0.0009306 2.3684830 0.0000000 -0.0000000 -0.0000000 2.8619603 2 Sr 2.3684830 -0.0009306 -0.0000000 0.0009306 2.3684830 0.0000000 -0.0000000 -0.0000000 2.8619603 3 Hf 5.5704908 0.0290463 -0.0000000 -0.0290463 5.5704908 0.0000000 -0.0000000 -0.0000000 5.9883619 4 Hf 5.4611720 0.5653207 -0.1354815 0.5672022 4.5628075 0.3558619 -0.1700204 0.2465362 5.0666510 5 Hf 4.2970018 0.1049318 0.3759262 0.1068132 5.7269776 -0.0606006 0.2985169 0.0239739 5.0666510 6 Hf 5.2777954 -0.6730746 -0.2404447 -0.6711932 4.7461841 -0.2952614 -0.1284964 -0.2705101 5.0666510 7 Hf 5.2777954 -0.6730746 -0.2404447 -0.6711932 4.7461841 -0.2952614 -0.1284964 -0.2705101 5.0666510 8 Hf 4.2970018 0.1049318 0.3759262 0.1068132 5.7269776 -0.0606006 0.2985169 0.0239739 5.0666510 9 Hf 5.4611720 0.5653207 -0.1354815 0.5672022 4.5628075 0.3558619 -0.1700204 0.2465362 5.0666510 10 O -3.1422890 -0.1666036 -0.0000000 0.1666036 -3.1422890 0.0000000 -0.0000000 -0.0000000 -1.6660728 11 O -1.9341359 0.4134620 0.5330030 0.4234234 -2.3535984 -0.9497162 0.5490791 -0.9929069 -3.6022301 12 O -2.1619975 0.0819109 0.0701841 0.0842300 -2.9724532 -0.0978413 -0.0559673 0.0193893 -2.3000690 13 O -2.8417804 0.3082429 -0.1198251 0.3105619 -2.2926703 -0.0118606 0.0447753 0.0387745 -2.3000690 14 O -2.6111148 -0.0325695 -1.0889799 -0.0226081 -1.6766195 0.0132640 -1.1344221 0.0209370 -3.6022301 15 O -1.8863507 -0.3958346 0.5559769 -0.3858732 -2.4013835 0.9364522 0.5853430 0.9719699 -3.6022301 16 O -2.6978982 -0.3936324 0.0496410 -0.3913133 -2.4365525 0.1097019 0.0111920 -0.0581638 -2.3000690 17 O -2.9141311 0.1742540 -0.0000000 -0.1742540 -2.9141311 0.0000000 -0.0000000 -0.0000000 -1.6831242 18 O -2.9141311 0.1742540 -0.0000000 -0.1742540 -2.9141311 0.0000000 -0.0000000 -0.0000000 -1.6831242 19 O -2.6978982 -0.3936324 0.0496410 -0.3913133 -2.4365525 0.1097019 0.0111920 -0.0581638 -2.3000690 20 O -1.8863507 -0.3958346 0.5559769 -0.3858732 -2.4013835 0.9364522 0.5853430 0.9719699 -3.6022301 21 O -2.6111148 -0.0325695 -1.0889799 -0.0226081 -1.6766195 0.0132640 -1.1344221 0.0209370 -3.6022301 22 O -2.8417804 0.3082429 -0.1198251 0.3105619 -2.2926703 -0.0118606 0.0447753 0.0387745 -2.3000690 23 O -2.1619975 0.0819109 0.0701841 0.0842300 -2.9724532 -0.0978413 -0.0559673 0.0193893 -2.3000690 24 O -1.9341359 0.4134620 0.5330030 0.4234234 -2.3535984 -0.9497162 0.5490791 -0.9929069 -3.6022301 25 O -3.1422890 -0.1666036 -0.0000000 0.1666036 -3.1422890 0.0000000 -0.0000000 -0.0000000 -1.6660728 ---------------------------------------------------------------------------- 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: 717 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) 234 eigenvectors found. (2) Complementary block size: 35 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 662 / 662 (1) 148 eigenvectors found. (1) Complementary block size: 33 (1) Compute compressed projector. (1) Use standard solver. (1) 14 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, 14), data: (662, 33) @ (33, 14) |-- (162, 148), data: True |-- (500, 481), data: False |-- (500, 16), data: (500, 35) @ (35, 16) |-- (250, 234), data: True |-- (250, 231), data: True ----- Solver_atoms: 1 -- 75 / 75 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 560 - Time: 1.268 Solver_block: 200 / 560 - Time: 1.265 Solver_block: 300 / 560 - Time: 1.265 Solver_block: 400 / 560 - Time: 1.263 Solver_block: 500 / 560 - Time: 1.264 Solver_block: 560 / 560 - Time: 0.804 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 7.162 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) 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: 717 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) 234 eigenvectors found. (2) Complementary block size: 35 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 662 / 662 (1) 148 eigenvectors found. (1) Complementary block size: 33 (1) Compute compressed projector. (1) Use standard solver. (1) 14 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, 14), data: (662, 33) @ (33, 14) |-- (162, 148), data: True |-- (500, 481), data: False |-- (500, 16), data: (500, 35) @ (35, 16) |-- (250, 234), data: True |-- (250, 231), data: True Max drift after symmetrization by symfc projector: -0.00000000 (yy) -0.00000000 (yy) 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 00:05:57]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 00:05:57]------------------------- 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 3.166334945945258 1.828084333386010 8.832884879999993 b -3.166334945945252 1.828084333386010 8.832884879999993 c 0.000000000000003 -3.656168666772026 8.832884879999993 Atomic positions (fractional): 1 Sr 0.33365412633647 0.33365412633647 0.33365412633647 87.620 2 Sr 0.66634587366353 0.66634587366354 0.66634587366353 87.620 3 Hf 0.00000000000000 0.00000000000000 0.00000000000000 178.490 4 Hf 0.88674072551517 0.51324259082681 0.25384331353759 178.490 5 Hf 0.48675740917319 0.74615668646241 0.11325927448483 178.490 6 Hf 0.74615668646241 0.11325927448483 0.48675740917319 178.490 7 Hf 0.25384331353759 0.88674072551517 0.51324259082681 178.490 8 Hf 0.51324259082681 0.25384331353759 0.88674072551517 178.490 9 Hf 0.11325927448483 0.48675740917319 0.74615668646241 178.490 10 O 0.23633566058649 0.23633566058649 0.23633566058649 15.999 11 O 0.96244003033171 0.67899888551463 0.23070872302588 15.999 12 O 0.84940256518966 0.41147578150563 0.14891440310360 15.999 13 O 0.58852421849437 0.85108559689641 0.15059743481033 15.999 14 O 0.32100111448537 0.76929127697412 0.03755996966829 15.999 15 O 0.76929127697412 0.03755996966829 0.32100111448537 15.999 16 O 0.85108559689641 0.15059743481034 0.58852421849437 15.999 17 O 0.57052954905183 0.57052954905183 0.57052954905183 15.999 18 O 0.42947045094817 0.42947045094817 0.42947045094817 15.999 19 O 0.14891440310360 0.84940256518966 0.41147578150563 15.999 20 O 0.23070872302588 0.96244003033171 0.67899888551463 15.999 21 O 0.67899888551463 0.23070872302588 0.96244003033171 15.999 22 O 0.41147578150563 0.14891440310360 0.84940256518966 15.999 23 O 0.15059743481033 0.58852421849437 0.85108559689640 15.999 24 O 0.03755996966829 0.32100111448537 0.76929127697412 15.999 25 O 0.76366433941351 0.76366433941351 0.76366433941351 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 6.332669891890510 0.000000000000000 0.000000000000000 b -3.166334945945255 5.484253000158036 0.000000000000000 c 0.000000000000000 0.000000000000000 26.498654640000005 Atomic positions (fractional): 1 Sr 0.33333333333333 0.66666666666667 0.00032079300313 87.620 > 1 2 Sr 0.33333333333333 0.66666666666667 0.33301254033020 87.620 > 2 3 Sr 0.00000000000000 0.00000000000000 0.33365412633647 87.620 > 1 4 Sr 0.00000000000000 0.00000000000000 0.66634587366353 87.620 > 2 5 Sr 0.66666666666667 0.33333333333333 0.66698745966980 87.620 > 1 6 Sr 0.66666666666667 0.33333333333333 0.99967920699687 87.620 > 2 7 Hf 0.00000000000000 0.00000000000000 0.00000000000000 178.490 > 7 8 Hf 0.66879851555531 0.96409889642227 0.21794220995986 178.490 > 8 9 Hf 0.37136628579971 0.00213184888865 0.11539112337347 178.490 > 9 10 Hf 0.63076556308893 0.62863371420029 0.11539112337347 178.490 > 10 11 Hf 0.03590110357773 0.70469961913305 0.21794220995986 178.490 > 11 12 Hf 0.29530038086695 0.33120148444469 0.21794220995986 178.490 > 12 13 Hf 0.99786815111135 0.36923443691107 0.11539112337347 178.490 > 13 14 Hf 0.66666666666667 0.33333333333333 0.33333333333333 178.490 > 7 15 Hf 0.33546518222198 0.29743222975560 0.55127554329319 178.490 > 8 16 Hf 0.03803295246638 0.33546518222198 0.44872445670681 178.490 > 9 17 Hf 0.29743222975560 0.96196704753362 0.44872445670681 178.490 > 10 18 Hf 0.70256777024440 0.03803295246638 0.55127554329319 178.490 > 11 19 Hf 0.96196704753362 0.66453481777802 0.55127554329319 178.490 > 12 20 Hf 0.66453481777802 0.70256777024440 0.44872445670681 178.490 > 13 21 Hf 0.33333333333333 0.66666666666667 0.66666666666667 178.490 > 7 22 Hf 0.00213184888865 0.63076556308893 0.88460887662652 178.490 > 8 23 Hf 0.70469961913305 0.66879851555531 0.78205779004014 178.490 > 9 24 Hf 0.96409889642227 0.29530038086695 0.78205779004014 178.490 > 10 25 Hf 0.36923443691107 0.37136628579971 0.88460887662652 178.490 > 11 26 Hf 0.62863371420029 0.99786815111135 0.88460887662652 178.490 > 12 27 Hf 0.33120148444469 0.03590110357773 0.78205779004014 178.490 > 13 28 O 0.00000000000000 0.00000000000000 0.23633566058649 15.999 > 28 29 O 0.67172415070764 0.06000715659819 0.29071587962408 15.999 > 29 30 O 0.71280498192337 0.98768318016270 0.13659758326630 15.999 > 30 31 O 0.39178846842734 0.04613831525670 0.19673575006704 15.999 > 31 32 O 0.27838366077611 0.00505748404097 0.04261745370926 15.999 > 32 33 O 0.72667382326486 0.72161633922389 0.04261745370926 15.999 > 33 34 O 0.65434984682937 0.60821153157266 0.19673575006704 15.999 > 34 35 O 0.33333333333333 0.66666666666667 0.23719621571849 15.999 > 35 36 O 0.33333333333333 0.66666666666667 0.09613711761484 15.999 > 36 37 O 0.01231681983730 0.72512180176067 0.13659758326630 15.999 > 37 38 O 0.93999284340181 0.61171699410945 0.29071587962408 15.999 > 38 39 O 0.38828300589055 0.32827584929236 0.29071587962408 15.999 > 39 40 O 0.27487819823933 0.28719501807663 0.13659758326630 15.999 > 40 41 O 0.95386168474330 0.34565015317063 0.19673575006704 15.999 > 41 42 O 0.99494251595903 0.27332617673514 0.04261745370926 15.999 > 42 43 O 0.66666666666667 0.33333333333333 0.09699767274684 15.999 > 43 44 O 0.66666666666667 0.33333333333333 0.56966899391982 15.999 > 28 45 O 0.33839081737430 0.39334048993152 0.62404921295741 15.999 > 29 46 O 0.37947164859004 0.32101651349603 0.46993091659963 15.999 > 30 47 O 0.05845513509400 0.37947164859004 0.53006908340037 15.999 > 31 48 O 0.94505032744278 0.33839081737430 0.37595078704259 15.999 > 32 49 O 0.39334048993152 0.05494967255722 0.37595078704259 15.999 > 33 50 O 0.32101651349603 0.94154486490600 0.53006908340037 15.999 > 34 51 O 0.00000000000000 0.00000000000000 0.57052954905183 15.999 > 35 52 O 0.00000000000000 0.00000000000000 0.42947045094817 15.999 > 36 53 O 0.67898348650397 0.05845513509400 0.46993091659963 15.999 > 37 54 O 0.60665951006848 0.94505032744278 0.62404921295741 15.999 > 38 55 O 0.05494967255722 0.66160918262570 0.62404921295741 15.999 > 39 56 O 0.94154486490600 0.62052835140996 0.46993091659963 15.999 > 40 57 O 0.62052835140996 0.67898348650397 0.53006908340037 15.999 > 41 58 O 0.66160918262570 0.60665951006848 0.37595078704259 15.999 > 42 59 O 0.33333333333333 0.66666666666667 0.43033100608018 15.999 > 43 60 O 0.33333333333333 0.66666666666667 0.90300232725316 15.999 > 28 61 O 0.00505748404097 0.72667382326486 0.95738254629074 15.999 > 29 62 O 0.04613831525670 0.65434984682937 0.80326424993296 15.999 > 30 63 O 0.72512180176067 0.71280498192337 0.86340241673370 15.999 > 31 64 O 0.61171699410945 0.67172415070764 0.70928412037593 15.999 > 32 65 O 0.06000715659819 0.38828300589055 0.70928412037593 15.999 > 33 66 O 0.98768318016270 0.27487819823933 0.86340241673370 15.999 > 34 67 O 0.66666666666667 0.33333333333333 0.90386288238516 15.999 > 35 68 O 0.66666666666667 0.33333333333333 0.76280378428151 15.999 > 36 69 O 0.34565015317063 0.39178846842734 0.80326424993296 15.999 > 37 70 O 0.27332617673514 0.27838366077611 0.95738254629074 15.999 > 38 71 O 0.72161633922389 0.99494251595903 0.95738254629074 15.999 > 39 72 O 0.60821153157266 0.95386168474330 0.80326424993296 15.999 > 40 73 O 0.28719501807663 0.01231681983730 0.86340241673370 15.999 > 41 74 O 0.32827584929236 0.93999284340181 0.70928412037593 15.999 > 42 75 O 0.00000000000000 0.00000000000000 0.76366433941351 15.999 > 43 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.5148461 0.0000008 0.0000000 -0.0000008 4.5148461 0.0000000 0.0000000 0.0000000 4.6420724 -------------------------- Born effective charges -------------------------- 1 Sr 2.3684830 -0.0009306 -0.0000000 0.0009306 2.3684830 0.0000000 -0.0000000 -0.0000000 2.8619603 2 Sr 2.3684830 -0.0009306 -0.0000000 0.0009306 2.3684830 0.0000000 -0.0000000 -0.0000000 2.8619603 3 Hf 5.5704908 0.0290463 -0.0000000 -0.0290463 5.5704908 0.0000000 -0.0000000 -0.0000000 5.9883619 4 Hf 5.4611720 0.5653207 -0.1354815 0.5672022 4.5628075 0.3558619 -0.1700204 0.2465362 5.0666510 5 Hf 4.2970018 0.1049318 0.3759262 0.1068132 5.7269776 -0.0606006 0.2985169 0.0239739 5.0666510 6 Hf 5.2777954 -0.6730746 -0.2404447 -0.6711932 4.7461841 -0.2952614 -0.1284964 -0.2705101 5.0666510 7 Hf 5.2777954 -0.6730746 -0.2404447 -0.6711932 4.7461841 -0.2952614 -0.1284964 -0.2705101 5.0666510 8 Hf 4.2970018 0.1049318 0.3759262 0.1068132 5.7269776 -0.0606006 0.2985169 0.0239739 5.0666510 9 Hf 5.4611720 0.5653207 -0.1354815 0.5672022 4.5628075 0.3558619 -0.1700204 0.2465362 5.0666510 10 O -3.1422890 -0.1666036 -0.0000000 0.1666036 -3.1422890 0.0000000 -0.0000000 -0.0000000 -1.6660728 11 O -1.9341359 0.4134620 0.5330030 0.4234234 -2.3535984 -0.9497162 0.5490791 -0.9929069 -3.6022301 12 O -2.1619975 0.0819109 0.0701841 0.0842300 -2.9724532 -0.0978413 -0.0559673 0.0193893 -2.3000690 13 O -2.8417804 0.3082429 -0.1198251 0.3105619 -2.2926703 -0.0118606 0.0447753 0.0387745 -2.3000690 14 O -2.6111148 -0.0325695 -1.0889799 -0.0226081 -1.6766195 0.0132640 -1.1344221 0.0209370 -3.6022301 15 O -1.8863507 -0.3958346 0.5559769 -0.3858732 -2.4013835 0.9364522 0.5853430 0.9719699 -3.6022301 16 O -2.6978982 -0.3936324 0.0496410 -0.3913133 -2.4365525 0.1097019 0.0111920 -0.0581638 -2.3000690 17 O -2.9141311 0.1742540 -0.0000000 -0.1742540 -2.9141311 0.0000000 -0.0000000 -0.0000000 -1.6831242 18 O -2.9141311 0.1742540 -0.0000000 -0.1742540 -2.9141311 0.0000000 -0.0000000 -0.0000000 -1.6831242 19 O -2.6978982 -0.3936324 0.0496410 -0.3913133 -2.4365525 0.1097019 0.0111920 -0.0581638 -2.3000690 20 O -1.8863507 -0.3958346 0.5559769 -0.3858732 -2.4013835 0.9364522 0.5853430 0.9719699 -3.6022301 21 O -2.6111148 -0.0325695 -1.0889799 -0.0226081 -1.6766195 0.0132640 -1.1344221 0.0209370 -3.6022301 22 O -2.8417804 0.3082429 -0.1198251 0.3105619 -2.2926703 -0.0118606 0.0447753 0.0387745 -2.3000690 23 O -2.1619975 0.0819109 0.0701841 0.0842300 -2.9724532 -0.0978413 -0.0559673 0.0193893 -2.3000690 24 O -1.9341359 0.4134620 0.5330030 0.4234234 -2.3535984 -0.9497162 0.5490791 -0.9929069 -3.6022301 25 O -3.1422890 -0.1666036 -0.0000000 0.1666036 -3.1422890 0.0000000 -0.0000000 -0.0000000 -1.6660728 ---------------------------------------------------------------------------- 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 8, 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[ 28, 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[ 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[ 30, 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[ 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 (zzz) 0.00000000 (zzz) 0.00000000 (zzz) 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 00:06:10]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 00:06:10]------------------------- 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 3.166334945945258 1.828084333386010 8.832884879999993 b -3.166334945945252 1.828084333386010 8.832884879999993 c 0.000000000000003 -3.656168666772026 8.832884879999993 Atomic positions (fractional): 1 Sr 0.33365412633647 0.33365412633647 0.33365412633647 87.620 2 Sr 0.66634587366353 0.66634587366354 0.66634587366353 87.620 3 Hf 0.00000000000000 0.00000000000000 0.00000000000000 178.490 4 Hf 0.88674072551517 0.51324259082681 0.25384331353759 178.490 5 Hf 0.48675740917319 0.74615668646241 0.11325927448483 178.490 6 Hf 0.74615668646241 0.11325927448483 0.48675740917319 178.490 7 Hf 0.25384331353759 0.88674072551517 0.51324259082681 178.490 8 Hf 0.51324259082681 0.25384331353759 0.88674072551517 178.490 9 Hf 0.11325927448483 0.48675740917319 0.74615668646241 178.490 10 O 0.23633566058649 0.23633566058649 0.23633566058649 15.999 11 O 0.96244003033171 0.67899888551463 0.23070872302588 15.999 12 O 0.84940256518966 0.41147578150563 0.14891440310360 15.999 13 O 0.58852421849437 0.85108559689641 0.15059743481033 15.999 14 O 0.32100111448537 0.76929127697412 0.03755996966829 15.999 15 O 0.76929127697412 0.03755996966829 0.32100111448537 15.999 16 O 0.85108559689641 0.15059743481034 0.58852421849437 15.999 17 O 0.57052954905183 0.57052954905183 0.57052954905183 15.999 18 O 0.42947045094817 0.42947045094817 0.42947045094817 15.999 19 O 0.14891440310360 0.84940256518966 0.41147578150563 15.999 20 O 0.23070872302588 0.96244003033171 0.67899888551463 15.999 21 O 0.67899888551463 0.23070872302588 0.96244003033171 15.999 22 O 0.41147578150563 0.14891440310360 0.84940256518966 15.999 23 O 0.15059743481033 0.58852421849437 0.85108559689640 15.999 24 O 0.03755996966829 0.32100111448537 0.76929127697412 15.999 25 O 0.76366433941351 0.76366433941351 0.76366433941351 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 6.332669891890510 0.000000000000000 0.000000000000000 b -3.166334945945255 5.484253000158036 0.000000000000000 c 0.000000000000000 0.000000000000000 26.498654640000005 Atomic positions (fractional): 1 Sr 0.33333333333333 0.66666666666667 0.00032079300313 87.620 > 1 2 Sr 0.33333333333333 0.66666666666667 0.33301254033020 87.620 > 2 3 Sr 0.00000000000000 0.00000000000000 0.33365412633647 87.620 > 1 4 Sr 0.00000000000000 0.00000000000000 0.66634587366353 87.620 > 2 5 Sr 0.66666666666667 0.33333333333333 0.66698745966980 87.620 > 1 6 Sr 0.66666666666667 0.33333333333333 0.99967920699687 87.620 > 2 7 Hf 0.00000000000000 0.00000000000000 0.00000000000000 178.490 > 7 8 Hf 0.66879851555531 0.96409889642227 0.21794220995986 178.490 > 8 9 Hf 0.37136628579971 0.00213184888865 0.11539112337347 178.490 > 9 10 Hf 0.63076556308893 0.62863371420029 0.11539112337347 178.490 > 10 11 Hf 0.03590110357773 0.70469961913305 0.21794220995986 178.490 > 11 12 Hf 0.29530038086695 0.33120148444469 0.21794220995986 178.490 > 12 13 Hf 0.99786815111135 0.36923443691107 0.11539112337347 178.490 > 13 14 Hf 0.66666666666667 0.33333333333333 0.33333333333333 178.490 > 7 15 Hf 0.33546518222198 0.29743222975560 0.55127554329319 178.490 > 8 16 Hf 0.03803295246638 0.33546518222198 0.44872445670681 178.490 > 9 17 Hf 0.29743222975560 0.96196704753362 0.44872445670681 178.490 > 10 18 Hf 0.70256777024440 0.03803295246638 0.55127554329319 178.490 > 11 19 Hf 0.96196704753362 0.66453481777802 0.55127554329319 178.490 > 12 20 Hf 0.66453481777802 0.70256777024440 0.44872445670681 178.490 > 13 21 Hf 0.33333333333333 0.66666666666667 0.66666666666667 178.490 > 7 22 Hf 0.00213184888865 0.63076556308893 0.88460887662652 178.490 > 8 23 Hf 0.70469961913305 0.66879851555531 0.78205779004014 178.490 > 9 24 Hf 0.96409889642227 0.29530038086695 0.78205779004014 178.490 > 10 25 Hf 0.36923443691107 0.37136628579971 0.88460887662652 178.490 > 11 26 Hf 0.62863371420029 0.99786815111135 0.88460887662652 178.490 > 12 27 Hf 0.33120148444469 0.03590110357773 0.78205779004014 178.490 > 13 28 O 0.00000000000000 0.00000000000000 0.23633566058649 15.999 > 28 29 O 0.67172415070764 0.06000715659819 0.29071587962408 15.999 > 29 30 O 0.71280498192337 0.98768318016270 0.13659758326630 15.999 > 30 31 O 0.39178846842734 0.04613831525670 0.19673575006704 15.999 > 31 32 O 0.27838366077611 0.00505748404097 0.04261745370926 15.999 > 32 33 O 0.72667382326486 0.72161633922389 0.04261745370926 15.999 > 33 34 O 0.65434984682937 0.60821153157266 0.19673575006704 15.999 > 34 35 O 0.33333333333333 0.66666666666667 0.23719621571849 15.999 > 35 36 O 0.33333333333333 0.66666666666667 0.09613711761484 15.999 > 36 37 O 0.01231681983730 0.72512180176067 0.13659758326630 15.999 > 37 38 O 0.93999284340181 0.61171699410945 0.29071587962408 15.999 > 38 39 O 0.38828300589055 0.32827584929236 0.29071587962408 15.999 > 39 40 O 0.27487819823933 0.28719501807663 0.13659758326630 15.999 > 40 41 O 0.95386168474330 0.34565015317063 0.19673575006704 15.999 > 41 42 O 0.99494251595903 0.27332617673514 0.04261745370926 15.999 > 42 43 O 0.66666666666667 0.33333333333333 0.09699767274684 15.999 > 43 44 O 0.66666666666667 0.33333333333333 0.56966899391982 15.999 > 28 45 O 0.33839081737430 0.39334048993152 0.62404921295741 15.999 > 29 46 O 0.37947164859004 0.32101651349603 0.46993091659963 15.999 > 30 47 O 0.05845513509400 0.37947164859004 0.53006908340037 15.999 > 31 48 O 0.94505032744278 0.33839081737430 0.37595078704259 15.999 > 32 49 O 0.39334048993152 0.05494967255722 0.37595078704259 15.999 > 33 50 O 0.32101651349603 0.94154486490600 0.53006908340037 15.999 > 34 51 O 0.00000000000000 0.00000000000000 0.57052954905183 15.999 > 35 52 O 0.00000000000000 0.00000000000000 0.42947045094817 15.999 > 36 53 O 0.67898348650397 0.05845513509400 0.46993091659963 15.999 > 37 54 O 0.60665951006848 0.94505032744278 0.62404921295741 15.999 > 38 55 O 0.05494967255722 0.66160918262570 0.62404921295741 15.999 > 39 56 O 0.94154486490600 0.62052835140996 0.46993091659963 15.999 > 40 57 O 0.62052835140996 0.67898348650397 0.53006908340037 15.999 > 41 58 O 0.66160918262570 0.60665951006848 0.37595078704259 15.999 > 42 59 O 0.33333333333333 0.66666666666667 0.43033100608018 15.999 > 43 60 O 0.33333333333333 0.66666666666667 0.90300232725316 15.999 > 28 61 O 0.00505748404097 0.72667382326486 0.95738254629074 15.999 > 29 62 O 0.04613831525670 0.65434984682937 0.80326424993296 15.999 > 30 63 O 0.72512180176067 0.71280498192337 0.86340241673370 15.999 > 31 64 O 0.61171699410945 0.67172415070764 0.70928412037593 15.999 > 32 65 O 0.06000715659819 0.38828300589055 0.70928412037593 15.999 > 33 66 O 0.98768318016270 0.27487819823933 0.86340241673370 15.999 > 34 67 O 0.66666666666667 0.33333333333333 0.90386288238516 15.999 > 35 68 O 0.66666666666667 0.33333333333333 0.76280378428151 15.999 > 36 69 O 0.34565015317063 0.39178846842734 0.80326424993296 15.999 > 37 70 O 0.27332617673514 0.27838366077611 0.95738254629074 15.999 > 38 71 O 0.72161633922389 0.99494251595903 0.95738254629074 15.999 > 39 72 O 0.60821153157266 0.95386168474330 0.80326424993296 15.999 > 40 73 O 0.28719501807663 0.01231681983730 0.86340241673370 15.999 > 41 74 O 0.32827584929236 0.93999284340181 0.70928412037593 15.999 > 42 75 O 0.00000000000000 0.00000000000000 0.76366433941351 15.999 > 43 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.5148461 0.0000008 0.0000000 -0.0000008 4.5148461 0.0000000 0.0000000 0.0000000 4.6420724 -------------------------- Born effective charges -------------------------- 1 Sr 2.3684830 -0.0009306 -0.0000000 0.0009306 2.3684830 0.0000000 -0.0000000 -0.0000000 2.8619603 2 Sr 2.3684830 -0.0009306 -0.0000000 0.0009306 2.3684830 0.0000000 -0.0000000 -0.0000000 2.8619603 3 Hf 5.5704908 0.0290463 -0.0000000 -0.0290463 5.5704908 0.0000000 -0.0000000 -0.0000000 5.9883619 4 Hf 5.4611720 0.5653207 -0.1354815 0.5672022 4.5628075 0.3558619 -0.1700204 0.2465362 5.0666510 5 Hf 4.2970018 0.1049318 0.3759262 0.1068132 5.7269776 -0.0606006 0.2985169 0.0239739 5.0666510 6 Hf 5.2777954 -0.6730746 -0.2404447 -0.6711932 4.7461841 -0.2952614 -0.1284964 -0.2705101 5.0666510 7 Hf 5.2777954 -0.6730746 -0.2404447 -0.6711932 4.7461841 -0.2952614 -0.1284964 -0.2705101 5.0666510 8 Hf 4.2970018 0.1049318 0.3759262 0.1068132 5.7269776 -0.0606006 0.2985169 0.0239739 5.0666510 9 Hf 5.4611720 0.5653207 -0.1354815 0.5672022 4.5628075 0.3558619 -0.1700204 0.2465362 5.0666510 10 O -3.1422890 -0.1666036 -0.0000000 0.1666036 -3.1422890 0.0000000 -0.0000000 -0.0000000 -1.6660728 11 O -1.9341359 0.4134620 0.5330030 0.4234234 -2.3535984 -0.9497162 0.5490791 -0.9929069 -3.6022301 12 O -2.1619975 0.0819109 0.0701841 0.0842300 -2.9724532 -0.0978413 -0.0559673 0.0193893 -2.3000690 13 O -2.8417804 0.3082429 -0.1198251 0.3105619 -2.2926703 -0.0118606 0.0447753 0.0387745 -2.3000690 14 O -2.6111148 -0.0325695 -1.0889799 -0.0226081 -1.6766195 0.0132640 -1.1344221 0.0209370 -3.6022301 15 O -1.8863507 -0.3958346 0.5559769 -0.3858732 -2.4013835 0.9364522 0.5853430 0.9719699 -3.6022301 16 O -2.6978982 -0.3936324 0.0496410 -0.3913133 -2.4365525 0.1097019 0.0111920 -0.0581638 -2.3000690 17 O -2.9141311 0.1742540 -0.0000000 -0.1742540 -2.9141311 0.0000000 -0.0000000 -0.0000000 -1.6831242 18 O -2.9141311 0.1742540 -0.0000000 -0.1742540 -2.9141311 0.0000000 -0.0000000 -0.0000000 -1.6831242 19 O -2.6978982 -0.3936324 0.0496410 -0.3913133 -2.4365525 0.1097019 0.0111920 -0.0581638 -2.3000690 20 O -1.8863507 -0.3958346 0.5559769 -0.3858732 -2.4013835 0.9364522 0.5853430 0.9719699 -3.6022301 21 O -2.6111148 -0.0325695 -1.0889799 -0.0226081 -1.6766195 0.0132640 -1.1344221 0.0209370 -3.6022301 22 O -2.8417804 0.3082429 -0.1198251 0.3105619 -2.2926703 -0.0118606 0.0447753 0.0387745 -2.3000690 23 O -2.1619975 0.0819109 0.0701841 0.0842300 -2.9724532 -0.0978413 -0.0559673 0.0193893 -2.3000690 24 O -1.9341359 0.4134620 0.5330030 0.4234234 -2.3535984 -0.9497162 0.5490791 -0.9929069 -3.6022301 25 O -3.1422890 -0.1666036 -0.0000000 0.1666036 -3.1422890 0.0000000 -0.0000000 -0.0000000 -1.6660728 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000000 (zzz) 0.00000000 (zzz) 0.00000000 (zzz) Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- 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: 0.62, 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 2.868 ( 0.000 0.000 0.000) 0.000 2.868 ( 0.000 0.000 0.000) 0.000 2.919 ( 0.000 0.000 0.000) 0.000 2.919 ( 0.000 0.000 0.000) 0.000 3.154 ( 0.000 0.000 0.000) 0.000 3.639 ( 0.000 0.000 0.000) 0.000 3.639 ( 0.000 0.000 0.000) 0.000 3.819 ( 0.000 0.000 0.000) 0.000 3.853 ( 0.000 0.000 0.000) 0.000 3.853 ( 0.000 0.000 0.000) 0.000 4.231 ( 0.000 0.000 0.000) 0.000 4.640 ( 0.000 0.000 0.000) 0.000 4.856 ( 0.000 0.000 0.000) 0.000 4.856 ( 0.000 0.000 0.000) 0.000 5.017 ( 0.000 0.000 0.000) 0.000 5.017 ( 0.000 0.000 0.000) 0.000 5.306 ( 0.000 0.000 0.000) 0.000 5.509 ( 0.000 0.000 0.000) 0.000 5.509 ( 0.000 0.000 0.000) 0.000 5.806 ( 0.000 0.000 0.000) 0.000 6.015 ( 0.000 0.000 0.000) 0.000 6.015 ( 0.000 0.000 0.000) 0.000 6.188 ( 0.000 0.000 0.000) 0.000 6.292 ( 0.000 0.000 0.000) 0.000 6.768 ( 0.000 0.000 0.000) 0.000 7.651 ( 0.000 0.000 0.000) 0.000 8.140 ( 0.000 0.000 0.000) 0.000 8.140 ( 0.000 0.000 0.000) 0.000 8.360 ( 0.000 0.000 0.000) 0.000 8.360 ( 0.000 0.000 0.000) 0.000 8.876 ( 0.000 0.000 0.000) 0.000 9.100 ( 0.000 0.000 0.000) 0.000 9.100 ( 0.000 0.000 0.000) 0.000 9.119 ( 0.000 0.000 0.000) 0.000 9.119 ( 0.000 0.000 0.000) 0.000 9.337 ( 0.000 0.000 0.000) 0.000 9.896 ( 0.000 0.000 0.000) 0.000 9.896 ( 0.000 0.000 0.000) 0.000 10.026 ( 0.000 0.000 0.000) 0.000 11.260 ( 0.000 0.000 0.000) 0.000 11.260 ( 0.000 0.000 0.000) 0.000 11.377 ( 0.000 0.000 0.000) 0.000 11.377 ( 0.000 0.000 0.000) 0.000 11.614 ( 0.000 0.000 0.000) 0.000 11.772 ( 0.000 0.000 0.000) 0.000 11.788 ( 0.000 0.000 0.000) 0.000 11.788 ( 0.000 0.000 0.000) 0.000 11.911 ( 0.000 0.000 0.000) 0.000 13.243 ( 0.000 0.000 0.000) 0.000 13.544 ( 0.000 0.000 0.000) 0.000 13.544 ( 0.000 0.000 0.000) 0.000 14.149 ( 0.000 0.000 0.000) 0.000 14.229 ( 0.000 0.000 0.000) 0.000 14.641 ( 0.000 0.000 0.000) 0.000 14.667 ( 0.000 0.000 0.000) 0.000 14.667 ( 0.000 0.000 0.000) 0.000 15.662 ( 0.000 0.000 0.000) 0.000 17.028 ( 0.000 0.000 0.000) 0.000 17.028 ( 0.000 0.000 0.000) 0.000 17.539 ( 0.000 0.000 0.000) 0.000 17.539 ( 0.000 0.000 0.000) 0.000 17.699 ( 0.000 0.000 0.000) 0.000 18.186 ( 0.000 0.000 0.000) 0.000 18.186 ( 0.000 0.000 0.000) 0.000 18.375 ( 0.000 0.000 0.000) 0.000 18.375 ( 0.000 0.000 0.000) 0.000 19.205 ( 0.000 0.000 0.000) 0.000 21.534 ( 0.000 0.000 0.000) 0.000 21.534 ( 0.000 0.000 0.000) 0.000 21.971 ( 0.000 0.000 0.000) 0.000 21.971 ( 0.000 0.000 0.000) 0.000 23.593 ( 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.532 ( 21.278 15.268 0.627) 26.196 0.725 ( 28.727 18.978 4.107) 34.674 1.088 ( 43.244 21.759 19.283) 52.108 2.804 ( -3.758 -0.384 -11.835) 12.423 2.895 ( 1.091 2.467 -9.475) 9.852 2.945 ( 3.525 -0.252 8.197) 8.926 2.991 ( 3.779 0.426 8.554) 9.362 3.149 ( -1.763 -0.316 2.505) 3.080 3.455 ( -7.980 -7.594 -3.596) 11.587 3.562 ( -6.295 0.866 2.128) 6.701 3.835 ( 1.284 -3.151 0.090) 3.404 3.923 ( 5.083 -2.313 -4.180) 6.975 3.986 ( 3.646 10.668 3.101) 11.693 4.304 ( 6.384 3.172 -0.346) 7.137 4.633 ( -0.735 -0.913 0.137) 1.180 4.792 ( -5.012 -1.713 -0.653) 5.337 4.836 ( -1.032 -2.618 -1.315) 3.106 4.983 ( -2.427 -1.432 -1.898) 3.397 5.049 ( -0.193 1.518 7.106) 7.269 5.341 ( 5.000 1.980 -9.978) 11.335 5.473 ( -1.715 -1.276 -3.809) 4.368 5.500 ( -1.244 0.155 3.741) 3.945 5.861 ( 2.399 1.097 6.677) 7.179 6.020 ( 0.607 -1.098 -2.258) 2.583 6.038 ( -4.596 -2.078 -5.004) 7.105 6.175 ( -3.658 -2.122 9.209) 10.133 6.363 ( 5.019 2.808 -0.985) 5.835 6.797 ( 2.664 1.643 -1.287) 3.384 7.621 ( -3.344 -2.522 2.934) 5.114 8.040 ( -8.628 5.366 -6.186) 11.896 8.244 ( 0.850 -16.430 3.729) 16.870 8.423 ( -16.671 2.222 -7.035) 18.230 8.532 ( 12.799 3.912 -2.963) 13.708 8.663 ( 3.510 -4.175 6.310) 8.340 9.113 ( 10.724 -16.599 -2.863) 19.968 9.130 ( -10.424 19.120 4.458) 22.228 9.245 ( -3.519 -0.816 -4.015) 5.401 9.463 ( 15.560 5.884 1.752) 16.727 9.688 ( -0.801 -0.113 -5.148) 5.212 9.847 ( -3.352 -2.401 -1.688) 4.455 9.998 ( 0.628 1.427 -8.083) 8.232 10.840 ( -9.586 0.224 -2.376) 9.879 11.171 ( -5.082 -4.125 -0.696) 6.582 11.204 ( -5.096 -5.399 6.171) 9.654 11.418 ( -0.462 1.454 -5.581) 5.786 11.460 ( -3.762 -9.020 -0.138) 9.774 11.598 ( -5.150 2.257 6.533) 8.620 11.804 ( 2.085 2.628 -1.416) 3.642 11.911 ( 0.777 1.626 -3.782) 4.189 12.133 ( 16.426 2.957 0.817) 16.710 13.170 ( 4.794 4.619 -2.226) 7.019 13.302 ( 3.032 1.735 4.533) 5.723 13.524 ( -1.509 -0.959 1.855) 2.576 13.978 ( -9.002 -2.573 -7.586) 12.050 14.191 ( -4.021 -2.431 2.224) 5.198 14.511 ( -11.437 -6.839 2.808) 13.618 14.569 ( -5.391 -3.674 -0.400) 6.536 14.784 ( 12.417 0.661 -8.732) 15.195 15.732 ( 6.694 -4.328 -2.730) 8.426 16.070 ( 1.334 17.645 26.540) 31.898 16.724 ( -20.450 -13.349 0.714) 24.432 16.984 ( -17.061 -12.806 1.933) 21.419 17.542 ( -0.438 0.785 -1.474) 1.726 17.714 ( 2.726 3.467 3.978) 5.939 17.893 ( 14.387 11.034 -4.048) 18.578 18.238 ( -3.133 -3.386 -3.260) 5.649 18.526 ( 13.958 4.798 -0.379) 14.765 18.586 ( 22.000 12.511 0.261) 25.310 19.292 ( 16.848 4.902 -21.292) 27.591 20.468 ( -14.029 -0.881 35.537) 38.216 21.485 ( -3.336 -3.672 -1.851) 5.295 21.672 ( -5.950 0.221 1.653) 6.180 21.926 ( -4.719 0.752 -3.475) 5.909 21.986 ( 3.362 -4.263 2.000) 5.786 23.495 ( -8.013 -4.637 -1.149) 9.329 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.055 ( 20.497 15.061 -0.329) 25.438 1.412 ( 25.995 17.926 2.630) 31.686 2.070 ( 34.902 15.875 16.091) 41.582 2.662 ( -5.133 0.975 -7.641) 9.256 2.887 ( -0.074 0.911 -5.177) 5.258 2.992 ( -4.014 -4.611 0.952) 6.187 3.095 ( 2.256 -1.114 6.330) 6.812 3.150 ( 5.897 1.308 -0.921) 6.110 3.322 ( 1.783 -0.543 2.319) 2.975 3.551 ( 0.471 5.321 1.578) 5.570 3.812 ( -0.200 -3.319 -0.812) 3.422 3.914 ( 1.324 -4.641 -3.599) 6.020 4.168 ( 0.933 13.114 5.521) 14.260 4.457 ( 7.488 0.009 -0.216) 7.491 4.554 ( -5.911 -4.767 -2.406) 7.967 4.692 ( -3.191 -0.017 -0.597) 3.246 4.777 ( -1.253 -3.860 -1.366) 4.282 4.893 ( -4.342 -2.428 -2.508) 5.572 5.084 ( -1.409 3.743 4.003) 5.658 5.357 ( -0.662 -2.634 -7.844) 8.301 5.459 ( 3.212 3.469 -9.280) 10.415 5.531 ( 2.337 1.331 4.728) 5.440 5.826 ( -8.490 -6.087 -2.596) 10.764 5.973 ( 2.311 2.592 3.594) 4.998 6.031 ( 2.108 -1.714 -2.906) 3.978 6.106 ( -5.583 -3.504 10.884) 12.724 6.460 ( 2.666 1.802 -2.304) 3.958 6.885 ( 4.910 3.294 -3.154) 6.701 7.484 ( -8.423 -6.280 5.217) 11.731 7.941 ( -7.929 9.364 -5.903) 13.616 8.024 ( -4.993 -12.255 -0.222) 13.235 8.302 ( 3.779 -1.491 3.813) 5.572 8.744 ( 10.213 -5.836 -3.358) 12.233 8.818 ( 7.384 7.605 -3.030) 11.025 8.912 ( -9.307 -6.628 0.314) 11.430 9.207 ( 6.337 -2.263 1.131) 6.823 9.306 ( -3.745 12.775 2.485) 13.542 9.539 ( -4.148 -7.904 0.877) 8.969 9.703 ( 0.315 0.072 -5.086) 5.096 9.806 ( 4.630 0.225 -0.318) 4.647 9.994 ( -1.284 2.925 -0.188) 3.199 10.595 ( -14.157 1.312 -10.845) 17.882 11.002 ( -10.311 -3.673 1.321) 11.026 11.068 ( -2.216 -12.775 13.213) 18.512 11.275 ( -3.201 -5.286 -6.400) 8.897 11.504 ( 3.222 5.771 -1.159) 6.711 11.598 ( 0.596 1.066 6.171) 6.291 11.914 ( 7.654 1.083 0.237) 7.734 11.918 ( -1.501 5.176 -5.215) 7.499 12.398 ( 11.724 -1.307 1.760) 11.927 13.223 ( -3.351 -0.452 -3.252) 4.691 13.409 ( 4.904 2.703 0.236) 5.605 13.541 ( 1.900 2.608 1.775) 3.683 13.784 ( -6.927 -1.253 0.469) 7.055 14.054 ( -9.441 -3.964 4.524) 11.194 14.256 ( -8.010 -6.428 -0.367) 10.277 14.407 ( -7.852 -3.921 0.625) 8.799 14.977 ( 11.661 1.198 -8.387) 14.414 15.723 ( 1.188 -9.026 -0.050) 9.104 16.221 ( -19.316 -12.242 1.305) 22.906 16.418 ( -1.773 19.122 5.152) 19.884 16.656 ( -4.167 -4.039 4.718) 7.479 17.530 ( 2.326 -4.589 -2.680) 5.801 17.845 ( 2.860 7.440 5.579) 9.729 18.069 ( -10.625 7.267 -7.888) 15.097 18.270 ( 22.056 -3.535 2.779) 22.510 18.884 ( 16.649 9.743 -0.573) 19.299 19.167 ( 26.216 13.052 -0.898) 29.299 19.593 ( 19.714 1.511 -11.151) 22.700 20.352 ( -14.987 5.520 26.061) 30.565 21.318 ( -8.097 -6.888 -5.033) 11.762 21.543 ( -8.448 -3.207 3.961) 9.866 21.798 ( -8.596 1.329 -5.279) 10.175 22.015 ( 4.187 -4.529 2.268) 6.572 23.229 ( -13.427 -7.803 -2.627) 15.750 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.535 ( 17.458 13.415 -1.968) 22.105 1.979 ( 17.458 13.859 -0.738) 22.303 2.394 ( -2.083 0.476 -3.021) 3.700 2.788 ( 1.293 -6.783 0.550) 6.927 2.832 ( -4.051 2.713 -5.013) 6.993 2.962 ( 11.789 -0.293 14.791) 18.917 3.095 ( -0.999 2.866 2.807) 4.134 3.360 ( 15.086 3.585 1.942) 15.627 3.480 ( 7.394 4.735 1.807) 8.964 3.650 ( 4.300 0.070 -2.927) 5.202 3.775 ( -0.438 1.309 0.915) 1.656 3.910 ( 3.803 2.133 0.471) 4.385 4.261 ( -5.904 -0.566 2.483) 6.430 4.413 ( -4.191 8.798 1.525) 9.864 4.548 ( 5.902 -5.892 4.154) 9.317 4.658 ( -1.766 0.153 -2.065) 2.721 4.698 ( -0.843 -3.733 -5.314) 6.549 4.773 ( -5.099 -1.837 -2.765) 6.085 5.079 ( -4.034 0.611 -2.129) 4.602 5.298 ( -1.896 2.160 -2.297) 3.679 5.480 ( -3.678 -3.868 -2.122) 5.743 5.581 ( -2.957 -2.562 -13.417) 13.976 5.615 ( 1.967 1.325 1.915) 3.048 5.976 ( -5.914 -5.766 9.259) 12.407 6.058 ( 3.109 -0.394 4.848) 5.773 6.085 ( 2.848 2.414 0.478) 3.764 6.455 ( -2.523 -0.508 -2.472) 3.569 6.897 ( -5.145 -2.658 -3.053) 6.546 7.398 ( 3.965 1.309 1.244) 4.357 7.911 ( -3.198 7.474 -1.139) 8.209 7.929 ( 2.215 -4.536 1.237) 5.198 8.437 ( 7.340 1.214 6.444) 9.842 8.583 ( -10.572 -8.816 -3.811) 14.283 8.810 ( 5.675 -5.436 -2.714) 8.314 9.092 ( 2.529 6.568 0.295) 7.045 9.164 ( -6.826 0.907 -0.751) 6.927 9.336 ( 5.095 -0.657 3.277) 6.094 9.433 ( -2.138 -6.091 -6.036) 8.838 9.697 ( 1.460 3.744 -3.428) 5.282 9.836 ( -2.586 -2.393 2.762) 4.477 10.024 ( 0.086 4.487 0.791) 4.557 10.349 ( -9.301 0.936 -8.199) 12.434 10.783 ( -10.230 -3.489 2.199) 11.030 10.993 ( 0.514 -10.498 15.431) 18.671 11.156 ( -3.091 -0.793 -9.237) 9.773 11.643 ( 4.348 2.185 4.355) 6.530 11.698 ( 8.682 2.894 -1.047) 9.211 11.904 ( -2.772 3.733 0.356) 4.664 12.100 ( 9.865 4.526 -3.616) 11.440 12.535 ( 5.927 -2.815 1.769) 6.796 13.013 ( -13.438 -6.557 -2.804) 15.213 13.457 ( -5.245 -0.553 -1.058) 5.379 13.581 ( 4.471 2.419 -1.421) 5.279 13.742 ( -4.726 0.968 -1.142) 4.958 13.922 ( -0.372 -0.331 11.323) 11.334 14.119 ( -1.467 -4.892 -4.846) 7.040 14.246 ( -7.354 -0.867 1.907) 7.647 15.126 ( 6.797 1.826 -6.741) 9.746 15.607 ( -3.595 -8.565 1.214) 9.368 15.855 ( -10.112 -8.498 0.580) 13.222 16.289 ( -8.495 -3.292 -0.304) 9.116 16.901 ( 4.916 19.910 4.850) 21.073 17.495 ( 2.997 -9.233 -5.371) 11.095 17.926 ( -5.505 -1.666 4.394) 7.238 17.981 ( 1.457 7.862 -2.106) 8.268 18.697 ( 22.057 6.498 4.442) 23.420 19.245 ( 13.284 8.070 -0.866) 15.567 19.668 ( 17.741 4.641 -6.855) 19.578 19.875 ( 15.692 1.185 -4.596) 16.394 20.342 ( -6.739 12.164 23.766) 27.535 21.030 ( -11.766 -9.004 -6.159) 16.046 21.344 ( -9.267 -6.797 0.946) 11.532 21.620 ( -10.270 0.455 -3.466) 10.849 22.077 ( 5.566 -1.082 2.664) 6.265 22.876 ( -14.765 -8.584 -3.892) 17.517 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.869 ( 8.230 5.722 -2.560) 10.345 2.228 ( 1.800 11.784 -4.111) 12.610 2.364 ( -0.334 -9.118 4.741) 10.282 2.689 ( -1.235 -3.427 -3.234) 4.871 2.864 ( 3.330 9.513 -3.496) 10.668 3.008 ( -1.108 -7.813 7.103) 10.617 3.211 ( 2.645 1.513 5.491) 6.280 3.565 ( 0.240 -0.088 -2.406) 2.420 3.628 ( -0.827 1.210 -0.565) 1.571 3.665 ( 10.322 -0.585 0.058) 10.339 3.796 ( -1.566 2.175 -1.163) 2.922 4.117 ( -2.714 -1.524 -0.601) 3.170 4.192 ( 11.533 6.520 7.506) 15.228 4.494 ( 0.085 4.401 3.536) 5.646 4.548 ( -1.072 -3.555 2.670) 4.573 4.641 ( -1.269 -1.429 -1.659) 2.531 4.672 ( -2.816 1.291 -3.426) 4.619 4.712 ( 8.739 4.357 -2.712) 10.135 4.968 ( -4.619 -1.711 -2.222) 5.404 5.077 ( -16.117 -9.130 -3.229) 18.803 5.417 ( 1.244 2.223 3.405) 4.252 5.546 ( 1.891 -2.134 -10.657) 11.031 5.686 ( 2.226 4.084 -0.649) 4.696 5.849 ( -4.853 -5.384 7.228) 10.237 6.110 ( 1.259 -0.264 2.360) 2.688 6.200 ( 5.633 3.454 -0.246) 6.612 6.359 ( -5.235 -2.211 -1.254) 5.820 6.748 ( -4.140 -2.556 -0.566) 4.898 7.541 ( 5.234 2.886 -1.866) 6.262 7.928 ( -1.322 3.920 -1.380) 4.361 8.015 ( 7.446 0.108 5.069) 9.008 8.295 ( -9.605 -5.604 -2.872) 11.486 8.634 ( 8.407 0.734 4.833) 9.725 8.789 ( -3.861 -4.062 -0.242) 5.609 8.918 ( -6.682 2.339 -0.979) 7.146 9.275 ( -1.764 -4.001 -5.427) 6.969 9.354 ( 7.531 3.851 -4.342) 9.508 9.433 ( 3.827 -2.680 5.905) 7.530 9.710 ( -11.648 10.283 8.591) 17.754 9.738 ( 4.337 -9.741 -10.658) 15.076 10.093 ( 0.725 6.620 1.245) 6.775 10.218 ( -2.017 -4.599 -1.976) 5.397 10.626 ( -5.120 -0.261 0.328) 5.137 11.005 ( 2.995 -6.979 15.716) 17.455 11.069 ( -3.058 3.147 -12.848) 13.577 11.728 ( 5.009 -4.101 3.442) 7.332 11.808 ( -1.969 3.981 -3.550) 5.686 12.026 ( 8.952 10.268 3.927) 14.177 12.240 ( 2.011 -3.052 -3.421) 5.006 12.581 ( 1.812 -1.890 1.008) 2.806 12.701 ( -9.671 -3.706 -1.637) 10.485 13.306 ( -6.281 -1.809 -0.437) 6.551 13.655 ( -2.348 -0.163 -0.403) 2.388 13.698 ( 4.359 1.883 -0.458) 4.771 13.991 ( -3.146 0.334 4.220) 5.275 14.053 ( 4.528 -4.003 -1.071) 6.138 14.169 ( -3.442 2.547 -0.338) 4.295 15.193 ( 1.483 1.257 -2.220) 2.951 15.490 ( -1.666 -3.747 0.186) 4.105 15.688 ( -2.794 -3.308 0.259) 4.338 16.165 ( -2.783 -1.271 -0.144) 3.063 17.147 ( 1.111 13.667 3.214) 14.083 17.400 ( 0.852 -9.968 -4.696) 11.052 17.872 ( -1.220 -0.319 1.427) 1.904 18.046 ( 0.490 2.015 0.227) 2.087 19.141 ( 14.120 7.237 4.189) 16.410 19.468 ( 5.329 2.828 -0.225) 6.037 19.753 ( -0.028 -3.282 -5.589) 6.481 20.137 ( 7.112 3.070 1.090) 7.823 20.512 ( 2.579 7.428 10.166) 12.852 20.756 ( -5.955 -4.506 -3.563) 8.274 21.126 ( -5.839 -5.386 -2.138) 8.226 21.451 ( -6.047 -0.587 -0.934) 6.146 22.219 ( 7.472 2.916 3.170) 8.624 22.541 ( -11.280 -6.390 -3.771) 13.501 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.550 ( 9.842 24.504 5.607) 26.996 0.784 ( -2.685 32.700 12.679) 35.174 1.171 ( -3.138 43.450 29.446) 52.582 2.796 ( 1.247 1.700 -13.712) 13.873 2.822 ( 1.629 0.577 -10.774) 10.912 2.973 ( -2.891 -0.938 8.220) 8.764 3.017 ( -0.221 3.133 7.797) 8.405 3.159 ( 0.792 -1.273 3.534) 3.839 3.500 ( -0.701 -7.233 3.065) 7.887 3.539 ( 0.308 -6.965 -1.139) 7.064 3.799 ( 1.104 -1.435 -5.524) 5.813 3.875 ( -4.909 3.311 -6.529) 8.814 4.021 ( 4.835 7.853 3.915) 10.019 4.306 ( 0.256 6.602 -0.139) 6.608 4.645 ( -0.943 0.359 1.679) 1.959 4.772 ( 0.656 -5.655 -2.059) 6.054 4.837 ( -2.269 -1.608 -2.072) 3.468 5.015 ( -0.167 -1.624 3.311) 3.692 5.065 ( 3.091 -1.313 8.548) 9.184 5.283 ( -1.499 5.467 -16.559) 17.502 5.449 ( 0.126 -2.823 -5.119) 5.847 5.520 ( 0.521 -0.144 3.541) 3.582 5.876 ( -0.020 0.073 6.101) 6.101 6.009 ( -0.891 -4.027 -5.595) 6.951 6.039 ( -0.575 1.600 0.026) 1.701 6.216 ( -0.110 -5.134 11.430) 12.531 6.358 ( -0.252 5.102 -0.571) 5.140 6.790 ( 0.149 3.332 -2.274) 4.036 7.634 ( -0.251 -4.622 4.895) 6.736 8.058 ( 7.756 -4.181 -3.095) 9.339 8.229 ( -0.168 -9.804 0.396) 9.814 8.416 ( -15.497 9.415 -10.075) 20.744 8.554 ( -1.592 -14.500 2.421) 14.787 8.632 ( 7.708 9.238 2.343) 12.258 9.071 ( -20.469 1.230 -6.286) 21.448 9.137 ( 12.990 2.418 -2.517) 13.451 9.218 ( 2.289 -6.474 -2.339) 7.254 9.445 ( 2.121 15.035 -1.979) 15.312 9.664 ( -1.124 5.374 -5.576) 7.825 9.879 ( -0.051 -3.061 3.434) 4.601 9.962 ( 1.304 2.781 -7.305) 7.925 10.914 ( 8.590 -7.118 0.779) 11.183 11.123 ( -0.378 -10.717 -1.806) 10.875 11.178 ( -4.691 -7.389 -1.068) 8.817 11.401 ( 1.270 1.635 -5.157) 5.557 11.450 ( -3.991 -3.699 -3.927) 6.710 11.582 ( 1.313 -5.930 5.097) 7.929 11.808 ( 0.594 2.085 -0.386) 2.202 11.932 ( 0.440 5.499 -1.593) 5.742 12.165 ( -5.279 14.682 6.096) 16.750 13.168 ( 2.406 7.022 -1.604) 7.593 13.315 ( 0.481 0.981 5.288) 5.400 13.509 ( -0.304 -2.884 -0.406) 2.928 13.941 ( 2.692 -4.162 -9.991) 11.153 14.208 ( 0.021 -4.481 3.383) 5.615 14.466 ( -3.238 -15.023 -2.073) 15.507 14.585 ( 0.612 -5.680 0.682) 5.753 14.730 ( -9.052 8.660 -10.514) 16.355 15.832 ( -0.725 15.202 -1.295) 15.274 16.168 ( 14.215 -9.284 42.114) 45.408 16.737 ( -2.167 -23.153 2.639) 23.403 16.964 ( -4.649 -21.733 -0.859) 22.242 17.559 ( 4.847 0.288 1.085) 4.976 17.655 ( -3.042 1.643 -5.255) 6.291 17.898 ( 10.061 17.246 -2.632) 20.139 18.281 ( -7.733 -0.420 2.941) 8.284 18.527 ( -7.035 13.656 -0.177) 15.362 18.565 ( 4.176 25.044 -3.300) 25.603 19.196 ( -5.445 25.725 -25.666) 36.745 20.620 ( 9.493 -24.916 45.796) 52.992 21.509 ( -3.547 -3.266 1.961) 5.205 21.638 ( 6.746 -5.794 -3.380) 9.513 21.925 ( -0.474 -3.580 -2.589) 4.444 22.002 ( -4.137 0.417 3.081) 5.175 23.488 ( -0.020 -9.468 -1.935) 9.664 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.111 ( 8.091 26.615 6.221) 28.505 1.174 ( 18.243 23.036 8.548) 30.602 1.882 ( 20.353 31.500 20.618) 42.797 2.711 ( -3.409 0.733 -8.249) 8.955 2.875 ( 4.447 2.988 -10.085) 11.420 2.930 ( -1.823 -4.756 3.204) 6.018 3.105 ( 1.890 2.708 6.506) 7.296 3.175 ( -2.243 1.759 3.925) 4.850 3.368 ( -5.504 2.711 0.650) 6.170 3.507 ( 4.287 -8.171 1.033) 9.285 3.779 ( 0.523 -2.310 -5.972) 6.425 3.851 ( 0.213 3.435 -2.407) 4.200 4.208 ( 6.164 3.380 6.282) 9.428 4.409 ( 3.691 6.022 -3.936) 8.086 4.608 ( -4.501 1.225 -1.453) 4.886 4.698 ( -0.609 -7.595 0.954) 7.679 4.746 ( -3.454 -2.908 -1.154) 4.660 4.971 ( -3.996 -1.556 3.447) 5.501 5.156 ( 1.085 2.270 6.662) 7.122 5.256 ( 2.220 1.268 -15.584) 15.792 5.407 ( 0.556 0.801 -11.441) 11.483 5.550 ( 0.851 0.184 6.888) 6.942 5.879 ( -1.326 -6.831 -5.476) 8.855 5.918 ( -1.644 -0.008 1.755) 2.404 6.040 ( -0.750 2.612 0.197) 2.725 6.182 ( -3.009 -5.846 12.650) 14.257 6.427 ( 2.435 4.204 -3.015) 5.718 6.855 ( 2.899 6.406 -2.703) 7.533 7.542 ( -4.974 -9.401 5.890) 12.158 7.979 ( -3.642 -11.439 4.368) 12.774 8.200 ( -8.196 9.563 -12.377) 17.658 8.269 ( 0.837 -3.243 3.522) 4.860 8.507 ( 5.367 -0.298 -9.049) 10.526 8.787 ( 1.273 4.992 -1.503) 5.366 8.843 ( 0.575 -7.238 -1.579) 7.431 9.067 ( -0.740 -4.222 -5.159) 6.708 9.451 ( 8.922 -0.985 3.539) 9.648 9.590 ( 0.887 10.626 -4.175) 11.451 9.656 ( -1.430 0.836 -1.135) 2.008 9.791 ( -6.406 -2.799 4.000) 8.055 10.022 ( 3.550 3.216 0.924) 4.878 10.789 ( -10.529 -4.482 -9.116) 14.630 10.987 ( -1.446 -10.749 5.198) 12.027 11.079 ( -1.384 -9.265 1.821) 9.543 11.283 ( -5.258 -1.948 -5.380) 7.771 11.470 ( 4.235 4.217 -4.519) 7.493 11.580 ( 2.893 -7.828 6.923) 10.843 11.873 ( 2.106 6.378 -1.901) 6.980 11.979 ( -1.377 4.801 2.904) 5.777 12.262 ( 1.594 7.598 0.015) 7.763 13.251 ( -0.740 2.301 -2.216) 3.279 13.364 ( 2.342 1.023 0.376) 2.583 13.554 ( 4.541 4.600 2.429) 6.905 13.843 ( -3.576 -7.264 1.032) 8.162 14.089 ( -2.804 -12.486 1.643) 12.902 14.287 ( -4.276 -11.211 -2.767) 12.314 14.492 ( -5.021 -5.675 2.811) 8.082 14.688 ( 5.554 5.751 -15.156) 17.136 15.921 ( -9.694 15.170 1.965) 18.110 16.357 ( -10.191 -20.706 5.373) 23.695 16.552 ( 9.562 3.426 22.338) 24.539 16.621 ( -5.318 -14.358 0.001) 15.312 17.485 ( -7.293 -1.310 -11.368) 13.570 17.810 ( 17.474 -6.382 5.424) 19.378 18.071 ( -8.482 16.877 9.705) 21.236 18.413 ( 3.636 13.555 -14.084) 19.882 18.559 ( 11.008 8.497 -0.004) 13.906 19.026 ( 14.905 25.564 -0.698) 29.600 19.346 ( 6.685 13.693 -12.578) 19.758 20.662 ( -2.337 -10.658 35.458) 37.098 21.369 ( -6.994 -5.177 -2.005) 8.930 21.652 ( -2.982 -6.549 5.238) 8.901 21.831 ( 3.011 -6.581 -5.774) 9.258 21.930 ( -5.508 0.551 -2.189) 5.953 23.295 ( -7.224 -12.700 -3.583) 15.044 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.506 ( 7.586 22.636 3.594) 24.143 1.784 ( 21.408 17.101 2.089) 27.479 2.387 ( 5.351 6.064 -4.472) 9.242 2.735 ( 0.723 0.494 6.101) 6.164 2.829 ( -1.243 -4.253 1.477) 4.670 2.964 ( 2.139 6.515 4.816) 8.379 3.151 ( 6.015 6.459 -2.340) 9.131 3.218 ( 0.209 4.045 6.883) 7.986 3.437 ( 3.329 6.131 3.124) 7.645 3.525 ( 5.596 -4.735 -2.869) 7.872 3.772 ( 2.152 -0.186 -2.755) 3.501 3.899 ( 1.557 5.869 2.025) 6.401 4.296 ( 0.826 -6.332 4.776) 7.975 4.465 ( -1.806 0.503 -4.622) 4.987 4.533 ( 1.954 -0.911 -5.992) 6.368 4.647 ( -0.399 -4.050 -0.747) 4.138 4.672 ( -3.587 2.943 6.928) 8.338 4.881 ( -5.845 -0.177 1.877) 6.142 5.153 ( -4.578 0.558 -4.916) 6.741 5.282 ( 4.391 1.001 0.650) 4.550 5.396 ( 2.728 3.331 -19.635) 20.102 5.608 ( 1.641 -1.111 7.532) 7.788 5.679 ( -11.026 -3.962 -5.262) 12.844 5.915 ( 3.360 -5.352 -1.408) 6.475 6.083 ( 1.338 3.223 1.746) 3.903 6.111 ( -3.932 -4.787 12.023) 13.525 6.463 ( -0.156 0.569 -3.056) 3.112 6.965 ( -0.599 7.788 -3.628) 8.612 7.362 ( -2.862 -9.279 4.876) 10.866 7.860 ( -0.570 -5.370 4.988) 7.351 8.101 ( -7.989 10.975 -10.096) 16.918 8.356 ( 6.215 0.392 8.497) 10.534 8.545 ( 3.204 -4.661 -13.228) 14.386 8.691 ( -3.287 -6.805 -0.267) 7.563 8.917 ( 12.851 -7.369 1.257) 14.868 9.107 ( 5.182 3.878 -7.764) 10.107 9.388 ( -8.912 -9.879 4.672) 14.102 9.561 ( -8.034 2.623 -0.396) 8.461 9.676 ( 0.853 1.794 -6.917) 7.197 9.796 ( 4.676 4.369 4.348) 7.737 10.142 ( 0.446 7.558 5.530) 9.375 10.507 ( -11.351 -2.883 -10.397) 15.660 10.874 ( -5.619 -7.693 -1.934) 9.721 10.949 ( -0.766 -10.056 17.475) 20.176 11.191 ( -3.725 3.291 -8.349) 9.717 11.559 ( 2.893 -9.288 4.617) 10.768 11.621 ( 6.781 8.673 -4.968) 12.079 11.997 ( 3.885 7.399 1.575) 8.504 12.012 ( -0.797 5.235 1.328) 5.459 12.359 ( 6.518 -2.832 -1.153) 7.200 13.144 ( -8.231 -4.637 -2.605) 9.800 13.441 ( 4.113 0.852 -2.326) 4.801 13.614 ( -4.673 0.599 0.163) 4.714 13.762 ( -0.675 -3.383 2.809) 4.449 13.989 ( 5.173 -7.666 1.328) 9.343 14.056 ( -8.713 -6.489 0.377) 10.871 14.354 ( -5.861 -3.889 2.428) 7.441 14.834 ( 12.072 1.269 -15.942) 20.037 15.860 ( -12.425 10.911 4.895) 17.245 15.977 ( -14.080 -13.604 10.935) 22.425 16.326 ( -5.561 -11.649 -1.075) 12.953 16.996 ( 13.208 12.845 10.566) 21.239 17.311 ( -2.657 -4.939 -13.936) 15.022 17.926 ( 3.166 -9.037 5.603) 11.095 18.197 ( -6.211 19.016 2.618) 20.175 18.571 ( 8.090 17.911 2.182) 19.774 18.960 ( 21.796 3.959 -4.705) 22.647 19.489 ( 8.864 15.006 -4.848) 18.090 19.599 ( 17.333 9.160 -4.342) 20.080 20.663 ( -5.719 -0.016 28.852) 29.414 21.139 ( -10.993 -6.631 -2.918) 13.165 21.437 ( -10.940 -9.244 0.352) 14.327 21.782 ( -9.157 1.741 -6.520) 11.376 21.898 ( 10.458 -7.388 1.520) 12.894 22.976 ( -11.131 -13.358 -5.057) 18.109 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 ( 6.617 12.055 -2.203) 13.927 2.206 ( 9.378 9.648 -1.257) 13.513 2.410 ( -4.651 3.201 0.330) 5.655 2.682 ( -0.162 -0.424 2.594) 2.633 2.843 ( 4.861 1.518 -3.042) 5.932 2.985 ( -1.397 -4.971 5.207) 7.333 3.263 ( -2.517 3.629 6.550) 7.899 3.433 ( 8.517 -4.431 -4.578) 10.636 3.529 ( 3.586 3.480 0.117) 4.998 3.624 ( 5.367 6.635 3.250) 9.132 3.831 ( 2.626 5.308 -2.356) 6.373 4.091 ( 8.281 6.930 6.977) 12.856 4.200 ( -4.299 -1.038 0.260) 4.430 4.386 ( 2.869 -10.417 -0.617) 10.823 4.535 ( -1.319 -2.807 -0.280) 3.114 4.620 ( 2.441 -1.063 -3.462) 4.367 4.688 ( -1.275 1.220 4.101) 4.464 4.845 ( -3.240 9.030 3.312) 10.149 5.018 ( -6.704 -2.037 -1.733) 7.218 5.305 ( -15.727 -4.552 -4.303) 16.928 5.385 ( 1.996 1.958 -5.679) 6.330 5.440 ( 3.899 1.772 -10.596) 11.429 5.660 ( 2.544 -1.389 0.060) 2.899 5.885 ( -1.701 -6.995 6.768) 9.881 6.096 ( 1.272 0.130 3.657) 3.874 6.154 ( 2.729 2.861 0.713) 4.017 6.409 ( -3.568 -2.162 -1.436) 4.412 6.874 ( -10.073 2.475 -0.660) 10.394 7.417 ( 9.110 -0.296 -0.024) 9.115 7.899 ( 5.250 -0.374 5.668) 7.735 8.041 ( -5.324 5.753 -6.988) 10.501 8.386 ( -7.054 -3.897 -3.666) 8.853 8.518 ( 7.116 -1.534 8.353) 11.079 8.691 ( 5.170 -3.107 -0.955) 6.107 9.003 ( 9.034 -13.322 -6.113) 17.218 9.103 ( -6.517 -10.033 1.569) 12.066 9.277 ( 6.138 8.764 -5.130) 11.866 9.458 ( -5.445 2.371 2.834) 6.580 9.649 ( -0.917 -1.545 -7.226) 7.446 9.962 ( 1.367 10.181 4.697) 11.296 10.142 ( -5.615 -0.669 1.584) 5.872 10.291 ( -8.812 1.684 -4.778) 10.164 10.705 ( -4.398 -4.581 -0.186) 6.353 10.959 ( 2.097 -6.297 17.020) 18.268 11.134 ( -4.404 7.031 -10.412) 13.314 11.561 ( 6.276 -7.928 3.267) 10.626 11.803 ( 5.347 5.920 -5.291) 9.573 12.092 ( 1.212 11.002 6.497) 12.835 12.154 ( 5.039 2.518 -0.774) 5.686 12.426 ( 7.933 -6.795 -1.540) 10.558 12.869 ( -13.988 -4.852 -3.305) 15.170 13.371 ( -6.298 -7.817 -1.651) 10.173 13.624 ( 4.472 2.197 -4.037) 6.413 13.675 ( -1.133 -5.810 0.094) 5.921 13.920 ( 0.853 -6.486 -1.853) 6.799 14.058 ( -0.489 0.392 10.568) 10.587 14.255 ( -2.887 0.596 -1.803) 3.455 14.964 ( 9.419 0.091 -16.855) 19.308 15.707 ( -6.593 -10.235 9.341) 15.345 15.799 ( -11.995 12.177 13.072) 21.518 16.171 ( -2.599 -4.898 0.600) 5.577 17.151 ( 2.641 -12.825 -15.153) 20.027 17.340 ( 2.677 19.484 0.013) 19.667 17.892 ( -0.128 -7.486 12.694) 14.737 18.215 ( -9.484 15.862 -5.106) 19.173 19.020 ( 17.869 12.284 10.516) 24.099 19.293 ( 12.850 3.014 -4.626) 13.986 19.632 ( 5.008 -0.874 -6.590) 8.323 19.991 ( 13.308 8.102 -0.482) 15.588 20.708 ( -5.553 5.329 18.993) 20.494 20.866 ( -10.330 -3.149 -1.492) 10.902 21.147 ( -8.150 -10.641 -2.531) 13.641 21.587 ( -10.361 0.066 -5.341) 11.657 22.057 ( 12.194 -2.815 2.192) 12.706 22.627 ( -10.731 -11.561 -5.078) 16.571 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.964 ( 1.128 5.470 -2.683) 6.196 2.198 ( -7.596 -9.756 10.594) 16.282 2.450 ( -0.725 10.572 -5.886) 12.122 2.724 ( 1.294 3.561 6.542) 7.560 2.855 ( -4.210 -6.113 -0.424) 7.435 3.027 ( 4.968 6.677 -6.204) 10.380 3.248 ( -3.356 -0.625 1.225) 3.627 3.430 ( 4.678 -6.212 -4.751) 9.113 3.578 ( 3.120 -2.134 2.310) 4.430 3.784 ( 1.061 5.972 2.020) 6.394 3.870 ( -5.264 4.466 -1.081) 6.987 4.097 ( -0.558 -1.044 -0.266) 1.213 4.273 ( -2.376 -0.903 -1.939) 3.197 4.382 ( 6.630 -6.323 -1.263) 9.248 4.469 ( -1.487 -4.995 -1.535) 5.434 4.627 ( 1.579 -0.967 1.014) 2.111 4.745 ( -10.169 -1.432 -0.014) 10.270 4.864 ( 5.912 4.210 5.792) 9.286 4.922 ( -1.989 -0.572 1.616) 2.626 5.062 ( -4.794 10.493 6.839) 13.412 5.362 ( 1.494 -1.043 -10.453) 10.610 5.575 ( 5.981 4.473 -0.304) 7.475 5.661 ( 0.414 -5.706 0.954) 5.800 5.818 ( -0.896 -1.335 0.878) 1.833 6.127 ( -0.472 2.432 -2.547) 3.553 6.226 ( 0.380 -1.543 -0.711) 1.741 6.323 ( -0.439 -0.792 2.272) 2.446 6.791 ( -3.333 6.671 0.351) 7.465 7.520 ( 3.699 -5.744 1.314) 6.957 7.923 ( -4.888 -1.666 -2.473) 5.725 8.077 ( 4.212 4.789 -2.061) 6.703 8.266 ( -2.496 2.780 3.100) 4.854 8.616 ( 6.954 -6.377 4.103) 10.289 8.729 ( -1.453 -1.611 1.404) 2.585 8.869 ( -1.515 -4.573 -0.474) 4.840 9.127 ( 15.640 -8.910 -6.560) 19.159 9.417 ( -2.474 -2.128 -1.991) 3.823 9.439 ( 3.669 6.897 -6.048) 9.880 9.578 ( -6.125 4.393 1.765) 7.741 9.944 ( -2.118 -1.741 1.912) 3.343 10.131 ( -11.126 2.859 2.499) 11.756 10.215 ( 5.760 5.443 1.874) 8.143 10.598 ( -3.484 -3.049 0.378) 4.645 11.026 ( 3.289 -2.221 6.911) 7.969 11.096 ( -3.635 8.251 -7.145) 11.504 11.637 ( 7.721 -5.198 2.477) 9.632 11.837 ( -2.518 0.709 -4.878) 5.535 12.125 ( -7.356 -3.965 0.984) 8.414 12.311 ( 2.377 8.586 6.009) 10.746 12.466 ( 6.021 -5.626 -0.981) 8.299 12.691 ( -1.347 4.093 -4.620) 6.318 13.200 ( 1.374 -7.229 -1.279) 7.469 13.621 ( 2.587 -2.600 -3.197) 4.865 13.725 ( 1.079 1.800 -2.226) 3.059 13.885 ( 3.149 -6.568 0.273) 7.289 14.060 ( 0.013 -3.080 8.267) 8.822 14.221 ( -3.938 3.409 -3.199) 6.112 15.031 ( 5.922 1.275 -16.091) 17.193 15.602 ( -0.445 -7.257 11.168) 13.326 15.828 ( -5.824 13.278 13.945) 20.117 16.134 ( -0.483 1.346 2.646) 3.008 16.983 ( 0.261 -13.672 -13.662) 19.330 17.502 ( -0.280 12.624 -8.318) 15.121 17.906 ( -0.225 -2.641 19.390) 19.571 18.161 ( -9.100 10.604 -7.280) 15.756 19.339 ( -8.477 5.513 2.199) 10.349 19.398 ( 8.655 -6.546 -0.270) 10.855 19.665 ( 7.401 -2.904 -1.801) 8.152 20.151 ( 1.005 -1.157 -0.260) 1.554 20.608 ( -11.975 -1.307 -2.749) 12.356 20.800 ( -1.515 7.280 4.811) 8.857 21.055 ( 5.739 -1.955 5.771) 8.370 21.428 ( -3.935 1.174 -5.370) 6.761 22.216 ( 2.960 -5.607 -1.853) 6.606 22.419 ( 4.400 -2.065 0.381) 4.875 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.832 ( -19.969 -1.109 10.191) 22.447 2.078 ( -4.287 -6.443 0.073) 7.739 2.411 ( -5.587 0.916 -1.401) 5.832 2.685 ( 4.587 -7.766 2.882) 9.469 2.933 ( -0.073 10.150 3.927) 10.883 3.067 ( -1.334 -1.382 -4.013) 4.450 3.131 ( -7.459 6.674 -11.050) 14.909 3.434 ( 3.389 -9.505 -3.943) 10.834 3.564 ( -6.744 -0.942 -0.726) 6.848 3.730 ( -7.020 -0.766 1.314) 7.183 3.836 ( -7.540 1.570 2.255) 8.025 3.972 ( -10.679 -5.137 -4.910) 12.827 4.203 ( 5.555 6.137 -0.419) 8.289 4.267 ( -2.008 -10.632 -0.382) 10.827 4.541 ( 9.608 0.943 -3.965) 10.437 4.616 ( 0.558 -1.985 -1.985) 2.862 4.709 ( 0.684 1.541 5.480) 5.733 4.842 ( -2.278 1.924 3.348) 4.483 5.072 ( -0.785 3.167 11.157) 11.624 5.222 ( 6.713 2.422 4.785) 8.592 5.390 ( 5.567 3.798 -9.458) 11.613 5.598 ( -0.128 -2.901 6.048) 6.709 5.697 ( 0.595 1.602 8.071) 8.250 5.849 ( 6.152 2.310 -12.289) 13.935 6.081 ( -4.937 -4.008 1.616) 6.561 6.140 ( -2.639 2.020 -7.051) 7.795 6.407 ( 4.541 0.657 3.153) 5.567 6.892 ( 3.492 10.068 1.631) 10.781 7.429 ( -4.239 -9.893 0.931) 10.803 7.812 ( -1.850 -5.214 0.487) 5.554 8.070 ( -5.561 7.612 -2.342) 9.713 8.432 ( 8.083 3.447 2.755) 9.209 8.576 ( -3.864 0.544 -3.953) 5.555 8.785 ( 10.245 -3.474 -0.565) 10.833 8.910 ( 5.913 -1.454 5.680) 8.327 9.198 ( 1.377 -9.374 -16.172) 18.742 9.327 ( -4.473 -1.158 3.622) 5.870 9.475 ( 5.161 -0.948 -1.845) 5.562 9.598 ( 0.691 8.513 -0.881) 8.586 9.971 ( -5.396 -2.478 4.727) 7.590 10.016 ( -0.744 3.410 8.493) 9.182 10.311 ( -1.284 3.585 4.833) 6.153 10.609 ( 8.857 -1.025 -1.093) 8.983 11.028 ( -0.728 4.432 -13.044) 13.795 11.163 ( 2.573 4.323 6.303) 8.064 11.668 ( -5.421 -4.496 -8.150) 10.771 11.742 ( 2.863 -4.762 4.927) 7.426 11.950 ( -10.463 2.858 1.593) 10.963 12.245 ( -8.913 -4.666 3.846) 10.771 12.509 ( 3.961 -5.848 -5.918) 9.215 12.878 ( 11.550 11.149 1.672) 16.140 13.320 ( 12.669 0.701 -0.211) 12.690 13.647 ( 2.415 0.118 -2.837) 3.727 13.664 ( -5.191 -1.150 -0.047) 5.317 13.882 ( 1.504 -5.825 -0.213) 6.020 14.110 ( 5.594 -1.747 -2.537) 6.386 14.169 ( -2.032 2.703 3.544) 4.899 15.069 ( 2.750 1.971 -12.798) 13.238 15.640 ( 6.928 -3.271 8.168) 11.198 15.958 ( -0.429 10.010 13.998) 17.215 16.201 ( 0.749 7.376 5.865) 9.453 16.757 ( -3.339 -15.398 -12.071) 19.848 17.557 ( 1.942 4.036 -8.272) 9.407 17.963 ( -4.503 4.177 16.038) 17.174 18.043 ( -7.817 2.517 -5.852) 10.084 19.068 ( -21.000 3.365 -2.069) 21.368 19.309 ( -6.416 -11.193 -3.013) 13.249 19.810 ( 9.413 -5.050 4.033) 11.418 20.004 ( -11.794 -6.921 -1.874) 13.803 20.301 ( -17.100 -1.624 -6.282) 18.290 20.990 ( 7.390 10.002 9.006) 15.354 21.227 ( 9.408 3.265 -0.286) 9.963 21.462 ( 7.345 1.216 -1.579) 7.611 22.103 ( -1.933 -5.371 -3.539) 6.716 22.675 ( 16.333 3.587 2.611) 16.925 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.457 ( -26.405 0.005 12.835) 29.360 1.690 ( -24.180 -10.218 -4.975) 26.717 2.420 ( -7.770 1.365 -3.209) 8.517 2.672 ( -11.134 -5.060 -1.616) 12.336 2.820 ( 3.775 -3.257 4.043) 6.419 2.994 ( -1.819 3.427 -2.707) 4.731 3.170 ( -3.746 7.211 -4.357) 9.221 3.285 ( -8.384 -5.534 -1.057) 10.101 3.391 ( -5.415 2.894 -1.983) 6.452 3.500 ( -5.127 -8.285 -1.712) 9.892 3.794 ( 3.155 1.815 -1.808) 4.064 3.959 ( -0.922 -0.307 -0.443) 1.068 4.093 ( -2.391 -4.192 4.510) 6.605 4.475 ( 10.433 6.013 1.956) 12.199 4.601 ( -2.476 2.599 -5.950) 6.949 4.644 ( -2.018 -2.644 3.075) 4.530 4.697 ( 5.439 -1.624 -2.623) 6.253 4.911 ( 3.304 0.869 5.099) 6.137 5.067 ( -4.016 0.716 6.359) 7.555 5.353 ( 4.540 0.205 8.188) 9.365 5.413 ( 1.868 -0.800 -9.814) 10.022 5.656 ( -7.662 -0.809 4.733) 9.043 5.747 ( 8.362 5.086 4.677) 10.848 5.956 ( 2.631 0.160 -4.654) 5.348 5.968 ( 3.382 -4.032 -4.297) 6.794 6.101 ( -2.646 3.004 -4.589) 6.090 6.476 ( 1.131 -0.042 2.040) 2.332 7.000 ( -6.372 3.531 3.758) 8.197 7.332 ( 7.896 -2.835 -3.918) 9.259 7.788 ( 3.995 -3.797 2.872) 6.215 8.094 ( -0.890 8.607 2.199) 8.928 8.407 ( -5.043 1.830 -2.255) 5.819 8.733 ( 8.799 3.618 -2.589) 9.860 8.805 ( 0.353 -4.317 -2.132) 4.828 8.951 ( 2.825 -15.044 -14.360) 20.988 9.075 ( -7.408 3.145 4.697) 9.318 9.275 ( 5.554 3.236 1.530) 6.607 9.638 ( 9.766 -0.542 -0.570) 9.798 9.664 ( -3.445 7.037 -1.044) 7.904 9.841 ( -5.984 -3.746 2.608) 7.526 10.023 ( -3.892 -0.463 6.520) 7.607 10.441 ( 9.086 2.120 14.459) 17.208 10.801 ( 12.129 0.885 -3.979) 12.796 11.034 ( 4.353 1.678 -12.007) 12.881 11.307 ( 4.245 8.083 4.466) 10.164 11.471 ( -4.341 -6.122 -6.516) 9.939 11.701 ( -9.182 2.494 -4.732) 10.626 11.865 ( -0.011 -5.994 11.722) 13.166 12.054 ( -8.672 -0.013 -1.384) 8.782 12.478 ( -0.089 -4.330 -6.337) 7.676 13.158 ( 8.166 4.978 1.785) 9.729 13.463 ( -2.098 -0.561 -0.950) 2.370 13.599 ( -2.405 3.098 4.251) 5.784 13.676 ( 3.223 -4.743 1.618) 5.958 13.890 ( 7.888 4.632 -7.674) 11.940 14.160 ( 6.408 -1.049 -2.278) 6.882 14.296 ( 8.019 1.541 3.781) 8.998 15.030 ( -3.166 0.446 -11.271) 11.715 15.863 ( 14.968 -0.666 9.360) 17.666 16.094 ( 4.104 -1.904 8.617) 9.732 16.311 ( -7.850 11.545 9.949) 17.143 16.510 ( 2.301 -8.461 -12.356) 15.151 17.606 ( 3.637 1.918 -4.710) 6.252 17.830 ( -9.670 0.621 -8.465) 12.867 18.017 ( -3.360 -2.606 17.726) 18.229 18.748 ( -21.481 12.363 -3.973) 25.101 18.987 ( -12.107 -14.803 -5.449) 19.885 19.555 ( -25.278 -6.407 1.591) 26.125 19.880 ( -5.467 -8.547 -22.058) 24.279 20.069 ( -1.362 3.901 20.387) 20.802 21.247 ( 9.252 3.485 4.655) 10.928 21.415 ( 8.446 3.641 -2.223) 9.462 21.647 ( 10.037 2.333 2.780) 10.673 22.038 ( 0.318 -2.752 -4.134) 4.976 23.019 ( 17.166 3.012 1.398) 17.485 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.014 ( -28.332 -6.737 12.966) 31.878 1.132 ( -30.731 7.369 -4.959) 31.989 1.769 ( -45.532 -0.795 -5.026) 45.815 2.752 ( 7.293 2.774 3.582) 8.586 2.892 ( 2.941 -4.238 3.084) 6.010 2.980 ( -2.810 2.084 -4.927) 6.043 3.073 ( -7.322 0.181 -3.898) 8.297 3.129 ( -1.188 -1.338 2.853) 3.368 3.369 ( 3.167 -5.296 -0.803) 6.222 3.498 ( 2.214 7.690 0.148) 8.004 3.853 ( 0.156 -6.644 -4.359) 7.948 3.872 ( 1.515 2.424 -1.220) 3.108 4.107 ( -4.529 3.948 8.533) 10.436 4.436 ( -9.392 -2.708 0.345) 9.781 4.620 ( 1.060 -0.280 -2.324) 2.570 4.703 ( 7.027 2.360 -0.337) 7.420 4.779 ( 4.963 0.103 -3.596) 6.129 4.963 ( 2.853 -2.353 -0.685) 3.761 5.047 ( -2.505 1.158 7.711) 8.190 5.404 ( 1.644 0.270 -8.225) 8.392 5.460 ( 2.159 0.692 7.054) 7.410 5.508 ( -6.833 -0.645 -0.244) 6.867 5.885 ( -1.724 -2.642 0.572) 3.206 5.937 ( 7.216 2.400 -1.757) 7.805 6.060 ( -1.702 0.204 -2.516) 3.044 6.080 ( 5.924 -0.285 0.238) 5.935 6.448 ( -4.597 0.115 -0.022) 4.598 6.871 ( -6.787 0.111 0.362) 6.798 7.508 ( 10.001 -0.655 -0.847) 10.058 7.917 ( 9.471 2.911 5.326) 11.249 8.191 ( 3.497 -4.995 5.365) 8.122 8.369 ( 1.319 4.389 -10.465) 11.425 8.620 ( -5.110 -1.624 -8.735) 10.250 8.773 ( -6.547 -6.917 2.529) 9.854 8.907 ( 1.088 5.459 -6.478) 8.541 9.086 ( 8.469 1.295 2.675) 8.975 9.419 ( -3.321 6.989 1.435) 7.870 9.600 ( -4.032 -12.487 3.557) 13.595 9.674 ( -5.078 5.287 -3.013) 7.926 9.784 ( 5.402 -0.109 -2.214) 5.840 10.013 ( -0.010 -0.021 3.749) 3.749 10.732 ( 10.850 3.314 14.772) 18.626 10.975 ( 11.682 -3.346 -5.358) 13.281 11.108 ( 7.759 -1.822 -5.158) 9.494 11.363 ( 1.909 -2.859 -4.851) 5.946 11.508 ( 4.256 4.492 3.728) 7.224 11.533 ( -6.464 3.071 -4.636) 8.526 11.830 ( -2.244 -4.505 7.076) 8.684 11.964 ( -3.807 3.567 -1.124) 5.337 12.324 ( -9.657 -2.749 -7.952) 12.808 13.255 ( -1.758 0.539 2.489) 3.095 13.363 ( -5.562 -0.088 -0.666) 5.602 13.520 ( -3.478 -0.604 2.242) 4.182 13.819 ( 10.659 0.828 2.599) 11.003 14.092 ( 8.495 1.843 -1.941) 8.907 14.326 ( 13.170 0.870 -2.405) 13.416 14.459 ( 8.151 -0.981 1.729) 8.389 14.891 ( -7.552 3.241 -13.821) 16.080 15.875 ( -3.172 -21.895 3.212) 22.356 16.216 ( -13.690 19.168 15.426) 28.157 16.367 ( 18.736 -0.501 2.545) 18.914 16.671 ( 17.884 -0.134 -5.810) 18.805 17.623 ( 1.323 -8.140 -10.123) 13.057 17.729 ( -6.174 14.283 8.049) 17.519 17.939 ( -4.438 -7.943 9.661) 13.271 18.556 ( -12.738 -7.518 -0.892) 14.818 18.587 ( -15.582 9.952 -10.618) 21.321 19.024 ( -29.239 -1.893 0.919) 29.315 19.544 ( -14.373 -0.366 -15.019) 20.791 20.270 ( 7.696 0.373 20.524) 21.923 21.407 ( 7.322 -0.697 -3.343) 8.080 21.577 ( 7.020 -0.341 5.864) 9.153 21.846 ( 6.718 4.608 2.177) 8.432 21.994 ( 0.133 -3.408 -6.414) 7.264 23.320 ( 14.300 -0.015 -0.029) 14.300 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.870 ( -13.324 21.711 -6.019) 26.175 1.261 ( -11.594 26.184 14.372) 32.041 1.973 ( -22.412 34.051 24.238) 47.426 2.652 ( 5.996 -1.496 -11.091) 12.697 2.796 ( -1.676 -1.081 -10.151) 10.345 3.069 ( -1.895 -0.926 8.090) 8.361 3.111 ( -1.723 0.941 0.864) 2.145 3.151 ( -1.674 5.420 6.018) 8.270 3.382 ( 1.872 -2.290 0.938) 3.103 3.511 ( 3.405 1.264 2.374) 4.339 3.821 ( -4.321 -2.099 -6.458) 8.049 3.922 ( -5.731 -4.357 2.703) 7.690 4.021 ( 4.745 6.074 -3.831) 8.608 4.407 ( -5.399 4.792 -3.801) 8.158 4.661 ( 1.052 -1.063 2.549) 2.955 4.706 ( 3.543 -0.449 1.235) 3.779 4.815 ( 1.627 -2.258 -0.250) 2.794 4.928 ( 5.263 -4.057 -0.200) 6.648 5.039 ( -0.238 -3.525 2.329) 4.232 5.347 ( -2.776 7.379 -16.132) 17.955 5.373 ( -0.011 -2.637 -7.733) 8.171 5.535 ( -0.509 -0.206 7.329) 7.349 5.859 ( 0.799 -7.663 -5.057) 9.216 5.957 ( 2.372 0.920 2.958) 3.902 6.079 ( -1.120 3.744 1.044) 4.045 6.195 ( 2.820 -4.670 13.871) 14.905 6.427 ( -1.911 3.499 -2.845) 4.898 6.848 ( -2.664 6.319 -3.100) 7.526 7.562 ( 3.730 -9.896 7.270) 12.833 7.853 ( 6.515 -3.622 -4.422) 8.667 8.127 ( 0.865 -7.574 -4.808) 9.012 8.457 ( 6.623 4.907 2.996) 8.770 8.677 ( -5.617 6.701 -1.651) 8.899 8.778 ( -14.830 -0.297 4.462) 15.490 8.949 ( 6.256 2.907 -2.741) 7.423 9.040 ( 3.229 -8.547 -0.345) 9.143 9.412 ( 3.508 4.792 0.042) 5.939 9.529 ( -15.363 -1.068 -8.447) 17.565 9.704 ( 5.431 4.752 2.029) 7.497 9.805 ( 2.221 -1.153 -0.343) 2.526 9.955 ( -0.317 -0.750 0.663) 1.050 10.579 ( 11.489 -9.525 -10.196) 18.075 11.014 ( 2.939 -9.929 0.673) 10.377 11.179 ( -2.095 -6.980 3.821) 8.229 11.365 ( 0.980 0.770 -3.574) 3.786 11.493 ( 1.865 -1.407 -1.365) 2.705 11.556 ( -4.925 3.120 0.245) 5.835 11.784 ( 2.185 0.207 0.759) 2.323 11.983 ( 0.134 6.301 1.776) 6.548 12.427 ( -5.748 7.508 7.874) 12.305 13.211 ( 0.041 3.803 -2.800) 4.723 13.368 ( -2.895 3.465 -0.811) 4.587 13.506 ( -2.662 -1.632 0.060) 3.123 13.791 ( 5.127 -5.817 -1.327) 7.866 14.125 ( 4.371 -6.469 2.955) 8.348 14.324 ( 3.798 -11.809 -2.452) 12.645 14.464 ( 5.516 -7.692 1.969) 9.668 14.926 ( -6.850 9.066 -8.582) 14.239 15.960 ( -2.628 -14.821 17.783) 23.298 16.088 ( 3.531 23.342 -6.150) 24.395 16.379 ( 13.125 -20.034 3.330) 24.181 16.757 ( 6.124 -14.829 7.650) 17.774 17.594 ( -1.290 6.876 -12.974) 14.740 17.723 ( -8.824 -5.516 4.247) 11.239 17.867 ( 2.832 8.151 -0.330) 8.635 18.557 ( -5.018 13.950 -0.009) 14.825 18.683 ( -7.056 14.949 3.734) 16.947 19.006 ( -16.961 22.877 -1.794) 28.535 19.557 ( -11.594 23.233 -11.425) 28.367 20.326 ( 8.649 -22.554 26.311) 35.718 21.416 ( 8.085 -5.513 -3.005) 10.236 21.546 ( -1.366 -5.331 2.359) 5.987 21.803 ( 6.523 -5.349 -4.314) 9.475 22.061 ( -1.166 -0.932 3.707) 3.997 23.296 ( 7.204 -12.709 -3.462) 15.013 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.077 ( 9.742 23.407 3.529) 25.598 1.519 ( -2.687 29.734 10.154) 31.535 2.148 ( -4.635 27.076 15.831) 31.706 2.713 ( 5.117 -1.584 -9.117) 10.574 2.763 ( 0.144 6.049 -3.878) 7.187 3.007 ( -4.000 0.266 4.875) 6.312 3.119 ( 0.289 0.233 6.488) 6.499 3.247 ( 2.138 7.022 4.166) 8.440 3.359 ( -0.029 -6.745 4.660) 8.198 3.543 ( -8.232 5.315 -0.438) 9.809 3.695 ( 2.355 -1.809 -7.760) 8.309 3.892 ( 0.440 2.749 -2.209) 3.554 4.167 ( 5.507 4.523 1.566) 7.296 4.366 ( -0.338 -0.426 -3.384) 3.428 4.620 ( -0.019 -8.675 1.104) 8.745 4.697 ( -4.547 1.434 -6.145) 7.778 4.795 ( -1.822 0.287 3.254) 3.741 4.997 ( 0.685 -2.187 1.642) 2.819 5.062 ( 8.289 -4.122 5.880) 10.968 5.281 ( -4.452 6.996 -14.724) 16.899 5.336 ( 1.650 -0.739 -11.860) 11.997 5.567 ( 0.396 0.032 7.339) 7.349 5.764 ( 0.911 -8.301 -4.587) 9.528 5.993 ( -1.572 0.771 1.058) 2.046 6.066 ( -1.558 -0.279 0.430) 1.640 6.217 ( -1.351 -4.982 14.166) 15.077 6.439 ( 0.157 4.040 -3.583) 5.402 6.897 ( 0.242 10.113 -2.578) 10.439 7.501 ( -0.271 -13.654 6.410) 15.086 7.985 ( 1.122 -9.082 0.098) 9.152 7.987 ( 5.764 -0.309 -3.100) 6.552 8.434 ( -6.538 -2.969 7.397) 10.309 8.574 ( -8.683 12.692 -12.188) 19.623 8.741 ( 2.096 -1.208 -2.605) 3.555 8.986 ( -1.459 -5.998 0.866) 6.233 9.061 ( -10.418 4.419 -11.061) 15.824 9.278 ( 4.192 3.942 4.641) 7.393 9.499 ( 4.807 -4.452 -4.126) 7.743 9.782 ( -3.064 -0.399 1.224) 3.323 9.852 ( 4.539 1.141 4.294) 6.352 9.972 ( 1.684 1.609 2.149) 3.169 10.650 ( 9.276 -9.993 -13.084) 18.897 10.949 ( 0.697 -10.674 -3.226) 11.173 11.004 ( -5.125 -6.824 9.427) 12.716 11.337 ( -3.793 -1.584 -4.352) 5.987 11.421 ( -1.442 -0.986 -0.260) 1.766 11.581 ( 0.127 4.027 2.990) 5.017 11.860 ( 2.521 3.915 -1.365) 4.852 12.076 ( 0.089 8.167 0.685) 8.197 12.428 ( -5.508 5.259 6.245) 9.849 13.268 ( 0.266 -0.169 -1.428) 1.462 13.357 ( -1.107 1.224 -1.250) 2.070 13.481 ( 5.168 3.863 -2.878) 7.065 13.802 ( 0.753 -5.635 3.026) 6.441 14.018 ( -5.840 -16.786 1.772) 17.861 14.224 ( 0.702 -4.865 -0.533) 4.944 14.448 ( 1.394 -8.072 1.260) 8.288 14.775 ( -9.475 5.183 -13.907) 17.609 16.028 ( 9.733 -5.060 6.420) 12.711 16.333 ( -0.418 -2.303 3.089) 3.876 16.392 ( 7.965 -2.204 10.710) 13.528 16.611 ( -5.399 -12.784 4.022) 14.448 17.569 ( 6.539 0.538 -0.395) 6.573 17.647 ( -9.887 3.711 -7.149) 12.753 18.101 ( 14.763 4.272 -1.757) 15.469 18.445 ( -9.435 12.770 10.338) 18.946 18.837 ( -8.765 17.291 -3.580) 19.714 19.095 ( 3.779 28.022 -7.227) 29.185 19.556 ( -9.703 21.847 -7.295) 24.993 20.483 ( 16.346 -17.672 27.773) 36.754 21.434 ( -4.331 -5.468 -0.563) 6.998 21.481 ( 6.710 -8.405 3.745) 11.388 21.782 ( -1.117 -7.043 -5.304) 8.887 22.009 ( -3.468 -1.399 0.702) 3.805 23.193 ( -0.036 -16.190 -4.644) 16.843 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.572 ( 15.911 18.708 3.486) 24.806 1.789 ( -0.356 25.241 4.992) 25.733 2.335 ( 3.348 5.083 -5.406) 8.140 2.759 ( 3.701 -2.563 -7.755) 8.967 2.839 ( -2.504 7.116 8.805) 11.595 3.021 ( -0.566 5.132 10.023) 11.275 3.148 ( -1.487 -0.782 3.619) 3.990 3.299 ( 1.078 -1.924 0.891) 2.379 3.409 ( 4.059 10.435 6.012) 12.708 3.525 ( -0.533 10.687 0.685) 10.723 3.718 ( 1.791 1.561 -1.689) 2.915 3.947 ( 1.314 4.804 0.074) 4.981 4.251 ( -0.673 -3.395 6.041) 6.962 4.383 ( 6.895 -1.393 -7.630) 10.378 4.501 ( -3.648 -5.778 -1.817) 7.071 4.589 ( -1.613 -5.210 -5.677) 7.873 4.785 ( -1.948 -0.475 3.346) 3.901 4.964 ( -2.529 -1.149 2.402) 3.672 5.188 ( 3.651 1.475 1.019) 4.067 5.235 ( -0.980 3.665 -4.740) 6.072 5.310 ( 1.739 2.257 -18.178) 18.400 5.585 ( 0.411 -4.403 3.860) 5.870 5.715 ( 1.912 -3.379 -1.513) 4.167 5.899 ( -7.162 -0.960 -2.555) 7.665 6.060 ( 1.781 -4.032 3.370) 5.548 6.183 ( -2.858 -3.247 10.781) 11.616 6.466 ( -0.082 2.540 -2.768) 3.758 7.035 ( 3.335 12.001 -1.979) 12.612 7.337 ( -5.083 -12.621 4.575) 14.355 7.865 ( -3.056 -3.215 3.132) 5.429 8.150 ( 9.084 -1.061 0.243) 9.149 8.383 ( -4.130 3.521 -0.194) 5.431 8.501 ( -5.672 9.452 -14.559) 18.261 8.666 ( -2.655 -6.857 -1.190) 7.449 8.811 ( -5.937 -0.530 2.379) 6.417 9.034 ( 2.801 1.467 -6.546) 7.270 9.346 ( 1.009 -10.387 1.872) 10.602 9.543 ( 6.795 -3.002 -5.140) 9.034 9.681 ( -4.928 -5.092 3.900) 8.088 9.929 ( -2.902 10.540 3.984) 11.635 10.130 ( 9.886 4.761 2.861) 11.340 10.529 ( -3.654 -10.237 -10.672) 15.233 10.818 ( -0.168 -7.657 -5.795) 9.604 10.972 ( -1.997 -7.926 16.939) 18.808 11.252 ( -1.688 3.766 -8.960) 9.865 11.420 ( 1.835 -4.382 4.896) 6.822 11.646 ( -0.013 9.271 -0.308) 9.276 11.953 ( 4.586 3.706 -3.519) 6.867 12.154 ( -0.993 8.638 3.165) 9.253 12.357 ( -7.408 0.506 1.893) 7.663 13.165 ( -2.725 -8.628 -0.901) 9.093 13.386 ( 1.916 2.216 -3.287) 4.403 13.687 ( 5.509 4.080 -2.659) 7.353 13.723 ( -4.576 -18.659 -1.299) 19.256 13.768 ( 1.902 -1.021 6.143) 6.511 14.155 ( -5.309 -3.421 1.450) 6.480 14.372 ( -1.798 -7.204 1.606) 7.597 14.704 ( 2.019 5.068 -10.815) 12.113 15.958 ( -4.449 -13.660 0.737) 14.385 16.271 ( -7.847 -2.977 -4.009) 9.301 16.337 ( -9.452 4.466 9.236) 13.950 16.743 ( 17.489 -4.870 9.646) 20.558 17.446 ( -10.404 6.114 -4.556) 12.899 17.756 ( 10.027 -1.551 3.945) 10.887 18.341 ( 13.340 -2.497 2.724) 13.843 18.621 ( -2.219 22.772 -3.036) 23.081 18.873 ( 0.385 17.896 -0.218) 17.901 19.454 ( 9.409 15.272 -8.748) 19.957 19.617 ( -2.893 20.827 -0.582) 21.035 20.680 ( 9.696 -11.117 23.773) 27.978 21.254 ( -9.401 -5.884 1.413) 11.180 21.502 ( -2.055 -11.585 4.392) 12.559 21.642 ( 3.994 -7.115 -4.067) 9.117 21.914 ( -6.417 0.595 -4.631) 7.936 22.948 ( -5.664 -16.633 -5.956) 18.553 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.848 ( 1.600 8.688 -1.744) 9.005 2.163 ( 11.883 18.033 -1.661) 21.660 2.439 ( 6.435 5.519 -2.406) 8.812 2.681 ( -2.497 -3.251 -2.382) 4.741 2.852 ( -4.635 4.018 3.907) 7.272 3.008 ( -4.529 -5.212 4.893) 8.463 3.213 ( 8.773 -1.031 1.032) 8.894 3.334 ( 1.745 -1.900 1.893) 3.200 3.616 ( -4.118 6.644 2.121) 8.100 3.664 ( 3.094 16.792 5.473) 17.930 3.821 ( 4.320 7.191 2.269) 8.690 4.045 ( 5.356 1.713 2.721) 6.247 4.225 ( 0.801 0.836 3.593) 3.775 4.306 ( -3.342 -8.336 -1.128) 9.052 4.491 ( -0.081 -7.460 -2.605) 7.902 4.532 ( 5.119 2.484 -4.047) 6.982 4.727 ( -2.287 -3.115 -0.152) 3.868 4.918 ( -1.794 -2.804 4.027) 5.225 5.185 ( -6.030 6.081 1.894) 8.771 5.290 ( 1.607 2.630 -17.933) 18.196 5.326 ( 6.281 2.845 -3.738) 7.843 5.530 ( -3.555 -6.287 0.842) 7.271 5.601 ( -7.094 -2.710 -6.667) 10.106 5.849 ( 1.641 -2.050 6.193) 6.727 6.060 ( 2.449 -5.564 5.019) 7.883 6.173 ( -0.269 1.612 2.801) 3.243 6.446 ( -3.005 0.160 -1.029) 3.180 7.119 ( -12.074 4.231 0.632) 12.809 7.230 ( 9.417 -2.460 0.707) 9.759 7.859 ( 2.104 1.075 4.648) 5.213 8.196 ( -7.960 6.623 -10.498) 14.746 8.371 ( 6.510 -3.407 5.424) 9.133 8.473 ( -3.056 4.073 -6.559) 8.303 8.594 ( 2.220 -2.426 1.424) 3.583 8.762 ( 0.212 -5.907 0.991) 5.993 9.040 ( 1.450 -10.024 -2.152) 10.355 9.270 ( 1.669 1.250 -3.857) 4.384 9.526 ( -1.173 -5.585 -2.642) 6.289 9.619 ( 0.724 -1.901 5.080) 5.473 10.043 ( 0.754 11.299 3.638) 11.894 10.240 ( -7.124 -5.546 -4.304) 10.002 10.396 ( 3.150 6.406 -6.095) 9.387 10.677 ( -3.162 -8.901 -3.071) 9.932 10.957 ( 0.013 -5.335 18.042) 18.815 11.247 ( -2.381 7.956 -9.322) 12.485 11.423 ( 2.287 -5.312 5.848) 8.224 11.765 ( 2.755 7.908 -3.521) 9.084 12.080 ( 6.645 6.053 -3.267) 9.564 12.238 ( -2.094 -6.570 2.383) 7.296 12.265 ( 1.286 10.205 3.355) 10.819 13.010 ( -7.223 -6.031 -2.247) 9.674 13.338 ( -3.509 -12.481 0.644) 12.981 13.513 ( 1.204 -7.437 -4.745) 8.903 13.670 ( -2.797 -1.987 2.805) 4.432 13.862 ( 0.814 -1.929 -4.884) 5.314 14.108 ( 1.100 3.338 8.085) 8.816 14.266 ( -2.446 -4.872 -1.398) 5.628 14.805 ( 6.767 4.738 -8.946) 12.177 15.727 ( -6.507 -11.355 2.625) 13.348 16.106 ( -6.655 -0.524 -1.886) 6.937 16.285 ( -9.286 7.463 17.317) 21.019 16.868 ( 6.950 -10.755 -14.357) 19.238 17.507 ( 2.172 16.875 1.644) 17.093 17.843 ( 1.995 -6.001 9.951) 11.790 18.545 ( -3.224 9.520 3.381) 10.604 18.728 ( 12.659 5.565 -10.272) 17.226 19.225 ( 10.809 17.677 5.456) 21.426 19.553 ( 1.109 1.845 -5.185) 5.615 19.911 ( 8.044 16.836 -1.832) 18.748 20.803 ( 5.148 -6.231 16.243) 18.143 21.011 ( -11.746 -5.250 1.776) 12.988 21.235 ( -12.462 -7.772 -0.006) 14.687 21.728 ( -0.885 -5.995 1.869) 6.342 21.795 ( 5.607 0.694 -6.553) 8.652 22.638 ( -8.084 -14.446 -5.836) 17.553 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.923 ( 3.733 2.587 -3.930) 6.005 2.325 ( -4.040 2.376 2.962) 5.544 2.569 ( -1.698 4.415 2.245) 5.236 2.749 ( 4.869 2.148 -3.687) 6.475 2.844 ( 2.369 5.969 1.212) 6.536 2.908 ( -0.630 -3.562 0.114) 3.620 3.311 ( -2.826 -1.620 2.032) 3.839 3.359 ( 5.781 0.735 1.407) 5.995 3.540 ( -4.412 -1.630 0.109) 4.704 3.857 ( 0.328 9.897 2.843) 10.303 3.922 ( 1.419 3.830 -2.632) 4.859 4.144 ( -3.288 -5.500 1.799) 6.656 4.171 ( 6.307 3.591 -3.594) 8.099 4.330 ( -0.771 -0.559 4.342) 4.446 4.414 ( 0.218 -6.460 -1.257) 6.585 4.581 ( 1.787 -2.123 0.955) 2.934 4.778 ( 8.708 4.938 2.913) 10.425 4.860 ( -4.013 -5.559 3.248) 7.587 5.060 ( -13.085 1.109 -0.718) 13.152 5.274 ( 2.210 0.571 -13.588) 13.779 5.347 ( -9.161 5.515 8.478) 13.646 5.458 ( 7.585 2.925 -6.364) 10.324 5.557 ( 4.292 -4.995 -3.663) 7.536 5.831 ( -2.660 -4.575 4.869) 7.191 6.108 ( 4.143 -0.215 0.327) 4.161 6.222 ( 1.894 3.364 0.119) 3.863 6.358 ( -5.407 -2.197 0.925) 5.909 6.982 ( -8.706 7.494 0.754) 11.512 7.344 ( 7.367 -7.187 0.060) 10.292 7.995 ( 4.513 5.835 2.757) 7.875 8.053 ( -5.905 3.261 -5.129) 8.474 8.397 ( -6.350 2.176 1.994) 7.003 8.484 ( 5.859 -4.699 2.424) 7.892 8.653 ( 6.419 -4.646 -5.567) 9.684 8.762 ( 5.733 -1.837 3.723) 7.078 8.876 ( -2.798 -10.411 0.273) 10.784 9.380 ( 1.909 -0.756 -5.405) 5.782 9.437 ( 1.825 2.825 -6.368) 7.202 9.697 ( 3.799 2.002 11.823) 12.579 9.976 ( -10.548 -5.292 -8.978) 14.828 10.178 ( 2.465 4.546 1.701) 5.444 10.392 ( -8.070 7.197 0.607) 10.830 10.610 ( 0.866 -3.470 -2.709) 4.486 10.972 ( 1.059 -6.158 12.279) 13.777 11.238 ( -4.440 9.598 -8.338) 13.467 11.486 ( 5.908 -1.115 5.837) 8.379 11.825 ( 1.132 0.013 -5.476) 5.591 12.114 ( 0.711 -7.027 1.528) 7.226 12.326 ( 6.157 4.713 -0.617) 7.778 12.431 ( 2.449 11.183 4.052) 12.144 12.779 ( -8.545 0.191 -2.615) 8.938 13.145 ( -5.687 -11.207 -1.584) 12.667 13.414 ( 5.884 -13.668 -2.186) 15.040 13.700 ( 3.198 3.580 -1.136) 4.933 13.825 ( -0.345 -2.017 -0.721) 2.169 14.107 ( -4.624 -4.513 6.558) 9.206 14.261 ( 1.707 3.411 -2.819) 4.743 14.931 ( 5.389 6.093 -8.963) 12.104 15.554 ( -2.196 -10.554 5.763) 12.224 16.009 ( -4.739 2.450 -1.002) 5.429 16.319 ( -5.205 7.476 21.118) 22.999 16.776 ( 2.592 -7.416 -17.140) 18.855 17.619 ( -5.308 10.319 -14.966) 18.938 17.923 ( 6.109 -2.523 23.366) 24.283 18.483 ( -13.891 14.140 -4.338) 20.291 19.052 ( 21.075 -3.531 -2.917) 21.567 19.407 ( 0.883 -8.605 -1.662) 8.808 19.655 ( 1.080 15.713 2.501) 15.948 20.105 ( 2.793 1.165 0.242) 3.036 20.760 ( -7.768 -3.684 -7.497) 11.407 20.900 ( 0.954 -1.274 12.059) 12.163 21.027 ( -4.892 1.210 5.538) 7.488 21.554 ( -10.087 2.111 -5.542) 11.701 21.992 ( 14.005 -4.882 -0.370) 14.836 22.367 ( -4.523 -9.214 -3.073) 10.714 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.016 ( 4.751 2.640 -4.601) 7.121 2.229 ( -13.912 0.424 17.516) 22.373 2.509 ( 0.936 -5.707 -1.964) 6.108 2.625 ( -12.379 -0.769 -1.678) 12.516 2.977 ( 6.679 -1.243 -4.329) 8.056 3.009 ( 3.242 4.438 -1.486) 5.693 3.249 ( -2.439 3.901 -3.602) 5.843 3.331 ( -4.196 -1.347 -1.638) 4.701 3.570 ( 3.073 -1.165 2.189) 3.949 3.884 ( -2.965 2.353 1.595) 4.107 3.964 ( -5.881 5.318 0.244) 7.932 4.068 ( 1.208 -2.487 -0.287) 2.779 4.179 ( -8.660 -1.245 -3.968) 9.607 4.328 ( -6.477 -5.468 -2.360) 8.799 4.356 ( 8.231 1.757 -1.493) 8.548 4.586 ( -2.657 -3.206 -0.240) 4.171 4.683 ( 4.176 -1.435 4.243) 6.124 4.888 ( -5.382 -2.018 1.019) 5.838 5.072 ( 9.268 1.801 6.832) 11.654 5.267 ( -0.105 1.007 1.726) 2.001 5.379 ( -2.323 10.597 1.470) 10.947 5.571 ( 2.733 -4.212 4.161) 6.522 5.595 ( 8.860 -0.718 -4.167) 9.818 5.753 ( -0.039 -2.748 -5.947) 6.551 6.152 ( 0.003 2.040 -6.175) 6.503 6.198 ( -8.362 0.216 3.019) 8.893 6.338 ( 5.259 -0.085 2.091) 5.661 6.987 ( -1.627 10.422 0.527) 10.561 7.336 ( 2.070 -10.459 0.121) 10.663 7.888 ( -8.628 -0.093 -0.123) 8.630 8.220 ( 0.666 9.043 -0.403) 9.076 8.337 ( 3.913 -1.792 5.189) 6.742 8.530 ( 2.802 -4.084 -1.588) 5.201 8.677 ( 3.234 1.610 -2.459) 4.371 8.803 ( 6.168 -6.372 -3.361) 9.484 8.905 ( 6.971 -3.540 -1.702) 8.002 9.287 ( 0.726 -5.820 -0.573) 5.893 9.529 ( -1.221 5.884 -4.567) 7.548 9.737 ( -7.817 5.556 -9.716) 13.652 9.892 ( 8.695 -1.571 16.000) 18.278 10.163 ( -5.430 -1.591 1.530) 5.862 10.445 ( 2.585 9.050 2.251) 9.677 10.506 ( -5.837 -5.537 2.816) 8.524 10.968 ( 1.935 -5.202 -5.040) 7.497 11.235 ( -2.495 7.920 -1.673) 8.471 11.623 ( 5.923 1.094 6.062) 8.545 11.721 ( -6.149 -5.571 -7.451) 11.152 12.138 ( 3.579 0.465 3.897) 5.312 12.278 ( -7.328 -1.987 0.368) 7.602 12.460 ( -7.638 -2.541 -3.774) 8.891 12.875 ( 3.602 13.318 1.392) 13.867 13.054 ( 12.683 -3.532 -1.720) 13.278 13.474 ( 12.690 -7.534 -3.555) 15.180 13.738 ( -3.316 1.938 -3.270) 5.044 13.822 ( 1.700 -2.427 6.180) 6.853 14.020 ( -0.274 -4.031 -0.428) 4.063 14.267 ( -3.580 2.542 0.694) 4.445 15.042 ( 2.659 9.036 -9.657) 13.490 15.487 ( 4.028 -11.061 8.008) 14.237 15.980 ( -0.309 0.138 0.902) 0.963 16.377 ( -1.038 -2.626 9.646) 10.051 16.711 ( -3.595 7.684 -2.490) 8.842 17.522 ( -2.217 -0.017 -13.261) 13.445 18.080 ( 1.283 1.058 11.237) 11.359 18.334 ( -15.612 10.884 0.337) 19.035 19.224 ( -0.404 -13.164 -4.150) 13.809 19.308 ( 3.301 0.048 -2.932) 4.415 19.696 ( -7.378 3.739 3.721) 9.070 20.082 ( -1.761 -6.255 1.826) 6.750 20.552 ( -11.927 1.942 -4.054) 12.746 20.982 ( 4.963 -1.204 7.038) 8.696 21.122 ( 6.254 5.908 0.196) 8.605 21.440 ( -3.193 5.779 -1.714) 6.821 22.027 ( 0.681 -8.479 -3.430) 9.172 22.421 ( 14.410 -0.039 1.344) 14.472 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.911 ( -18.715 -7.792 6.903) 21.416 2.036 ( -17.197 10.309 1.574) 20.112 2.483 ( -3.772 7.053 0.724) 8.031 2.547 ( 10.494 -8.908 3.379) 14.174 2.912 ( -6.757 -6.012 -3.827) 9.821 3.028 ( 1.067 -0.655 -3.611) 3.822 3.238 ( -3.128 -3.511 -1.239) 4.863 3.348 ( 0.534 12.882 -5.860) 14.163 3.545 ( -3.859 -2.814 0.926) 4.865 3.628 ( -21.681 -2.600 -3.730) 22.153 3.853 ( -8.565 2.649 -0.658) 8.990 3.983 ( -2.878 -0.355 1.288) 3.173 4.129 ( -1.808 -1.031 5.235) 5.634 4.330 ( 11.222 3.776 -1.766) 11.971 4.512 ( 7.933 -1.046 0.090) 8.002 4.598 ( 2.870 1.934 -1.129) 3.640 4.742 ( -6.346 -2.578 -0.432) 6.863 4.831 ( 5.656 -1.092 2.997) 6.494 5.168 ( 2.716 -5.887 5.517) 8.513 5.294 ( -2.227 2.150 3.732) 4.849 5.425 ( -0.883 6.366 0.556) 6.451 5.647 ( 5.261 -3.845 2.554) 6.999 5.705 ( 5.248 0.237 2.344) 5.753 5.758 ( 7.868 -0.667 -12.739) 14.988 6.022 ( -7.980 -1.985 3.311) 8.865 6.156 ( -2.560 3.457 -5.369) 6.879 6.436 ( 4.263 0.135 1.494) 4.520 7.113 ( 7.221 1.175 -0.375) 7.326 7.217 ( -7.582 -1.052 0.027) 7.655 7.767 ( -3.524 -0.388 2.183) 4.163 8.230 ( -3.636 6.083 3.818) 8.050 8.433 ( -0.617 -5.820 1.210) 5.976 8.560 ( 10.945 -2.136 -9.813) 14.854 8.751 ( -0.378 -6.360 -9.230) 11.216 8.784 ( 1.376 7.050 -2.254) 7.529 9.023 ( 12.047 0.590 3.300) 12.505 9.318 ( 1.001 -1.667 1.268) 2.321 9.492 ( 0.158 3.214 -2.050) 3.816 9.729 ( 0.689 5.909 -5.696) 8.236 9.963 ( -9.334 -4.467 3.628) 10.966 10.097 ( 0.898 -2.850 14.329) 14.638 10.422 ( 1.269 -1.037 8.231) 8.393 10.615 ( 8.098 3.563 -0.763) 8.879 10.895 ( 2.118 -6.227 -10.983) 12.802 11.322 ( 3.269 7.295 1.481) 8.130 11.493 ( -7.535 -5.545 -8.015) 12.320 11.754 ( 3.234 1.632 5.908) 6.930 12.034 ( -15.989 0.869 0.900) 16.038 12.206 ( -8.567 0.919 0.253) 8.620 12.331 ( 7.654 -2.981 -5.021) 9.627 13.056 ( 8.588 1.220 -0.518) 8.690 13.346 ( 13.446 3.536 -0.476) 13.911 13.629 ( 7.603 1.977 -3.963) 8.799 13.655 ( -3.368 -0.240 -0.889) 3.492 13.827 ( -0.363 -2.646 9.998) 10.349 14.028 ( 4.588 -0.907 -7.285) 8.657 14.246 ( -0.276 1.120 4.118) 4.276 15.091 ( -3.187 9.195 -12.298) 15.683 15.568 ( 13.210 -10.428 11.317) 20.281 15.974 ( 1.626 -9.148 3.563) 9.951 16.304 ( 2.512 -6.299 -10.010) 12.091 16.792 ( -9.408 19.811 17.736) 28.206 17.470 ( 3.764 -2.554 -11.946) 12.783 18.006 ( -7.312 -0.769 -10.703) 12.986 18.228 ( -11.529 3.976 19.773) 23.232 18.975 ( -8.077 -14.662 -6.315) 17.891 19.200 ( -17.130 10.286 -4.479) 20.476 19.695 ( 4.367 -2.128 -3.162) 5.796 19.902 ( -14.698 -2.277 2.644) 15.107 20.360 ( -12.786 3.004 9.090) 15.973 21.080 ( 8.733 -5.391 0.159) 10.264 21.279 ( 8.957 0.968 -5.299) 10.452 21.582 ( 6.107 9.961 7.106) 13.675 21.953 ( 1.126 -5.189 -4.447) 6.926 22.722 ( 17.973 -0.228 0.308) 17.977 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 ( -25.648 -3.781 4.540) 26.320 1.766 ( -26.396 13.565 0.599) 29.683 2.410 ( -18.163 2.264 -1.523) 18.367 2.694 ( 2.161 3.486 1.387) 4.329 2.756 ( 4.506 -3.519 4.488) 7.268 3.013 ( 0.289 -1.063 -5.563) 5.671 3.143 ( -4.270 -6.124 3.035) 8.059 3.191 ( -9.926 3.285 -3.181) 10.929 3.399 ( -8.476 0.850 1.946) 8.738 3.565 ( 0.503 8.555 -3.192) 9.145 3.812 ( -1.236 0.433 -3.451) 3.691 3.870 ( -2.350 -2.285 3.250) 4.615 4.220 ( 1.698 5.568 6.720) 8.891 4.497 ( 4.580 -3.913 -0.425) 6.039 4.551 ( -4.738 -7.976 3.906) 10.066 4.647 ( 5.871 6.795 -4.937) 10.248 4.681 ( 2.632 1.592 -3.886) 4.956 4.875 ( 2.484 -4.103 -0.377) 4.811 5.146 ( -2.871 -2.803 6.007) 7.224 5.310 ( 3.337 1.606 -4.448) 5.788 5.491 ( 0.013 2.198 7.310) 7.634 5.606 ( -4.012 -0.620 -9.599) 10.422 5.750 ( 5.861 -5.679 -4.773) 9.454 5.921 ( 6.857 2.597 1.585) 7.502 5.964 ( 1.860 -0.571 7.121) 7.382 6.101 ( -3.722 0.534 -3.563) 5.180 6.485 ( 0.669 -0.010 -0.485) 0.826 7.014 ( -7.082 -3.341 -3.689) 8.656 7.309 ( 8.401 2.485 2.968) 9.250 7.808 ( 5.682 2.333 3.274) 6.960 8.208 ( -6.046 -10.531 1.258) 12.208 8.287 ( -1.815 0.501 -5.398) 5.717 8.688 ( -1.256 4.931 -5.330) 7.369 8.704 ( 12.963 -2.367 -5.852) 14.419 8.898 ( -1.857 11.420 1.963) 11.735 9.176 ( -5.294 4.301 -1.850) 7.067 9.338 ( 11.106 -0.970 2.160) 11.356 9.565 ( 2.447 -7.703 0.340) 8.089 9.734 ( -7.306 -3.315 -0.406) 8.033 9.778 ( 0.007 5.797 -3.025) 6.539 10.062 ( -4.277 -3.366 7.570) 9.324 10.591 ( 10.827 -3.603 3.175) 11.844 10.766 ( 8.263 0.731 3.765) 9.109 10.898 ( 8.390 -4.156 -2.403) 9.667 11.301 ( -2.249 -4.303 -8.755) 10.011 11.499 ( 5.018 6.041 5.007) 9.313 11.704 ( -12.640 1.155 -7.282) 14.633 11.861 ( -0.893 -1.672 11.214) 11.373 12.090 ( -7.400 3.584 -5.468) 9.875 12.388 ( -0.708 3.411 -3.272) 4.779 13.180 ( 7.709 -3.841 -2.746) 9.040 13.457 ( -2.547 1.931 -0.007) 3.196 13.610 ( -1.514 -2.605 1.065) 3.196 13.712 ( 1.342 2.527 4.534) 5.361 13.936 ( 9.242 -2.221 3.433) 10.106 14.112 ( 8.259 2.168 -5.957) 10.412 14.316 ( 6.084 -2.742 3.398) 7.488 15.037 ( -6.511 10.460 -14.255) 18.842 15.703 ( 5.225 -17.461 13.544) 22.708 15.957 ( 13.708 -4.599 -3.310) 14.833 16.370 ( 11.279 -0.570 -5.639) 12.623 16.815 ( -17.706 11.689 16.863) 27.102 17.474 ( 4.416 -1.275 -11.677) 12.549 17.911 ( 1.910 2.089 -2.719) 3.925 18.083 ( -13.583 -1.533 14.142) 19.668 18.601 ( -15.253 -12.028 -5.608) 20.219 19.026 ( -15.149 16.102 -5.523) 22.787 19.516 ( -23.187 2.561 0.575) 23.335 19.709 ( -7.944 7.494 -13.466) 17.338 20.305 ( -1.893 -3.388 26.984) 27.262 21.194 ( 11.236 -5.067 -5.146) 13.356 21.424 ( 9.770 -3.622 1.388) 10.511 21.798 ( 6.425 0.662 4.092) 7.646 21.922 ( 0.730 2.083 -5.249) 5.694 23.017 ( 17.222 -3.121 -1.293) 17.550 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.305 ( -16.822 16.415 -8.942) 25.148 1.790 ( -15.217 17.950 9.735) 25.466 2.411 ( 4.028 1.328 -4.958) 6.524 2.686 ( -7.007 -4.111 -2.923) 8.634 2.848 ( -9.586 11.864 10.264) 18.384 3.016 ( 3.577 1.457 1.748) 4.239 3.218 ( 3.038 7.895 3.254) 9.063 3.328 ( -5.401 8.724 5.234) 11.518 3.420 ( -6.611 6.013 3.145) 9.474 3.549 ( -6.684 0.093 5.325) 8.546 3.782 ( 1.356 -1.701 -3.200) 3.869 3.949 ( 4.962 2.662 -2.646) 6.222 4.079 ( -13.155 -4.484 2.582) 14.136 4.430 ( 7.230 -2.143 -4.964) 9.028 4.602 ( -1.069 -4.368 -1.925) 4.892 4.671 ( 3.313 6.039 3.680) 7.810 4.758 ( 3.671 -4.840 6.110) 8.616 4.812 ( 3.161 0.046 -8.819) 9.368 5.013 ( -1.620 -4.350 -2.569) 5.305 5.267 ( 1.706 -3.369 -5.175) 6.406 5.443 ( -3.704 6.524 -13.266) 15.241 5.593 ( -2.044 0.431 4.327) 4.805 5.666 ( 8.632 -6.622 -6.387) 12.616 5.973 ( -3.282 -0.954 1.295) 3.655 6.105 ( 3.927 -3.841 9.305) 10.806 6.175 ( 2.038 4.131 8.134) 9.348 6.438 ( 0.435 -1.101 -3.831) 4.010 6.954 ( 0.305 7.632 -3.369) 8.349 7.390 ( 3.312 -9.260 4.723) 10.910 7.761 ( -1.699 -3.622 -1.046) 4.135 8.071 ( 2.363 4.696 -1.345) 5.427 8.450 ( -0.060 1.932 3.999) 4.442 8.741 ( 11.189 -2.922 -1.769) 11.699 8.797 ( -4.568 -2.295 -3.527) 6.211 8.981 ( -4.494 3.832 -7.452) 9.508 9.108 ( -6.492 -2.224 7.846) 10.423 9.295 ( 2.335 -3.929 5.314) 7.009 9.588 ( 5.067 0.853 -12.633) 13.638 9.651 ( 1.608 -1.442 0.868) 2.328 9.839 ( -4.250 0.613 4.050) 5.903 9.982 ( -1.171 1.784 0.752) 2.263 10.306 ( 5.362 -5.070 -8.270) 11.084 10.820 ( 6.283 -11.033 -0.575) 12.709 11.144 ( 2.104 -2.518 1.377) 3.559 11.278 ( 7.744 1.236 2.486) 8.227 11.545 ( -6.548 3.127 5.614) 9.175 11.726 ( -9.003 0.206 -9.114) 12.812 11.763 ( 1.717 5.844 3.835) 7.198 12.076 ( -2.619 5.947 2.149) 6.845 12.547 ( -2.146 -1.477 4.400) 5.114 13.131 ( 8.612 -3.817 -2.167) 9.666 13.453 ( -1.614 2.435 -2.262) 3.694 13.570 ( -1.063 4.117 -0.511) 4.282 13.660 ( -0.145 -7.603 -0.749) 7.641 13.973 ( 4.668 -7.417 5.396) 10.291 14.160 ( 2.809 -3.235 -3.424) 5.484 14.287 ( 6.018 -7.710 3.364) 10.343 15.072 ( -4.525 6.248 -6.829) 10.303 15.786 ( 8.617 -12.004 2.339) 14.960 16.021 ( 12.164 -1.150 -4.109) 12.891 16.271 ( -1.206 -0.861 2.070) 2.546 16.664 ( -5.788 -2.238 11.619) 13.172 17.622 ( 0.561 6.117 -4.105) 7.388 17.772 ( -2.335 -2.364 -13.466) 13.870 18.000 ( -5.193 5.920 12.895) 15.109 18.789 ( -0.637 24.010 2.533) 24.152 19.022 ( -16.160 5.463 -0.360) 17.062 19.526 ( -17.231 18.285 -3.273) 25.337 19.852 ( -5.010 7.999 -12.874) 15.963 20.205 ( -5.346 -9.092 27.783) 29.718 21.172 ( 10.895 -5.766 -5.930) 13.679 21.464 ( 8.140 -6.369 3.734) 10.989 21.609 ( 4.247 -6.056 -2.339) 7.757 22.074 ( -1.445 -1.572 1.448) 2.580 22.976 ( 11.176 -13.556 -5.106) 18.296 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.268 ( -4.001 21.122 -5.067) 22.087 1.896 ( -4.265 24.640 10.148) 26.987 2.443 ( -4.437 0.899 -6.402) 7.841 2.584 ( 4.197 0.926 -7.667) 8.789 2.860 ( -2.325 3.769 13.375) 14.089 3.090 ( -1.240 -0.448 5.369) 5.529 3.211 ( -6.468 7.759 6.510) 12.018 3.378 ( -7.858 9.685 9.609) 15.744 3.437 ( -1.498 9.718 4.379) 10.763 3.582 ( 5.805 1.288 -3.425) 6.862 3.726 ( -6.056 3.011 -5.263) 8.570 3.899 ( -2.787 0.131 2.048) 3.461 4.071 ( 7.270 1.373 -2.889) 7.943 4.435 ( -4.993 3.286 -3.846) 7.108 4.526 ( 0.440 -9.338 0.297) 9.353 4.747 ( -1.603 -4.165 1.149) 4.609 4.776 ( 1.809 -5.609 -3.352) 6.780 4.877 ( 8.423 5.783 1.440) 10.318 4.960 ( 2.409 -4.794 -1.089) 5.475 5.231 ( 1.212 -4.840 -4.362) 6.628 5.394 ( -4.319 10.061 -18.401) 21.412 5.595 ( -0.391 -1.155 4.879) 5.029 5.648 ( 1.604 -6.968 -3.151) 7.814 5.957 ( 1.875 -3.190 3.425) 5.042 6.118 ( -2.089 -2.482 4.124) 5.247 6.240 ( -0.091 -2.425 8.098) 8.454 6.447 ( 1.463 2.631 -2.506) 3.917 7.029 ( -2.760 12.537 -2.777) 13.134 7.347 ( 3.936 -13.637 5.101) 15.082 7.785 ( 6.527 -1.144 1.646) 6.827 8.056 ( -5.215 2.514 -4.141) 7.118 8.471 ( 1.653 -3.892 -0.978) 4.340 8.727 ( -0.985 0.809 -5.248) 5.401 8.796 ( -11.351 -1.282 3.658) 11.995 8.905 ( 6.208 1.137 1.548) 6.499 9.105 ( -0.937 5.237 -0.754) 5.373 9.323 ( 5.672 -9.076 -0.796) 10.732 9.473 ( -8.637 0.254 -10.446) 13.556 9.684 ( 4.880 -5.957 -1.729) 7.893 9.814 ( -1.156 0.131 6.216) 6.324 10.015 ( 0.616 3.517 4.917) 6.077 10.366 ( 7.852 -2.809 -7.548) 11.248 10.788 ( 3.741 -11.046 -2.551) 11.938 11.068 ( -5.434 -6.231 4.883) 9.602 11.333 ( 0.327 -2.294 -4.542) 5.099 11.495 ( -5.137 4.098 1.966) 6.859 11.630 ( 0.094 3.845 -0.798) 3.928 11.914 ( -0.449 9.818 4.470) 10.797 12.126 ( 2.153 6.517 -1.127) 6.956 12.507 ( -0.275 -4.288 5.112) 6.678 13.205 ( 3.648 -5.157 -1.061) 6.405 13.414 ( -3.806 -0.263 -1.679) 4.168 13.494 ( -3.424 3.852 -4.355) 6.748 13.722 ( 5.441 -1.790 3.663) 6.799 13.920 ( 0.125 -14.197 0.127) 14.198 14.159 ( 2.025 -1.220 -2.436) 3.395 14.316 ( 4.477 -8.310 3.985) 10.246 14.935 ( -11.226 1.830 -16.226) 19.816 15.780 ( 9.621 -14.340 11.968) 21.011 16.148 ( 6.742 -7.279 11.260) 15.008 16.445 ( 9.635 12.588 -9.574) 18.519 16.582 ( -6.010 -6.170 9.879) 13.107 17.572 ( -4.954 5.171 -15.323) 16.914 17.742 ( 0.437 3.422 1.228) 3.662 18.091 ( -1.774 8.631 9.213) 12.749 18.752 ( -11.973 6.871 4.938) 14.662 19.101 ( -0.857 20.567 -1.829) 20.666 19.425 ( -13.790 20.022 -5.269) 24.876 19.805 ( 2.829 4.206 -11.139) 12.238 20.253 ( 1.150 0.251 26.829) 26.855 21.240 ( 7.507 -8.567 -1.690) 11.515 21.494 ( -1.872 -4.846 7.719) 9.304 21.622 ( 6.578 -7.082 -8.393) 12.801 22.023 ( -1.147 -4.163 1.064) 4.447 22.946 ( 5.798 -17.054 -5.883) 18.949 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.538 ( 10.273 20.160 -0.301) 22.628 2.090 ( -5.465 14.681 2.234) 15.824 2.350 ( -1.353 6.351 -3.762) 7.504 2.646 ( 3.233 1.507 -8.929) 9.615 2.961 ( 3.242 -2.264 12.492) 13.103 3.044 ( 0.039 -1.541 4.578) 4.830 3.227 ( -5.169 1.954 8.300) 9.972 3.335 ( -7.740 1.370 1.964) 8.102 3.557 ( 0.910 9.889 -2.123) 10.155 3.635 ( 0.447 16.643 10.383) 19.622 3.779 ( -0.501 12.914 -1.289) 12.988 3.934 ( 2.736 0.986 0.436) 2.941 4.200 ( 8.130 -0.520 -3.505) 8.869 4.334 ( -6.817 -0.054 1.636) 7.011 4.427 ( 0.290 -10.946 1.031) 10.999 4.609 ( -6.577 -1.228 -8.686) 10.964 4.750 ( 1.997 -6.222 -0.482) 6.553 4.957 ( 1.536 -2.874 -0.556) 3.306 5.087 ( 8.892 0.036 -1.514) 9.020 5.188 ( 1.534 -3.638 -2.032) 4.441 5.352 ( -3.636 10.113 -13.171) 16.999 5.523 ( -0.612 -7.486 -3.671) 8.360 5.668 ( 2.096 0.765 3.853) 4.453 5.970 ( 2.044 -5.614 5.989) 8.459 6.019 ( -6.334 -2.890 -1.472) 7.116 6.219 ( -0.906 -4.252 5.553) 7.052 6.493 ( 0.061 3.659 -0.335) 3.675 7.037 ( 0.030 -4.763 0.531) 4.793 7.368 ( 0.149 8.225 0.721) 8.258 7.922 ( 0.837 -0.367 3.518) 3.634 7.986 ( 3.460 1.140 0.409) 3.665 8.446 ( 0.711 -1.000 -1.213) 1.726 8.597 ( -7.535 -1.450 0.724) 7.707 8.749 ( -3.718 7.132 -5.371) 9.671 8.939 ( -1.990 -1.642 0.462) 2.621 9.032 ( -6.998 -3.372 -4.448) 8.951 9.260 ( -2.291 -6.701 -7.334) 10.195 9.396 ( 3.742 -0.361 -0.814) 3.846 9.644 ( 0.840 -8.548 -0.177) 8.591 9.936 ( 11.384 0.108 4.483) 12.235 10.086 ( -0.298 6.895 3.253) 7.629 10.388 ( 2.609 -7.958 -5.506) 10.023 10.709 ( 0.730 -7.621 -4.519) 8.890 10.985 ( -0.923 -4.499 10.740) 11.681 11.254 ( -1.649 -1.208 -7.689) 7.956 11.487 ( -3.988 5.489 5.088) 8.481 11.739 ( 3.493 9.073 0.385) 9.730 11.951 ( -3.445 4.933 1.462) 6.192 12.243 ( 1.391 9.017 -3.163) 9.657 12.472 ( -2.633 -4.488 3.323) 6.174 13.085 ( -2.341 -14.360 0.724) 14.567 13.380 ( 0.188 0.648 -3.162) 3.233 13.527 ( 2.892 -0.038 -5.076) 5.842 13.726 ( -2.329 -6.359 3.096) 7.446 13.792 ( -1.590 -1.548 2.524) 3.361 14.174 ( 0.767 -0.822 -1.046) 1.535 14.306 ( 1.445 -6.865 3.166) 7.697 14.717 ( -5.046 0.605 -11.382) 12.465 15.833 ( 4.479 -11.566 4.858) 13.321 16.247 ( 0.991 -5.443 1.685) 5.783 16.471 ( 5.732 -6.799 11.779) 14.759 16.620 ( -2.663 10.776 -4.604) 12.017 17.594 ( 7.195 3.544 -2.293) 8.342 17.690 ( -10.413 4.413 -4.320) 12.107 18.146 ( 3.126 -0.516 4.929) 5.860 18.853 ( 3.702 16.794 10.565) 20.183 19.135 ( -11.263 15.234 -5.368) 19.691 19.492 ( 1.179 17.638 -11.739) 21.220 19.894 ( -2.036 12.926 0.051) 13.085 20.439 ( 10.520 -4.279 18.635) 21.823 21.254 ( 4.545 -11.149 0.110) 12.040 21.398 ( -4.255 -6.606 9.621) 12.422 21.577 ( -0.204 -6.423 -7.393) 9.796 21.968 ( -1.925 -1.441 -2.175) 3.242 22.795 ( 0.193 -17.249 -6.400) 18.399 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.911 ( 3.512 9.454 2.370) 10.360 2.061 ( 7.610 3.963 -8.298) 11.937 2.477 ( -1.481 12.267 1.614) 12.461 2.666 ( 1.627 2.996 -7.941) 8.642 2.959 ( -1.828 -0.324 -0.387) 1.897 3.068 ( -0.977 -3.712 7.789) 8.683 3.205 ( -6.202 2.287 11.470) 13.238 3.239 ( 3.645 -3.500 0.135) 5.055 3.706 ( 2.659 10.928 -1.563) 11.355 3.828 ( -2.278 6.541 2.876) 7.500 3.949 ( 1.952 12.367 6.457) 14.087 3.969 ( 0.296 4.039 3.891) 5.617 4.247 ( -0.468 -4.581 2.644) 5.310 4.285 ( -0.329 3.937 1.344) 4.173 4.357 ( 3.584 -8.633 -2.451) 9.663 4.488 ( -0.301 0.902 -8.026) 8.082 4.708 ( -0.601 -3.921 0.063) 3.967 4.933 ( -1.296 -2.523 2.597) 3.845 5.123 ( 5.628 -7.167 -7.222) 11.628 5.219 ( 3.278 -0.459 -9.120) 9.702 5.385 ( -2.060 9.160 0.167) 9.390 5.435 ( 0.603 -4.735 -5.685) 7.423 5.694 ( -3.341 -0.893 -2.652) 4.358 5.889 ( -2.944 0.215 3.856) 4.856 5.963 ( 1.719 -7.361 7.445) 10.610 6.186 ( -0.315 -2.162 1.140) 2.464 6.508 ( -2.146 2.436 0.486) 3.283 7.003 ( 5.564 -10.560 1.858) 12.079 7.428 ( -8.907 14.426 -1.687) 17.038 7.895 ( -1.325 4.434 3.251) 5.656 8.132 ( 7.752 -4.202 3.233) 9.392 8.460 ( -5.211 -1.114 -3.418) 6.331 8.505 ( -0.380 8.612 -1.858) 8.818 8.674 ( -8.747 4.516 -0.049) 9.844 8.825 ( -7.951 -0.044 1.069) 8.023 8.895 ( 1.109 -10.592 -2.299) 10.896 9.183 ( 3.771 -0.834 -9.276) 10.048 9.424 ( 2.780 -6.742 -1.943) 7.547 9.586 ( 1.181 -6.553 6.232) 9.120 10.156 ( 1.344 3.786 0.857) 4.108 10.189 ( 10.388 1.001 -1.660) 10.568 10.288 ( -0.705 -3.353 -2.979) 4.540 10.633 ( -0.787 -4.700 -5.188) 7.044 10.983 ( -0.457 -5.673 15.787) 16.781 11.234 ( 2.726 2.533 -10.425) 11.069 11.494 ( -4.631 5.799 7.720) 10.708 11.869 ( -5.175 8.986 -0.105) 10.370 11.981 ( 7.893 4.072 -1.479) 9.004 12.272 ( -7.244 0.237 -5.897) 9.344 12.390 ( 0.041 4.046 4.624) 6.144 12.945 ( 1.790 -11.816 1.764) 12.080 13.312 ( -6.925 -11.994 0.755) 13.871 13.447 ( -0.567 -1.493 -3.856) 4.173 13.711 ( -0.941 -0.498 3.373) 3.537 13.814 ( 1.932 2.430 -2.884) 4.237 14.157 ( -0.605 2.043 -1.987) 2.913 14.247 ( -2.157 -6.271 3.813) 7.650 14.705 ( 5.128 1.865 -4.847) 7.299 15.737 ( -4.842 -8.258 1.065) 9.632 16.148 ( -2.365 -3.145 2.000) 4.414 16.580 ( -2.308 0.268 3.414) 4.129 16.617 ( 1.318 1.002 -5.427) 5.674 17.598 ( 0.334 5.139 5.861) 7.802 17.798 ( 5.984 0.933 5.246) 8.013 18.270 ( 13.669 -1.385 -4.247) 14.380 19.007 ( -12.840 16.331 -4.913) 21.347 19.229 ( 8.481 12.453 6.907) 16.575 19.570 ( -1.036 5.330 -7.886) 9.574 20.025 ( 0.410 15.167 0.927) 15.201 20.635 ( 9.491 -5.221 8.013) 13.474 21.118 ( -5.739 -9.656 0.863) 11.266 21.335 ( -3.702 -8.715 10.317) 14.004 21.506 ( 4.709 -2.962 -2.468) 6.086 21.891 ( -5.464 1.898 -5.481) 7.969 22.572 ( -3.945 -14.144 -5.666) 15.740 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.884 ( 0.048 -2.990 0.375) 3.013 2.370 ( 12.278 6.925 -7.320) 15.883 2.440 ( -3.395 -3.605 -4.874) 6.948 2.766 ( 2.002 9.818 1.784) 10.178 2.907 ( -1.928 -0.633 -4.794) 5.206 3.049 ( -7.163 4.023 14.110) 16.327 3.219 ( 5.619 -0.082 -1.584) 5.839 3.301 ( 3.321 -1.621 5.574) 6.687 3.668 ( -9.309 -3.429 1.765) 10.077 3.909 ( 1.406 6.137 -5.177) 8.151 3.980 ( 2.567 0.910 2.600) 3.765 4.079 ( -1.457 6.450 2.550) 7.087 4.196 ( -1.461 -1.886 -2.275) 3.297 4.293 ( 2.063 -4.566 -0.522) 5.038 4.415 ( 0.403 5.064 6.642) 8.362 4.533 ( 2.163 -0.416 -2.489) 3.324 4.694 ( 3.917 1.042 1.136) 4.210 4.899 ( -2.573 -1.875 5.266) 6.154 5.126 ( 4.309 -3.765 -5.978) 8.275 5.218 ( 5.891 -6.711 -5.933) 10.721 5.332 ( -7.966 -1.957 -7.169) 10.894 5.429 ( 2.269 1.027 -4.673) 5.295 5.588 ( -4.764 5.462 1.424) 7.386 5.889 ( -4.697 -0.551 7.097) 8.528 6.004 ( 6.831 -2.650 5.278) 9.030 6.188 ( 2.428 0.213 -3.560) 4.315 6.465 ( -5.291 1.135 1.335) 5.573 7.048 ( 7.543 -4.535 1.414) 8.914 7.326 ( -11.362 4.422 -0.859) 12.223 8.003 ( 2.793 8.538 4.399) 10.002 8.163 ( 1.070 -4.645 -4.517) 6.567 8.331 ( -4.629 -2.057 -0.677) 5.111 8.540 ( -4.164 6.139 -2.802) 7.929 8.627 ( -2.243 2.743 0.550) 3.585 8.698 ( -2.091 -5.242 2.162) 6.044 8.859 ( 0.288 -0.335 5.634) 5.651 9.280 ( 6.580 0.838 -9.607) 11.675 9.361 ( 2.788 -4.103 -3.870) 6.292 9.629 ( 5.369 -4.701 10.685) 12.849 10.073 ( -6.533 -2.277 -3.054) 7.563 10.233 ( -2.379 2.273 -1.320) 3.545 10.429 ( 11.327 -1.239 -6.276) 13.008 10.545 ( -3.846 -0.015 -1.661) 4.189 10.978 ( -1.311 -5.548 12.797) 14.009 11.288 ( 3.377 4.711 -9.043) 10.741 11.527 ( -2.667 7.176 9.562) 12.249 11.798 ( -2.817 -2.786 -2.919) 4.921 12.073 ( -4.299 -5.717 -2.503) 7.579 12.262 ( 9.075 12.765 -0.700) 15.678 12.511 ( 1.955 7.004 2.017) 7.546 12.917 ( 0.369 -1.331 1.011) 1.712 13.019 ( -4.910 -14.690 0.747) 15.507 13.364 ( -8.848 -4.377 -0.571) 9.888 13.695 ( 0.029 0.167 3.377) 3.381 13.818 ( -0.534 1.787 -5.035) 5.369 14.137 ( -2.736 -6.336 -0.615) 6.929 14.239 ( 3.492 4.231 1.697) 5.742 14.841 ( 8.033 3.034 -1.677) 8.749 15.554 ( -6.430 -6.240 -0.316) 8.966 16.112 ( -3.845 1.749 2.907) 5.128 16.463 ( -4.375 -8.079 -2.308) 9.473 16.667 ( 2.970 7.561 -1.372) 8.238 17.764 ( -6.948 5.966 -9.919) 13.501 17.825 ( 10.899 -4.682 19.122) 22.502 18.588 ( 20.670 2.190 -0.733) 20.799 18.894 ( -11.679 11.102 -8.238) 18.097 19.322 ( -3.553 -6.985 1.323) 7.947 19.711 ( 10.011 10.965 0.074) 14.847 20.125 ( -1.794 1.073 0.122) 2.094 20.723 ( 2.765 1.133 -3.628) 4.700 20.957 ( -4.371 -5.155 5.903) 8.974 21.180 ( -8.286 -2.628 5.644) 10.365 21.646 ( 10.410 -3.486 5.078) 12.096 21.780 ( -5.437 3.527 -8.347) 10.567 22.350 ( -5.231 -8.311 -2.950) 10.254 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.921 ( 6.343 -1.603 1.085) 6.632 2.320 ( -0.686 -5.756 -3.929) 7.003 2.495 ( -1.163 -2.184 2.997) 3.886 2.801 ( 2.406 -5.805 -1.326) 6.422 2.914 ( -8.119 12.831 -0.835) 15.207 3.043 ( -2.287 4.156 5.281) 7.098 3.238 ( 2.363 -3.570 -4.834) 6.458 3.440 ( -1.508 3.608 1.508) 4.192 3.483 ( 0.920 -2.570 0.753) 2.831 3.904 ( 1.696 -0.719 0.522) 1.915 4.060 ( -2.082 2.348 2.660) 4.114 4.104 ( -4.237 0.053 -6.683) 7.913 4.167 ( 8.265 0.512 0.821) 8.321 4.336 ( -8.591 1.674 2.944) 9.235 4.373 ( 0.667 3.402 -2.503) 4.275 4.590 ( 5.246 2.272 2.468) 6.227 4.663 ( -7.212 -8.088 -0.422) 10.844 4.938 ( 7.130 -0.153 1.801) 7.356 5.048 ( -12.406 -2.032 -0.936) 12.606 5.194 ( 7.064 -3.863 -2.466) 8.421 5.309 ( 9.446 -4.708 -0.423) 10.563 5.480 ( 3.361 -0.687 2.333) 4.148 5.617 ( -1.309 8.116 -2.129) 8.492 5.789 ( -7.800 0.255 1.702) 7.988 6.122 ( 4.713 0.901 1.682) 5.085 6.237 ( 4.454 -0.606 -3.563) 5.736 6.362 ( -7.591 0.914 1.524) 7.796 7.148 ( -8.630 1.679 -0.022) 8.792 7.185 ( 7.442 -1.357 0.053) 7.565 8.075 ( -8.322 4.151 -1.552) 9.428 8.172 ( 6.423 4.111 4.322) 8.766 8.248 ( 4.233 -12.402 -3.342) 13.523 8.492 ( -4.150 2.267 0.900) 4.814 8.639 ( 1.778 -2.153 0.699) 2.879 8.694 ( 1.707 7.741 -1.692) 8.106 8.894 ( -2.367 2.518 -0.110) 3.458 9.226 ( 0.650 -5.542 4.575) 7.215 9.520 ( 7.367 7.184 -8.472) 13.329 9.711 ( 4.791 -7.002 4.788) 9.742 9.944 ( -5.669 4.265 0.466) 7.110 10.194 ( -0.721 -2.010 -0.094) 2.137 10.461 ( -4.275 -3.861 -0.219) 5.765 10.538 ( 5.148 -1.475 -1.849) 5.665 10.919 ( -3.922 -3.270 3.110) 5.979 11.347 ( -0.740 6.980 -5.392) 8.852 11.613 ( 0.589 3.061 10.839) 11.278 11.722 ( -1.506 -1.893 -7.358) 7.745 12.005 ( 3.876 -2.317 0.177) 4.519 12.471 ( -2.882 -7.885 -0.253) 8.399 12.490 ( -1.627 8.202 0.593) 8.383 12.931 ( -1.314 4.504 -0.242) 4.698 12.979 ( 1.495 0.053 0.026) 1.496 13.183 ( 3.826 -0.142 -0.103) 3.830 13.760 ( 4.476 -0.119 4.382) 6.266 13.803 ( -1.877 2.297 -4.210) 5.150 14.012 ( -3.619 -6.058 -0.387) 7.067 14.321 ( 0.783 2.129 0.304) 2.288 15.018 ( 7.316 5.838 -0.038) 9.360 15.404 ( -3.494 -6.004 0.267) 6.952 16.043 ( -6.160 -0.476 2.776) 6.773 16.307 ( -1.011 -8.995 -6.013) 10.866 16.859 ( 4.929 13.344 4.723) 14.989 17.557 ( -9.211 -5.934 -1.767) 11.099 18.046 ( 6.829 1.104 -0.635) 6.947 18.684 ( -13.238 2.571 1.566) 13.576 19.002 ( 16.432 -1.557 -0.892) 16.529 19.196 ( -0.929 -0.118 0.007) 0.936 19.952 ( 2.173 -14.627 0.395) 14.793 19.971 ( -4.721 9.885 -0.251) 10.958 20.723 ( -6.093 5.987 -3.237) 9.135 20.912 ( 0.856 -4.872 7.809) 9.244 21.092 ( -0.109 -0.447 -5.403) 5.423 21.633 ( -8.598 6.727 1.276) 10.991 21.861 ( 9.791 -4.557 -0.580) 10.815 22.257 ( 2.412 -0.135 0.048) 2.417 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.029 ( 0.847 2.324 -2.958) 3.856 2.245 ( 5.789 -13.800 -0.293) 14.968 2.410 ( -9.570 3.867 11.731) 15.625 2.741 ( -6.901 1.508 -1.053) 7.142 2.887 ( -4.494 4.640 -1.976) 6.755 2.980 ( -1.394 -4.752 -0.352) 4.964 3.247 ( -0.268 -3.966 -1.431) 4.225 3.405 ( 1.316 8.860 -3.702) 9.692 3.554 ( 1.377 -0.615 -1.253) 1.961 3.905 ( -11.735 -3.632 -5.558) 13.483 3.988 ( -2.484 3.414 -1.189) 4.387 4.103 ( 3.392 3.107 3.075) 5.533 4.168 ( -4.461 -1.335 0.579) 4.692 4.254 ( -8.487 0.925 0.418) 8.547 4.381 ( 6.216 1.659 2.777) 7.007 4.583 ( 1.928 3.822 -2.042) 4.743 4.752 ( 5.965 3.670 4.355) 8.247 4.832 ( -8.383 -2.810 -0.798) 8.878 5.017 ( 4.947 -8.383 2.951) 10.172 5.264 ( 10.022 -10.146 -2.016) 14.403 5.418 ( 1.609 -0.125 3.665) 4.005 5.556 ( 7.012 -2.364 2.860) 7.933 5.659 ( 0.943 0.244 -7.148) 7.214 5.687 ( -6.110 9.311 1.531) 11.241 6.153 ( -5.182 1.563 -2.006) 5.772 6.213 ( -2.374 -0.903 1.134) 2.782 6.349 ( 4.624 0.490 -1.437) 4.867 6.989 ( -1.939 -9.774 -1.367) 10.057 7.340 ( 2.208 10.089 0.282) 10.332 7.935 ( -11.807 4.531 1.505) 12.736 8.223 ( 6.974 -9.037 -4.217) 12.169 8.320 ( 6.906 -3.903 2.865) 8.434 8.447 ( -4.521 2.463 -2.559) 5.749 8.668 ( 2.801 0.094 -0.797) 2.914 8.858 ( 5.848 10.693 0.137) 12.189 8.874 ( 2.163 4.437 -4.622) 6.763 9.261 ( 1.632 -2.016 11.670) 11.955 9.573 ( -3.310 0.440 -2.595) 4.229 9.719 ( 2.305 3.817 -12.012) 12.813 10.009 ( 6.317 -1.771 9.546) 11.583 10.124 ( -8.011 -2.706 1.753) 8.636 10.338 ( 1.655 -10.934 3.973) 11.750 10.608 ( 3.740 0.210 1.789) 4.151 10.810 ( -4.651 -1.262 -3.381) 5.887 11.383 ( -0.952 7.646 -2.100) 7.986 11.524 ( -6.395 -6.508 -6.896) 11.437 11.770 ( 1.949 6.255 7.337) 9.837 12.147 ( 10.033 1.070 -2.225) 10.332 12.312 ( -11.799 -1.672 -0.896) 11.951 12.376 ( -9.522 -0.009 1.544) 9.647 12.861 ( 4.909 -5.138 -2.480) 7.526 13.190 ( 12.011 2.741 -1.038) 12.364 13.434 ( 11.139 11.155 0.344) 15.768 13.749 ( -4.582 1.469 -2.886) 5.611 13.860 ( 2.048 -0.357 8.544) 8.793 13.916 ( 1.624 -3.380 -3.925) 5.428 14.313 ( -2.828 0.587 0.334) 2.907 15.190 ( 0.550 12.093 -8.000) 14.510 15.331 ( 5.401 -10.203 9.022) 14.651 15.910 ( -4.315 -11.125 5.311) 13.061 16.204 ( -0.269 -1.469 -9.300) 9.419 17.111 ( 3.340 16.231 4.541) 17.182 17.376 ( -3.766 -6.368 3.274) 8.091 18.011 ( -3.962 -5.835 -14.033) 15.706 18.476 ( -8.714 -7.650 7.158) 13.627 19.027 ( -6.789 3.154 3.707) 8.353 19.394 ( 5.599 6.731 -0.208) 8.758 19.682 ( -6.696 -5.050 -2.573) 8.772 20.060 ( -2.355 3.035 3.584) 5.254 20.621 ( -10.370 3.084 4.139) 11.584 20.901 ( 2.542 -8.361 2.395) 9.061 21.095 ( 6.551 -1.319 -12.824) 14.460 21.619 ( 0.746 0.991 2.463) 2.758 21.933 ( -0.467 5.584 2.771) 6.251 22.423 ( 13.997 -0.120 -0.313) 14.001 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.841 ( -17.093 -0.420 -0.484) 17.105 2.234 ( -12.366 6.730 -3.074) 14.410 2.389 ( 7.492 -8.033 3.088) 11.410 2.666 ( -2.355 5.360 0.870) 5.919 2.839 ( -2.305 2.655 3.447) 4.924 2.957 ( 0.402 -2.485 -2.132) 3.299 3.177 ( -2.578 -4.615 5.918) 7.935 3.497 ( -8.368 7.508 -3.424) 11.752 3.541 ( -1.645 4.203 -3.445) 5.678 3.624 ( -8.064 2.382 -2.932) 8.905 3.865 ( -6.616 -1.330 -2.863) 7.330 4.010 ( -10.977 3.318 5.647) 12.782 4.206 ( 3.458 -1.940 -0.682) 4.023 4.356 ( 8.933 5.702 5.335) 11.865 4.523 ( 4.450 -1.199 1.360) 4.805 4.630 ( -0.774 -0.331 2.792) 2.916 4.690 ( -2.583 1.949 -5.309) 6.218 4.821 ( -1.945 -3.900 1.054) 4.484 5.037 ( 7.355 -5.247 -0.856) 9.075 5.349 ( 13.413 -11.315 -2.801) 17.770 5.379 ( -5.432 0.445 3.452) 6.451 5.610 ( 1.229 1.045 -9.379) 9.517 5.657 ( -2.532 2.846 -3.466) 5.150 5.789 ( 8.506 0.780 8.094) 11.767 6.050 ( -5.089 1.131 4.140) 6.657 6.170 ( -4.164 1.709 -3.150) 5.494 6.425 ( 4.543 -1.563 -1.200) 4.952 6.894 ( 3.873 -10.149 -2.404) 11.126 7.422 ( -5.085 9.845 -0.682) 11.102 7.838 ( -4.040 4.936 3.900) 7.476 8.137 ( -2.827 -12.050 -7.085) 14.261 8.400 ( 2.690 2.626 3.198) 4.935 8.443 ( 4.579 -0.019 0.128) 4.581 8.721 ( 1.383 5.290 -3.754) 6.632 9.019 ( 7.375 2.651 3.641) 8.642 9.094 ( 6.764 11.460 -0.324) 13.311 9.305 ( 0.177 -0.126 1.554) 1.569 9.465 ( -3.547 -3.722 -4.614) 6.908 9.750 ( 2.774 1.214 -7.281) 7.885 9.901 ( -10.581 -5.795 4.361) 12.828 10.092 ( 0.052 -3.625 6.157) 7.145 10.347 ( 8.493 -9.117 -1.983) 12.617 10.685 ( 4.601 -0.641 3.255) 5.672 10.789 ( 2.590 2.360 6.721) 7.580 11.275 ( -5.034 -5.633 -11.605) 13.848 11.522 ( 2.451 8.886 3.418) 9.831 11.856 ( -1.700 2.969 -1.074) 3.586 11.989 ( -14.732 -3.083 5.048) 15.875 12.210 ( -3.421 2.032 -5.776) 7.014 12.422 ( 2.722 8.872 2.070) 9.509 12.916 ( 10.488 -9.490 -3.757) 14.635 13.388 ( 9.353 -1.599 -0.948) 9.536 13.646 ( -2.424 1.273 1.013) 2.920 13.693 ( 3.815 3.208 -3.373) 6.019 13.874 ( -0.633 0.074 10.235) 10.255 14.008 ( 6.622 2.967 -3.894) 8.235 14.261 ( -1.620 -2.231 0.779) 2.865 15.176 ( -4.265 8.834 -14.287) 17.330 15.481 ( 9.768 -8.502 17.099) 21.449 15.760 ( 1.359 -8.326 -0.752) 8.469 16.208 ( 4.514 0.524 -5.655) 7.254 17.234 ( -14.298 0.336 15.908) 21.392 17.335 ( 7.658 5.946 -13.878) 16.929 17.838 ( 1.455 -5.277 -3.778) 6.651 18.247 ( -8.991 -11.039 0.858) 14.263 18.895 ( -17.849 7.209 8.120) 20.893 19.353 ( -9.003 8.433 -4.749) 13.218 19.707 ( 1.394 5.658 -5.021) 7.692 19.982 ( -12.390 6.962 2.323) 14.401 20.478 ( -9.959 -2.943 15.497) 18.655 20.907 ( 9.455 -7.767 -4.484) 13.032 21.196 ( 10.725 -2.716 -5.005) 12.143 21.640 ( 5.113 -8.214 -2.623) 10.024 22.012 ( -2.198 10.632 4.342) 11.693 22.674 ( 16.237 -3.708 -2.056) 16.781 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.701 ( -16.024 11.644 -8.653) 21.616 2.098 ( -1.544 2.311 1.862) 3.346 2.428 ( -6.069 7.581 1.230) 9.789 2.672 ( -3.522 -6.054 0.032) 7.004 2.890 ( 11.609 4.953 -2.501) 12.867 3.082 ( -4.364 0.918 -0.344) 4.473 3.258 ( 2.948 4.675 8.180) 9.872 3.488 ( -5.456 -4.574 4.272) 8.303 3.570 ( -1.121 0.549 -0.748) 1.455 3.729 ( -3.481 8.237 0.687) 8.969 3.821 ( 1.900 4.717 0.971) 5.177 4.067 ( -15.819 11.633 10.356) 22.199 4.204 ( 8.840 -4.036 -0.423) 9.727 4.286 ( -12.433 -2.080 2.737) 12.899 4.562 ( 1.244 -6.878 -0.737) 7.028 4.620 ( 3.301 -2.318 -4.131) 5.773 4.680 ( 2.674 -2.994 2.213) 4.584 4.773 ( 0.978 8.883 -5.663) 10.580 4.971 ( 1.038 -3.356 -4.444) 5.665 5.174 ( 5.699 -5.869 -2.816) 8.652 5.433 ( 4.033 -1.903 -5.663) 7.208 5.513 ( -2.023 5.362 -9.226) 10.861 5.624 ( -0.925 -1.892 1.448) 2.556 5.985 ( 7.185 -4.706 8.566) 12.130 6.077 ( -6.379 0.757 1.391) 6.573 6.210 ( 2.215 3.794 3.806) 5.813 6.376 ( 2.303 -3.197 -1.602) 4.253 6.881 ( 9.831 3.042 -0.128) 10.292 7.419 ( -8.425 -1.266 -0.700) 8.548 7.818 ( -6.159 0.318 1.577) 6.366 8.110 ( 1.195 7.314 3.726) 8.295 8.397 ( 7.823 -6.468 -2.806) 10.531 8.628 ( -0.554 3.460 3.685) 5.085 8.793 ( 3.149 -11.614 0.319) 12.038 8.829 ( -0.147 -7.326 -6.029) 9.488 9.245 ( -2.040 6.098 -9.106) 11.148 9.348 ( -2.348 -0.974 2.843) 3.813 9.491 ( 0.732 -1.256 0.189) 1.466 9.589 ( -0.688 -3.945 3.671) 5.432 9.951 ( 6.500 7.268 -2.846) 10.157 9.958 ( -4.904 0.336 2.514) 5.521 10.253 ( -0.609 2.927 -3.936) 4.943 10.607 ( 3.669 -9.353 -1.351) 10.137 11.041 ( 5.045 -1.834 -7.178) 8.964 11.235 ( 5.359 5.106 13.166) 15.104 11.694 ( -0.940 -7.425 -2.135) 7.782 11.761 ( -8.055 5.026 6.381) 11.440 11.927 ( -4.409 9.883 -2.254) 11.054 12.200 ( -6.060 2.709 -3.074) 7.315 12.563 ( -0.969 -3.690 2.159) 4.384 12.861 ( 13.289 -3.691 -0.577) 13.804 13.323 ( 7.073 -9.718 0.379) 12.025 13.648 ( -2.801 3.888 -2.047) 5.211 13.667 ( -1.850 1.492 0.020) 2.376 13.899 ( -4.013 -10.853 2.296) 11.797 14.072 ( 4.079 -3.763 -5.671) 7.935 14.208 ( 0.370 2.286 6.672) 7.062 15.159 ( -2.623 3.915 -4.274) 6.362 15.538 ( 4.802 -11.706 0.290) 12.656 15.829 ( 10.863 6.273 -6.754) 14.247 16.205 ( 3.678 -3.143 4.483) 6.595 16.908 ( -12.550 0.284 11.397) 16.955 17.653 ( 7.950 9.013 5.929) 13.401 17.703 ( -4.046 -2.524 -20.673) 21.216 18.178 ( 0.140 7.655 12.375) 14.552 19.086 ( -6.808 18.860 0.045) 20.051 19.310 ( -12.544 0.227 -2.432) 12.780 19.730 ( -1.761 -5.464 -7.517) 9.458 20.025 ( -12.684 4.535 1.659) 13.572 20.461 ( -7.107 8.556 16.910) 20.240 20.891 ( 12.085 -1.647 -6.192) 13.678 21.200 ( 9.549 -9.344 -3.352) 13.774 21.513 ( 4.493 -1.360 5.667) 7.359 22.125 ( -6.484 -1.595 -0.355) 6.687 22.622 ( 10.724 -12.079 -5.522) 17.070 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.552 ( -10.175 15.437 -9.489) 20.782 2.186 ( 0.727 11.019 4.265) 11.839 2.442 ( -0.396 8.594 -1.634) 8.757 2.538 ( -4.334 -5.895 0.059) 7.317 2.984 ( -5.211 0.019 4.317) 6.767 3.104 ( 2.848 1.203 3.796) 4.896 3.391 ( -0.004 3.356 3.996) 5.219 3.393 ( 3.428 -1.015 -0.317) 3.589 3.552 ( -0.990 -1.178 -0.772) 1.722 3.727 ( -4.992 8.792 -2.711) 10.468 3.912 ( -1.370 5.358 5.117) 7.534 4.006 ( -7.440 10.805 6.992) 14.866 4.052 ( -9.375 4.972 3.298) 11.112 4.394 ( 5.452 -2.659 1.438) 6.234 4.492 ( 2.056 -1.618 -1.696) 3.117 4.611 ( 0.232 -8.033 -0.891) 8.085 4.725 ( 5.666 -1.834 -1.874) 6.243 4.833 ( 3.086 -2.406 2.531) 4.660 4.896 ( -3.983 1.021 -7.460) 8.518 5.175 ( 0.290 -1.442 -3.066) 3.400 5.416 ( 2.423 -1.191 -12.541) 12.829 5.533 ( 0.315 1.700 -9.271) 9.431 5.614 ( 0.975 -2.196 6.938) 7.342 5.978 ( -5.004 0.776 1.289) 5.225 6.075 ( 4.648 -6.507 8.842) 11.922 6.244 ( -1.277 -2.736 -0.488) 3.059 6.422 ( 4.068 2.691 0.787) 4.940 7.127 ( 11.343 7.596 0.543) 13.662 7.224 ( -8.837 -6.246 0.074) 10.822 7.769 ( -2.353 3.874 2.679) 5.265 8.162 ( -3.055 4.394 -1.745) 5.629 8.379 ( 0.910 -6.023 -1.827) 6.360 8.684 ( 1.857 -2.165 -9.202) 9.634 8.781 ( 7.842 -6.730 4.838) 11.410 8.837 ( 6.770 1.938 2.536) 7.485 9.175 ( -0.117 -11.074 -3.092) 11.498 9.257 ( -9.168 -0.469 7.360) 11.766 9.461 ( -5.201 -3.705 -11.896) 13.501 9.548 ( 4.015 1.231 -1.962) 4.635 9.964 ( -1.902 3.762 5.746) 7.126 10.047 ( -0.963 3.406 3.277) 4.824 10.283 ( 0.485 5.547 -3.170) 6.407 10.586 ( 6.058 -8.874 -2.316) 10.991 11.068 ( 1.374 -3.673 -2.306) 4.550 11.320 ( -2.438 -0.378 4.187) 4.860 11.606 ( -1.120 -0.384 -3.766) 3.948 11.709 ( -6.128 4.227 8.546) 11.334 12.035 ( 4.045 13.825 -3.396) 14.800 12.140 ( -0.968 -0.060 -1.532) 1.813 12.493 ( -4.122 -3.118 5.542) 7.578 13.023 ( 8.970 -5.654 -2.496) 10.893 13.344 ( 5.991 -12.463 -0.243) 13.831 13.591 ( -4.981 2.086 -5.616) 7.792 13.700 ( 0.849 3.625 3.193) 4.905 13.742 ( 1.608 -10.787 0.884) 10.942 14.082 ( 3.998 -3.765 -4.515) 7.109 14.246 ( -0.510 0.338 6.468) 6.496 15.058 ( -9.154 0.876 -16.238) 18.661 15.526 ( 8.512 -12.433 11.701) 19.077 16.054 ( 7.411 2.859 4.611) 9.184 16.283 ( 7.854 -0.083 -4.061) 8.842 16.779 ( -10.506 1.429 12.314) 16.250 17.608 ( 0.802 8.768 -25.335) 26.821 17.809 ( -2.418 1.092 12.754) 13.027 18.294 ( -2.104 13.585 9.816) 16.892 19.033 ( -14.482 -3.081 -2.196) 14.969 19.294 ( 1.973 22.674 0.503) 22.766 19.597 ( 3.723 -11.026 -6.951) 13.556 19.838 ( -15.124 10.376 -0.793) 18.358 20.541 ( -6.738 12.821 18.021) 23.120 21.029 ( 7.490 -4.618 -1.293) 8.893 21.285 ( 13.404 -8.658 -6.680) 17.299 21.563 ( -1.578 -1.246 6.302) 6.615 21.993 ( -2.308 -5.638 -2.037) 6.424 22.625 ( 8.294 -15.190 -6.077) 18.343 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.610 ( 1.657 16.871 -6.191) 18.048 2.253 ( -5.890 0.152 -0.599) 5.922 2.486 ( 0.636 10.154 2.386) 10.450 2.565 ( 4.389 5.678 -2.708) 7.670 2.928 ( -2.004 -2.207 10.639) 11.049 3.069 ( -2.636 -6.102 5.100) 8.377 3.344 ( -5.396 -2.191 -2.453) 6.320 3.476 ( -1.851 -0.862 1.992) 2.853 3.580 ( 4.167 9.883 -1.791) 10.874 3.759 ( 1.972 8.055 -7.855) 11.423 3.922 ( -0.304 2.156 2.330) 3.189 4.071 ( -3.759 14.452 8.192) 17.032 4.103 ( -1.157 10.173 8.358) 13.217 4.309 ( -0.793 -11.613 -0.078) 11.641 4.466 ( -5.685 -2.679 -2.654) 6.822 4.625 ( 4.419 -1.075 1.043) 4.666 4.715 ( -7.499 0.979 -1.189) 7.655 4.819 ( 7.270 -5.521 -6.215) 11.043 4.924 ( 5.428 -4.257 1.792) 7.127 5.149 ( -0.063 0.123 -5.070) 5.072 5.398 ( 1.459 -1.683 -4.018) 4.594 5.481 ( -1.949 1.720 -9.009) 9.377 5.654 ( 1.656 -0.298 3.457) 3.845 5.928 ( -1.602 -2.086 2.196) 3.427 6.082 ( -2.072 -3.837 6.147) 7.536 6.172 ( 0.472 -4.964 -2.866) 5.751 6.516 ( 1.995 2.972 1.172) 3.766 7.001 ( -5.634 -10.108 0.455) 11.581 7.430 ( 9.003 14.606 -0.576) 17.168 7.842 ( 3.858 4.136 4.248) 7.073 8.097 ( -6.703 3.089 -1.665) 7.566 8.355 ( 3.177 -3.651 -1.456) 5.054 8.684 ( 2.862 0.073 -4.606) 5.423 8.839 ( -3.339 0.648 2.403) 4.165 8.925 ( 1.028 -6.529 1.644) 6.811 9.057 ( -3.495 -7.152 5.448) 9.646 9.150 ( 2.303 -4.297 -2.615) 5.532 9.294 ( 0.643 -6.507 -12.663) 14.252 9.596 ( 1.031 0.275 -4.442) 4.569 9.918 ( -7.242 4.889 5.151) 10.143 10.129 ( 2.947 2.926 2.756) 4.984 10.304 ( 0.380 -1.672 2.101) 2.712 10.604 ( 2.860 -3.796 -1.907) 5.121 11.008 ( -1.995 -2.354 0.906) 3.216 11.244 ( -3.186 -2.605 -1.965) 4.561 11.638 ( -1.474 7.648 -0.302) 7.795 11.728 ( 2.715 3.570 4.836) 6.596 12.126 ( -2.560 2.569 0.077) 3.628 12.253 ( 4.998 12.584 -3.442) 13.971 12.419 ( -1.627 -5.872 3.950) 7.261 12.965 ( -1.152 -15.679 -1.108) 15.760 13.309 ( 3.973 -6.690 -2.437) 8.154 13.517 ( -1.627 -1.474 -4.267) 4.798 13.693 ( 1.506 -1.811 -0.902) 2.522 13.807 ( 1.463 2.461 4.516) 5.347 14.102 ( 3.707 -2.803 -2.647) 5.348 14.259 ( 0.180 -1.199 4.106) 4.281 14.797 ( -9.972 -1.738 -11.489) 15.312 15.641 ( 8.777 -6.450 6.811) 12.846 16.192 ( 3.358 0.027 10.291) 10.825 16.369 ( 3.768 -6.254 0.426) 7.314 16.712 ( -1.557 5.869 -0.760) 6.120 17.592 ( -3.844 8.738 -13.521) 16.552 17.819 ( -0.682 2.999 -0.405) 3.102 18.294 ( -14.200 0.028 11.505) 18.276 18.939 ( 4.938 8.058 5.309) 10.840 19.435 ( -7.057 13.656 -4.423) 15.995 19.583 ( 1.250 -0.663 -6.339) 6.495 19.852 ( 5.916 10.634 1.606) 12.274 20.589 ( -8.802 10.217 13.621) 19.167 21.052 ( 4.632 -11.084 2.901) 12.358 21.397 ( 8.542 -3.905 -12.862) 15.926 21.484 ( -5.395 -3.800 9.146) 11.278 21.942 ( 1.532 -2.835 -1.279) 3.467 22.561 ( 4.523 -14.406 -5.593) 16.102 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.865 ( 10.760 13.596 -4.343) 17.874 2.061 ( -8.916 -7.273 0.613) 11.523 2.613 ( 0.169 0.751 -3.649) 3.729 2.679 ( 1.160 14.864 1.658) 15.001 2.950 ( -0.479 -3.928 3.504) 5.286 3.037 ( 4.703 -2.424 8.200) 9.759 3.166 ( -5.161 -5.121 -7.623) 10.534 3.438 ( -6.060 2.678 9.739) 11.779 3.759 ( 3.452 11.368 -2.534) 12.148 3.833 ( 4.106 0.396 -7.640) 8.682 3.953 ( -2.427 1.612 4.027) 4.971 4.192 ( -0.277 -3.404 3.067) 4.591 4.197 ( 4.156 4.626 1.412) 6.378 4.208 ( -2.312 0.697 5.196) 5.730 4.371 ( -1.156 2.136 -2.318) 3.357 4.545 ( -8.031 4.314 0.991) 9.170 4.699 ( -0.133 -0.102 2.978) 2.983 4.851 ( 6.953 -8.033 -6.175) 12.289 4.957 ( 2.151 -0.375 -0.852) 2.344 5.101 ( 0.775 -7.276 -6.592) 9.849 5.404 ( -0.172 0.740 -2.951) 3.047 5.476 ( -0.055 4.386 0.328) 4.399 5.697 ( 1.830 1.488 -1.409) 2.748 5.852 ( -1.727 -7.055 1.529) 7.423 6.032 ( -3.654 1.876 5.898) 7.188 6.142 ( 1.631 -4.110 -2.330) 4.999 6.558 ( -0.333 1.732 0.728) 1.908 6.864 ( 0.120 -6.443 0.474) 6.462 7.665 ( -0.567 12.716 -2.705) 13.013 7.960 ( 3.421 -0.658 3.250) 4.764 8.034 ( -1.865 2.932 3.013) 4.599 8.407 ( 3.882 -0.217 -0.768) 3.963 8.674 ( -6.261 3.427 3.923) 8.145 8.759 ( 1.358 -6.302 -1.063) 6.534 8.839 ( -3.765 -1.833 -4.317) 6.014 8.930 ( -3.747 -1.912 1.173) 4.367 9.138 ( -2.065 0.496 -8.256) 8.524 9.272 ( 5.377 -7.001 -1.187) 8.906 9.567 ( -1.934 -0.695 1.184) 2.371 9.939 ( 6.304 -0.439 -0.095) 6.320 10.167 ( 0.409 -2.136 -1.053) 2.417 10.329 ( -0.074 3.583 3.861) 5.268 10.579 ( 0.064 -3.113 -1.875) 3.635 10.989 ( 0.046 -1.818 4.805) 5.138 11.182 ( 0.030 -0.211 -4.717) 4.722 11.665 ( -3.135 5.583 4.368) 7.752 11.892 ( 6.125 3.429 -0.265) 7.025 12.088 ( -6.805 8.992 1.202) 11.340 12.323 ( -0.815 -10.926 0.042) 10.956 12.398 ( 1.029 8.922 -4.209) 9.919 12.800 ( 0.626 -12.071 2.204) 12.286 13.302 ( 0.142 -4.606 -0.721) 4.664 13.448 ( -1.912 -1.147 -1.984) 2.985 13.715 ( 0.877 1.409 -1.059) 1.968 13.835 ( -0.963 1.352 2.740) 3.203 14.120 ( 1.827 -2.138 -2.385) 3.688 14.260 ( -0.581 -0.976 2.452) 2.702 14.652 ( -1.077 -0.074 -3.928) 4.074 15.716 ( 1.843 -3.562 2.851) 4.921 16.166 ( -2.774 -2.004 -1.341) 3.675 16.431 ( 5.129 -3.049 4.184) 7.288 16.752 ( -1.541 4.003 -1.223) 4.460 17.665 ( 9.284 4.311 -1.547) 10.352 17.718 ( -9.849 0.187 -1.406) 9.951 18.161 ( -0.836 -1.223 3.209) 3.535 19.226 ( 9.477 9.634 8.186) 15.800 19.331 ( -11.875 6.865 -4.003) 14.289 19.606 ( 0.055 3.000 -7.141) 7.746 20.061 ( 5.674 3.046 2.267) 6.827 20.600 ( -2.388 7.371 4.801) 9.115 21.003 ( 2.509 -11.847 0.359) 12.115 21.344 ( -1.942 -3.910 3.764) 5.765 21.475 ( 0.333 -0.342 -1.194) 1.286 21.941 ( -0.519 0.668 -1.872) 2.055 22.460 ( 0.288 -9.194 -3.634) 9.890 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.850 ( -3.867 -10.853 2.908) 11.882 2.173 ( 11.982 7.427 -3.064) 14.427 2.536 ( -7.125 0.532 -4.062) 8.219 2.791 ( 0.903 -3.935 0.999) 4.159 2.933 ( 0.334 8.144 -5.024) 9.575 3.020 ( 2.053 -2.888 -7.444) 8.245 3.210 ( 6.158 0.606 9.150) 11.045 3.405 ( -7.144 4.469 12.051) 14.705 3.757 ( -5.792 -7.732 2.533) 9.987 3.852 ( 2.006 -3.463 -6.844) 7.928 3.980 ( 2.137 5.348 1.266) 5.897 4.144 ( -0.566 -2.735 1.520) 3.180 4.180 ( -1.552 -1.839 -3.640) 4.363 4.300 ( 0.446 7.989 -1.402) 8.123 4.400 ( 4.914 -1.264 -1.755) 5.368 4.581 ( -2.653 9.719 8.089) 12.920 4.684 ( -0.357 -0.908 1.239) 1.577 4.869 ( 6.741 -6.726 -5.737) 11.117 4.978 ( -0.613 -11.802 -5.818) 13.172 5.027 ( 3.005 4.481 4.340) 6.924 5.387 ( -1.932 1.165 -3.955) 4.553 5.470 ( -3.275 1.111 -2.994) 4.574 5.671 ( -2.282 -1.055 1.947) 3.180 5.883 ( 5.973 -0.383 4.163) 7.291 6.027 ( -4.034 4.261 6.118) 8.477 6.124 ( 2.118 -1.610 -4.959) 5.628 6.547 ( -2.442 0.382 0.444) 2.511 6.887 ( 6.072 -0.377 0.546) 6.108 7.585 ( -12.811 0.970 -0.957) 12.883 8.006 ( 3.394 -8.278 0.909) 8.993 8.080 ( 1.243 5.899 1.651) 6.250 8.375 ( -1.884 -4.645 -2.357) 5.539 8.642 ( -5.010 1.245 2.459) 5.718 8.719 ( -3.075 5.530 -2.929) 6.972 8.844 ( -1.893 0.057 5.029) 5.374 8.897 ( -2.954 12.280 3.455) 13.094 9.104 ( 6.288 0.866 -11.635) 13.253 9.259 ( 1.219 -6.773 1.163) 6.980 9.564 ( 1.269 -1.910 7.517) 7.859 10.079 ( 11.788 -5.656 -4.792) 13.925 10.133 ( -1.992 -0.541 0.488) 2.121 10.343 ( -1.509 1.059 -3.137) 3.639 10.563 ( 0.175 0.625 -1.422) 1.563 10.990 ( -0.141 -3.076 7.410) 8.025 11.209 ( 4.214 2.087 -5.033) 6.888 11.689 ( -1.908 4.699 4.785) 6.973 11.830 ( -6.315 -6.157 -0.767) 8.853 12.131 ( -6.027 0.107 -1.500) 6.212 12.271 ( 4.139 8.602 -0.029) 9.546 12.479 ( 5.362 0.605 -4.206) 6.842 12.761 ( 2.548 -5.103 4.511) 7.272 13.176 ( -9.535 1.448 1.229) 9.722 13.446 ( -0.859 1.444 0.887) 1.900 13.711 ( -1.103 -2.813 3.921) 4.950 13.845 ( -1.023 3.049 -4.328) 5.392 14.096 ( -0.570 -2.797 -2.610) 3.867 14.251 ( -0.277 1.101 1.711) 2.053 14.715 ( 7.471 0.621 2.582) 7.928 15.633 ( -6.913 -1.171 -3.358) 7.775 16.176 ( 1.249 1.837 5.622) 6.045 16.402 ( -2.443 -2.845 -13.104) 13.630 16.737 ( -2.375 1.613 3.389) 4.442 17.661 ( 5.808 -5.769 9.759) 12.738 17.842 ( 1.619 -1.096 4.175) 4.610 18.276 ( 15.142 7.172 -8.990) 19.014 19.126 ( -11.700 -1.837 -5.873) 13.220 19.434 ( -4.699 3.761 7.588) 9.685 19.593 ( 6.570 0.799 -3.354) 7.420 20.089 ( 0.476 -8.601 -0.310) 8.619 20.720 ( 5.195 9.308 -3.478) 11.212 20.932 ( -0.128 -4.830 -2.487) 5.435 21.300 ( -5.220 -5.377 14.444) 16.272 21.484 ( 4.039 2.955 -5.945) 7.771 21.904 ( -4.343 1.877 -1.991) 5.133 22.371 ( -3.468 -0.518 -0.147) 3.510 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.762 ( 5.026 -11.236 5.951) 13.672 2.310 ( -3.119 -3.500 -1.398) 4.892 2.449 ( 3.168 5.330 -6.085) 8.688 2.700 ( 0.876 -12.126 0.933) 12.193 3.029 ( 2.123 5.872 -5.678) 8.440 3.079 ( 6.621 1.653 -7.058) 9.818 3.292 ( -8.860 4.093 10.963) 14.678 3.406 ( 2.170 2.112 4.688) 5.581 3.570 ( -6.297 -4.487 1.107) 7.810 3.822 ( 3.244 -4.603 -1.403) 5.804 4.011 ( 2.684 -6.208 -1.696) 6.973 4.090 ( -2.051 -3.173 -3.134) 4.909 4.210 ( 1.014 8.992 3.706) 9.778 4.401 ( 0.514 10.940 -3.244) 11.423 4.458 ( 4.840 -5.781 -5.436) 9.295 4.588 ( -4.066 5.404 5.202) 8.532 4.658 ( -3.520 -8.952 0.291) 9.623 4.837 ( 0.134 -2.776 -4.237) 5.068 4.925 ( 8.469 -6.418 -3.811) 11.289 5.157 ( 3.625 -0.537 6.287) 7.277 5.282 ( -7.051 2.749 0.795) 7.610 5.473 ( 0.787 2.004 4.096) 4.628 5.648 ( -0.643 -0.412 -1.747) 1.907 5.965 ( -3.136 3.983 1.997) 5.449 6.028 ( 2.880 0.027 1.647) 3.317 6.167 ( 3.358 2.818 -3.252) 5.459 6.478 ( -5.127 -1.087 -0.087) 5.241 7.052 ( 8.318 4.571 -0.218) 9.494 7.323 ( -12.100 -4.776 0.154) 13.009 7.957 ( 4.761 -10.971 -2.918) 12.311 8.166 ( 1.432 2.211 4.290) 5.034 8.302 ( -3.130 1.716 -3.296) 4.858 8.567 ( -3.844 0.118 5.131) 6.412 8.686 ( -9.585 3.597 2.171) 10.465 8.824 ( -0.615 13.759 -2.340) 13.970 8.985 ( -5.682 2.691 -4.232) 7.579 9.183 ( 4.921 -0.180 9.424) 10.633 9.351 ( 12.417 4.544 -8.233) 15.576 9.604 ( 2.411 -5.800 8.878) 10.875 10.066 ( -5.116 -0.355 -1.965) 5.492 10.142 ( 3.753 -4.780 -2.123) 6.437 10.356 ( 6.152 -0.772 -6.145) 8.729 10.524 ( -4.896 -2.733 1.325) 5.762 10.988 ( -1.768 0.367 4.864) 5.188 11.315 ( 6.201 3.240 -4.358) 8.243 11.659 ( -3.587 -6.019 -0.237) 7.011 11.756 ( 0.970 5.237 2.346) 5.820 12.010 ( -5.620 1.365 0.570) 5.811 12.334 ( 0.772 -9.405 0.304) 9.442 12.566 ( 6.320 -2.222 -4.890) 8.294 12.832 ( 2.272 6.646 2.825) 7.571 13.111 ( -6.312 9.831 2.286) 11.904 13.385 ( -9.439 8.046 1.949) 12.555 13.693 ( 2.094 -3.751 4.822) 6.458 13.828 ( -0.450 1.293 -6.013) 6.167 14.022 ( -3.589 -2.588 0.268) 4.433 14.294 ( 2.768 0.433 -1.277) 3.079 14.916 ( 10.170 2.365 8.201) 13.277 15.477 ( -8.014 1.385 -6.151) 10.197 16.199 ( -9.142 0.607 4.358) 10.146 16.222 ( -1.099 -4.206 -9.999) 10.903 16.822 ( 8.365 4.228 -1.569) 9.503 17.659 ( -6.503 -14.189 18.969) 24.565 17.886 ( 8.631 4.671 -12.458) 15.859 18.636 ( 14.929 -4.850 -9.163) 18.176 18.883 ( -4.338 1.151 4.467) 6.332 19.354 ( -8.417 7.821 3.504) 12.012 19.704 ( 6.754 -13.933 -0.023) 15.484 19.997 ( 3.675 -5.975 -2.251) 7.367 20.853 ( 2.775 -6.377 -6.544) 9.549 20.895 ( -1.162 13.393 -4.983) 14.337 21.140 ( -11.630 -5.096 10.058) 16.199 21.622 ( 8.780 -0.725 -5.924) 10.616 21.842 ( -4.063 5.341 4.081) 7.854 22.335 ( -5.240 7.453 2.553) 9.462 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.851 ( 13.294 -9.117 7.276) 17.686 2.160 ( -5.994 -3.467 -3.990) 7.992 2.559 ( 2.668 3.597 2.582) 5.170 2.639 ( 4.341 -8.643 -2.249) 9.930 2.983 ( -7.679 -4.703 -2.187) 9.266 3.140 ( 2.124 -4.092 2.904) 5.449 3.210 ( -6.805 10.751 -2.461) 12.960 3.457 ( 0.760 2.098 -3.912) 4.504 3.513 ( -0.238 1.632 1.488) 2.221 3.905 ( 8.864 -4.453 1.203) 9.992 3.936 ( -1.817 -6.333 -3.491) 7.457 4.067 ( -0.721 3.393 -0.193) 3.474 4.333 ( 2.645 1.840 3.205) 4.544 4.360 ( -5.393 0.996 -6.260) 8.323 4.403 ( -7.092 1.220 -1.358) 7.323 4.587 ( 2.191 4.552 -0.279) 5.059 4.658 ( 9.357 -3.491 -2.475) 10.289 4.836 ( 3.223 -4.434 1.243) 5.621 4.953 ( -1.487 -3.798 -0.101) 4.080 5.084 ( -5.914 -1.832 5.148) 8.052 5.358 ( 5.656 1.014 6.481) 8.662 5.521 ( 0.124 -1.220 8.894) 8.978 5.618 ( 0.161 0.559 -7.103) 7.126 5.909 ( -7.912 7.675 -2.879) 11.393 6.126 ( 7.438 -3.126 1.399) 8.189 6.222 ( -0.735 3.160 -2.361) 4.012 6.364 ( -4.852 -0.849 -1.436) 5.130 6.998 ( -9.235 -7.165 -1.214) 11.752 7.332 ( 8.091 6.537 0.406) 10.410 7.951 ( 7.678 -9.640 -4.387) 13.082 8.208 ( -1.000 2.166 4.371) 4.980 8.247 ( -6.788 4.279 -1.615) 8.185 8.544 ( -3.128 4.293 -0.106) 5.312 8.654 ( 0.203 1.674 7.626) 7.811 8.804 ( -1.590 -1.795 -6.462) 6.892 9.008 ( -0.870 16.902 -1.496) 16.990 9.307 ( 0.958 1.239 13.654) 13.744 9.552 ( 3.625 -1.254 -2.116) 4.380 9.607 ( 6.779 -1.754 -4.743) 8.458 9.961 ( -2.526 -2.119 -3.085) 4.515 10.146 ( 2.302 -4.415 0.382) 4.994 10.341 ( -8.518 -8.476 4.040) 12.677 10.466 ( 6.458 1.224 -1.364) 6.713 10.949 ( -6.379 2.412 3.797) 7.805 11.402 ( 1.853 -0.185 -7.241) 7.476 11.565 ( -3.351 1.283 -1.891) 4.056 11.845 ( 1.817 3.305 2.239) 4.386 12.011 ( 3.824 1.902 1.082) 4.406 12.246 ( 4.782 -10.753 1.302) 11.840 12.557 ( -5.639 -0.911 -0.603) 5.744 12.872 ( -3.746 -3.672 -2.316) 5.734 13.078 ( -2.849 12.129 0.131) 12.460 13.504 ( 2.248 18.743 1.675) 18.951 13.734 ( 3.830 -4.081 2.775) 6.247 13.809 ( 2.396 -2.096 -3.992) 5.106 13.948 ( -4.621 2.197 3.182) 6.025 14.314 ( 1.201 -2.128 -2.937) 3.821 15.154 ( 8.782 -0.796 15.378) 17.727 15.345 ( -6.398 7.400 -12.842) 16.143 15.954 ( -10.067 -10.369 5.729) 15.546 16.195 ( -1.721 2.326 -5.930) 6.599 17.021 ( 10.778 3.697 -13.847) 17.932 17.510 ( -5.760 -4.499 23.735) 24.835 17.925 ( -0.492 -5.558 -15.457) 16.434 18.465 ( -3.342 -14.264 -4.172) 15.233 19.147 ( 7.690 6.504 10.464) 14.523 19.372 ( -0.230 7.973 -0.834) 8.020 19.595 ( 4.195 -13.295 1.066) 13.982 20.085 ( 5.723 1.352 -1.625) 6.101 20.764 ( -1.580 -5.600 -5.761) 8.188 20.910 ( -9.022 -7.461 3.775) 12.301 20.975 ( -1.688 8.907 -3.724) 9.800 21.602 ( -2.026 -3.589 -6.676) 7.845 21.997 ( 6.961 8.116 7.004) 12.782 22.354 ( -3.387 8.814 2.568) 9.785 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.986 ( -0.418 -7.889 -0.914) 7.953 2.107 ( 10.646 2.635 3.742) 11.588 2.515 ( -12.363 -1.973 -3.180) 12.917 2.654 ( 3.228 -1.799 3.317) 4.966 2.853 ( 3.950 -3.412 0.772) 5.276 3.099 ( -11.592 2.321 -5.310) 12.959 3.180 ( 0.622 1.456 7.785) 7.945 3.520 ( 3.548 6.122 -8.017) 10.693 3.553 ( 1.571 2.378 1.965) 3.462 3.791 ( -7.208 -2.602 -3.262) 8.329 3.898 ( -0.174 -9.125 -3.255) 9.689 4.103 ( 1.145 0.328 -0.771) 1.419 4.269 ( -7.205 3.347 2.492) 8.326 4.377 ( 4.357 8.791 2.311) 10.080 4.473 ( 2.885 3.893 1.092) 4.967 4.629 ( -0.352 1.230 -1.510) 1.979 4.764 ( 3.284 -8.996 -2.810) 9.980 4.828 ( -3.241 1.317 0.614) 3.551 4.893 ( 5.071 -0.606 2.786) 5.817 4.995 ( -0.152 -8.844 2.520) 9.197 5.446 ( 1.162 -0.825 -0.292) 1.455 5.533 ( 0.894 -2.257 5.174) 5.715 5.655 ( 4.898 2.225 -1.218) 5.516 5.833 ( -6.591 4.772 -2.511) 8.515 6.144 ( -3.355 -1.373 -0.342) 3.641 6.230 ( 1.022 1.611 0.225) 1.921 6.323 ( 1.262 -0.647 -2.340) 2.736 6.796 ( -4.005 -6.452 -1.024) 7.663 7.512 ( 3.994 5.319 -0.068) 6.652 7.964 ( 3.200 -4.599 -3.849) 6.798 8.104 ( -10.410 3.764 -1.525) 11.175 8.237 ( 3.574 -4.532 0.860) 5.836 8.569 ( -2.021 10.329 3.015) 10.948 8.715 ( 2.575 1.220 0.720) 2.939 8.870 ( 7.196 0.640 0.400) 7.235 9.157 ( 0.988 10.465 1.869) 10.676 9.362 ( -1.141 3.320 9.180) 9.828 9.499 ( -2.519 -4.453 -2.453) 5.674 9.645 ( 2.458 -1.037 -12.027) 12.319 9.921 ( -2.130 -8.923 2.468) 9.500 10.119 ( 6.062 -8.323 0.007) 10.296 10.184 ( -6.216 3.343 2.820) 7.601 10.583 ( 5.325 -1.034 1.660) 5.673 10.893 ( -4.288 3.758 9.215) 10.836 11.257 ( -5.753 -6.444 -13.605) 16.116 11.609 ( 0.407 9.464 1.853) 9.652 11.875 ( -0.117 -1.640 -0.405) 1.694 12.127 ( 8.109 -2.482 -1.632) 8.636 12.257 ( -7.479 -2.320 2.087) 8.104 12.442 ( 0.776 5.582 4.370) 7.131 12.757 ( -2.550 -3.143 -5.198) 6.588 13.214 ( 6.052 3.843 -0.877) 7.222 13.647 ( 0.478 2.514 -0.405) 2.591 13.736 ( -0.773 -1.234 0.200) 1.470 13.904 ( 5.994 7.023 -3.049) 9.723 13.951 ( -0.781 3.101 7.879) 8.503 14.265 ( -1.552 -4.296 -3.443) 5.720 15.214 ( 0.077 -1.051 -4.528) 4.649 15.407 ( 2.600 6.035 7.686) 10.112 15.724 ( -5.974 -8.348 4.884) 11.368 16.163 ( -0.693 1.416 -5.744) 5.957 17.149 ( 9.438 0.693 -11.797) 15.123 17.513 ( -9.973 -1.572 11.474) 15.283 17.749 ( 2.077 -3.986 -0.393) 4.512 18.251 ( -5.865 -10.446 -6.396) 13.581 19.246 ( -5.518 1.320 10.620) 12.040 19.422 ( 4.355 1.827 -2.818) 5.500 19.686 ( 3.700 5.620 -0.602) 6.755 20.153 ( -0.257 2.848 0.006) 2.859 20.633 ( -4.397 -5.853 -0.346) 7.328 20.758 ( -1.740 -5.072 1.487) 5.564 21.027 ( 2.589 4.140 -2.595) 5.530 21.500 ( -0.682 -5.428 -5.618) 7.842 22.190 ( 0.433 8.558 5.797) 10.346 22.421 ( 5.118 1.516 -0.592) 5.371 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.427 ( -0.000 0.000 33.616) 33.616 0.427 ( -0.000 0.000 33.616) 33.616 0.768 ( -0.000 0.000 60.758) 60.758 2.731 ( 0.000 -0.000 -14.229) 14.229 2.731 ( 0.000 -0.000 -14.229) 14.229 3.018 ( -0.000 0.000 8.090) 8.090 3.018 ( -0.000 0.000 8.090) 8.090 3.234 ( -0.000 0.000 0.540) 0.540 3.631 ( 0.000 -0.000 -1.386) 1.386 3.631 ( 0.000 -0.000 -1.386) 1.386 3.796 ( 0.000 -0.000 -3.596) 3.596 3.839 ( 0.000 -0.000 -1.985) 1.985 3.839 ( 0.000 -0.000 -1.985) 1.985 4.242 ( -0.000 0.000 1.735) 1.735 4.655 ( -0.000 0.000 2.058) 2.058 4.832 ( 0.000 -0.000 -1.658) 1.658 4.832 ( 0.000 -0.000 -1.658) 1.658 5.092 ( -0.000 0.000 9.515) 9.515 5.092 ( -0.000 0.000 9.515) 9.515 5.153 ( 0.000 -0.000 -22.554) 22.554 5.493 ( 0.000 -0.000 -2.332) 2.332 5.493 ( 0.000 -0.000 -2.332) 2.332 5.977 ( -0.000 0.000 2.088) 2.088 6.000 ( 0.000 -0.000 -2.375) 2.375 6.000 ( 0.000 -0.000 -2.375) 2.375 6.223 ( 0.000 -0.000 -6.909) 6.909 6.504 ( -0.000 0.000 11.098) 11.098 6.754 ( 0.000 -0.000 -1.869) 1.869 7.702 ( -0.000 0.000 7.630) 7.630 8.087 ( 0.000 -0.000 -7.223) 7.223 8.087 ( 0.000 -0.000 -7.223) 7.223 8.397 ( -0.000 0.000 4.835) 4.835 8.397 ( -0.000 0.000 4.835) 4.835 8.855 ( 0.000 -0.000 -5.510) 5.510 9.077 ( 0.000 -0.000 -1.924) 1.924 9.077 ( 0.000 -0.000 -1.924) 1.924 9.167 ( -0.000 0.000 5.775) 5.775 9.167 ( -0.000 0.000 5.775) 5.775 9.371 ( -0.000 0.000 4.824) 4.824 9.925 ( -0.000 0.000 4.418) 4.418 9.925 ( -0.000 0.000 4.418) 4.418 11.142 ( 0.000 -0.000 -20.175) 20.175 11.241 ( 0.000 -0.000 -3.141) 3.141 11.241 ( 0.000 -0.000 -3.141) 3.141 11.337 ( 0.000 -0.000 -5.580) 5.580 11.337 ( 0.000 -0.000 -5.580) 5.580 11.717 ( -0.000 0.000 6.817) 6.817 11.804 ( -0.000 0.000 2.345) 2.345 11.804 ( -0.000 0.000 2.345) 2.345 11.985 ( -0.000 0.000 13.808) 13.808 13.103 ( -0.000 0.000 1.684) 1.684 13.552 ( -0.000 0.000 1.355) 1.355 13.552 ( -0.000 0.000 1.355) 1.355 13.595 ( 0.000 -0.000 -3.774) 3.774 14.236 ( -0.000 0.000 0.987) 0.987 14.624 ( 0.000 -0.000 -2.677) 2.677 14.671 ( -0.000 0.000 0.604) 0.604 14.671 ( -0.000 0.000 0.604) 0.604 15.628 ( 0.000 -0.000 -0.483) 0.483 17.037 ( -0.000 0.000 1.384) 1.384 17.037 ( -0.000 0.000 1.384) 1.384 17.502 ( -0.000 0.000 1.051) 1.051 17.519 ( 0.000 -0.000 -3.201) 3.201 17.519 ( 0.000 -0.000 -3.201) 3.201 17.701 ( -0.000 0.000 0.261) 0.261 18.180 ( 0.000 -0.000 -0.899) 0.899 18.180 ( 0.000 -0.000 -0.899) 0.899 18.384 ( -0.000 0.000 1.245) 1.245 18.384 ( -0.000 0.000 1.245) 1.245 21.541 ( -0.000 0.000 0.996) 0.996 21.541 ( -0.000 0.000 0.996) 0.996 21.827 ( 0.000 -0.000 -0.700) 0.700 21.968 ( 0.000 0.000 -0.552) 0.552 21.968 ( 0.000 0.000 -0.552) 0.552 23.598 ( -0.000 0.000 0.625) 0.625 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.653 ( 6.822 18.263 19.685) 27.705 0.895 ( 24.521 8.155 20.359) 32.898 1.502 ( 32.746 15.592 41.093) 54.810 2.628 ( -2.498 -0.115 -15.464) 15.665 2.744 ( 3.104 3.927 -13.819) 14.698 3.037 ( 1.151 -1.903 6.052) 6.447 3.094 ( 3.630 0.517 7.322) 8.189 3.199 ( -2.924 0.000 4.359) 5.249 3.416 ( -8.161 -7.186 -2.415) 11.139 3.594 ( -5.200 1.313 3.188) 6.239 3.794 ( 1.866 -1.348 -6.669) 7.055 3.848 ( 6.159 -4.160 -5.251) 9.101 4.024 ( 4.474 12.541 0.718) 13.334 4.300 ( 4.366 2.485 -0.111) 5.025 4.647 ( -0.936 -2.350 1.855) 3.137 4.777 ( -3.827 -0.710 -0.062) 3.893 4.816 ( -0.695 -3.238 -0.538) 3.355 5.029 ( -4.181 -2.299 2.084) 5.206 5.080 ( -0.305 1.515 -11.696) 11.797 5.180 ( 2.656 1.851 0.233) 3.245 5.405 ( -3.109 -1.651 -6.650) 7.524 5.549 ( 2.060 1.243 3.707) 4.419 5.959 ( -1.366 -1.711 2.946) 3.670 5.965 ( -3.847 2.299 -2.855) 5.314 5.982 ( 2.965 -4.017 -3.169) 5.913 6.274 ( 3.124 1.835 -1.577) 3.951 6.405 ( -4.071 -3.066 13.212) 14.161 6.764 ( 2.463 1.706 -3.460) 4.577 7.700 ( -2.861 -3.297 8.860) 9.877 7.942 ( -8.198 6.096 -7.593) 12.729 8.275 ( -5.343 -6.956 -9.742) 13.109 8.329 ( 7.067 -9.770 3.091) 12.448 8.492 ( -0.317 4.419 -3.395) 5.581 8.709 ( 3.969 -1.616 0.387) 4.303 9.093 ( 9.587 -15.992 -0.438) 18.651 9.123 ( 0.531 -1.768 -10.878) 11.034 9.192 ( -7.368 16.543 5.033) 18.796 9.453 ( 11.934 12.890 -4.120) 18.043 9.597 ( 10.015 0.287 -0.572) 10.035 9.858 ( -7.219 -1.549 3.764) 8.287 9.981 ( 1.670 1.072 5.106) 5.478 10.786 ( -16.206 -1.428 -9.059) 18.621 11.145 ( -4.111 -3.480 -2.943) 6.137 11.226 ( -0.302 -4.599 -2.900) 5.445 11.327 ( 0.263 -0.827 -7.135) 7.188 11.423 ( 1.833 0.126 -6.551) 6.804 11.672 ( -5.237 2.734 3.997) 7.133 11.786 ( 0.062 0.341 0.181) 0.392 11.908 ( 3.601 0.883 2.712) 4.594 12.201 ( 13.670 -0.785 10.488) 17.248 13.157 ( 3.013 3.592 0.382) 4.704 13.354 ( -1.846 0.697 2.360) 3.077 13.552 ( -0.777 -0.711 2.412) 2.632 13.855 ( 1.014 3.987 -8.439) 9.388 14.225 ( -3.624 -1.324 2.519) 4.608 14.502 ( -9.581 -6.911 -2.432) 12.061 14.593 ( -6.312 -3.004 2.297) 7.359 14.646 ( 10.238 -5.786 -8.703) 14.630 15.752 ( 7.647 1.307 1.624) 7.926 16.477 ( -23.836 6.899 26.859) 36.567 16.762 ( -19.888 -13.428 5.748) 24.676 17.009 ( -14.247 -19.185 2.166) 23.994 17.524 ( -0.981 1.087 -1.363) 2.001 17.726 ( 0.756 6.966 -4.900) 8.550 17.830 ( 10.822 17.957 -2.160) 21.077 18.211 ( 3.599 -9.119 -1.082) 9.863 18.514 ( 19.841 -2.018 -1.581) 20.006 18.580 ( 17.911 16.640 -0.977) 24.468 19.013 ( 29.203 12.672 -15.531) 35.420 21.029 ( -32.287 -6.360 39.507) 51.417 21.464 ( -4.340 -5.845 -1.270) 7.390 21.676 ( -5.493 5.533 -1.049) 7.867 21.880 ( -5.605 -3.317 -3.039) 7.187 22.013 ( 4.601 -5.716 1.386) 7.468 23.471 ( -9.093 -5.307 -1.920) 10.701 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.090 ( 13.380 18.695 7.180) 24.084 1.500 ( 23.916 11.614 10.615) 28.628 2.270 ( 16.656 4.233 7.065) 18.581 2.624 ( 10.513 9.984 8.432) 16.772 2.777 ( 0.560 5.589 -11.105) 12.445 3.025 ( -1.811 -9.576 3.607) 10.392 3.122 ( -1.435 -0.483 1.461) 2.104 3.207 ( 5.042 0.749 6.412) 8.192 3.359 ( 3.704 2.029 2.873) 5.108 3.581 ( 0.660 1.419 3.021) 3.403 3.775 ( 0.359 -1.250 -4.213) 4.410 3.858 ( 2.668 -3.116 -4.387) 6.007 4.230 ( 2.356 14.875 2.051) 15.199 4.396 ( 3.225 1.827 -6.642) 7.606 4.568 ( -2.443 -8.094 2.649) 8.860 4.692 ( -4.685 -0.510 1.388) 4.913 4.754 ( -1.294 -4.684 -0.972) 4.956 4.926 ( -7.501 -1.510 5.659) 9.516 5.067 ( 1.705 2.859 -10.543) 11.056 5.243 ( 4.120 2.904 -8.648) 10.010 5.305 ( -2.536 -1.253 -8.386) 8.850 5.616 ( 1.162 1.374 5.318) 5.615 5.776 ( -9.271 -5.349 -3.860) 11.379 5.982 ( 2.026 0.338 -2.751) 3.433 6.043 ( 4.054 -1.199 4.666) 6.296 6.265 ( -5.165 -3.714 12.266) 13.818 6.418 ( 2.018 1.298 -3.606) 4.331 6.841 ( 4.467 3.117 -3.585) 6.521 7.568 ( -10.060 -7.691 7.401) 14.667 7.866 ( -5.055 7.454 -4.917) 10.261 8.019 ( -4.124 -6.782 -0.384) 7.947 8.385 ( 5.447 -2.426 8.146) 10.095 8.608 ( 10.265 -4.441 -15.265) 18.924 8.780 ( 1.783 -0.091 -2.892) 3.399 8.938 ( -5.012 -0.036 2.019) 5.403 9.185 ( 11.807 -11.270 -7.039) 17.775 9.319 ( -1.820 15.746 2.941) 16.122 9.569 ( -10.774 -5.185 2.850) 12.292 9.626 ( 1.472 0.743 -4.338) 4.641 9.817 ( 5.719 -0.726 2.169) 6.160 10.038 ( -1.482 4.430 6.842) 8.285 10.473 ( -14.496 1.220 -9.472) 17.359 10.994 ( -7.963 -4.038 -1.856) 9.119 11.142 ( -1.533 -4.686 -4.874) 6.933 11.251 ( -1.825 -8.311 4.510) 9.631 11.480 ( 6.297 2.832 -2.867) 7.476 11.659 ( -0.842 3.576 3.279) 4.924 11.824 ( 0.619 6.174 -4.156) 7.469 11.982 ( 3.640 -0.698 5.532) 6.658 12.433 ( 11.344 -4.446 4.275) 12.912 13.194 ( -3.646 -0.729 -1.136) 3.888 13.392 ( 3.583 2.514 -2.781) 5.185 13.560 ( -0.843 2.447 1.318) 2.904 13.794 ( -5.383 1.381 1.243) 5.695 14.112 ( -6.361 -3.058 4.104) 8.164 14.228 ( -8.989 -8.242 -3.324) 12.640 14.438 ( -8.307 -3.295 3.396) 9.560 14.801 ( 15.702 -3.750 -16.016) 22.740 15.794 ( -2.770 -4.372 7.545) 9.150 16.275 ( -19.349 -10.713 7.145) 23.242 16.480 ( -11.509 10.745 4.293) 16.320 16.720 ( -0.907 0.037 5.186) 5.265 17.486 ( 4.270 -11.510 -4.549) 13.093 17.793 ( -3.838 16.358 -10.667) 19.902 18.099 ( -3.069 10.076 10.840) 15.114 18.312 ( 22.434 -6.480 2.981) 23.541 18.858 ( 17.818 7.200 -3.304) 19.500 19.135 ( 24.463 13.223 -4.310) 28.140 19.479 ( 22.376 2.910 -5.746) 23.285 20.726 ( -21.371 6.621 30.066) 37.478 21.267 ( -9.861 -6.606 -2.709) 12.174 21.592 ( -8.178 -4.078 3.885) 9.929 21.716 ( -6.665 0.043 -7.297) 9.883 22.036 ( 4.230 -4.944 0.626) 6.536 23.178 ( -14.011 -8.194 -4.927) 16.963 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.522 ( 13.215 15.676 0.497) 20.509 1.993 ( 14.552 8.919 2.357) 17.230 2.339 ( 2.936 2.346 -5.424) 6.599 2.774 ( -0.859 3.552 -4.228) 5.589 2.808 ( -4.352 -8.469 2.756) 9.913 3.099 ( -1.045 -0.008 0.007) 1.045 3.168 ( 9.310 3.716 14.401) 17.546 3.423 ( 14.656 3.687 7.927) 17.066 3.495 ( 5.169 1.347 0.216) 5.346 3.619 ( 3.594 -3.358 -2.384) 5.466 3.774 ( 1.073 0.441 0.121) 1.166 3.945 ( 9.027 8.221 5.767) 13.503 4.275 ( -8.347 -5.484 -0.932) 10.031 4.429 ( 2.067 13.524 -0.111) 13.682 4.550 ( 5.419 -4.031 -2.925) 7.360 4.623 ( -3.441 1.206 -1.771) 4.053 4.664 ( -3.127 -4.796 -0.196) 5.729 4.789 ( -7.624 -1.702 3.957) 8.757 5.049 ( -4.147 -0.127 -2.068) 4.636 5.273 ( 2.169 3.060 -7.809) 8.663 5.308 ( 4.593 2.090 -12.569) 13.544 5.478 ( -11.089 -7.545 -6.776) 15.027 5.672 ( -0.149 0.579 4.297) 4.338 6.028 ( 2.459 -2.271 1.518) 3.675 6.102 ( 1.251 0.172 3.673) 3.884 6.173 ( -3.935 -3.974 9.027) 10.619 6.418 ( -1.441 0.320 -3.261) 3.580 6.870 ( -3.358 -1.892 -1.146) 4.021 7.413 ( 0.373 -0.469 1.106) 1.258 7.876 ( -1.376 7.110 -1.539) 7.404 7.995 ( 4.001 -3.977 6.413) 8.541 8.494 ( -6.988 -6.910 -7.286) 12.234 8.530 ( 7.545 0.205 4.664) 8.873 8.786 ( 5.002 -3.781 -1.007) 6.350 9.041 ( 5.669 10.272 -6.430) 13.379 9.159 ( -9.138 -2.689 -2.130) 9.761 9.301 ( -3.168 -10.200 -7.339) 12.959 9.430 ( 2.006 2.593 5.673) 6.552 9.636 ( 3.382 -1.707 -5.152) 6.395 9.880 ( -1.486 -0.390 3.672) 3.980 10.070 ( -3.897 6.677 5.956) 9.759 10.264 ( -6.120 1.110 -5.536) 8.327 10.785 ( -10.056 -2.732 -1.502) 10.528 11.034 ( -3.353 -2.163 -9.033) 9.875 11.190 ( 0.872 -8.520 13.354) 15.865 11.656 ( 8.765 4.576 -0.713) 9.913 11.721 ( 4.774 -3.661 3.656) 7.039 11.884 ( -1.092 11.244 -2.950) 11.676 12.098 ( 7.379 1.505 2.421) 7.911 12.544 ( 5.839 -4.474 -0.229) 7.359 12.986 ( -13.199 -7.061 -1.089) 15.008 13.440 ( -3.625 -0.226 -1.585) 3.963 13.557 ( 3.039 1.644 -2.137) 4.063 13.730 ( -5.334 0.801 -0.853) 5.461 14.041 ( -0.824 -0.664 5.525) 5.626 14.061 ( -2.207 -2.435 -2.396) 4.067 14.283 ( -7.123 -2.467 3.868) 8.473 14.938 ( 12.058 -3.729 -18.452) 22.355 15.700 ( -6.625 -1.337 7.925) 10.415 15.922 ( -15.653 -4.544 11.278) 19.821 16.299 ( -7.016 -5.646 1.739) 9.172 16.936 ( 5.493 16.300 0.809) 17.220 17.412 ( 6.330 -15.831 -7.714) 18.713 17.820 ( -7.112 16.609 -9.396) 20.365 18.145 ( 1.288 -6.170 16.069) 17.260 18.757 ( 20.546 10.820 4.740) 23.700 19.212 ( 14.525 7.466 -4.124) 16.845 19.563 ( 15.418 3.092 -8.975) 18.106 19.856 ( 18.416 4.462 0.630) 18.959 20.639 ( -11.277 9.935 22.248) 26.849 20.975 ( -13.062 -7.544 -2.216) 15.245 21.343 ( -11.053 -8.385 -1.178) 13.923 21.588 ( -6.402 -1.739 -0.960) 6.703 22.092 ( 5.738 -0.257 -0.739) 5.791 22.809 ( -14.680 -8.415 -6.352) 18.074 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.843 ( 9.430 7.021 -1.627) 11.868 2.185 ( 0.870 10.050 -2.964) 10.514 2.437 ( 2.478 -7.514 6.767) 10.411 2.661 ( -2.450 0.379 -0.894) 2.635 2.826 ( 2.327 6.416 -2.805) 7.379 3.069 ( -0.710 -6.083 3.283) 6.949 3.249 ( -4.385 -0.962 0.314) 4.500 3.512 ( 3.915 -2.442 -4.942) 6.761 3.640 ( 0.900 -0.311 2.130) 2.333 3.704 ( 8.570 1.470 4.606) 9.840 3.804 ( -0.497 1.174 2.794) 3.071 4.115 ( -2.721 -2.140 0.191) 3.467 4.283 ( 4.737 1.790 5.605) 7.553 4.512 ( -1.549 -0.669 -2.442) 2.969 4.526 ( 1.291 -4.578 -2.255) 5.263 4.621 ( 2.742 3.561 -0.077) 4.495 4.638 ( -2.295 8.144 -1.442) 8.583 4.758 ( 6.570 3.791 6.850) 10.221 4.959 ( -4.354 1.118 1.132) 4.635 5.039 ( -16.383 -8.015 -2.963) 18.478 5.352 ( 5.540 -2.334 -13.524) 14.800 5.447 ( 6.098 6.112 -3.811) 9.438 5.696 ( 0.628 1.288 1.698) 2.221 5.932 ( -6.940 -6.639 5.658) 11.147 6.123 ( -0.401 -2.340 -0.411) 2.409 6.205 ( 4.154 2.717 0.431) 4.982 6.361 ( -3.084 -1.257 1.955) 3.862 6.751 ( -3.662 -2.573 1.118) 4.613 7.530 ( 5.930 3.992 0.173) 7.151 7.922 ( 0.978 2.098 0.403) 2.349 8.088 ( 5.524 -2.997 6.488) 9.033 8.256 ( -8.491 -3.787 -3.433) 9.911 8.690 ( 5.747 2.748 3.896) 7.467 8.805 ( -4.852 -4.930 2.682) 7.419 8.883 ( -8.758 2.815 -4.341) 10.173 9.182 ( 0.444 5.727 -8.189) 10.003 9.260 ( 11.942 -2.020 -10.218) 15.846 9.477 ( -0.770 -2.156 0.066) 2.290 9.647 ( 6.054 -10.458 -3.903) 12.699 9.831 ( -7.653 8.760 10.589) 15.730 10.120 ( -0.702 5.978 2.886) 6.675 10.189 ( -0.654 -3.852 -2.440) 4.606 10.620 ( -5.366 0.431 -1.360) 5.552 10.921 ( -3.950 0.899 -10.091) 10.874 11.203 ( 1.907 -6.706 14.669) 16.241 11.737 ( -1.033 -0.757 -2.493) 2.803 11.795 ( 4.714 -1.195 2.059) 5.281 12.074 ( 8.155 12.728 3.284) 15.469 12.215 ( 0.608 -2.386 -0.341) 2.486 12.537 ( -1.957 -0.110 -7.022) 7.290 12.716 ( -4.193 -7.167 3.229) 8.909 13.300 ( -5.467 -2.489 -0.474) 6.026 13.634 ( 0.891 -0.139 -3.128) 3.256 13.683 ( 2.894 1.183 -1.627) 3.524 13.975 ( -2.046 -2.848 -2.488) 4.300 14.090 ( -3.436 6.257 2.154) 7.456 14.199 ( -0.221 -4.301 5.208) 6.758 14.999 ( 9.183 -4.281 -19.349) 21.841 15.649 ( -3.024 3.318 5.610) 7.185 15.726 ( -12.686 3.216 16.326) 20.924 16.185 ( -1.271 -4.422 2.990) 5.487 17.135 ( 3.769 3.988 -5.574) 7.822 17.356 ( 7.010 -10.175 -1.327) 12.427 17.812 ( -6.761 12.859 -6.770) 16.028 18.154 ( 0.797 -7.368 12.344) 14.397 19.178 ( 8.376 9.715 1.573) 12.924 19.441 ( 5.804 3.851 -3.795) 7.932 19.689 ( 5.586 -1.806 -4.377) 7.323 20.145 ( 7.039 1.515 0.248) 7.204 20.637 ( -7.096 1.460 8.417) 11.106 20.732 ( -4.834 -1.236 0.209) 4.994 21.115 ( -5.190 -2.537 0.770) 5.828 21.462 ( -2.710 -4.841 2.724) 6.181 22.221 ( 5.817 3.494 -3.393) 7.587 22.489 ( -8.625 -4.780 -3.920) 10.612 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.903 ( -7.929 -4.420 2.558) 9.432 2.241 ( 1.792 -2.501 -4.606) 5.540 2.366 ( -2.359 0.573 7.428) 7.815 2.737 ( 0.612 6.326 4.068) 7.546 2.898 ( -0.028 5.582 -8.502) 10.171 2.922 ( -4.417 -10.646 5.300) 12.686 3.122 ( -4.190 -0.930 -7.877) 8.971 3.550 ( 1.803 -2.120 -4.448) 5.247 3.659 ( -1.121 -4.309 4.373) 6.241 3.710 ( -7.824 0.587 5.520) 9.593 3.832 ( 0.249 -2.086 4.457) 4.928 4.108 ( -13.415 -7.521 -4.954) 16.158 4.132 ( 4.844 1.565 1.095) 5.207 4.442 ( -1.464 -5.282 -4.370) 7.009 4.473 ( -1.490 1.895 -7.477) 7.856 4.648 ( -0.690 0.021 0.661) 0.955 4.720 ( 3.054 -0.042 1.395) 3.358 4.782 ( -4.370 1.280 6.640) 8.051 5.008 ( 2.385 6.439 3.486) 7.701 5.131 ( 17.151 8.822 5.938) 20.181 5.332 ( 1.364 -3.007 -8.385) 9.012 5.626 ( 6.683 6.596 -0.693) 9.416 5.705 ( -2.123 -2.782 1.520) 3.815 5.791 ( -3.121 -0.934 1.083) 3.433 6.061 ( -2.598 -1.112 -5.488) 6.173 6.206 ( -2.971 -3.755 0.091) 4.789 6.394 ( 3.778 2.084 4.479) 6.219 6.765 ( 4.791 2.553 2.194) 5.855 7.577 ( -5.115 -2.009 3.861) 6.716 7.952 ( 4.336 -6.870 1.530) 8.267 7.962 ( -9.328 -0.591 -2.864) 9.775 8.331 ( 9.119 5.874 2.896) 11.227 8.579 ( -11.657 -0.162 -3.331) 12.125 8.807 ( 2.816 2.983 2.213) 4.661 8.910 ( 6.890 0.704 -2.103) 7.238 9.275 ( 3.171 2.328 -7.277) 8.273 9.327 ( -4.287 5.989 -4.856) 8.822 9.420 ( 1.727 -4.797 2.098) 5.513 9.615 ( 8.378 -9.146 -6.150) 13.844 9.891 ( -6.077 6.550 12.178) 15.104 10.090 ( -1.351 -3.639 0.776) 3.959 10.230 ( 5.035 5.612 -0.332) 7.547 10.614 ( 4.086 0.482 -1.271) 4.306 10.839 ( -3.438 4.758 -9.350) 11.040 11.231 ( 1.577 -4.914 12.263) 13.305 11.664 ( -5.067 1.655 -6.620) 8.500 11.857 ( 2.994 -1.492 3.482) 4.829 11.994 ( -11.456 -9.804 -0.329) 15.082 12.289 ( -2.027 3.697 3.733) 5.631 12.534 ( -0.393 3.801 -5.129) 6.396 12.734 ( 10.936 0.524 2.501) 11.230 13.311 ( 7.089 1.546 0.325) 7.263 13.636 ( 2.199 -0.434 -3.692) 4.319 13.700 ( -1.264 -2.019 0.075) 2.383 13.911 ( -3.554 0.552 -5.794) 6.819 14.095 ( -1.630 6.232 3.408) 7.288 14.191 ( 2.054 -5.411 2.480) 6.297 15.040 ( 9.368 -4.348 -16.847) 19.761 15.633 ( -4.346 4.545 3.574) 7.233 15.745 ( -4.724 13.283 19.201) 23.821 16.188 ( 3.697 -1.767 3.076) 5.124 17.067 ( 0.968 -15.206 -9.056) 17.725 17.462 ( 5.134 2.369 5.227) 7.701 17.794 ( -3.687 8.205 -6.869) 11.318 18.129 ( -0.877 -6.052 8.679) 10.617 19.084 ( -17.419 -3.971 -4.098) 18.330 19.452 ( -3.276 -3.926 -2.369) 5.635 19.815 ( 4.595 5.443 3.359) 7.876 20.105 ( -7.904 -4.360 -4.604) 10.133 20.421 ( -11.603 -10.416 -2.816) 15.845 20.819 ( 7.334 7.836 6.310) 12.450 21.155 ( 5.504 4.110 2.018) 7.160 21.482 ( 7.643 -2.284 3.760) 8.818 22.154 ( -6.790 -1.407 -6.841) 9.740 22.572 ( 11.904 7.047 0.780) 13.856 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.554 ( -20.553 -9.432 0.671) 22.624 2.013 ( -19.096 -16.044 3.895) 25.243 2.412 ( 2.992 -0.662 -0.099) 3.066 2.759 ( -10.876 -2.912 -4.511) 12.129 2.835 ( -1.445 11.380 -0.624) 11.488 2.942 ( 4.850 -4.444 8.816) 11.000 3.031 ( 0.971 -1.503 -5.984) 6.246 3.358 ( -14.495 -4.029 0.474) 15.051 3.464 ( -8.337 -8.311 0.040) 11.772 3.697 ( -6.755 -5.732 4.457) 9.918 3.736 ( 1.766 -0.162 -5.182) 5.478 3.917 ( -1.835 1.713 1.041) 2.718 4.237 ( 1.464 -3.876 -0.722) 4.205 4.395 ( 5.523 -1.530 -1.853) 6.024 4.470 ( -0.541 6.720 -6.586) 9.425 4.681 ( 3.481 0.341 1.666) 3.874 4.752 ( 1.110 -1.919 2.532) 3.365 4.846 ( 0.976 6.737 7.502) 10.130 5.089 ( -0.750 -0.633 -0.792) 1.261 5.317 ( 2.799 2.520 -2.123) 4.323 5.442 ( 6.755 -0.293 -0.630) 6.790 5.631 ( 1.119 3.088 1.983) 3.837 5.717 ( -4.265 -3.279 0.058) 5.380 5.855 ( 8.805 6.148 -3.193) 11.204 6.008 ( -1.861 2.799 -1.875) 3.849 6.111 ( -2.252 -5.731 2.727) 6.735 6.479 ( 1.853 0.891 1.419) 2.498 6.946 ( 6.654 3.230 4.516) 8.666 7.383 ( -7.854 -3.597 -1.111) 8.710 7.879 ( -1.599 5.408 -1.729) 5.899 7.978 ( 5.435 -7.850 3.731) 10.252 8.379 ( -7.811 0.152 -1.868) 8.033 8.609 ( 11.633 7.500 0.753) 13.862 8.842 ( -3.143 2.783 1.539) 4.471 9.044 ( -4.321 -1.580 -6.458) 7.929 9.142 ( 7.346 -2.201 -4.094) 8.693 9.337 ( -1.915 -9.771 2.375) 10.236 9.459 ( 0.888 9.355 -1.845) 9.576 9.703 ( 7.007 -4.070 -2.232) 8.405 9.830 ( -4.456 3.535 2.005) 6.031 10.036 ( -4.606 0.368 1.497) 4.857 10.466 ( 12.416 4.114 8.246) 15.462 10.724 ( 6.772 3.457 -4.706) 8.942 10.849 ( 2.384 7.000 -6.552) 9.880 11.270 ( 2.034 -1.651 8.471) 8.866 11.554 ( -3.269 -1.513 -9.120) 9.806 11.723 ( -8.919 -7.224 1.907) 11.635 11.899 ( -0.727 2.756 0.631) 2.920 12.172 ( -7.325 -6.819 6.676) 12.030 12.500 ( -3.909 1.392 -3.498) 5.427 13.047 ( 14.009 5.961 2.358) 15.405 13.462 ( 3.669 0.608 -0.745) 3.793 13.593 ( -1.808 -1.512 0.843) 2.503 13.758 ( 1.898 -1.271 1.127) 2.547 13.780 ( 1.440 1.439 -10.161) 10.363 14.165 ( 1.232 0.757 2.148) 2.589 14.241 ( 6.135 4.093 1.276) 7.485 15.059 ( 5.012 -7.153 -13.146) 15.783 15.700 ( -2.116 14.783 9.109) 17.493 15.920 ( 2.235 12.779 13.195) 18.504 16.307 ( 8.862 1.060 2.419) 9.247 16.816 ( -5.361 -19.374 -8.308) 21.751 17.550 ( -0.966 3.316 3.588) 4.981 17.804 ( 3.517 -2.013 -7.907) 8.885 18.089 ( -1.939 -0.771 6.823) 7.135 18.666 ( -20.837 -5.218 0.608) 21.489 19.235 ( -11.019 -10.677 -2.174) 15.496 19.711 ( -21.670 -8.166 -0.439) 23.162 19.987 ( -5.862 9.001 11.381) 15.650 20.073 ( -2.803 -15.766 -15.990) 22.630 21.122 ( 10.566 10.140 8.175) 16.772 21.325 ( 8.335 3.365 -1.752) 9.158 21.658 ( 10.939 -0.628 1.900) 11.121 22.034 ( -4.102 1.511 -3.748) 5.758 22.899 ( 14.902 8.789 -0.429) 17.306 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.062 ( -24.379 -8.839 0.194) 25.933 1.429 ( -26.859 -18.720 4.440) 33.039 1.987 ( -33.995 -20.594 4.835) 40.039 2.740 ( 8.228 1.376 3.303) 8.972 2.865 ( -3.037 5.132 -7.287) 9.416 3.005 ( -1.530 -3.003 -4.322) 5.481 3.038 ( 1.558 -1.245 5.539) 5.887 3.192 ( -6.745 -0.609 4.354) 8.051 3.316 ( 2.160 3.543 1.687) 4.479 3.542 ( -0.886 -8.323 0.068) 8.370 3.784 ( 1.503 2.906 -5.274) 6.207 3.923 ( -0.888 1.985 -1.989) 2.947 4.140 ( -4.082 -5.250 1.374) 6.790 4.417 ( -2.901 1.794 -4.539) 5.678 4.602 ( 6.302 3.864 2.835) 7.917 4.704 ( -0.557 -3.426 2.046) 4.029 4.786 ( 4.044 -0.272 -0.025) 4.053 4.971 ( 1.317 6.206 7.636) 9.928 5.018 ( -1.524 -1.021 -4.727) 5.070 5.390 ( 2.826 -0.026 -6.465) 7.056 5.471 ( 1.292 0.279 6.176) 6.315 5.521 ( -7.533 -3.316 -8.562) 11.876 5.806 ( 6.521 4.949 -2.952) 8.703 5.988 ( -1.470 -1.195 1.048) 2.165 6.047 ( 4.387 2.122 3.894) 6.238 6.067 ( 1.801 -0.253 4.701) 5.041 6.469 ( -2.955 -1.787 -0.935) 3.578 6.911 ( -6.834 -4.055 0.586) 7.968 7.453 ( 9.460 5.988 0.689) 11.217 7.983 ( 9.019 0.068 0.810) 9.055 8.019 ( 0.664 7.008 -1.521) 7.202 8.321 ( 2.188 -1.048 7.030) 7.437 8.720 ( -5.845 -6.796 -7.459) 11.662 8.781 ( -7.784 0.412 -4.781) 9.145 8.957 ( 8.921 4.901 3.846) 10.881 9.211 ( 7.542 -19.494 -7.413) 22.177 9.225 ( -8.735 7.923 -0.152) 11.794 9.531 ( 0.914 7.881 -1.122) 8.013 9.747 ( -0.677 -1.343 3.107) 3.452 9.821 ( -1.232 -0.850 1.879) 2.402 9.988 ( -0.332 1.763 -2.760) 3.292 10.751 ( 7.971 6.332 8.101) 13.010 10.884 ( 9.041 7.375 -6.280) 13.251 10.999 ( 8.714 4.563 -2.362) 10.116 11.346 ( 2.707 2.760 3.867) 5.468 11.470 ( 3.001 -6.231 -6.979) 9.825 11.555 ( -5.090 -2.273 0.832) 5.637 11.876 ( -5.106 3.237 -1.766) 6.298 12.029 ( -3.908 -6.629 7.123) 10.486 12.386 ( -7.483 -3.627 0.492) 8.330 13.263 ( 3.178 1.091 2.390) 4.123 13.387 ( -4.924 -2.875 -2.910) 6.402 13.515 ( -5.752 -0.703 -2.344) 6.251 13.781 ( 7.548 3.938 0.355) 8.521 14.014 ( 13.662 3.085 -1.418) 14.077 14.240 ( 6.161 3.418 -1.877) 7.291 14.423 ( 6.986 5.420 2.305) 9.138 14.947 ( -1.494 -10.175 -11.329) 15.301 15.858 ( -7.940 19.048 17.934) 27.340 16.246 ( 16.395 12.151 5.751) 21.202 16.363 ( -8.601 -18.438 -3.109) 20.582 16.609 ( 11.170 3.679 -2.411) 12.005 17.557 ( -1.976 2.668 1.669) 3.716 17.745 ( 0.739 -8.604 -8.188) 11.901 18.134 ( -6.204 14.144 -1.324) 15.501 18.306 ( -8.620 -14.936 9.986) 19.927 18.874 ( -13.830 -13.367 -2.016) 19.339 19.158 ( -26.961 -11.951 -2.623) 29.608 19.660 ( -13.493 -14.013 -4.756) 20.026 20.212 ( 5.975 11.705 8.939) 15.893 21.387 ( 6.855 4.137 5.685) 9.820 21.495 ( 7.247 5.708 -3.474) 9.858 21.829 ( 8.062 -0.015 -1.042) 8.129 21.998 ( -1.282 1.324 0.150) 1.849 23.236 ( 13.496 7.816 -1.615) 15.680 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.737 ( 11.606 11.323 22.671) 27.872 1.022 ( -5.323 23.866 23.155) 33.676 1.653 ( -2.738 29.200 42.844) 51.921 2.606 ( 1.043 3.057 -15.959) 16.283 2.654 ( 1.890 2.412 -14.798) 15.112 3.077 ( -3.650 -1.204 7.549) 8.471 3.100 ( 0.339 2.243 5.503) 5.952 3.211 ( 1.627 -1.006 4.071) 4.498 3.506 ( -5.467 -2.849 -1.262) 6.293 3.553 ( 5.563 -8.039 2.077) 9.995 3.709 ( -0.935 -3.230 -7.726) 8.426 3.810 ( -3.808 3.845 -3.723) 6.568 4.041 ( 5.514 9.502 -1.026) 11.034 4.300 ( 0.423 3.824 -0.735) 3.916 4.662 ( -1.575 -0.712 0.974) 1.984 4.768 ( 0.503 -5.080 1.532) 5.330 4.818 ( -1.203 -1.487 -1.529) 2.449 4.989 ( -0.854 6.376 -22.673) 23.568 5.105 ( 0.066 -4.148 6.725) 7.902 5.181 ( 2.477 -1.630 7.471) 8.038 5.371 ( 0.077 -4.238 -7.137) 8.300 5.561 ( -0.161 3.212 3.132) 4.490 5.888 ( 0.245 -5.663 -4.866) 7.470 5.977 ( -1.924 -0.194 0.547) 2.009 6.036 ( -0.056 3.144 -0.309) 3.159 6.252 ( -0.089 5.753 -4.652) 7.399 6.466 ( -0.603 -7.514 14.920) 16.716 6.749 ( 0.245 3.152 -3.728) 4.888 7.731 ( -1.088 -5.205 9.654) 11.021 7.987 ( 11.091 -1.005 -7.300) 13.316 8.216 ( -4.785 0.552 -6.330) 7.955 8.275 ( -7.989 -1.234 -5.811) 9.956 8.580 ( -7.846 -9.575 0.016) 12.379 8.658 ( 5.011 9.499 1.026) 10.789 8.980 ( -6.417 -3.064 -3.753) 8.040 9.098 ( -9.469 -3.273 -0.905) 10.060 9.247 ( 12.996 0.722 3.185) 13.400 9.404 ( 4.451 12.701 -2.852) 13.758 9.641 ( -4.602 12.178 2.281) 13.217 9.926 ( 5.454 -3.455 4.982) 8.155 9.975 ( -3.120 0.254 5.914) 6.691 10.792 ( 7.474 -10.308 -15.292) 19.899 11.115 ( -2.224 -4.570 -2.448) 5.641 11.142 ( -3.736 -8.055 -4.128) 9.792 11.334 ( -0.072 2.822 -5.493) 6.176 11.382 ( 0.282 2.337 -6.839) 7.233 11.655 ( 2.986 -5.047 4.342) 7.297 11.808 ( -0.720 -1.232 0.962) 1.721 11.919 ( -0.706 7.218 0.642) 7.280 12.289 ( -5.712 11.266 13.345) 18.375 13.165 ( 1.142 4.673 0.747) 4.868 13.360 ( 2.599 -2.942 1.150) 4.090 13.514 ( -0.779 -3.819 1.257) 4.096 13.840 ( 1.989 5.119 -5.114) 7.504 14.243 ( 1.032 -1.765 2.307) 3.083 14.462 ( -3.266 -17.322 0.627) 17.639 14.559 ( -2.168 -2.659 -5.091) 6.139 14.650 ( -4.135 -0.533 -2.036) 4.640 15.807 ( -1.535 15.721 -1.761) 15.894 16.599 ( 16.467 -21.990 20.479) 34.265 16.795 ( -0.952 -20.868 6.436) 21.859 16.979 ( -11.870 -22.744 4.459) 26.040 17.558 ( 17.486 -0.090 -2.915) 17.728 17.589 ( -9.473 0.369 -3.738) 10.190 17.855 ( 8.261 16.445 -3.293) 18.696 18.305 ( -10.776 5.330 0.701) 12.042 18.497 ( -5.663 25.208 -5.098) 26.334 18.533 ( 1.762 12.167 -0.430) 12.301 18.966 ( -2.395 33.953 -10.172) 35.525 21.135 ( 9.710 -32.792 31.235) 46.317 21.534 ( -6.214 -4.229 1.951) 7.766 21.597 ( 9.929 -4.053 -2.755) 11.073 21.893 ( 0.497 -5.263 -2.163) 5.712 22.024 ( -6.663 0.877 0.041) 6.721 23.463 ( -0.060 -11.488 -1.509) 11.587 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.242 ( 12.048 17.648 14.174) 25.642 1.312 ( 7.620 21.685 13.886) 26.854 2.137 ( 10.207 12.666 10.993) 19.633 2.655 ( 3.369 12.164 3.715) 13.158 2.719 ( 6.836 5.830 -10.837) 14.077 2.999 ( -3.742 -4.334 6.505) 8.666 3.187 ( 0.722 1.854 6.017) 6.338 3.222 ( -3.260 1.372 3.674) 5.099 3.376 ( -1.871 3.362 0.159) 3.850 3.523 ( 1.480 -8.889 1.706) 9.171 3.706 ( 3.683 -1.446 -5.755) 6.984 3.828 ( 0.669 5.498 -0.618) 5.573 4.235 ( 6.643 7.657 -2.506) 10.442 4.355 ( 2.751 1.634 -4.454) 5.484 4.580 ( -4.552 -4.535 -1.213) 6.538 4.714 ( -0.254 -6.671 1.439) 6.829 4.780 ( -2.226 0.380 3.499) 4.164 4.973 ( 1.113 8.801 -22.022) 23.742 5.037 ( -4.716 -4.161 4.645) 7.818 5.239 ( 2.368 -1.290 3.106) 4.113 5.287 ( -2.337 -1.802 -6.551) 7.185 5.623 ( 1.540 1.602 3.801) 4.403 5.809 ( -0.808 -6.398 -5.330) 8.367 5.909 ( -2.502 -1.490 -1.783) 3.414 6.071 ( -0.162 3.198 3.796) 4.966 6.314 ( 0.803 1.174 2.682) 3.036 6.411 ( -2.078 -3.527 5.176) 6.600 6.812 ( 2.888 6.802 -3.786) 8.303 7.639 ( -5.366 -10.705 8.605) 14.746 8.025 ( -4.250 -11.158 2.980) 12.306 8.045 ( -5.486 7.796 -10.478) 14.166 8.271 ( 4.750 5.353 -6.957) 9.981 8.436 ( 0.664 -5.150 1.215) 5.333 8.741 ( -0.308 1.191 -4.543) 4.706 8.872 ( 2.707 -6.418 4.761) 8.437 8.994 ( -0.501 -1.598 -4.919) 5.196 9.493 ( 2.197 2.979 0.145) 3.705 9.532 ( 10.208 1.345 -2.279) 10.545 9.653 ( -5.845 5.425 2.007) 8.223 9.862 ( -7.807 -1.798 6.071) 10.052 10.065 ( 5.464 2.853 5.129) 8.019 10.639 ( -7.684 -4.837 -13.081) 15.923 10.975 ( -1.273 -8.754 -3.777) 9.618 11.086 ( 1.157 -2.669 -3.192) 4.319 11.266 ( -5.079 -4.540 0.851) 6.866 11.413 ( 3.384 4.973 -4.847) 7.725 11.675 ( 2.531 -6.958 7.208) 10.333 11.829 ( 1.174 4.917 -3.605) 6.209 11.995 ( 1.089 6.853 0.633) 6.968 12.338 ( -2.222 3.167 10.707) 11.385 13.223 ( -0.307 2.198 -1.860) 2.896 13.362 ( 0.269 -1.267 -0.912) 1.584 13.571 ( 5.940 3.264 0.452) 6.793 13.853 ( -1.261 -2.163 0.938) 2.674 14.126 ( -5.426 -16.683 3.674) 17.924 14.266 ( -4.491 -7.792 -0.603) 9.014 14.501 ( 1.519 -2.731 -5.512) 6.337 14.549 ( -2.135 1.417 -3.369) 4.233 15.928 ( -3.639 11.409 -0.185) 11.977 16.426 ( -10.043 -15.970 6.083) 19.822 16.591 ( -7.378 -17.604 -0.232) 19.089 16.846 ( 5.497 1.396 17.595) 18.487 17.344 ( -9.858 -3.453 -10.802) 15.027 17.874 ( 18.715 -6.755 4.681) 20.440 18.118 ( -5.731 24.358 -5.122) 25.542 18.305 ( 3.660 10.456 0.525) 11.091 18.560 ( 8.864 9.305 0.054) 12.852 19.008 ( 17.017 23.535 -2.079) 29.117 19.241 ( 6.530 16.274 -4.777) 18.174 21.070 ( -2.459 -14.974 26.945) 30.924 21.371 ( -9.250 -4.494 3.196) 10.769 21.687 ( 3.306 -2.618 -2.133) 4.726 21.737 ( -6.420 -7.120 -5.474) 11.040 21.920 ( -2.581 -2.899 -0.543) 3.919 23.243 ( -7.967 -14.062 -4.237) 16.708 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.563 ( 3.693 18.507 5.254) 19.589 1.825 ( 18.392 14.049 4.648) 23.606 2.285 ( 4.002 5.207 -10.795) 12.636 2.749 ( 3.765 0.091 -9.299) 10.033 2.842 ( -5.137 -3.869 9.317) 11.321 3.112 ( -4.338 -2.211 6.210) 7.892 3.193 ( 14.171 12.973 15.899) 24.938 3.295 ( 0.349 4.163 4.894) 6.435 3.462 ( 1.173 2.719 0.786) 3.064 3.500 ( 5.818 -0.186 -1.291) 5.963 3.752 ( 2.955 1.384 0.484) 3.299 3.938 ( 4.596 8.281 4.693) 10.570 4.322 ( -1.870 -6.282 -1.293) 6.681 4.384 ( 1.306 3.673 -8.302) 9.172 4.472 ( 2.534 -3.374 -2.274) 4.793 4.641 ( -0.660 -6.613 0.380) 6.657 4.772 ( -3.601 2.631 7.130) 8.410 4.922 ( -6.897 0.342 3.967) 7.964 5.022 ( 3.925 7.058 -18.556) 20.237 5.178 ( -2.173 -1.828 -9.731) 10.136 5.298 ( 2.370 1.767 0.896) 3.089 5.611 ( -9.370 -1.888 -5.829) 11.195 5.657 ( -1.013 -5.116 0.005) 5.215 5.921 ( 4.963 -2.992 3.146) 6.593 6.121 ( 0.663 2.349 3.917) 4.616 6.253 ( -5.290 -6.562 9.814) 12.937 6.413 ( 0.602 1.814 -4.639) 5.017 6.927 ( 0.328 8.368 -2.319) 8.689 7.421 ( -5.625 -10.560 4.267) 12.703 7.932 ( 0.236 -3.116 6.226) 6.966 8.000 ( -4.275 6.766 -5.620) 9.779 8.358 ( 4.384 0.416 -13.188) 13.904 8.479 ( 6.130 -2.472 8.169) 10.508 8.678 ( -0.080 -4.933 -1.900) 5.287 8.927 ( 7.055 -9.280 -0.817) 11.686 9.020 ( 5.041 4.860 -3.811) 7.972 9.430 ( -6.309 -10.345 0.748) 12.140 9.557 ( -6.050 3.323 -0.993) 6.974 9.613 ( -4.016 2.326 -1.043) 4.756 9.858 ( 3.531 5.583 5.064) 8.323 10.206 ( 1.676 5.949 4.523) 7.659 10.379 ( -10.152 -4.051 -9.703) 14.616 10.838 ( -3.446 -8.307 -3.627) 9.697 11.061 ( -2.223 2.307 -5.049) 5.980 11.162 ( -1.604 -5.097 8.426) 9.978 11.554 ( 7.445 5.734 -3.799) 10.137 11.650 ( 0.420 -7.575 7.531) 10.690 11.923 ( 4.584 7.757 -5.002) 10.306 12.093 ( 0.968 7.566 3.279) 8.302 12.373 ( 3.638 -5.076 4.094) 7.467 13.121 ( -8.510 -5.229 -0.870) 10.026 13.406 ( 4.246 1.440 -3.050) 5.423 13.614 ( -6.074 -0.279 -0.388) 6.093 13.791 ( -3.200 -4.527 2.391) 6.038 13.953 ( 3.191 -10.952 -3.720) 11.999 14.113 ( -3.309 -1.938 4.383) 5.824 14.379 ( -5.946 -5.181 1.921) 8.117 14.658 ( 8.763 3.722 -11.779) 15.146 15.868 ( -8.573 1.132 -0.177) 8.649 16.167 ( -10.731 -7.347 15.072) 19.907 16.346 ( -6.462 -7.697 4.558) 11.035 17.055 ( 9.714 -1.538 -2.557) 10.162 17.141 ( -5.898 5.915 -11.211) 13.980 18.045 ( 7.021 -8.733 12.337) 16.666 18.160 ( -11.184 21.519 -6.802) 25.187 18.642 ( 16.698 14.166 7.258) 23.069 18.914 ( 18.486 6.900 -2.455) 19.884 19.421 ( 5.392 14.061 -5.287) 15.960 19.567 ( 20.373 9.850 -1.535) 22.681 20.991 ( -7.213 -2.777 19.919) 21.366 21.139 ( -13.003 -5.537 4.966) 14.980 21.430 ( -11.895 -10.864 -1.295) 16.162 21.684 ( -5.756 1.906 -8.017) 10.051 21.913 ( 8.893 -6.734 0.105) 11.155 22.901 ( -11.321 -13.639 -6.245) 18.793 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.783 ( 5.218 9.107 -4.146) 11.285 2.199 ( 8.765 10.829 -0.088) 13.932 2.405 ( 2.785 6.424 -0.554) 7.023 2.745 ( -4.450 -0.326 7.061) 8.353 2.792 ( 4.303 0.680 -4.497) 6.261 3.039 ( -1.576 -6.234 3.884) 7.512 3.318 ( -3.038 1.669 1.756) 3.886 3.404 ( 2.740 -4.295 -0.667) 5.138 3.532 ( 4.542 0.927 0.307) 4.646 3.681 ( 5.893 8.543 3.227) 10.869 3.830 ( 1.352 3.929 4.060) 5.809 4.147 ( -0.112 -1.457 0.640) 1.595 4.243 ( 3.013 2.637 6.153) 7.341 4.368 ( 4.369 -4.577 -0.134) 6.329 4.503 ( -0.077 -1.353 -3.903) 4.131 4.590 ( 2.450 -1.159 -1.145) 2.942 4.752 ( 0.257 -1.746 5.515) 5.791 4.887 ( -7.263 11.973 1.478) 14.082 5.001 ( -2.974 -2.310 -0.468) 3.795 5.164 ( 3.546 1.793 -16.054) 16.538 5.298 ( -12.912 -1.657 -6.715) 14.648 5.389 ( 3.076 3.188 0.316) 4.441 5.646 ( 3.560 -3.759 -1.921) 5.522 5.956 ( -0.369 -5.350 4.245) 6.840 6.137 ( -3.889 -2.900 2.006) 5.250 6.183 ( 2.139 1.844 3.578) 4.559 6.393 ( -1.757 -0.945 -0.661) 2.101 6.877 ( -9.500 2.885 1.131) 9.993 7.421 ( 8.359 -0.232 0.602) 8.384 7.966 ( -2.920 3.040 -0.813) 4.293 7.985 ( 4.572 -2.981 3.821) 6.663 8.323 ( -2.733 1.120 -5.867) 6.568 8.626 ( 6.335 -0.659 8.630) 10.726 8.689 ( 5.487 -4.112 -0.024) 6.857 8.905 ( 7.394 -10.958 -8.089) 15.497 9.114 ( -6.810 -10.091 -0.188) 12.175 9.213 ( 0.828 8.057 -4.120) 9.087 9.477 ( -3.294 -1.517 -1.445) 3.904 9.599 ( -2.258 6.125 -0.266) 6.533 10.007 ( 0.257 7.202 2.165) 7.524 10.128 ( -3.191 -5.293 -2.940) 6.844 10.271 ( -5.192 4.664 1.647) 7.170 10.685 ( -3.565 -4.924 -2.919) 6.743 11.000 ( -5.668 5.916 -8.570) 11.856 11.178 ( 1.437 -4.160 14.314) 14.975 11.614 ( 4.640 -8.591 5.310) 11.114 11.735 ( 5.297 4.976 -5.452) 9.086 12.095 ( 6.518 8.700 -0.690) 10.892 12.225 ( 1.452 8.754 5.640) 10.515 12.392 ( 6.429 -8.202 -2.689) 10.763 12.844 ( -14.051 -6.090 -0.432) 15.320 13.351 ( -6.791 -8.180 -1.235) 10.703 13.565 ( 3.983 0.115 -5.280) 6.615 13.673 ( -2.185 -3.932 -0.553) 4.533 13.912 ( 2.262 -5.773 1.183) 6.313 14.166 ( 1.797 4.071 2.248) 4.985 14.234 ( -5.383 -4.799 1.841) 7.443 14.776 ( 6.390 3.344 -12.527) 14.455 15.727 ( -5.100 -2.754 -0.301) 5.804 16.030 ( -6.250 -3.000 15.712) 17.173 16.243 ( -7.381 4.180 11.992) 14.689 16.961 ( 4.509 -15.200 -14.642) 21.581 17.279 ( 1.701 15.182 -7.656) 17.088 18.093 ( -4.868 4.128 12.180) 13.751 18.145 ( -4.382 7.506 -0.948) 8.743 19.125 ( 21.299 4.313 4.101) 22.115 19.251 ( 9.186 10.810 -0.676) 14.202 19.550 ( 4.376 0.985 -5.998) 7.489 19.975 ( 14.413 7.283 -1.994) 16.271 20.867 ( -11.527 -5.121 4.044) 13.246 20.908 ( -11.979 2.850 7.849) 14.603 21.157 ( -5.339 -8.207 5.498) 11.229 21.518 ( -8.191 -2.038 -4.672) 9.648 22.058 ( 11.778 -1.978 -2.321) 12.166 22.557 ( -9.778 -10.586 -5.452) 15.407 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.922 ( 5.185 3.784 -3.867) 7.494 2.341 ( -13.402 0.146 5.089) 14.336 2.392 ( 3.887 4.490 3.000) 6.654 2.807 ( 1.862 4.704 5.915) 7.784 2.844 ( 2.070 -2.680 -1.652) 3.768 2.960 ( -1.146 -1.242 -2.109) 2.703 3.203 ( -8.335 -0.449 -6.413) 10.526 3.401 ( 3.372 -4.283 -2.241) 5.894 3.615 ( 4.451 -2.273 3.682) 6.208 3.824 ( -0.388 4.220 3.157) 5.284 3.883 ( -1.389 3.097 3.734) 5.046 4.096 ( -0.539 -0.499 -0.022) 0.735 4.231 ( -6.217 -3.562 -3.939) 8.177 4.356 ( 4.685 -4.769 -2.275) 7.062 4.447 ( -4.769 -6.252 -1.501) 8.005 4.644 ( 0.316 -1.782 1.261) 2.205 4.764 ( -6.432 -0.365 2.712) 6.989 4.893 ( -4.652 -1.404 -4.088) 6.350 4.984 ( 12.488 8.779 8.454) 17.450 5.132 ( -1.588 11.652 2.523) 12.027 5.244 ( 1.037 1.279 -5.331) 5.580 5.527 ( 8.433 4.284 -4.985) 10.692 5.677 ( 3.138 -3.414 1.064) 4.757 5.842 ( -4.861 -5.935 2.188) 7.978 6.073 ( -1.853 0.656 -6.085) 6.395 6.216 ( -2.311 -0.636 -0.761) 2.515 6.377 ( 1.860 -1.046 5.842) 6.220 6.805 ( -3.028 6.354 1.755) 7.254 7.544 ( 5.296 -6.412 2.482) 8.679 7.906 ( -3.660 -1.392 -0.089) 3.917 8.059 ( 0.460 2.249 -0.749) 2.415 8.307 ( -0.081 5.448 3.470) 6.460 8.662 ( 3.462 -8.786 2.811) 9.854 8.745 ( -2.093 -3.562 1.036) 4.259 8.859 ( -0.267 0.286 -1.068) 1.137 9.009 ( 13.080 -9.138 -11.077) 19.424 9.351 ( 3.154 8.143 -6.044) 10.620 9.399 ( 0.181 -3.535 -0.898) 3.652 9.576 ( -8.361 4.973 -4.435) 10.691 10.001 ( 5.469 -2.952 7.298) 9.586 10.182 ( -9.759 3.197 5.328) 11.569 10.222 ( 3.884 8.266 -1.005) 9.188 10.590 ( -2.287 -2.142 -1.234) 3.368 10.927 ( -4.921 5.815 -9.424) 12.117 11.215 ( 0.978 -3.729 12.681) 13.255 11.647 ( 2.847 -3.167 -2.477) 4.927 11.789 ( 2.250 -2.001 -1.028) 3.182 12.147 ( -8.548 -2.446 2.397) 9.208 12.379 ( 2.348 11.005 1.299) 11.327 12.428 ( 4.863 -7.453 -1.541) 9.032 12.655 ( -0.292 3.169 -0.797) 3.281 13.185 ( 2.457 -7.446 -1.093) 7.917 13.571 ( 3.087 -3.339 -4.650) 6.504 13.688 ( 1.436 1.356 -3.094) 3.671 13.908 ( 1.317 -3.215 2.862) 4.501 14.124 ( -1.241 -5.490 0.548) 5.655 14.205 ( -2.679 3.542 1.733) 4.768 14.856 ( 4.318 4.325 -11.457) 12.985 15.650 ( -0.362 -2.374 0.039) 2.402 16.014 ( 0.892 -2.347 10.647) 10.939 16.269 ( -7.899 14.417 18.572) 24.802 16.819 ( 3.326 -16.535 -11.710) 20.533 17.391 ( 3.083 6.089 -8.052) 10.556 18.050 ( -12.192 14.504 -5.263) 19.665 18.163 ( -0.536 -2.361 14.984) 15.178 19.324 ( -6.274 -0.614 -2.298) 6.710 19.376 ( 2.684 -3.344 -4.627) 6.308 19.660 ( 10.498 0.818 0.699) 10.553 20.141 ( 0.505 0.354 -1.384) 1.515 20.599 ( -13.988 -6.630 2.206) 15.636 20.868 ( 0.803 10.123 5.726) 11.658 21.122 ( 0.990 -0.426 2.751) 2.954 21.391 ( -0.294 -2.616 0.901) 2.782 22.155 ( 0.327 -5.034 -7.234) 8.820 22.423 ( 7.778 -0.318 -0.116) 7.785 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.900 ( -15.553 2.712 0.738) 15.805 2.126 ( -9.739 -7.457 5.567) 13.470 2.402 ( -4.013 0.058 0.825) 4.097 2.754 ( 5.881 -9.098 7.690) 13.285 2.939 ( -4.487 6.236 -7.142) 10.490 3.001 ( -2.376 -2.319 -3.870) 5.100 3.035 ( -2.335 11.365 -0.205) 11.605 3.378 ( 2.166 -7.964 -5.719) 10.041 3.582 ( -9.120 -3.624 4.369) 10.742 3.761 ( -5.041 -1.855 2.821) 6.068 3.851 ( -17.996 -5.892 0.033) 18.936 3.946 ( -0.279 1.407 0.620) 1.563 4.201 ( 1.843 1.993 0.359) 2.738 4.269 ( 2.898 -4.698 0.509) 5.544 4.477 ( 7.215 3.822 -5.565) 9.881 4.605 ( 0.083 -2.854 -0.441) 2.889 4.761 ( -1.548 0.989 1.017) 2.099 4.863 ( 3.805 0.553 1.366) 4.080 5.203 ( -6.500 4.727 7.351) 10.891 5.268 ( 5.153 3.114 -8.497) 10.414 5.307 ( 8.616 4.026 9.619) 13.527 5.633 ( 0.430 0.373 -6.669) 6.693 5.711 ( 4.503 0.229 -3.024) 5.429 5.778 ( 2.958 -1.655 4.376) 5.535 6.035 ( -0.359 2.758 -8.441) 8.887 6.117 ( -4.876 -3.861 3.210) 6.999 6.450 ( 3.225 -0.086 3.491) 4.753 6.922 ( 4.891 9.953 3.085) 11.511 7.441 ( -5.925 -12.701 0.812) 14.038 7.827 ( -1.104 -4.494 1.759) 4.951 8.057 ( -4.442 9.342 0.484) 10.356 8.467 ( 6.555 4.239 2.766) 8.281 8.533 ( -4.568 -1.322 -2.845) 5.542 8.783 ( 6.451 -4.588 0.412) 7.927 8.935 ( 5.763 -7.595 -6.003) 11.267 9.003 ( 4.043 -3.153 -10.577) 11.754 9.340 ( -5.502 -2.041 -1.494) 6.056 9.465 ( 7.872 -1.098 0.997) 8.010 9.543 ( 2.428 9.451 -6.307) 11.619 10.042 ( -9.493 0.331 6.061) 11.268 10.147 ( -1.224 2.430 9.072) 9.471 10.361 ( 5.836 7.935 2.119) 10.076 10.600 ( 6.488 -1.360 1.902) 6.896 10.872 ( -1.676 3.958 -10.145) 11.018 11.258 ( 2.047 -0.546 7.844) 8.125 11.552 ( -5.239 -3.965 -10.079) 12.032 11.809 ( -0.277 -5.115 5.078) 7.213 11.971 ( -8.472 4.295 1.695) 9.649 12.292 ( -10.670 -5.516 3.518) 12.516 12.427 ( 5.726 -7.137 -6.705) 11.343 12.898 ( 11.889 11.258 1.580) 16.450 13.317 ( 13.623 -0.205 -0.327) 13.628 13.586 ( 2.212 0.069 -6.035) 6.428 13.666 ( -0.847 -1.154 0.269) 1.457 13.880 ( -5.183 0.052 -0.775) 5.241 14.091 ( 3.615 -5.869 0.992) 6.963 14.219 ( 1.521 3.188 2.770) 4.489 14.911 ( 1.913 3.482 -11.522) 12.188 15.690 ( 6.826 0.321 1.669) 7.035 16.095 ( 6.719 -1.890 6.262) 9.377 16.393 ( -8.019 19.328 21.464) 29.976 16.619 ( -1.341 -18.665 -8.921) 20.731 17.464 ( 6.018 -1.194 -5.137) 8.002 17.915 ( -11.826 6.491 -7.750) 15.557 18.197 ( -3.281 4.125 13.327) 14.332 19.046 ( -20.763 1.482 -1.056) 20.842 19.246 ( -6.281 -11.592 -6.086) 14.521 19.790 ( 7.165 -7.507 -7.092) 12.569 19.991 ( -15.042 -4.277 0.691) 15.654 20.332 ( -13.240 1.976 9.904) 16.652 21.107 ( 7.127 8.991 9.155) 14.678 21.188 ( 8.254 1.898 -4.839) 9.754 21.476 ( 8.705 0.217 2.948) 9.193 22.043 ( -1.353 -4.398 -5.709) 7.332 22.682 ( 16.176 3.865 -1.505) 16.699 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.548 ( -26.981 6.212 1.572) 27.731 1.709 ( -23.668 -15.687 7.037) 29.253 2.376 ( -12.155 -0.321 -2.484) 12.410 2.696 ( -6.078 -2.086 5.541) 8.485 2.885 ( 4.466 -4.817 2.540) 7.043 2.935 ( -1.602 2.544 -3.545) 4.648 3.133 ( -4.154 5.057 -0.801) 6.594 3.288 ( -3.715 -7.138 0.849) 8.092 3.373 ( -4.748 5.858 -0.087) 7.541 3.507 ( -8.096 -8.639 1.887) 11.989 3.753 ( 0.884 1.806 -3.745) 4.251 3.952 ( -3.156 -1.804 -0.629) 3.689 4.167 ( 0.703 0.496 6.708) 6.763 4.469 ( 6.214 6.873 -4.009) 10.095 4.526 ( 0.385 2.077 -4.054) 4.571 4.647 ( 6.372 -1.044 -2.761) 7.023 4.724 ( -1.933 -4.689 5.372) 7.388 4.943 ( 2.903 -2.046 1.225) 3.756 5.150 ( -5.655 5.687 5.459) 9.702 5.294 ( 2.763 -3.127 -7.517) 8.598 5.469 ( 2.698 2.365 7.750) 8.540 5.575 ( -5.233 -1.666 -15.070) 16.039 5.744 ( 5.297 5.240 -1.842) 7.675 5.925 ( 6.033 -2.805 -1.139) 6.750 6.029 ( 2.268 -1.865 8.087) 8.604 6.061 ( -1.234 1.792 0.916) 2.361 6.487 ( -0.114 -0.397 -0.408) 0.581 7.038 ( -8.868 0.592 1.691) 9.048 7.305 ( 9.745 -1.298 0.093) 9.831 7.826 ( 4.738 -3.063 3.085) 6.430 8.125 ( -0.495 10.978 2.674) 11.310 8.392 ( -5.516 -0.633 -0.621) 5.587 8.670 ( -0.803 -7.996 -8.681) 11.830 8.731 ( 6.010 0.173 -10.298) 11.925 8.809 ( 4.395 -9.104 -3.385) 10.661 9.094 ( -3.958 2.188 -2.047) 4.964 9.310 ( 6.120 4.492 3.378) 8.309 9.608 ( 1.278 7.028 -4.247) 8.311 9.651 ( 6.858 -1.056 0.370) 6.948 9.878 ( -8.031 -5.848 3.723) 10.609 10.091 ( -7.775 3.370 3.737) 9.261 10.626 ( 13.046 2.596 4.036) 13.901 10.755 ( 7.930 1.350 6.497) 10.340 10.907 ( 6.862 3.089 -7.590) 10.688 11.361 ( 2.199 6.019 1.952) 6.699 11.373 ( -1.749 -5.503 -6.847) 8.957 11.659 ( -9.585 -1.797 -1.906) 9.937 11.976 ( -1.424 3.386 2.234) 4.299 12.068 ( -7.867 -8.035 6.484) 12.981 12.396 ( -0.014 -5.405 -6.116) 8.162 13.170 ( 8.844 3.640 0.172) 9.565 13.432 ( -2.578 -0.402 -3.606) 4.451 13.667 ( 6.720 3.264 5.299) 9.159 13.702 ( -5.821 -3.132 2.981) 7.251 13.791 ( 8.251 8.215 -7.507) 13.854 14.143 ( 7.022 -2.870 -0.011) 7.585 14.344 ( 7.030 1.891 3.176) 7.942 14.861 ( -3.705 -0.205 -13.781) 14.272 15.935 ( 16.538 4.602 2.941) 17.417 16.219 ( 3.258 -15.374 9.721) 18.479 16.365 ( 3.527 -7.410 -10.049) 12.974 16.529 ( -10.832 20.198 21.336) 31.313 17.523 ( 6.408 -6.428 -7.369) 11.691 17.753 ( -8.457 6.870 -3.140) 11.339 18.229 ( -4.149 0.645 14.227) 14.833 18.685 ( -22.134 7.537 -5.994) 24.138 18.911 ( -11.916 -15.883 -5.431) 20.585 19.554 ( -25.470 -3.341 -3.764) 25.962 19.662 ( -7.509 -10.769 -10.440) 16.774 20.363 ( 0.344 9.461 25.385) 27.093 21.261 ( 8.642 -2.852 -1.427) 9.212 21.438 ( 9.877 6.789 4.933) 12.961 21.667 ( 8.831 3.820 0.076) 9.622 21.977 ( 0.730 -4.146 -5.222) 6.707 23.008 ( 17.112 3.224 -3.082) 17.684 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.913 ( -7.405 12.149 12.660) 19.045 1.470 ( -9.511 21.997 18.053) 30.004 2.273 ( -12.900 17.487 15.257) 26.551 2.500 ( -0.213 1.896 -11.298) 11.458 2.696 ( -4.442 9.326 0.148) 10.331 3.141 ( 0.604 0.466 3.639) 3.718 3.163 ( 1.404 -0.233 6.561) 6.714 3.223 ( -4.738 4.508 5.580) 8.597 3.386 ( 4.796 1.342 -0.476) 5.003 3.556 ( -0.333 -0.756 4.427) 4.504 3.719 ( -5.411 -2.505 -8.815) 10.642 3.903 ( -4.496 1.501 -3.733) 6.034 4.027 ( 1.787 1.976 2.307) 3.524 4.344 ( -2.589 3.137 -5.814) 7.095 4.666 ( 0.519 -2.517 -1.625) 3.041 4.722 ( 1.497 -0.905 1.423) 2.255 4.792 ( 1.035 -0.154 -5.032) 5.139 4.983 ( 6.599 -4.138 3.568) 8.567 5.018 ( 0.654 0.908 -5.256) 5.374 5.156 ( -2.558 0.125 -7.245) 7.684 5.293 ( 1.677 -2.795 -4.840) 5.835 5.618 ( -1.024 0.948 4.758) 4.958 5.786 ( 1.692 -7.699 -5.556) 9.644 5.990 ( 2.443 0.813 1.961) 3.236 6.087 ( -2.976 4.815 0.178) 5.663 6.320 ( -1.111 3.363 0.647) 3.600 6.426 ( 2.589 -4.898 7.197) 9.082 6.803 ( -2.683 6.552 -3.697) 7.988 7.673 ( 4.270 -11.927 9.484) 15.825 7.815 ( 5.863 -0.850 -1.353) 6.077 8.065 ( 2.526 -6.275 -5.190) 8.526 8.426 ( -5.485 4.133 -7.639) 10.272 8.657 ( 1.745 10.897 -1.085) 11.089 8.753 ( -4.177 2.104 -7.272) 8.646 8.943 ( -1.210 -8.967 3.836) 9.828 9.065 ( 0.453 -0.556 1.975) 2.101 9.379 ( -1.589 5.079 -8.306) 9.865 9.444 ( -8.273 1.019 0.942) 8.389 9.758 ( 9.277 -2.068 6.585) 11.564 9.819 ( -2.830 3.832 3.182) 5.729 10.028 ( -0.074 -1.934 8.160) 8.387 10.441 ( 9.973 -10.043 -12.037) 18.580 11.004 ( 3.504 -9.763 -2.059) 10.575 11.171 ( -2.573 -3.416 -4.671) 6.333 11.314 ( 0.133 2.457 -4.233) 4.896 11.426 ( -3.909 4.238 -6.482) 8.675 11.598 ( 0.082 -1.800 4.392) 4.747 11.810 ( 1.959 1.130 2.270) 3.204 12.009 ( -1.754 5.452 2.066) 6.088 12.526 ( -3.169 6.672 8.261) 11.082 13.202 ( 0.702 2.105 0.975) 2.424 13.335 ( -2.064 2.277 -4.163) 5.175 13.519 ( -2.990 -3.390 1.660) 4.815 13.792 ( 4.317 -2.467 1.453) 5.180 14.162 ( 4.287 -6.368 2.833) 8.182 14.285 ( 4.447 -12.425 -3.276) 13.597 14.487 ( 3.660 -6.991 1.209) 7.983 14.766 ( -7.367 7.887 -13.753) 17.482 16.028 ( -2.170 15.773 -3.773) 16.362 16.225 ( 10.516 -18.028 20.695) 29.392 16.439 ( 12.423 -17.032 5.726) 21.845 16.853 ( 5.654 -12.869 7.073) 15.736 17.422 ( -4.075 -0.344 -13.607) 14.208 17.730 ( -1.367 2.011 -1.132) 2.683 17.922 ( -3.798 9.196 6.648) 11.966 18.556 ( -3.746 16.696 -0.159) 17.111 18.684 ( -9.331 14.092 -3.058) 17.175 18.982 ( -16.677 21.956 -2.006) 27.644 19.409 ( -12.628 24.817 -9.741) 29.500 20.717 ( 10.953 -27.677 31.030) 42.998 21.368 ( 8.509 -5.838 -3.108) 10.777 21.601 ( -2.303 -2.715 4.468) 5.713 21.747 ( 7.415 -7.058 -3.899) 10.954 22.081 ( -0.829 -0.554 -0.579) 1.153 23.246 ( 7.934 -14.023 -4.127) 16.632 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 ( 11.730 16.116 11.874) 23.202 1.679 ( -4.500 24.028 14.717) 28.534 2.231 ( -5.738 6.145 -5.473) 10.032 2.554 ( 6.249 2.955 -14.095) 15.699 2.864 ( 0.598 20.245 19.564) 28.160 3.094 ( -6.533 -2.547 7.991) 10.632 3.197 ( 2.725 0.695 5.867) 6.506 3.300 ( 1.797 9.101 4.707) 10.402 3.421 ( -3.659 -4.827 4.537) 7.568 3.521 ( -6.133 1.425 -2.491) 6.771 3.612 ( 3.870 2.138 -5.216) 6.837 3.874 ( 0.153 4.190 -0.577) 4.233 4.172 ( 7.300 3.765 -0.380) 8.222 4.315 ( -0.951 1.252 -5.883) 6.090 4.606 ( -2.385 -3.834 -5.229) 6.909 4.652 ( -2.856 -8.058 3.566) 9.263 4.782 ( 0.375 3.960 -11.028) 11.724 5.001 ( 0.600 -3.086 -4.551) 5.531 5.076 ( -2.900 5.847 -5.984) 8.855 5.128 ( 6.447 -3.705 3.764) 8.334 5.275 ( 0.859 -2.837 -0.661) 3.037 5.630 ( -0.118 -1.650 0.004) 1.654 5.706 ( 1.048 -5.006 -2.261) 5.592 6.000 ( -5.812 1.348 -0.231) 5.971 6.080 ( 2.093 -0.557 1.993) 2.943 6.356 ( -1.003 4.845 1.957) 5.320 6.408 ( -0.335 -6.230 4.272) 7.561 6.855 ( 0.390 10.836 -3.825) 11.498 7.595 ( -0.590 -16.504 7.565) 18.165 7.950 ( 4.528 0.765 -2.457) 5.209 7.992 ( 3.479 -5.928 1.079) 6.957 8.353 ( -4.118 8.272 -13.594) 16.437 8.556 ( -13.271 2.556 2.698) 13.782 8.723 ( 0.822 -2.461 0.186) 2.601 8.929 ( 0.057 2.401 -5.770) 6.250 9.027 ( -10.884 -2.921 2.279) 11.497 9.332 ( 8.006 3.889 3.278) 9.485 9.442 ( 1.443 -5.660 -3.501) 6.810 9.795 ( -0.847 -2.861 1.956) 3.568 9.924 ( 4.076 2.783 5.583) 7.452 10.028 ( -0.502 -0.140 5.676) 5.700 10.489 ( 7.997 -6.707 -12.187) 16.045 10.892 ( -1.978 -11.541 -4.669) 12.606 11.055 ( -0.977 -0.910 -1.293) 1.859 11.305 ( -3.100 -2.388 -0.721) 3.979 11.411 ( 0.566 4.008 -1.825) 4.440 11.631 ( 0.889 0.469 4.543) 4.653 11.835 ( -0.336 4.821 -2.434) 5.411 12.076 ( 0.000 7.206 0.105) 7.206 12.528 ( -5.728 1.985 8.893) 10.763 13.244 ( -0.257 0.757 -1.882) 2.044 13.339 ( -0.057 0.255 -2.400) 2.414 13.460 ( 4.134 -0.110 0.242) 4.143 13.848 ( 1.038 -1.984 3.698) 4.323 14.049 ( -4.893 -19.568 2.881) 20.375 14.225 ( 2.026 -4.081 0.441) 4.577 14.449 ( 0.240 -5.147 -1.438) 5.349 14.622 ( -6.333 2.375 -9.694) 11.821 16.046 ( 0.495 1.476 -1.718) 2.318 16.388 ( 0.740 -7.303 6.061) 9.519 16.484 ( 4.827 -9.281 3.552) 11.047 16.719 ( 1.491 -12.121 10.445) 16.070 17.501 ( 9.291 1.997 -9.802) 13.652 17.603 ( -6.859 2.043 -0.365) 7.166 18.113 ( 7.277 8.398 3.684) 11.707 18.553 ( -6.408 15.642 6.669) 18.172 18.786 ( -10.045 15.173 -4.466) 18.736 18.995 ( 3.785 25.893 -7.515) 27.226 19.499 ( -6.294 24.455 -2.543) 25.379 20.822 ( 14.561 -21.968 24.214) 35.790 21.414 ( 3.542 -6.194 -1.384) 7.268 21.542 ( -0.811 -3.904 3.876) 5.561 21.723 ( -0.318 -9.047 -2.715) 9.451 22.000 ( -5.255 -1.990 -2.509) 6.153 23.131 ( -0.108 -17.766 -4.785) 18.400 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.641 ( 15.938 14.730 7.230) 22.875 1.837 ( -4.981 16.940 2.064) 17.778 2.241 ( 2.986 8.628 -8.129) 12.225 2.616 ( 4.431 0.242 -11.837) 12.641 2.981 ( -6.287 -1.084 9.298) 11.277 3.127 ( 3.595 3.776 6.997) 8.726 3.250 ( -6.354 -0.361 11.468) 13.115 3.313 ( 3.058 -4.702 1.402) 5.781 3.478 ( 3.343 10.793 1.248) 11.367 3.568 ( -1.751 15.442 7.305) 17.172 3.715 ( 6.275 6.903 4.139) 10.206 3.958 ( 3.097 4.927 1.676) 6.056 4.269 ( 0.236 -2.844 -4.737) 5.531 4.336 ( 6.457 2.659 0.361) 6.992 4.441 ( -6.814 -4.749 -5.565) 9.998 4.559 ( 0.634 -9.841 1.270) 9.942 4.785 ( 0.473 -0.816 -5.152) 5.237 4.969 ( 1.016 3.026 -10.872) 11.331 5.035 ( -1.141 0.748 -6.695) 6.833 5.206 ( -1.873 5.858 2.018) 6.473 5.262 ( 1.706 -3.639 0.637) 4.070 5.557 ( 0.792 -7.193 -6.507) 9.732 5.708 ( -1.645 -1.258 -1.522) 2.570 5.900 ( -3.741 0.267 3.706) 5.273 6.118 ( 2.188 -2.843 5.224) 6.337 6.299 ( -3.695 -7.594 7.206) 11.102 6.422 ( -0.137 5.262 -3.925) 6.567 6.998 ( 3.334 13.244 -3.535) 14.108 7.401 ( -5.099 -15.297 4.870) 16.844 7.903 ( -0.604 -3.638 2.533) 4.474 8.121 ( 1.734 6.098 -3.516) 7.249 8.331 ( -1.126 7.499 -10.874) 13.257 8.425 ( -4.340 0.062 5.496) 7.003 8.673 ( -3.404 -2.507 1.711) 4.561 8.859 ( -4.019 -1.803 4.735) 6.467 8.949 ( 2.792 0.512 -6.269) 6.882 9.341 ( 0.347 -12.233 -2.808) 12.556 9.508 ( 6.078 -2.755 -0.014) 6.673 9.736 ( -2.958 -3.751 4.562) 6.606 9.973 ( -2.981 9.640 2.773) 10.465 10.159 ( 9.117 2.824 1.416) 9.649 10.403 ( -4.002 -7.988 -9.113) 12.762 10.750 ( -0.155 -8.912 -4.475) 9.973 11.082 ( 2.285 2.382 -3.435) 4.763 11.207 ( -4.009 -2.987 5.549) 7.469 11.481 ( 3.052 0.912 4.088) 5.182 11.654 ( -1.909 4.827 1.889) 5.524 11.906 ( 3.473 4.908 -3.883) 7.158 12.144 ( 0.419 7.187 -2.532) 7.632 12.437 ( -7.806 -1.605 8.558) 11.694 13.151 ( -3.272 -8.040 -1.148) 8.756 13.355 ( 2.157 2.639 -1.665) 3.793 13.646 ( 11.721 -0.112 -2.596) 12.005 13.720 ( -9.481 -12.681 -0.425) 15.839 13.847 ( -1.739 -5.735 6.320) 8.710 14.161 ( -4.039 -3.428 -1.028) 5.396 14.394 ( -1.619 -6.236 2.283) 6.835 14.592 ( 2.657 6.123 -7.030) 9.694 15.950 ( -5.463 -9.257 -1.764) 10.893 16.272 ( -5.457 -7.791 3.679) 10.199 16.451 ( -3.687 5.276 8.606) 10.747 16.760 ( 7.370 -11.192 -5.106) 14.340 17.392 ( -9.339 10.923 -4.811) 15.155 17.835 ( 16.065 -1.004 6.077) 17.206 18.341 ( 14.290 -1.033 1.029) 14.364 18.597 ( -13.890 19.588 -2.146) 24.109 18.901 ( 6.779 20.220 3.935) 21.686 19.363 ( 12.102 13.059 -5.642) 18.677 19.613 ( -4.565 22.117 -0.066) 22.584 20.924 ( 8.611 -15.627 13.897) 22.616 21.309 ( -7.521 -7.312 6.294) 12.233 21.526 ( -8.880 -8.093 -2.840) 12.346 21.593 ( 8.944 -4.942 -0.011) 10.219 21.860 ( -7.019 -1.325 -3.991) 8.182 22.871 ( -5.841 -17.180 -5.855) 19.067 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.824 ( -2.245 7.451 -3.404) 8.494 2.119 ( 13.918 12.527 -3.718) 19.091 2.413 ( 5.414 11.750 -1.322) 13.004 2.612 ( 3.386 -3.766 -6.422) 8.179 2.934 ( -3.585 1.234 7.163) 8.104 3.088 ( -9.452 -2.448 7.900) 12.560 3.255 ( 7.785 -4.084 4.904) 10.067 3.355 ( 0.836 -0.969 1.620) 2.065 3.615 ( -4.749 7.941 -2.774) 9.659 3.678 ( 4.931 11.180 -2.685) 12.511 3.924 ( -1.866 7.677 11.923) 14.303 4.069 ( 4.136 -3.856 1.058) 5.752 4.265 ( -3.898 -4.703 -2.273) 6.518 4.317 ( 5.591 6.548 8.402) 12.030 4.446 ( 2.310 -2.702 -3.418) 4.931 4.504 ( 4.424 -2.755 0.153) 5.213 4.732 ( -0.509 -4.166 0.244) 4.204 4.971 ( -0.647 -2.331 3.955) 4.637 5.048 ( 3.454 7.543 -18.459) 20.237 5.197 ( -7.627 8.057 -1.562) 11.204 5.267 ( 3.656 -2.247 -5.495) 6.972 5.477 ( 0.457 -6.369 -10.320) 12.136 5.571 ( -6.735 -1.705 4.572) 8.317 5.927 ( 0.927 -0.635 5.538) 5.651 6.139 ( 0.917 -6.574 6.440) 9.248 6.198 ( -1.528 -1.563 1.417) 2.605 6.427 ( -2.515 2.387 -1.888) 3.948 7.127 ( -10.425 9.402 0.667) 14.054 7.236 ( 7.953 -8.152 0.082) 11.389 7.911 ( 2.695 0.022 2.960) 4.003 8.099 ( -7.106 6.061 -4.189) 10.236 8.355 ( -0.012 6.474 -5.918) 8.771 8.460 ( 5.890 -5.282 2.358) 8.256 8.629 ( -0.179 -1.286 4.630) 4.809 8.792 ( -1.737 -3.731 3.715) 5.545 9.016 ( 4.187 -5.593 -1.325) 7.111 9.215 ( 0.991 -4.809 -4.789) 6.859 9.482 ( -1.600 -5.772 -3.034) 6.714 9.714 ( 0.033 1.658 8.220) 8.386 10.079 ( 0.423 10.273 1.163) 10.347 10.155 ( -9.122 -7.740 -7.393) 14.063 10.342 ( 5.148 5.841 -3.096) 8.379 10.629 ( -1.269 -8.271 -3.898) 9.231 11.105 ( -1.769 3.351 -5.009) 6.281 11.192 ( 0.277 -0.500 10.460) 10.476 11.519 ( 0.695 -4.604 9.187) 10.300 11.711 ( 0.592 7.911 -4.778) 9.260 12.045 ( 7.846 7.663 -2.115) 11.170 12.184 ( 1.965 -2.807 -5.543) 6.517 12.381 ( -1.984 4.570 9.511) 10.737 12.988 ( -7.600 -6.244 -1.192) 9.908 13.357 ( -5.335 -11.457 2.205) 12.829 13.456 ( 1.329 -6.106 -4.113) 7.481 13.711 ( -6.342 -3.315 2.880) 7.714 13.816 ( 4.040 -1.782 -1.885) 4.802 14.132 ( 3.156 2.254 -4.102) 5.645 14.290 ( -4.151 -5.264 5.208) 8.489 14.713 ( 4.805 7.254 -5.506) 10.297 15.743 ( -4.960 -10.149 0.327) 11.301 16.133 ( -6.306 -2.701 5.536) 8.815 16.503 ( -3.972 8.213 15.550) 18.029 16.667 ( 3.498 -13.383 -15.142) 20.509 17.421 ( -2.659 16.058 -11.267) 19.796 18.064 ( 6.595 -3.733 18.900) 20.363 18.522 ( -14.372 19.269 -5.488) 24.656 18.643 ( 24.563 -6.633 -2.973) 25.616 19.292 ( 9.428 17.511 4.410) 20.371 19.504 ( 1.878 1.867 -2.544) 3.672 19.876 ( 7.513 18.808 -3.287) 20.518 20.896 ( -0.017 -13.199 2.418) 13.418 21.106 ( -8.404 -6.607 4.567) 11.624 21.276 ( -11.590 -4.366 10.118) 15.993 21.656 ( -7.757 3.474 -9.587) 12.812 21.780 ( 11.825 -6.706 0.915) 13.625 22.565 ( -7.600 -13.583 -5.199) 16.410 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.867 ( 2.477 5.099 -5.442) 7.858 2.354 ( 5.264 3.314 1.817) 6.480 2.582 ( 2.156 3.119 -0.646) 3.846 2.656 ( 3.663 1.445 -6.782) 7.843 2.913 ( -1.353 -1.872 4.678) 5.217 2.956 ( -6.298 2.512 9.851) 11.959 3.309 ( -4.329 -2.049 -2.207) 5.273 3.384 ( 2.806 0.724 1.443) 3.238 3.535 ( -1.875 -0.603 -1.216) 2.315 3.855 ( 4.491 7.656 -2.654) 9.264 3.951 ( -3.761 1.776 6.542) 7.753 4.111 ( 3.556 0.802 -4.800) 6.028 4.168 ( -0.234 -2.928 1.525) 3.310 4.372 ( -6.761 -1.600 1.681) 7.148 4.406 ( 1.947 -6.020 0.927) 6.395 4.600 ( 3.450 -1.607 2.275) 4.434 4.831 ( 4.363 -2.647 2.616) 5.734 4.898 ( -1.051 -0.069 3.272) 3.437 5.032 ( -10.670 3.470 -7.227) 13.346 5.135 ( 4.082 5.079 -2.838) 7.107 5.338 ( 4.469 8.460 -10.619) 14.293 5.426 ( 2.781 -1.644 0.088) 3.232 5.560 ( 2.513 -1.850 5.698) 6.496 5.874 ( -5.421 -5.748 2.262) 8.218 6.082 ( -1.052 -0.079 -4.540) 4.661 6.250 ( 2.733 1.087 3.636) 4.677 6.372 ( -3.404 -1.487 1.432) 3.981 6.997 ( -9.103 7.253 1.602) 11.749 7.343 ( 8.236 -7.818 -0.280) 11.360 8.009 ( -6.460 3.126 -0.487) 7.193 8.033 ( 5.502 6.464 1.772) 8.671 8.413 ( -1.563 7.099 0.719) 7.305 8.491 ( 7.521 -10.836 -2.388) 13.405 8.603 ( 1.935 -6.712 -0.573) 7.009 8.822 ( 2.320 -2.320 4.484) 5.556 8.879 ( -4.379 -6.145 0.205) 7.548 9.315 ( 6.637 3.990 -5.422) 9.454 9.373 ( -1.587 -2.589 -2.371) 3.852 9.804 ( -8.818 8.777 -3.477) 12.918 9.888 ( 2.130 -8.192 3.438) 9.136 10.193 ( 2.164 3.184 0.807) 3.933 10.402 ( -3.703 6.932 0.867) 7.907 10.565 ( 2.252 -3.481 -3.743) 5.586 11.028 ( -5.938 -0.448 -5.222) 7.920 11.244 ( -0.433 0.191 10.619) 10.630 11.564 ( 3.415 1.214 5.663) 6.724 11.738 ( 0.293 0.002 -7.313) 7.319 12.120 ( 2.898 -7.377 -1.314) 8.034 12.309 ( 6.978 7.193 -1.169) 10.089 12.500 ( 0.944 7.930 6.105) 10.052 12.761 ( -9.030 1.179 -0.291) 9.111 13.129 ( -7.177 -10.957 -1.127) 13.147 13.383 ( 4.729 -12.282 -2.429) 13.383 13.672 ( 1.178 3.917 -2.942) 5.038 13.855 ( 2.680 -3.006 4.913) 6.353 14.111 ( -2.783 -4.139 -5.212) 7.214 14.269 ( -0.007 2.583 3.443) 4.304 14.841 ( 2.926 8.759 -5.192) 10.594 15.594 ( -0.790 -9.506 0.787) 9.572 16.048 ( -4.326 -0.159 6.596) 7.890 16.526 ( 1.782 -13.551 -3.929) 14.221 16.625 ( -0.900 12.132 8.230) 14.687 17.446 ( -4.353 10.226 -11.805) 16.214 18.161 ( 1.737 -5.477 11.301) 12.677 18.445 ( -13.224 16.876 1.277) 21.478 19.002 ( 22.590 -3.792 -4.661) 23.376 19.364 ( -1.459 -9.032 -4.373) 10.141 19.696 ( 2.543 15.902 3.096) 16.399 20.096 ( 3.924 3.790 -1.664) 5.703 20.708 ( -6.205 -8.436 -0.219) 10.474 20.979 ( -2.721 1.187 1.198) 3.201 21.148 ( -4.560 -3.982 11.054) 12.603 21.490 ( -9.571 4.857 -3.434) 11.269 21.961 ( 12.159 -4.908 -4.326) 13.807 22.334 ( -2.251 -7.232 -2.013) 7.837 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.951 ( 3.199 3.201 -5.172) 6.872 2.445 ( -9.097 -0.999 14.683) 17.302 2.490 ( -2.973 0.476 -1.879) 3.549 2.608 ( -4.463 -3.590 -0.124) 5.729 2.892 ( 3.413 -3.140 -4.314) 6.334 3.036 ( 0.303 1.615 0.980) 1.913 3.185 ( -4.524 6.782 -3.893) 9.034 3.323 ( -3.411 -1.815 -1.257) 4.063 3.598 ( 3.254 -2.757 2.473) 4.930 3.904 ( -7.805 1.359 1.408) 8.047 3.965 ( 1.822 2.462 -0.015) 3.063 4.052 ( -4.356 -2.569 -1.132) 5.182 4.175 ( -4.978 0.519 2.131) 5.440 4.300 ( -2.896 -3.636 -1.409) 4.857 4.347 ( 3.152 1.950 -0.134) 3.709 4.587 ( -2.325 -3.650 0.227) 4.334 4.741 ( 6.737 -1.592 4.469) 8.240 4.860 ( -7.224 0.152 -6.266) 9.564 5.122 ( 8.885 -0.056 1.864) 9.078 5.286 ( 4.110 6.320 4.256) 8.658 5.426 ( -2.756 7.810 1.668) 8.449 5.511 ( 8.646 -1.330 -7.841) 11.748 5.630 ( 3.949 -1.688 3.702) 5.670 5.709 ( -3.047 -6.592 0.431) 7.275 6.054 ( -1.831 4.192 -8.268) 9.449 6.226 ( -6.944 1.005 1.149) 7.110 6.382 ( 5.026 -2.819 4.268) 7.171 7.001 ( -1.218 9.507 1.588) 9.715 7.338 ( 2.265 -11.174 0.075) 11.402 7.903 ( -7.637 -0.227 2.451) 8.024 8.218 ( 0.990 11.961 -0.013) 12.001 8.384 ( 2.639 -6.214 1.022) 6.828 8.514 ( 1.610 -4.889 0.473) 5.169 8.639 ( 7.269 -2.377 -4.172) 8.712 8.746 ( -0.370 -4.286 -2.763) 5.113 8.873 ( 4.037 -1.142 -4.455) 6.120 9.340 ( 1.913 -1.740 7.975) 8.384 9.470 ( 0.645 6.752 -4.687) 8.244 9.591 ( -5.861 4.011 -11.814) 13.784 10.062 ( 8.200 -0.487 8.185) 11.596 10.201 ( -2.795 -1.727 4.426) 5.512 10.462 ( 2.580 7.404 1.595) 8.001 10.534 ( -3.210 -0.777 1.613) 3.676 10.881 ( -3.915 -4.304 -6.853) 8.990 11.275 ( -0.558 1.984 6.930) 7.230 11.581 ( -5.596 -1.241 -10.128) 11.638 11.739 ( 4.838 -1.343 6.788) 8.443 12.151 ( 5.867 -1.419 -1.941) 6.341 12.271 ( -9.937 0.275 -0.812) 9.974 12.449 ( -10.456 -4.182 1.698) 11.389 12.892 ( 3.747 12.902 1.290) 13.497 13.031 ( 13.222 -3.342 -1.705) 13.744 13.426 ( 10.995 -6.087 -3.678) 13.094 13.694 ( -1.913 1.998 -3.101) 4.155 13.903 ( 2.492 -0.984 4.193) 4.976 14.005 ( -1.141 -5.506 0.639) 5.659 14.277 ( -2.797 2.787 0.103) 3.950 14.940 ( -0.305 9.672 -6.555) 11.688 15.544 ( 5.452 -7.900 1.769) 9.760 16.039 ( 0.180 0.047 7.073) 7.075 16.377 ( 0.322 -17.170 -4.387) 17.724 16.793 ( -1.624 17.282 7.835) 19.045 17.416 ( -2.402 2.912 -0.624) 3.826 18.067 ( -6.465 -4.286 -8.756) 11.698 18.442 ( -8.164 12.477 11.875) 19.062 19.137 ( -3.588 -12.437 -8.919) 15.719 19.288 ( 5.034 2.159 -0.139) 5.479 19.719 ( -9.241 1.817 0.070) 9.418 20.107 ( -1.520 -4.487 1.719) 5.039 20.568 ( -7.395 2.143 6.522) 10.091 21.053 ( 6.851 1.780 -6.506) 9.614 21.074 ( 0.509 -5.821 3.973) 7.066 21.476 ( -0.570 10.328 6.093) 12.005 21.967 ( 0.347 -6.610 -5.881) 8.854 22.421 ( 14.076 0.119 -1.359) 14.142 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.886 ( -11.556 -2.889 -4.273) 12.655 2.134 ( -23.216 2.033 6.753) 24.263 2.469 ( -4.579 5.672 -2.243) 7.627 2.630 ( 8.310 -7.505 8.116) 13.829 2.866 ( -1.338 -3.963 -3.509) 5.460 2.982 ( -0.376 0.509 -1.862) 1.966 3.226 ( -4.140 4.461 -1.905) 6.377 3.311 ( 1.115 4.795 0.757) 4.980 3.571 ( -4.088 -2.383 3.446) 5.853 3.613 ( -18.549 -6.908 1.448) 19.846 3.831 ( -8.516 2.378 -2.167) 9.103 4.010 ( -4.852 0.777 2.588) 5.554 4.184 ( -0.602 1.016 3.553) 3.744 4.316 ( 11.698 2.399 -0.707) 11.962 4.511 ( 7.647 1.158 -0.589) 7.756 4.575 ( -0.812 2.824 -2.557) 3.895 4.737 ( -2.674 -2.943 -0.817) 4.059 4.871 ( 4.288 -0.874 3.407) 5.546 5.175 ( 2.349 -6.809 -0.991) 7.271 5.327 ( -6.444 4.174 1.552) 7.833 5.487 ( 3.002 1.620 2.678) 4.337 5.537 ( 1.326 1.092 -14.729) 14.829 5.647 ( 5.340 -5.183 -1.773) 7.650 5.784 ( 7.035 1.110 4.814) 8.597 6.034 ( -1.416 2.755 -0.713) 3.179 6.135 ( -4.323 0.606 2.332) 4.949 6.450 ( 3.397 -1.403 0.470) 3.705 7.112 ( 6.324 -6.893 0.307) 9.359 7.221 ( -6.766 4.936 0.559) 8.394 7.805 ( -2.777 0.159 3.755) 4.673 8.285 ( -3.956 9.246 4.001) 10.824 8.358 ( 0.254 -12.427 -10.752) 16.435 8.515 ( 6.992 -4.296 0.896) 8.255 8.630 ( -1.311 0.402 -8.200) 8.314 8.764 ( 2.709 6.769 -1.112) 7.375 9.055 ( 12.301 3.894 0.524) 12.913 9.311 ( -5.334 -0.480 -2.357) 5.851 9.500 ( 4.838 0.590 3.497) 5.999 9.646 ( 2.915 5.866 -6.482) 9.215 9.999 ( -10.369 -5.350 3.142) 12.084 10.237 ( 1.083 -3.469 5.475) 6.571 10.478 ( 0.413 -0.328 -3.911) 3.947 10.653 ( 10.474 2.289 8.796) 13.868 10.806 ( 1.610 -1.199 -0.080) 2.009 11.335 ( -0.509 -1.101 -1.177) 1.690 11.398 ( -2.367 1.107 -4.959) 5.606 11.791 ( -4.368 0.923 -0.113) 4.466 12.082 ( -8.768 1.967 5.029) 10.297 12.182 ( -8.215 -5.221 -1.570) 9.859 12.291 ( 3.987 1.601 -2.238) 4.844 13.039 ( 8.551 -1.470 -2.094) 8.926 13.339 ( 13.187 4.242 -0.509) 13.862 13.573 ( 6.526 4.100 -4.722) 9.039 13.650 ( 0.671 -1.027 0.432) 1.301 13.926 ( -1.060 3.501 -2.995) 4.728 13.984 ( 2.026 -5.404 8.254) 10.071 14.277 ( 1.820 0.930 0.630) 2.139 14.936 ( -5.453 6.935 -11.714) 14.665 15.675 ( 14.131 -3.430 5.838) 15.669 16.086 ( 0.273 -13.266 13.468) 18.906 16.177 ( 2.236 -6.774 -8.760) 11.297 16.964 ( -2.918 18.808 3.352) 19.326 17.402 ( -2.763 -3.296 5.064) 6.643 17.871 ( -3.924 -1.543 -9.428) 10.328 18.441 ( -8.730 1.310 13.071) 15.773 18.866 ( -9.700 -6.076 -10.574) 15.583 19.178 ( -19.389 4.518 1.299) 19.951 19.628 ( -0.382 -0.807 -6.357) 6.420 19.920 ( -17.019 -1.004 0.353) 17.052 20.555 ( -3.535 3.871 19.805) 20.487 21.048 ( 7.530 -6.715 -4.596) 11.086 21.239 ( 13.302 -3.105 -1.018) 13.698 21.669 ( 4.946 10.778 6.264) 13.412 21.884 ( -0.383 -3.880 -6.497) 7.577 22.700 ( 17.463 0.039 -3.634) 17.837 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.267 ( -15.090 9.586 3.432) 18.204 1.913 ( -10.172 16.025 9.037) 21.022 2.315 ( 1.788 3.656 -8.973) 9.852 2.611 ( -7.918 -3.341 -8.198) 11.877 2.995 ( -0.934 6.197 10.037) 11.832 3.061 ( 4.425 -0.770 6.063) 7.546 3.260 ( -0.885 9.547 3.269) 10.130 3.391 ( -4.142 4.042 3.793) 6.919 3.487 ( -8.114 11.611 7.903) 16.221 3.602 ( -4.758 0.161 0.754) 4.820 3.763 ( -4.960 3.093 3.818) 6.982 3.907 ( 2.276 3.454 -3.080) 5.157 4.123 ( -11.822 -5.740 2.730) 13.423 4.358 ( 2.812 1.532 -5.805) 6.629 4.584 ( 1.295 -6.267 -1.700) 6.621 4.665 ( 6.541 4.662 -4.488) 9.201 4.746 ( 2.697 -0.678 -0.968) 2.945 4.834 ( 4.267 -5.834 4.007) 8.265 4.999 ( -1.229 -5.024 0.793) 5.232 5.210 ( -2.425 6.240 -16.327) 17.646 5.231 ( -1.146 -0.556 -3.486) 3.711 5.566 ( 6.883 -5.332 -7.667) 11.601 5.684 ( 0.841 -2.327 5.270) 5.822 5.994 ( -2.384 -0.098 2.115) 3.188 6.175 ( 0.059 2.900 3.267) 4.368 6.294 ( 5.857 -3.483 8.738) 11.081 6.385 ( -0.404 0.032 -4.306) 4.325 6.919 ( -0.926 8.362 -2.059) 8.662 7.441 ( 6.460 -10.987 3.168) 13.134 7.767 ( -1.895 -1.737 2.106) 3.323 8.062 ( -2.016 4.252 0.023) 4.705 8.475 ( -1.623 -3.017 -2.150) 4.045 8.683 ( 7.396 4.273 -6.447) 10.701 8.740 ( -2.763 0.605 -3.460) 4.470 8.913 ( -2.043 0.464 -2.996) 3.655 9.147 ( -1.857 -1.433 -1.760) 2.932 9.369 ( 5.420 -6.892 1.394) 8.878 9.428 ( -2.437 2.565 -6.196) 7.135 9.698 ( 1.721 -0.679 6.976) 7.217 9.906 ( -1.209 1.166 4.964) 5.240 10.025 ( 1.067 -0.725 5.628) 5.774 10.210 ( 2.585 -3.399 -7.058) 8.249 10.796 ( 6.059 -11.218 -2.929) 13.082 11.090 ( 5.282 -0.493 -6.705) 8.549 11.338 ( 0.003 1.146 4.223) 4.375 11.577 ( -10.435 4.868 -2.644) 11.814 11.672 ( -5.024 1.306 2.592) 5.802 11.794 ( 2.974 5.070 0.988) 5.960 12.104 ( -2.277 3.599 2.010) 4.709 12.589 ( -0.042 -1.529 2.492) 2.924 13.112 ( 8.928 -4.505 -0.562) 10.016 13.414 ( -3.393 3.935 -3.587) 6.314 13.578 ( -0.550 4.338 1.435) 4.602 13.659 ( 2.596 -9.676 0.615) 10.037 14.022 ( 2.571 -9.796 1.843) 10.294 14.107 ( 3.596 -3.138 -3.443) 5.885 14.347 ( 4.772 -5.870 4.960) 9.046 14.901 ( -5.693 7.662 -16.926) 19.432 15.917 ( 14.112 -7.645 14.987) 21.959 15.976 ( 9.640 -7.985 -2.492) 12.763 16.329 ( -0.753 -4.479 6.015) 7.537 16.790 ( -3.986 3.425 7.812) 9.415 17.464 ( -9.258 -5.577 -16.199) 19.474 17.709 ( 8.177 11.573 0.327) 14.174 18.172 ( -9.803 2.312 13.604) 16.926 18.810 ( 0.177 24.190 0.288) 24.193 18.983 ( -15.735 5.589 -4.995) 17.429 19.467 ( -12.982 18.561 -6.006) 23.433 19.738 ( -12.233 5.965 -5.860) 14.818 20.559 ( -1.445 -10.361 27.582) 29.499 21.120 ( 11.647 -6.255 -1.862) 13.351 21.470 ( 11.657 -9.477 -2.951) 15.311 21.618 ( 0.330 -1.665 3.825) 4.184 22.068 ( -0.794 -1.883 -2.708) 3.393 22.901 ( 11.540 -13.976 -6.256) 19.174 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.271 ( -0.365 14.386 5.700) 15.478 2.027 ( -3.509 19.614 9.502) 22.075 2.327 ( -4.084 2.253 -10.537) 11.523 2.475 ( 0.758 4.424 -8.922) 9.988 3.034 ( 0.580 -0.838 12.740) 12.781 3.170 ( -0.697 -1.461 6.876) 7.064 3.296 ( -5.867 6.655 5.731) 10.562 3.434 ( 5.221 5.002 -3.279) 7.939 3.497 ( -6.996 4.710 -0.425) 8.445 3.557 ( -1.380 5.792 4.673) 7.569 3.717 ( -8.217 12.492 7.223) 16.606 3.912 ( -1.946 0.951 1.329) 2.541 4.076 ( 5.057 0.623 2.928) 5.876 4.363 ( -2.461 5.472 -8.042) 10.034 4.518 ( 0.774 -8.311 -1.891) 8.558 4.696 ( -2.751 -2.313 -2.641) 4.460 4.785 ( -2.729 0.640 -4.181) 5.034 4.845 ( 7.176 -5.112 -2.319) 9.111 4.990 ( 5.272 -5.010 1.238) 7.377 5.185 ( -1.020 6.914 -10.051) 12.242 5.211 ( 0.526 -0.828 0.211) 1.004 5.544 ( 1.533 -6.932 -7.336) 10.209 5.691 ( 0.097 -0.927 3.935) 4.044 6.002 ( 2.677 -2.068 3.566) 4.915 6.137 ( -6.007 0.026 -0.049) 6.007 6.324 ( 2.578 -8.799 3.905) 9.966 6.425 ( 1.021 5.762 -0.411) 5.866 6.985 ( -2.983 12.881 -3.832) 13.766 7.411 ( 4.582 -15.609 4.661) 16.922 7.821 ( 6.980 0.814 4.148) 8.161 8.021 ( -5.195 2.535 -1.762) 6.043 8.402 ( -1.231 -0.077 -8.807) 8.893 8.657 ( 1.344 -1.794 -5.271) 5.728 8.812 ( -6.410 3.962 -0.876) 7.587 8.902 ( 2.349 1.967 -1.815) 3.561 9.120 ( -1.923 2.523 0.966) 3.316 9.333 ( -3.381 -4.360 -1.804) 5.805 9.363 ( 2.237 -7.774 0.138) 8.090 9.696 ( 1.762 -8.718 2.058) 9.130 9.903 ( -0.662 -0.205 7.174) 7.207 10.077 ( 0.309 2.147 4.323) 4.837 10.280 ( 6.835 2.190 -5.501) 9.043 10.751 ( 2.917 -11.106 -2.795) 11.818 11.061 ( -2.625 -3.411 -5.038) 6.626 11.317 ( -1.783 -2.136 1.168) 3.018 11.478 ( -2.681 6.387 -2.481) 7.358 11.673 ( -1.463 3.866 5.382) 6.787 11.937 ( -0.440 10.863 -0.468) 10.882 12.114 ( 0.919 3.303 -0.724) 3.504 12.560 ( 0.946 -5.805 3.077) 6.638 13.186 ( 3.865 -5.485 -1.765) 6.938 13.387 ( -3.046 3.864 -2.892) 5.707 13.474 ( -4.847 -2.696 1.380) 5.715 13.776 ( 7.373 -0.300 4.764) 8.783 13.914 ( -0.033 -15.334 -1.118) 15.375 14.132 ( 3.793 -2.452 -1.686) 4.821 14.365 ( 2.365 -6.133 3.715) 7.550 14.737 ( -9.502 2.148 -14.460) 17.435 15.901 ( 6.293 -15.152 6.476) 17.639 16.284 ( 7.272 -4.873 9.311) 12.780 16.369 ( 10.285 6.983 -1.855) 12.569 16.712 ( -8.425 -6.140 10.668) 14.915 17.337 ( 3.086 6.210 -19.707) 20.891 17.792 ( -7.473 2.196 4.958) 9.233 18.205 ( -1.651 11.087 8.428) 14.025 18.801 ( -7.328 8.917 2.657) 11.843 19.045 ( -2.162 21.136 -6.324) 22.168 19.367 ( -18.194 17.055 -3.681) 25.208 19.698 ( 6.208 9.729 -6.636) 13.313 20.593 ( 0.760 -6.828 26.189) 27.075 21.226 ( 8.063 -6.405 -0.054) 10.297 21.515 ( 5.092 -9.297 -8.415) 13.534 21.600 ( -0.167 -4.303 8.620) 9.636 22.008 ( -0.986 -4.087 -3.581) 5.522 22.870 ( 6.015 -17.661 -5.810) 19.541 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.553 ( 11.824 14.787 2.625) 19.114 2.090 ( -8.791 4.526 -3.119) 10.368 2.328 ( 0.467 17.198 1.057) 17.236 2.539 ( 2.144 4.396 -7.275) 8.766 3.065 ( -5.786 -4.652 -0.803) 7.468 3.123 ( 4.397 -3.849 11.085) 12.531 3.258 ( -2.695 -1.823 1.449) 3.562 3.433 ( -5.963 2.679 8.308) 10.572 3.528 ( 1.449 7.617 -0.083) 7.754 3.670 ( 4.796 7.110 -10.586) 13.624 3.880 ( -1.684 23.665 21.460) 31.991 3.945 ( 1.944 2.187 1.543) 3.308 4.183 ( 4.851 0.211 0.471) 4.878 4.337 ( -1.877 2.721 -3.180) 4.587 4.435 ( 0.528 -9.442 -0.082) 9.457 4.535 ( -9.187 -3.883 -0.063) 9.974 4.738 ( 0.873 -3.350 -1.846) 3.923 4.901 ( 4.685 2.297 -11.688) 12.800 4.996 ( 0.678 -0.912 -7.850) 7.931 5.158 ( 1.889 -7.347 -1.420) 7.718 5.313 ( 2.083 9.049 3.967) 10.097 5.441 ( -0.739 -7.273 -8.023) 10.854 5.702 ( 0.357 -0.624 0.146) 0.733 6.011 ( -4.768 -2.858 1.302) 5.709 6.048 ( 1.716 -2.696 5.918) 6.726 6.271 ( -0.064 -8.398 2.471) 8.754 6.482 ( -0.674 5.476 -1.459) 5.707 7.013 ( 0.681 -0.354 -4.041) 4.113 7.389 ( -0.380 2.216 2.344) 3.248 7.944 ( -4.086 1.213 0.501) 4.291 8.026 ( 9.767 1.851 4.923) 11.093 8.367 ( 0.254 3.056 -8.496) 9.032 8.628 ( -8.323 3.244 2.532) 9.285 8.727 ( -2.546 2.324 1.344) 3.700 8.902 ( -0.522 -0.619 -5.848) 5.904 9.021 ( -10.381 -0.254 1.692) 10.521 9.192 ( -1.112 -14.057 -2.104) 14.257 9.393 ( 4.764 -1.725 0.027) 5.066 9.651 ( 3.339 -7.988 0.838) 8.698 9.984 ( 8.529 -2.435 2.912) 9.335 10.118 ( -0.895 5.933 1.497) 6.184 10.337 ( 0.358 -2.777 -2.596) 3.818 10.662 ( -0.483 -7.055 -2.472) 7.491 11.006 ( 2.679 -1.020 -6.636) 7.228 11.251 ( -2.163 -4.453 6.472) 8.148 11.542 ( -1.267 7.877 3.529) 8.724 11.751 ( 2.366 7.561 1.546) 8.071 11.954 ( -6.188 7.666 -1.192) 9.923 12.191 ( 1.540 6.119 -4.015) 7.479 12.520 ( -1.282 -6.935 3.470) 7.860 13.083 ( -1.665 -12.656 -1.194) 12.821 13.364 ( 0.004 0.943 0.671) 1.157 13.474 ( 3.094 -0.629 -3.187) 4.486 13.738 ( -3.724 -8.797 -0.611) 9.572 13.858 ( -0.076 -1.302 7.339) 7.454 14.149 ( 1.200 -2.757 -2.862) 4.151 14.349 ( 0.771 -5.320 3.579) 6.458 14.596 ( -1.930 2.944 -7.596) 8.372 15.877 ( 1.635 -10.558 1.348) 10.768 16.255 ( -1.529 -6.913 1.387) 7.215 16.548 ( 3.349 -4.604 -2.020) 6.041 16.630 ( -2.290 5.327 7.451) 9.442 17.504 ( 14.695 6.987 -10.923) 19.598 17.657 ( -8.606 3.238 -0.703) 9.222 18.253 ( -1.690 -1.134 10.935) 11.123 18.972 ( 3.570 18.031 7.456) 19.835 19.061 ( -11.392 15.743 -6.207) 20.400 19.368 ( 1.240 16.415 -7.342) 18.025 19.898 ( 0.055 15.249 0.227) 15.250 20.652 ( 6.513 -10.564 14.642) 19.194 21.256 ( 3.073 -10.348 0.477) 10.805 21.421 ( 1.475 -6.480 -8.669) 10.923 21.583 ( -1.912 -5.989 11.233) 12.872 21.926 ( -3.295 -1.111 -4.820) 5.943 22.719 ( 0.155 -17.132 -5.209) 17.907 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 ( 13.750 10.304 -7.906) 18.913 1.955 ( -4.787 3.495 1.879) 6.218 2.493 ( -3.393 6.648 1.455) 7.605 2.581 ( 1.878 10.292 -5.464) 11.803 2.931 ( -0.443 -4.660 -3.290) 5.722 3.143 ( 1.407 -6.264 5.183) 8.251 3.272 ( 1.557 -1.522 4.948) 5.406 3.376 ( -6.936 2.620 12.649) 14.662 3.680 ( 3.543 11.383 -1.826) 12.060 3.743 ( 0.742 7.461 -13.304) 15.271 3.982 ( 0.532 -2.310 2.966) 3.796 4.134 ( -4.484 7.316 13.822) 16.269 4.242 ( 0.409 -2.441 -3.566) 4.340 4.340 ( 2.559 -8.568 0.598) 8.962 4.356 ( 2.357 5.370 8.157) 10.047 4.433 ( 0.789 3.305 1.487) 3.709 4.715 ( -0.954 -1.384 0.595) 1.783 4.957 ( 2.678 -0.942 -1.476) 3.199 4.980 ( 2.721 2.765 -11.739) 12.364 5.130 ( 4.354 -5.056 -4.219) 7.894 5.316 ( -1.040 -4.598 -11.122) 12.080 5.394 ( -3.584 4.495 -1.775) 6.017 5.667 ( -2.845 -0.043 -0.091) 2.847 5.971 ( -0.167 0.633 7.724) 7.751 6.060 ( 1.378 -6.477 7.292) 9.850 6.186 ( -1.026 -5.745 -1.070) 5.933 6.499 ( -2.147 3.928 -1.902) 4.863 7.005 ( 6.430 -9.276 -1.689) 11.412 7.409 ( -8.235 12.394 -1.067) 14.919 7.931 ( -0.506 5.066 2.071) 5.496 8.149 ( 2.726 -2.782 -0.154) 3.898 8.415 ( 1.205 2.274 -3.321) 4.202 8.499 ( -9.554 7.026 1.353) 11.936 8.720 ( -6.879 2.825 4.760) 8.829 8.835 ( -4.015 -2.264 2.453) 5.222 8.892 ( 2.262 -4.344 0.843) 4.969 9.078 ( 3.844 -6.734 -6.587) 10.174 9.405 ( 1.433 -6.455 -1.188) 6.719 9.668 ( 4.634 -5.077 6.919) 9.753 10.133 ( 6.402 -1.967 -3.251) 7.444 10.185 ( 3.983 1.864 0.659) 4.446 10.249 ( -4.595 1.656 -4.490) 6.635 10.575 ( -1.378 -4.082 -3.648) 5.645 11.047 ( 5.027 -0.581 -8.191) 9.628 11.230 ( -0.335 -3.096 12.064) 12.460 11.594 ( -3.088 5.442 7.819) 10.015 11.858 ( -7.985 8.860 -1.690) 12.046 11.956 ( 7.713 6.407 -2.345) 10.298 12.200 ( -5.020 1.530 -5.272) 7.439 12.447 ( 0.934 -2.105 4.146) 4.743 12.957 ( 0.748 -8.688 -0.085) 8.721 13.329 ( -6.774 -14.815 1.343) 16.346 13.421 ( 0.450 2.022 0.329) 2.098 13.723 ( 4.214 2.155 -2.180) 5.211 13.824 ( -5.420 -1.666 5.061) 7.601 14.103 ( -0.706 -0.599 -5.494) 5.572 14.306 ( -1.387 -4.558 4.561) 6.595 14.665 ( 5.796 4.599 -1.468) 7.543 15.732 ( -5.243 -8.986 -1.509) 10.513 16.204 ( -0.925 -2.454 6.430) 6.944 16.448 ( -0.712 -7.561 -15.972) 17.685 16.691 ( -2.347 5.403 9.793) 11.429 17.563 ( -2.754 9.785 -7.431) 12.592 17.913 ( 19.026 3.319 4.932) 19.933 18.262 ( 6.148 -8.483 6.209) 12.178 18.938 ( -14.110 16.194 -5.478) 22.166 19.321 ( 7.638 14.158 6.696) 17.425 19.483 ( 0.869 4.865 -5.622) 7.485 20.033 ( -1.206 16.179 0.539) 16.233 20.702 ( 6.103 -11.511 3.768) 13.563 21.110 ( -2.790 -11.415 -3.342) 12.217 21.434 ( 1.806 -0.580 -4.577) 4.955 21.513 ( 0.131 -7.886 13.375) 15.527 21.828 ( -6.644 2.850 -4.434) 8.480 22.510 ( -3.819 -12.679 -3.695) 13.747 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.891 ( -1.328 1.819 -0.305) 2.273 2.273 ( 11.122 7.944 -6.852) 15.289 2.404 ( -1.084 -6.989 -0.652) 7.103 2.746 ( 2.021 14.470 -3.181) 14.953 2.891 ( -0.307 -5.852 1.692) 6.100 3.170 ( 8.265 -7.562 -1.295) 11.277 3.243 ( -9.600 4.897 10.669) 15.165 3.382 ( 0.164 2.251 6.400) 6.786 3.655 ( -9.469 -0.885 -5.806) 11.142 3.824 ( 3.438 3.633 -5.173) 7.196 4.009 ( 4.047 3.091 2.077) 5.499 4.105 ( -3.811 2.447 0.759) 4.592 4.182 ( -3.317 -1.440 1.232) 3.820 4.289 ( 3.420 -6.561 0.167) 7.401 4.475 ( 2.784 3.490 2.088) 4.929 4.562 ( -3.626 -0.985 6.045) 7.118 4.734 ( 6.761 2.444 4.958) 8.733 4.897 ( -3.818 -6.926 -8.227) 11.412 5.076 ( 6.046 3.193 1.991) 7.121 5.167 ( 9.127 -6.942 -2.907) 11.830 5.245 ( -7.376 -0.301 -6.524) 9.852 5.319 ( 0.906 8.500 -9.626) 12.874 5.652 ( -2.285 2.413 6.465) 7.269 5.953 ( -6.821 -2.532 2.459) 7.680 6.063 ( 2.466 -0.459 2.072) 3.254 6.165 ( 4.562 -3.792 2.026) 6.269 6.463 ( -4.660 1.983 -1.675) 5.334 7.056 ( 8.308 -5.057 -0.317) 9.731 7.318 ( -11.211 5.053 -0.396) 12.303 8.047 ( 3.184 9.677 2.173) 10.416 8.120 ( -0.868 -2.578 -1.661) 3.188 8.322 ( -3.903 -5.968 -1.146) 7.223 8.511 ( -2.166 8.538 -1.568) 8.947 8.602 ( -4.815 0.268 -2.374) 5.376 8.762 ( -1.165 -8.351 6.265) 10.505 8.947 ( -2.006 2.344 7.348) 7.970 9.166 ( 10.571 2.766 -8.569) 13.886 9.337 ( 0.394 -4.795 1.022) 4.918 9.761 ( 5.906 -4.986 10.200) 12.798 10.025 ( -9.577 1.265 -4.944) 10.852 10.210 ( -1.082 0.931 -2.225) 2.644 10.339 ( 10.601 -1.936 -6.907) 12.800 10.529 ( -1.041 1.356 -0.831) 1.900 11.051 ( -0.524 -3.174 -4.605) 5.617 11.275 ( 2.046 -0.287 9.805) 10.020 11.634 ( -1.845 6.763 6.017) 9.238 11.746 ( -5.408 -1.381 -4.266) 7.025 12.042 ( -3.237 -4.621 -2.244) 6.072 12.250 ( 9.479 13.130 -1.132) 16.234 12.530 ( 3.515 1.710 1.000) 4.034 12.932 ( -0.576 1.892 1.140) 2.283 13.031 ( -5.473 -14.737 1.124) 15.761 13.375 ( -10.074 -3.666 2.256) 10.955 13.721 ( -3.718 3.652 -1.533) 5.432 13.793 ( 3.159 -2.154 3.158) 4.959 14.075 ( -0.014 -2.180 -7.076) 7.404 14.289 ( 0.820 -0.229 4.352) 4.434 14.834 ( 6.451 6.820 0.784) 9.420 15.546 ( -4.932 -8.263 -0.879) 9.664 16.180 ( -5.006 1.425 7.190) 8.876 16.304 ( 2.168 -8.101 -17.268) 19.197 16.765 ( 0.910 3.921 11.627) 12.304 17.600 ( -3.553 12.294 -13.517) 18.613 18.080 ( 2.600 -12.472 17.652) 21.769 18.541 ( 25.644 3.131 -6.282) 26.587 18.830 ( -12.448 11.552 -1.259) 17.029 19.334 ( -6.498 -5.180 0.865) 8.355 19.702 ( 11.768 11.002 -1.824) 16.213 20.125 ( -2.138 1.004 -0.246) 2.375 20.685 ( 0.983 -0.792 -0.875) 1.536 20.970 ( -0.821 -6.825 -3.690) 7.802 21.300 ( -10.694 -4.693 10.203) 15.508 21.639 ( 10.833 -2.672 -5.780) 12.566 21.733 ( -5.499 5.325 1.922) 7.892 22.322 ( -4.817 -5.862 -1.268) 7.692 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.932 ( 2.115 3.603 -0.122) 4.179 2.307 ( 3.067 -11.162 2.722) 11.892 2.486 ( 6.537 2.617 -3.734) 7.970 2.812 ( -1.701 -5.986 2.622) 6.753 2.878 ( -2.304 11.675 -3.012) 12.275 3.110 ( -9.051 -1.910 -0.810) 9.286 3.217 ( 1.253 -1.313 4.952) 5.274 3.437 ( -8.808 2.187 -1.912) 9.275 3.489 ( 5.381 -1.502 -0.288) 5.594 3.888 ( 5.544 0.494 -2.049) 5.931 4.042 ( -4.445 -1.406 -2.241) 5.172 4.099 ( -4.450 1.412 3.207) 5.664 4.180 ( 6.838 2.661 0.934) 7.397 4.336 ( 3.415 1.271 -1.825) 4.075 4.391 ( -11.765 -0.007 3.303) 12.220 4.624 ( 6.754 2.817 2.096) 7.612 4.636 ( -6.164 -7.967 -3.488) 10.660 4.922 ( 3.691 -1.294 -3.100) 4.991 5.059 ( -5.054 -2.935 2.081) 6.204 5.183 ( 8.467 -5.954 0.727) 10.377 5.333 ( 7.226 3.707 4.502) 9.285 5.431 ( 3.356 7.515 -7.138) 10.895 5.667 ( -0.275 -1.879 6.557) 6.826 5.779 ( -9.422 0.862 -3.545) 10.104 6.102 ( -0.706 5.233 -2.979) 6.063 6.249 ( 7.214 -4.726 4.095) 9.547 6.362 ( -7.009 0.254 -1.572) 7.187 7.148 ( -7.926 -3.982 0.042) 8.870 7.185 ( 6.837 3.621 -0.030) 7.736 8.075 ( -5.733 4.317 1.402) 7.312 8.182 ( 1.969 -10.197 -4.512) 11.323 8.235 ( 6.389 2.350 3.259) 7.547 8.500 ( -2.240 1.031 -0.154) 2.471 8.635 ( 0.253 9.645 -0.806) 9.682 8.717 ( 0.365 -1.520 4.878) 5.123 8.841 ( -6.109 -3.761 -5.979) 9.339 9.325 ( 5.274 1.544 3.240) 6.379 9.432 ( 6.911 6.433 0.739) 9.471 9.708 ( -7.603 -4.147 -3.867) 9.485 9.975 ( 2.625 1.484 2.236) 3.755 10.200 ( 1.129 -2.167 0.676) 2.535 10.436 ( 2.958 -1.937 -1.828) 3.981 10.535 ( 2.843 -1.639 1.081) 3.456 10.932 ( -7.063 -1.890 -1.785) 7.526 11.348 ( 0.338 2.518 5.667) 6.210 11.600 ( -4.092 -3.928 -10.406) 11.851 11.740 ( 0.888 6.897 7.317) 10.095 11.995 ( 3.948 -2.049 -1.218) 4.611 12.470 ( 0.072 -8.959 0.098) 8.960 12.494 ( -2.641 8.094 -0.167) 8.515 12.938 ( -6.627 0.799 1.150) 6.773 12.971 ( 3.962 0.174 -1.027) 4.096 13.183 ( 2.334 3.429 0.099) 4.149 13.740 ( -0.863 4.630 -3.338) 5.773 13.839 ( 3.826 -3.511 5.078) 7.263 13.993 ( -2.221 -3.620 -1.727) 4.585 14.323 ( 0.286 0.680 -0.083) 0.742 15.017 ( 2.795 10.829 -0.077) 11.184 15.402 ( -0.026 -8.783 -0.473) 8.796 16.130 ( -5.134 1.428 7.439) 9.150 16.201 ( 1.047 -10.579 -6.304) 12.359 16.882 ( 3.853 5.390 -2.227) 6.989 17.572 ( -5.773 7.097 3.367) 9.748 18.022 ( -0.903 -10.563 -1.787) 10.751 18.694 ( -5.601 -2.146 -0.630) 6.031 19.004 ( 13.753 7.285 1.139) 15.605 19.192 ( -2.061 1.711 -0.410) 2.710 19.949 ( -10.742 -6.155 -0.603) 12.395 19.975 ( 10.602 -0.442 0.491) 10.623 20.721 ( -3.245 7.485 2.869) 8.648 20.914 ( 3.907 -4.682 -7.469) 9.642 21.094 ( -8.836 -7.594 5.567) 12.913 21.629 ( -2.886 2.461 -1.623) 4.126 21.863 ( 6.367 3.350 0.783) 7.237 22.257 ( 2.069 0.767 -0.060) 2.207 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 ( -2.724 3.260 -4.579) 6.246 2.275 ( 5.572 -12.141 4.250) 14.018 2.525 ( -6.031 0.021 5.739) 8.325 2.735 ( -3.534 -2.553 1.199) 4.522 2.877 ( -8.158 11.218 -0.743) 13.891 2.940 ( -0.694 -4.143 -5.369) 6.817 3.267 ( 2.790 -3.290 3.835) 5.772 3.365 ( -2.408 7.416 -2.257) 8.118 3.541 ( 2.770 -2.416 -0.520) 3.712 3.848 ( -10.647 -4.442 -2.190) 11.743 3.961 ( -5.179 0.767 -2.912) 5.991 4.125 ( 8.740 1.423 1.240) 8.941 4.188 ( -8.608 1.897 0.921) 8.863 4.279 ( -3.725 1.264 3.313) 5.143 4.414 ( 5.854 3.220 1.649) 6.882 4.571 ( 1.807 2.270 0.268) 2.914 4.783 ( -3.252 1.624 -1.820) 4.065 4.818 ( 1.693 0.965 2.280) 2.999 5.055 ( 4.521 -10.100 2.267) 11.295 5.261 ( 8.364 -11.878 2.814) 14.797 5.433 ( 0.365 0.052 -7.309) 7.318 5.491 ( -1.739 5.512 -2.895) 6.464 5.616 ( 0.408 1.334 -4.013) 4.249 5.752 ( 1.023 3.231 7.178) 7.938 6.114 ( -3.058 5.103 -2.368) 6.403 6.224 ( -4.978 -2.034 0.258) 5.383 6.348 ( 5.563 -2.093 0.625) 5.977 6.979 ( -2.251 -10.611 -0.257) 10.850 7.343 ( 2.306 9.674 0.171) 9.947 7.961 ( -10.360 3.533 2.504) 11.229 8.138 ( 5.204 -9.251 -7.837) 13.194 8.362 ( 5.869 -5.722 3.429) 8.885 8.452 ( -4.539 4.071 2.262) 6.504 8.674 ( -2.042 3.236 1.418) 4.081 8.787 ( 3.210 11.381 -6.733) 13.607 8.871 ( 9.819 4.203 0.579) 10.696 9.398 ( -1.571 -0.479 6.503) 6.707 9.516 ( -5.510 0.969 -5.907) 8.136 9.610 ( 3.419 3.741 -2.278) 5.557 10.054 ( 8.568 -4.859 -2.267) 10.107 10.152 ( -7.064 -1.766 2.316) 7.641 10.380 ( 1.305 -12.100 2.005) 12.335 10.622 ( 4.888 0.178 0.622) 4.931 10.834 ( -3.631 4.164 7.347) 9.192 11.347 ( -4.450 -5.328 -6.035) 9.198 11.448 ( -2.754 4.619 -1.835) 5.682 11.846 ( 0.455 4.053 2.965) 5.042 12.110 ( 7.577 1.459 -1.882) 7.942 12.317 ( -10.079 -0.783 1.257) 10.187 12.400 ( -9.766 0.004 1.798) 9.930 12.821 ( 4.563 -6.288 -3.624) 8.573 13.169 ( 12.329 1.930 -1.984) 12.636 13.432 ( 9.966 12.603 -0.725) 16.084 13.715 ( -4.442 2.011 -1.980) 5.262 13.860 ( 2.071 -1.817 -3.909) 4.783 13.991 ( 2.755 -1.904 10.612) 11.127 14.300 ( -2.173 -0.143 -2.415) 3.252 15.059 ( -5.767 6.884 -11.078) 14.261 15.456 ( 10.656 -2.225 9.416) 14.393 16.030 ( -5.113 -16.042 6.974) 18.224 16.114 ( -0.372 1.331 1.755) 2.234 16.990 ( 6.600 7.204 -16.081) 18.817 17.606 ( -7.347 2.850 24.624) 25.854 17.820 ( -2.802 -7.244 -15.443) 17.287 18.518 ( -5.431 -14.494 -0.437) 15.485 19.064 ( -7.706 14.181 1.291) 16.191 19.402 ( 4.007 5.129 1.441) 6.666 19.651 ( -8.823 -5.537 -1.745) 10.562 20.093 ( -1.373 2.143 1.719) 3.071 20.727 ( -4.491 1.623 11.882) 12.806 20.883 ( 0.034 -5.741 -8.162) 9.979 20.990 ( 7.212 -4.565 -0.423) 8.546 21.612 ( 3.070 -5.779 -3.160) 7.267 21.973 ( -2.635 12.463 2.940) 13.074 22.404 ( 12.810 0.078 -2.553) 13.062 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.643 ( -16.624 8.032 -0.142) 18.463 2.103 ( 0.366 3.396 -1.454) 3.712 2.444 ( -8.946 8.664 1.545) 12.550 2.664 ( -3.921 -4.650 -1.968) 6.393 2.871 ( 12.605 4.827 -0.530) 13.508 3.095 ( -1.992 0.219 3.610) 4.129 3.328 ( 3.395 -0.008 3.134) 4.620 3.511 ( -0.652 1.077 -3.494) 3.714 3.555 ( -4.484 -2.731 1.332) 5.416 3.740 ( -5.050 6.633 0.396) 8.346 3.861 ( 2.541 4.990 5.052) 7.542 4.186 ( 0.715 -4.126 -0.501) 4.218 4.235 ( -11.732 13.089 13.292) 22.037 4.327 ( -7.153 -3.975 3.093) 8.749 4.526 ( -0.651 -3.724 -4.252) 5.689 4.555 ( 3.433 0.027 -5.487) 6.472 4.676 ( 2.318 1.132 -0.540) 2.636 4.771 ( 1.014 1.343 2.440) 2.964 4.953 ( 1.457 -5.079 1.516) 5.497 5.148 ( 8.859 -8.175 -2.037) 12.225 5.289 ( -6.217 6.872 -14.386) 17.113 5.391 ( 1.953 2.527 -8.365) 8.954 5.680 ( -0.292 -1.713 4.305) 4.643 6.051 ( 2.693 -3.121 2.892) 5.036 6.122 ( -0.296 -2.632 4.444) 5.174 6.230 ( 3.849 2.455 -0.781) 4.631 6.373 ( 0.318 -1.168 1.372) 1.829 6.890 ( 9.290 3.645 1.498) 10.091 7.410 ( -7.836 -1.410 -0.597) 7.985 7.852 ( -6.123 1.701 3.618) 7.312 8.155 ( -1.751 4.597 3.082) 5.805 8.362 ( 8.022 -5.147 -2.416) 9.833 8.637 ( -2.457 -0.789 -3.185) 4.100 8.787 ( -2.771 0.747 1.518) 3.247 8.800 ( 5.295 -15.675 -0.410) 16.551 9.118 ( 2.140 2.128 -9.671) 10.131 9.264 ( -1.883 4.800 -11.472) 12.577 9.473 ( 0.598 -1.271 -3.015) 3.326 9.740 ( -5.385 -4.580 16.490) 17.941 9.911 ( 8.199 10.564 -3.920) 13.935 10.013 ( -2.280 -2.688 4.998) 6.116 10.221 ( -1.062 2.933 -1.261) 3.365 10.581 ( 3.254 -8.954 -2.488) 9.847 10.954 ( 6.446 -0.124 -5.937) 8.764 11.378 ( 1.971 4.217 8.834) 9.986 11.682 ( -0.938 -7.386 0.228) 7.448 11.832 ( -5.121 4.977 4.480) 8.430 11.892 ( -8.301 9.280 -3.109) 12.833 12.169 ( -4.374 -0.081 -2.020) 4.818 12.561 ( 3.761 -2.107 -2.071) 4.783 12.871 ( 9.421 -2.658 2.155) 10.023 13.328 ( 7.229 -9.734 0.335) 12.130 13.600 ( -3.964 3.504 -5.004) 7.283 13.672 ( -0.656 2.873 0.545) 2.997 13.924 ( -4.032 -11.429 1.289) 12.188 14.016 ( 3.627 -3.688 -2.618) 5.798 14.291 ( 1.399 0.925 5.892) 6.126 14.980 ( -3.499 7.439 -18.089) 19.870 15.681 ( 4.621 -17.174 15.889) 23.849 15.769 ( 10.861 4.857 -1.307) 11.969 16.276 ( 3.164 -2.682 5.615) 6.982 17.024 ( -8.444 8.106 5.659) 13.001 17.452 ( -5.585 -9.142 -15.900) 19.172 17.734 ( 6.799 16.632 5.785) 18.877 18.335 ( 1.450 2.552 11.718) 12.080 19.046 ( -7.361 12.547 -7.028) 16.156 19.283 ( -11.804 4.658 -0.442) 12.697 19.634 ( -4.544 -2.371 -7.549) 9.125 20.044 ( -13.700 4.764 1.060) 14.543 20.681 ( -0.296 4.157 16.348) 16.871 20.840 ( 11.778 -3.196 -1.869) 12.346 21.172 ( 8.247 -8.831 -0.027) 12.083 21.588 ( 4.625 0.621 5.837) 7.473 22.084 ( -6.422 -2.963 -6.435) 9.562 22.549 ( 9.633 -11.094 -5.360) 15.639 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.505 ( -9.244 11.142 2.071) 14.624 2.197 ( 2.729 8.453 -2.386) 9.197 2.440 ( -3.879 11.784 1.440) 12.489 2.519 ( -5.722 -0.862 -3.036) 6.535 3.074 ( -0.779 -0.852 9.503) 9.573 3.146 ( 7.407 2.660 2.061) 8.136 3.334 ( 0.893 -3.312 -4.552) 5.700 3.454 ( -4.956 -0.853 2.373) 5.561 3.522 ( 1.665 0.191 -3.875) 4.222 3.673 ( -5.791 4.864 -5.115) 9.130 3.966 ( 0.236 3.153 6.521) 7.247 4.063 ( -2.368 -1.354 1.762) 3.247 4.199 ( -12.475 15.628 13.884) 24.344 4.385 ( -0.488 2.891 -1.191) 3.165 4.467 ( -0.526 1.420 -2.234) 2.699 4.592 ( 5.089 -5.569 -2.086) 7.827 4.697 ( 4.453 -4.433 -1.516) 6.463 4.845 ( 5.388 1.174 -1.730) 5.780 4.884 ( -5.618 -3.863 4.861) 8.374 5.152 ( -1.742 -3.101 -1.380) 3.815 5.261 ( 2.290 6.541 -10.255) 12.377 5.407 ( 2.756 -1.676 -9.377) 9.916 5.685 ( 0.427 -1.492 3.486) 3.816 5.997 ( -3.096 -1.488 1.410) 3.713 6.159 ( 5.536 -8.102 3.781) 10.516 6.232 ( -3.606 -2.211 0.011) 4.230 6.426 ( 3.795 3.451 -0.496) 5.154 7.134 ( 6.795 11.936 0.564) 13.746 7.222 ( -4.499 -10.788 -0.290) 11.692 7.817 ( -2.178 3.888 4.744) 6.509 8.141 ( -4.071 2.901 -1.821) 5.320 8.357 ( -0.317 -3.689 -1.764) 4.101 8.565 ( 2.353 -2.656 -8.955) 9.632 8.792 ( 7.100 -6.522 -1.790) 9.806 8.900 ( 3.933 6.726 5.273) 9.408 9.098 ( 1.635 -5.813 -5.558) 8.207 9.202 ( 0.688 -3.606 -11.149) 11.738 9.466 ( -6.095 1.188 1.097) 6.305 9.582 ( -4.475 -11.032 11.730) 16.713 10.035 ( -1.251 1.771 4.919) 5.376 10.065 ( 1.574 4.449 -1.170) 4.862 10.264 ( 0.379 8.675 0.504) 8.698 10.562 ( 5.617 -8.058 -1.033) 9.876 11.012 ( 2.203 -2.326 -4.921) 5.872 11.381 ( -5.585 -0.331 4.253) 7.028 11.575 ( -3.689 0.994 -1.005) 3.951 11.793 ( -4.201 1.878 3.616) 5.853 11.977 ( 5.584 10.581 -4.288) 12.709 12.129 ( 0.019 1.173 -0.727) 1.380 12.541 ( -3.803 -0.758 1.934) 4.333 12.995 ( 8.002 -6.639 -1.658) 10.529 13.345 ( 6.085 -12.932 0.596) 14.304 13.523 ( -4.156 0.673 -5.083) 6.600 13.729 ( 2.271 -9.613 -0.184) 9.879 13.766 ( -0.126 3.999 4.383) 5.935 14.036 ( 3.585 -2.983 -2.625) 5.352 14.320 ( -0.062 -1.554 4.919) 5.159 14.859 ( -8.288 2.774 -14.278) 16.741 15.665 ( 6.697 -13.201 8.917) 17.280 16.102 ( 16.558 6.323 4.961) 18.406 16.281 ( 0.367 -4.259 1.926) 4.688 16.937 ( -13.566 -2.066 12.402) 18.496 17.297 ( 1.563 8.981 -23.635) 25.332 17.963 ( -3.879 5.072 11.688) 13.319 18.406 ( -1.482 12.997 7.861) 15.261 18.955 ( -6.392 -2.596 -10.243) 12.349 19.299 ( -4.833 21.762 1.070) 22.318 19.526 ( 5.763 -7.487 -4.256) 10.362 19.832 ( -16.874 11.616 -0.454) 20.491 20.778 ( -4.374 5.263 18.187) 19.432 21.026 ( 10.029 -0.802 0.123) 10.061 21.212 ( 9.457 -12.857 -3.040) 16.247 21.641 ( -2.206 -0.238 5.423) 5.859 21.936 ( 0.026 -6.167 -7.207) 9.485 22.553 ( 7.836 -14.207 -4.931) 16.958 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.578 ( 2.234 13.395 1.199) 13.633 2.230 ( -6.138 1.805 -2.530) 6.880 2.487 ( 0.849 10.486 -2.167) 10.741 2.567 ( 1.027 9.854 3.017) 10.356 3.080 ( 0.284 -2.342 10.236) 10.504 3.115 ( -6.146 -6.852 2.407) 9.514 3.279 ( -3.822 -6.943 -3.981) 8.869 3.426 ( 6.955 -1.228 -10.572) 12.714 3.581 ( 2.583 5.954 0.747) 6.532 3.676 ( -1.336 11.126 -3.619) 11.776 3.983 ( -1.897 2.051 6.566) 7.136 4.130 ( 3.464 3.341 3.496) 5.948 4.219 ( -1.562 5.156 -0.173) 5.390 4.329 ( -4.633 -0.741 7.750) 9.059 4.446 ( -5.249 1.452 2.541) 6.010 4.625 ( 0.948 -0.828 -1.404) 1.885 4.736 ( 2.874 -3.011 -0.742) 4.228 4.761 ( -3.543 0.243 2.099) 4.125 4.927 ( 3.270 -1.101 -1.797) 3.890 5.073 ( -0.440 -3.900 -6.101) 7.255 5.344 ( -0.199 5.729 -10.173) 11.677 5.394 ( 2.739 1.154 1.454) 3.308 5.682 ( 0.202 -1.783 0.010) 1.795 5.955 ( 0.339 -4.923 2.041) 5.340 6.129 ( -3.441 -2.892 0.722) 4.553 6.163 ( 1.833 -6.580 2.529) 7.284 6.511 ( 2.020 3.233 -2.100) 4.353 6.986 ( -5.837 -8.528 -2.683) 10.677 7.428 ( 7.911 12.534 0.253) 14.824 7.899 ( 4.527 2.540 4.220) 6.690 8.082 ( -4.706 3.594 -0.654) 5.957 8.326 ( 1.007 -0.090 -3.434) 3.580 8.622 ( 7.284 1.106 -3.327) 8.084 8.829 ( -0.480 -0.448 -2.233) 2.327 8.915 ( -4.149 -2.738 -3.627) 6.153 9.084 ( 1.920 -2.797 -2.917) 4.474 9.158 ( 1.002 -11.058 1.184) 11.166 9.258 ( -6.974 -3.854 8.944) 11.978 9.550 ( 3.021 -3.829 -2.316) 5.399 9.990 ( -7.287 3.913 5.681) 10.034 10.128 ( 2.851 1.143 -2.432) 3.918 10.338 ( -0.079 2.142 2.296) 3.141 10.588 ( 2.567 -2.981 -0.329) 3.948 10.949 ( -1.279 -2.122 -7.009) 7.434 11.289 ( -4.282 -2.660 6.187) 7.981 11.623 ( 2.274 8.259 -0.936) 8.617 11.777 ( 0.742 0.679 1.709) 1.983 12.122 ( 2.216 0.262 0.402) 2.267 12.208 ( 0.873 15.579 -3.951) 16.096 12.453 ( -3.468 -4.936 1.252) 6.161 12.941 ( 0.587 -15.098 -2.783) 15.363 13.301 ( 3.732 -9.055 1.205) 9.867 13.472 ( -1.009 0.627 -2.800) 3.042 13.675 ( 2.068 -4.325 -1.623) 5.062 13.886 ( 1.372 3.048 7.781) 8.469 14.064 ( 3.555 -1.437 -3.457) 5.163 14.307 ( 0.076 -3.567 3.174) 4.775 14.676 ( -7.854 2.096 -7.342) 10.954 15.717 ( 6.715 -7.512 4.467) 11.022 16.224 ( -1.470 -4.518 -2.040) 5.170 16.424 ( 9.245 0.123 6.509) 11.308 16.752 ( -5.213 -0.622 5.527) 7.624 17.362 ( 2.948 12.339 -19.448) 23.220 17.868 ( -10.360 0.114 5.761) 11.855 18.413 ( -11.584 0.292 6.438) 13.256 19.001 ( 10.597 9.368 4.456) 14.830 19.356 ( -5.302 11.902 -6.328) 14.485 19.536 ( -5.431 4.639 -2.490) 7.564 19.877 ( 7.099 11.684 2.300) 13.863 20.752 ( -10.028 2.721 11.494) 15.495 21.098 ( 2.722 -10.607 4.757) 11.940 21.230 ( 7.818 -6.144 -13.155) 16.490 21.591 ( -1.334 -4.424 6.614) 8.068 21.914 ( 2.030 -0.436 -2.518) 3.263 22.502 ( 4.285 -12.838 -3.385) 13.951 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.826 ( 9.419 12.829 -1.644) 16.000 2.075 ( -8.167 -3.538 1.622) 9.047 2.594 ( 0.025 4.039 0.136) 4.042 2.686 ( -0.429 11.777 0.083) 11.785 2.915 ( -6.366 -2.548 -8.907) 11.241 3.092 ( -2.142 -9.751 3.027) 10.433 3.200 ( 4.939 -2.799 9.964) 11.468 3.457 ( 4.208 -2.784 -8.596) 9.967 3.718 ( 2.046 9.223 -1.376) 9.547 3.768 ( 0.180 10.499 -1.932) 10.676 3.992 ( -0.820 -0.871 1.460) 1.887 4.176 ( 2.849 -2.447 -3.366) 5.043 4.225 ( 0.189 -6.055 2.357) 6.501 4.330 ( -8.431 -3.494 10.246) 13.721 4.361 ( 2.425 3.851 2.625) 5.254 4.587 ( -4.166 6.529 3.774) 8.615 4.762 ( -1.962 5.032 5.115) 7.439 4.770 ( 6.086 -10.927 -3.516) 12.992 4.953 ( 1.265 3.781 -0.129) 3.989 5.023 ( 1.415 -3.453 -5.244) 6.436 5.295 ( -2.775 4.855 -11.856) 13.109 5.479 ( -1.310 3.299 -1.451) 3.834 5.686 ( 1.436 1.733 -0.036) 2.251 5.911 ( 1.751 -7.971 7.084) 10.807 6.091 ( 1.101 -2.873 0.967) 3.225 6.120 ( -1.765 -2.938 1.204) 3.633 6.544 ( -0.107 2.251 -2.879) 3.656 6.851 ( 0.551 -5.568 -2.317) 6.056 7.625 ( -1.368 12.828 -3.460) 13.357 7.977 ( 2.720 -0.153 -0.495) 2.769 8.081 ( -0.080 -0.624 4.332) 4.377 8.369 ( 3.628 1.869 -5.260) 6.658 8.693 ( -5.677 -0.347 0.764) 5.739 8.787 ( 1.743 -2.169 4.148) 4.995 8.847 ( 0.243 -1.299 5.105) 5.274 8.934 ( -1.535 -5.614 -1.424) 5.992 9.042 ( -10.139 4.945 -5.276) 12.453 9.298 ( 4.774 -4.143 4.611) 7.824 9.578 ( 4.189 -1.777 0.658) 4.598 9.964 ( 1.508 -1.386 3.818) 4.333 10.156 ( 1.009 -1.190 -0.948) 1.826 10.334 ( -2.325 1.843 -3.430) 4.535 10.561 ( -1.509 -1.730 -0.621) 2.378 10.927 ( 3.255 0.467 -9.217) 9.786 11.251 ( -1.049 -2.610 10.303) 10.680 11.700 ( -0.020 2.276 1.037) 2.501 11.883 ( 5.261 3.253 -1.193) 6.300 12.108 ( -7.309 9.043 2.006) 11.799 12.317 ( -5.575 3.004 -2.427) 6.782 12.342 ( 3.815 -3.813 -2.656) 6.013 12.818 ( 3.123 -10.908 0.292) 11.350 13.297 ( 0.952 -4.941 -0.124) 5.034 13.448 ( -1.103 0.438 2.121) 2.430 13.687 ( 1.757 2.110 -2.563) 3.756 13.902 ( -2.563 -2.631 6.751) 7.686 14.083 ( 0.039 0.467 -3.208) 3.242 14.289 ( 0.587 -3.233 1.930) 3.810 14.627 ( 1.334 3.123 0.055) 3.396 15.718 ( -1.395 -4.650 -2.390) 5.411 16.180 ( 2.424 -2.348 3.273) 4.701 16.407 ( -6.455 -3.170 -7.573) 10.444 16.784 ( 0.952 2.247 5.659) 6.163 17.588 ( 17.924 9.215 -10.218) 22.596 17.697 ( -8.287 0.653 -0.261) 8.317 18.251 ( -5.944 -6.388 8.804) 12.395 19.255 ( -10.194 5.371 -4.942) 12.538 19.324 ( 8.676 9.169 3.951) 13.227 19.557 ( -1.749 7.703 -0.208) 7.902 20.091 ( 5.316 1.998 2.437) 6.180 20.645 ( -5.309 1.765 2.563) 6.154 20.988 ( -0.191 -11.744 -3.236) 12.183 21.271 ( 6.617 -0.694 -9.004) 11.195 21.562 ( -1.141 -5.631 8.026) 9.870 21.929 ( -2.190 2.938 1.001) 3.799 22.430 ( 0.183 -6.353 -0.938) 6.425 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.912 ( -3.118 -7.132 6.710) 10.277 2.129 ( 10.743 9.088 -4.394) 14.741 2.495 ( -11.009 0.148 -2.628) 11.319 2.781 ( 4.192 -1.953 -1.984) 5.032 2.872 ( -0.058 8.567 -3.915) 9.420 2.962 ( 2.287 -10.923 -1.581) 11.271 3.323 ( 3.948 1.169 7.773) 8.796 3.460 ( 0.918 -0.521 -4.372) 4.498 3.739 ( -4.500 0.309 -6.366) 7.802 3.830 ( -2.669 0.184 7.629) 8.085 4.007 ( 3.044 2.498 1.281) 4.141 4.126 ( -3.871 -3.088 -3.135) 5.861 4.160 ( 0.543 -5.798 0.698) 5.865 4.277 ( 3.299 3.029 -1.701) 4.791 4.414 ( -0.298 -2.146 1.986) 2.939 4.688 ( 2.480 8.306 7.256) 11.305 4.710 ( -2.058 -5.209 3.449) 6.578 4.794 ( 5.896 -5.055 -5.124) 9.304 4.909 ( -4.208 -7.281 -4.712) 9.640 5.113 ( 4.298 7.231 8.583) 12.018 5.291 ( -0.649 9.046 -10.181) 13.634 5.424 ( -4.208 3.297 -3.189) 6.225 5.708 ( -1.438 -0.609 3.026) 3.406 5.961 ( 5.518 -4.147 6.797) 9.687 6.033 ( -0.929 -3.891 -5.533) 6.828 6.118 ( -0.640 2.489 4.942) 5.570 6.528 ( -2.076 0.859 -3.403) 4.078 6.879 ( 6.518 0.053 -1.752) 6.750 7.567 ( -11.664 2.587 -1.793) 12.082 8.016 ( 1.419 -10.966 1.425) 11.149 8.087 ( 3.915 5.480 -0.852) 6.788 8.345 ( -3.216 -3.017 -2.206) 4.931 8.649 ( -0.509 8.147 -3.349) 8.823 8.713 ( -5.756 -2.632 2.454) 6.789 8.844 ( -9.502 1.771 -3.251) 10.198 8.963 ( 6.064 8.414 2.534) 10.676 9.044 ( 2.036 2.446 5.666) 6.499 9.304 ( -0.041 -2.350 6.020) 6.463 9.665 ( 5.125 -2.549 8.239) 10.032 10.037 ( 9.271 -6.476 -1.300) 11.383 10.135 ( -2.588 -0.241 -0.595) 2.667 10.258 ( -2.534 0.653 -9.642) 9.990 10.551 ( -0.142 2.550 -0.440) 2.592 10.963 ( 4.123 0.022 -8.364) 9.325 11.274 ( 0.985 -2.317 11.701) 11.968 11.710 ( 0.452 0.154 -2.278) 2.328 11.817 ( -6.908 -5.441 -0.685) 8.820 12.139 ( -7.143 2.752 2.814) 8.156 12.269 ( 3.507 9.165 0.022) 9.813 12.407 ( 5.757 -0.832 -6.772) 8.927 12.809 ( 3.162 -5.011 2.905) 6.599 13.196 ( -8.388 2.788 1.688) 8.999 13.481 ( -0.730 1.467 4.417) 4.711 13.735 ( 2.140 0.114 -0.818) 2.294 13.830 ( -4.495 -2.309 2.349) 5.572 14.049 ( -2.205 1.197 -4.370) 5.039 14.278 ( 0.593 -2.293 2.212) 3.241 14.768 ( 8.216 4.451 5.835) 11.017 15.589 ( -6.577 -2.963 -3.037) 7.827 16.182 ( -4.686 -4.009 -17.585) 18.635 16.263 ( 1.477 2.982 3.462) 4.802 16.817 ( -1.216 -1.400 9.540) 9.719 17.638 ( 1.838 3.855 -7.770) 8.867 17.990 ( 11.104 -3.934 9.174) 14.931 18.174 ( 9.386 0.556 -3.061) 9.888 19.061 ( -9.968 -2.187 -4.014) 10.966 19.514 ( -10.277 4.814 2.629) 11.649 19.566 ( 10.009 2.805 1.166) 10.459 20.094 ( -0.293 -10.235 1.167) 10.306 20.672 ( 4.403 3.740 -3.517) 6.763 20.882 ( -0.963 -3.431 -5.368) 6.443 21.380 ( 8.038 2.004 -9.463) 12.577 21.479 ( -5.677 -5.659 11.972) 14.408 21.898 ( -4.907 3.137 1.537) 6.023 22.383 ( -3.723 2.960 1.834) 5.098 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.879 ( 4.568 -8.867 11.852) 15.491 2.286 ( -7.952 -3.382 -2.536) 9.006 2.364 ( 8.197 7.835 -6.656) 13.148 2.717 ( 1.204 -13.949 1.874) 14.126 2.969 ( 1.434 8.830 -4.067) 9.827 3.005 ( 7.853 -1.971 -4.138) 9.092 3.399 ( 2.374 -1.185 -2.236) 3.470 3.409 ( -8.813 0.965 2.590) 9.236 3.575 ( -5.502 -2.592 -0.273) 6.088 3.835 ( 0.219 1.433 5.002) 5.208 4.016 ( 2.324 -10.493 2.166) 10.964 4.053 ( 0.309 -1.592 -2.938) 3.356 4.234 ( 3.136 8.841 -0.307) 9.386 4.361 ( -5.224 7.017 -2.819) 9.191 4.370 ( 10.787 -13.146 -7.953) 18.773 4.626 ( -3.788 -3.717 1.714) 5.577 4.671 ( -9.238 1.607 0.325) 9.382 4.816 ( 3.614 -3.075 0.275) 4.753 4.913 ( 7.888 0.853 2.618) 8.355 5.224 ( -1.150 -2.083 4.683) 5.253 5.342 ( -0.591 7.865 7.930) 11.184 5.460 ( 1.280 10.099 -4.610) 11.175 5.656 ( -1.779 -5.782 1.843) 6.324 5.920 ( -5.561 4.004 -8.532) 10.943 6.070 ( 7.463 -6.465 5.132) 11.128 6.168 ( -0.105 4.729 2.287) 5.254 6.454 ( -4.793 -0.833 -3.711) 6.119 7.038 ( 7.991 3.981 -1.791) 9.106 7.329 ( -11.411 -4.104 0.591) 12.141 7.930 ( 3.894 -12.267 -1.304) 12.936 8.210 ( 3.027 2.147 2.715) 4.598 8.279 ( -2.973 3.828 -0.292) 4.855 8.585 ( -8.427 4.593 -2.588) 9.940 8.724 ( -1.973 3.896 1.621) 4.658 8.799 ( 0.327 11.924 0.237) 11.931 8.930 ( -10.325 -4.725 -3.050) 11.757 9.181 ( 10.051 4.546 -5.340) 12.256 9.429 ( 4.847 5.174 14.368) 16.022 9.712 ( 0.255 -7.283 8.628) 11.293 10.006 ( -5.180 -1.757 -7.527) 9.305 10.121 ( 5.730 -5.340 -1.347) 7.947 10.295 ( 6.746 3.402 -2.473) 7.950 10.543 ( -3.552 -1.355 1.904) 4.252 10.989 ( 0.557 2.310 -5.116) 5.641 11.327 ( 2.689 -1.759 5.768) 6.602 11.629 ( -5.823 -1.684 -3.768) 7.137 11.748 ( 4.430 -2.036 -3.020) 5.735 12.056 ( -7.076 5.337 6.099) 10.758 12.334 ( 0.751 -8.072 -0.179) 8.108 12.483 ( 8.568 -3.980 -7.652) 12.157 12.864 ( 1.170 6.846 2.059) 7.244 13.151 ( -7.459 8.375 3.600) 11.779 13.408 ( -10.693 8.301 1.665) 13.639 13.750 ( 2.671 -4.828 2.944) 6.254 13.775 ( -0.333 0.357 -1.556) 1.631 14.008 ( -2.612 1.834 -2.374) 3.978 14.285 ( 2.129 -2.833 0.171) 3.549 15.030 ( 9.539 8.781 9.718) 16.203 15.401 ( -8.669 -3.574 -5.713) 10.980 16.061 ( 1.818 -2.748 -13.086) 13.495 16.283 ( -5.016 2.493 5.769) 8.041 16.819 ( 2.099 -4.378 2.723) 5.567 17.684 ( 0.497 6.634 -14.020) 15.518 17.941 ( -1.451 -12.852 19.160) 23.117 18.495 ( 13.775 -6.127 -11.860) 19.182 18.941 ( 4.001 3.212 4.088) 6.560 19.389 ( -10.577 7.792 1.785) 13.257 19.710 ( 8.026 -11.983 0.571) 14.434 19.982 ( 1.709 -5.899 0.289) 6.149 20.730 ( 5.650 -9.178 -10.288) 14.900 20.864 ( -2.219 9.720 -0.575) 9.987 21.272 ( -12.836 -2.758 7.282) 15.013 21.536 ( 6.060 -1.891 -5.118) 8.154 21.887 ( 0.118 5.612 2.566) 6.172 22.374 ( -6.182 10.058 3.379) 12.280 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.987 ( 9.573 -5.291 12.509) 16.616 2.109 ( -5.257 -5.870 -2.559) 8.284 2.545 ( 4.975 4.628 -3.247) 7.530 2.636 ( 5.862 -11.218 0.183) 12.659 2.969 ( -7.640 -1.467 0.326) 7.786 3.093 ( 1.889 4.372 -6.569) 8.113 3.247 ( -5.763 1.078 3.224) 6.691 3.386 ( 1.544 -2.299 -6.097) 6.697 3.540 ( -1.606 3.425 2.465) 4.515 3.878 ( -0.389 -1.390 -1.328) 1.961 3.952 ( 3.234 -11.077 1.875) 11.691 4.064 ( -1.519 4.717 0.088) 4.957 4.263 ( 2.087 -6.178 -8.051) 10.360 4.349 ( 5.881 -3.103 -0.673) 6.684 4.382 ( -4.238 7.608 -2.119) 8.963 4.588 ( 1.505 2.086 0.189) 2.579 4.647 ( 4.013 -0.760 0.988) 4.202 4.862 ( 3.569 -2.364 2.476) 4.945 4.986 ( -4.846 1.578 5.435) 7.451 5.178 ( -2.434 -3.827 9.071) 10.142 5.412 ( -1.909 1.113 -0.458) 2.257 5.540 ( 2.730 2.603 -1.629) 4.108 5.604 ( -0.785 1.508 2.796) 3.272 5.842 ( -4.715 5.227 -7.232) 10.093 6.154 ( 6.990 -6.123 3.038) 9.776 6.201 ( -2.167 3.334 -1.547) 4.267 6.340 ( -4.456 0.348 -1.966) 4.883 6.987 ( -8.822 -7.082 -0.442) 11.322 7.335 ( 7.766 6.667 0.100) 10.235 7.905 ( 5.902 -8.716 -2.616) 10.847 8.228 ( -5.095 -1.952 -0.920) 5.533 8.270 ( -2.898 5.447 5.089) 7.998 8.542 ( -1.834 4.628 -0.388) 4.993 8.714 ( -2.801 -2.919 -2.434) 4.721 8.770 ( 1.139 4.037 5.072) 6.582 8.962 ( -0.548 19.603 -5.534) 20.376 9.340 ( 6.951 1.569 -5.950) 9.283 9.576 ( -0.109 -3.088 -2.094) 3.733 9.640 ( -2.399 -1.784 15.857) 16.137 9.888 ( 0.056 -2.625 -8.122) 8.536 10.152 ( 3.547 -4.646 0.549) 5.871 10.397 ( -8.615 -7.080 4.724) 12.110 10.473 ( 8.308 2.156 2.073) 8.830 10.987 ( -3.655 5.287 1.428) 6.584 11.307 ( -2.296 -6.712 -7.883) 10.605 11.560 ( -2.850 5.739 2.409) 6.845 11.814 ( 6.612 -2.216 -6.066) 9.242 12.067 ( -0.851 3.670 6.491) 7.505 12.264 ( 5.086 -8.316 1.466) 9.858 12.522 ( 0.779 -1.905 -4.728) 5.157 12.861 ( -9.632 -3.649 0.465) 10.310 13.072 ( -3.243 12.313 -1.028) 12.774 13.507 ( 1.100 17.700 -1.366) 17.786 13.756 ( 1.375 -3.343 0.973) 3.744 13.782 ( 2.838 -1.538 -0.530) 3.271 13.996 ( -1.138 2.940 3.777) 4.920 14.277 ( 1.188 -4.096 -2.300) 4.845 15.181 ( -8.319 1.290 -12.406) 14.992 15.344 ( 9.391 6.542 13.993) 18.077 16.002 ( -2.570 -5.359 -1.554) 6.143 16.206 ( -6.935 -2.608 11.029) 13.287 16.839 ( 6.920 0.029 -14.093) 15.700 17.700 ( 1.949 0.264 -11.467) 11.635 17.845 ( -7.055 -5.854 19.554) 21.596 18.394 ( -0.298 -16.382 -6.546) 17.644 19.234 ( 9.932 7.961 2.858) 13.046 19.348 ( -0.244 4.377 -2.766) 5.184 19.636 ( 0.962 -9.911 4.918) 11.105 20.071 ( 6.542 1.429 -0.297) 6.703 20.652 ( 4.408 -12.001 -10.412) 16.489 20.911 ( -3.764 3.615 3.227) 6.136 21.059 ( -11.536 2.272 8.268) 14.374 21.509 ( -0.679 -4.234 -7.562) 8.693 22.046 ( 7.682 6.410 0.855) 10.042 22.391 ( -5.981 11.283 3.054) 13.131 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.003 ( -9.534 10.570 2.416) 14.439 2.076 ( -0.954 -3.019 -2.687) 4.152 2.501 ( 8.307 -7.450 -3.533) 11.704 2.676 ( -3.571 6.802 5.364) 9.370 2.843 ( 0.129 4.785 -0.564) 4.820 3.065 ( 5.953 -8.228 -8.469) 13.223 3.185 ( 7.386 2.870 7.669) 11.027 3.516 ( -2.673 -0.785 -4.107) 4.963 3.612 ( -3.656 -4.496 6.204) 8.489 3.859 ( 6.380 2.644 6.791) 9.686 3.942 ( -2.487 10.150 3.119) 10.906 4.117 ( -0.136 -1.302 1.341) 1.874 4.220 ( 10.081 -5.787 -4.929) 12.626 4.325 ( 0.365 -7.491 -5.202) 9.128 4.453 ( -3.145 -5.430 -1.517) 6.456 4.664 ( 2.314 0.466 3.671) 4.365 4.788 ( -1.853 7.814 -0.950) 8.087 4.825 ( 7.123 -5.456 0.924) 9.020 4.856 ( -6.248 -1.930 -3.090) 7.233 5.025 ( -10.454 12.115 7.240) 17.563 5.372 ( 1.624 4.325 -9.604) 10.658 5.460 ( -10.443 2.931 -5.723) 12.264 5.704 ( -1.288 -1.057 4.420) 4.724 5.869 ( 7.607 -7.292 3.632) 11.146 6.130 ( 6.822 1.413 -3.096) 7.624 6.214 ( -3.045 0.083 -2.320) 3.829 6.381 ( -1.287 -0.580 6.417) 6.571 6.816 ( 3.652 6.476 2.226) 7.761 7.521 ( -5.418 -5.526 1.277) 7.844 8.014 ( -0.545 4.079 3.829) 5.621 8.095 ( 9.101 -3.250 -2.732) 10.043 8.260 ( -4.251 3.235 4.098) 6.733 8.551 ( 4.242 -9.387 0.531) 10.315 8.713 ( -6.152 -3.150 0.477) 6.928 8.858 ( -3.547 0.323 -1.503) 3.866 9.092 ( -5.557 -0.048 -7.512) 9.344 9.249 ( 0.418 -8.228 -8.050) 11.519 9.488 ( -1.871 7.095 -4.367) 8.539 9.792 ( 5.412 2.952 5.455) 8.232 9.913 ( -0.331 4.678 5.818) 7.473 10.107 ( -2.412 2.106 -2.905) 4.323 10.153 ( 2.831 -0.765 -1.158) 3.153 10.565 ( -4.676 1.351 -1.111) 4.993 10.824 ( 5.342 -0.750 -1.221) 5.531 11.410 ( 4.734 5.741 9.052) 11.718 11.587 ( 1.371 -9.179 -1.046) 9.339 11.853 ( 0.180 -2.964 -2.906) 4.155 12.161 ( -9.217 3.130 3.006) 10.187 12.261 ( 5.998 2.865 2.692) 7.171 12.367 ( -0.651 -2.965 -6.951) 7.585 12.810 ( 3.187 2.680 3.017) 5.142 13.220 ( -6.472 -3.377 -0.007) 7.300 13.620 ( -0.714 -2.212 -4.469) 5.038 13.730 ( -1.165 3.638 -0.779) 3.898 13.882 ( 4.101 -5.854 -2.706) 7.643 13.949 ( -6.906 -5.503 3.606) 9.539 14.298 ( 2.923 2.007 1.584) 3.883 15.050 ( -3.267 10.707 -17.310) 20.614 15.527 ( 0.739 -15.443 10.230) 18.539 15.714 ( 2.579 5.202 7.424) 9.425 16.244 ( 1.391 0.025 5.975) 6.135 17.185 ( 1.503 6.722 -12.326) 14.120 17.402 ( -6.832 -10.875 4.321) 13.551 17.832 ( 5.671 17.201 9.151) 20.292 18.303 ( 7.235 3.856 0.925) 8.250 19.113 ( 3.815 -5.793 -9.217) 11.535 19.459 ( -4.034 2.015 2.990) 5.411 19.672 ( -6.606 -3.976 -2.751) 8.186 20.144 ( 3.314 -4.322 -1.506) 5.651 20.630 ( 11.331 0.846 -0.033) 11.363 20.760 ( -2.348 4.031 1.906) 5.039 21.114 ( -2.996 1.310 9.883) 10.409 21.560 ( 1.864 3.998 3.516) 5.641 22.086 ( -0.726 -8.710 -10.080) 13.342 22.424 ( -7.302 -0.470 -0.463) 7.332 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 ( -13.582 7.074 1.174) 15.359 2.198 ( 4.060 7.211 2.025) 8.519 2.494 ( 3.252 -2.811 -6.371) 7.685 2.681 ( -7.084 6.602 3.288) 10.227 2.995 ( 8.562 5.576 -2.823) 10.601 3.084 ( 5.703 -4.259 -0.449) 7.132 3.301 ( -0.595 -3.731 9.510) 10.233 3.455 ( 1.505 -1.326 -3.397) 3.945 3.516 ( -5.648 -3.630 0.898) 6.774 3.863 ( -9.107 5.547 -3.933) 11.365 4.015 ( 1.910 3.644 6.782) 7.933 4.061 ( -0.154 -2.139 -1.235) 2.475 4.279 ( -2.914 -3.224 -4.848) 6.511 4.359 ( 10.332 -5.222 -3.921) 12.223 4.461 ( 7.776 5.219 4.884) 10.562 4.606 ( -5.471 -8.351 3.457) 10.566 4.690 ( -4.457 -2.983 1.913) 5.694 4.833 ( -2.854 8.424 -0.271) 8.898 4.987 ( 1.517 6.156 5.653) 8.494 5.058 ( 5.473 3.232 1.200) 6.468 5.281 ( -8.530 -0.277 -5.393) 10.096 5.386 ( -0.624 5.180 -11.640) 12.756 5.698 ( -1.193 -0.145 4.725) 4.875 5.922 ( 7.525 -9.889 0.332) 12.431 6.108 ( -6.237 -0.277 -1.842) 6.509 6.250 ( 2.990 0.818 0.697) 3.177 6.383 ( 1.512 -0.932 2.285) 2.894 7.017 ( 9.380 6.749 1.873) 11.706 7.325 ( -8.956 -6.595 -0.656) 11.141 8.008 ( -8.437 9.626 4.386) 13.531 8.158 ( 2.052 -2.449 -3.510) 4.746 8.272 ( 5.547 -5.874 2.326) 8.407 8.541 ( -3.602 0.189 -1.695) 3.985 8.577 ( 2.865 -5.540 -3.081) 6.956 8.879 ( 4.009 -1.959 3.574) 5.717 9.012 ( 0.602 -2.833 0.545) 2.947 9.129 ( -1.513 -4.698 -11.900) 12.883 9.501 ( -1.605 6.811 -7.745) 10.438 9.756 ( -11.037 -7.555 14.232) 19.530 9.964 ( 5.573 1.329 -2.703) 6.335 10.147 ( -1.300 4.378 0.993) 4.674 10.297 ( 9.387 7.475 -2.716) 12.303 10.499 ( -4.619 1.623 2.829) 5.654 10.918 ( 4.641 -1.022 -0.080) 4.753 11.498 ( -4.169 -1.331 7.352) 8.556 11.558 ( 4.443 -1.559 -3.761) 6.026 11.792 ( -0.516 -5.228 -3.966) 6.582 12.019 ( -5.009 -1.884 0.757) 5.405 12.234 ( -5.053 13.101 -0.402) 14.048 12.549 ( 8.127 1.402 -1.079) 8.318 12.909 ( 0.525 3.472 2.969) 4.599 13.068 ( 3.110 -12.354 -1.297) 12.805 13.469 ( -2.706 -16.434 -3.770) 17.077 13.698 ( -4.535 1.197 -2.122) 5.148 13.874 ( -1.569 5.336 4.684) 7.271 13.918 ( 4.977 -3.617 -0.905) 6.218 14.340 ( -0.003 0.117 0.867) 0.875 14.978 ( -7.310 5.750 -11.741) 14.978 15.479 ( 5.012 -10.484 7.397) 13.775 15.945 ( 10.934 7.808 5.589) 14.552 16.265 ( -0.413 -1.569 3.601) 3.950 17.109 ( -6.919 -12.773 -8.043) 16.605 17.307 ( -0.037 14.300 0.608) 14.313 18.111 ( 0.037 4.920 13.201) 14.088 18.489 ( 8.944 11.986 -0.522) 14.965 18.995 ( -8.071 -2.870 -12.440) 15.104 19.367 ( -0.873 -10.557 -1.335) 10.676 19.612 ( -4.863 16.095 3.314) 17.137 20.105 ( -4.530 -1.410 1.385) 4.942 20.799 ( 5.135 1.838 -6.837) 8.746 20.829 ( 9.346 -1.861 3.137) 10.032 21.134 ( -2.959 -0.215 15.513) 15.794 21.665 ( 5.311 2.421 2.675) 6.421 21.878 ( -7.331 -7.392 -11.084) 15.207 22.329 ( 1.277 -6.981 -1.422) 7.238 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.736 ( -5.124 9.587 1.733) 11.008 2.331 ( -0.715 6.466 2.160) 6.855 2.506 ( 1.435 -1.095 3.320) 3.779 2.680 ( -1.267 9.672 -2.878) 10.170 3.093 ( 2.225 -5.660 -3.081) 6.817 3.113 ( 1.558 -6.994 -0.368) 7.175 3.228 ( -2.840 -0.971 5.873) 6.596 3.324 ( -6.405 -6.707 -6.194) 11.153 3.549 ( 6.324 5.559 -2.147) 8.689 3.831 ( -2.758 9.348 0.033) 9.746 4.039 ( -0.849 0.752 1.756) 2.091 4.123 ( 3.059 -1.027 -1.110) 3.412 4.160 ( -1.299 -1.282 -1.335) 2.261 4.411 ( -5.673 -7.616 -1.368) 9.595 4.485 ( 7.978 -2.986 -4.813) 9.784 4.585 ( -1.672 -5.506 9.977) 11.518 4.662 ( 1.682 3.720 0.529) 4.117 4.888 ( 1.179 2.358 2.351) 3.532 5.001 ( -7.436 9.381 7.330) 14.037 5.084 ( -7.573 1.671 -3.817) 8.644 5.311 ( 10.305 2.386 4.551) 11.515 5.372 ( -0.699 5.623 -10.361) 11.809 5.679 ( -1.695 -1.522 1.383) 2.664 5.926 ( 2.441 -6.141 -3.168) 7.329 6.004 ( -1.304 -4.581 -1.227) 4.918 6.229 ( -4.098 -1.289 5.039) 6.622 6.457 ( 5.153 0.989 -3.286) 6.191 7.043 ( -9.292 -4.802 -1.426) 10.556 7.327 ( 12.364 4.841 0.663) 13.294 7.997 ( -5.757 9.635 2.896) 11.592 8.106 ( -0.821 -3.126 -4.925) 5.890 8.356 ( 3.717 -0.179 4.928) 6.176 8.493 ( 1.265 3.906 -5.365) 6.756 8.661 ( 10.979 -5.015 -2.254) 12.279 8.850 ( 1.138 -10.925 1.790) 11.129 8.962 ( 0.268 -10.084 -7.249) 12.422 9.145 ( 1.041 9.935 5.017) 11.178 9.485 ( -6.510 1.853 -4.104) 7.916 9.511 ( -8.886 -6.421 9.054) 14.219 10.055 ( 4.644 0.955 -3.250) 5.748 10.177 ( -1.995 5.438 2.790) 6.429 10.413 ( -5.556 3.105 1.851) 6.629 10.515 ( 4.961 2.436 0.390) 5.541 10.927 ( -0.506 -2.686 -2.560) 3.745 11.396 ( -6.551 -2.200 6.164) 9.261 11.617 ( 4.896 -1.132 -5.929) 7.773 11.719 ( 0.145 -0.316 -2.605) 2.629 12.032 ( 5.420 0.144 3.387) 6.393 12.325 ( -1.877 10.583 -1.147) 10.809 12.596 ( -3.693 1.677 -0.136) 4.058 12.798 ( -4.884 -6.332 -2.499) 8.378 13.100 ( 5.625 -11.676 0.521) 12.971 13.364 ( 9.573 -6.167 -1.216) 11.452 13.646 ( -1.804 2.587 -2.192) 3.841 13.914 ( 0.775 -3.029 6.991) 7.659 14.000 ( 3.752 5.825 -2.865) 7.498 14.308 ( -2.391 -2.462 0.739) 3.511 14.832 ( -9.414 2.840 -4.710) 10.903 15.546 ( 7.756 -4.455 4.438) 9.985 16.165 ( 3.238 -3.917 -0.663) 5.125 16.320 ( 7.981 7.137 4.730) 11.705 16.840 ( -7.732 -8.754 0.594) 11.695 17.442 ( -1.949 15.607 -13.762) 20.898 18.042 ( -7.431 -6.668 11.657) 15.348 18.672 ( -17.034 -3.180 -5.019) 18.041 18.871 ( 14.316 12.407 3.731) 19.309 19.315 ( 6.200 -7.206 -1.946) 9.703 19.712 ( -7.140 12.030 0.971) 14.023 20.031 ( -4.105 6.810 2.860) 8.451 20.860 ( 4.158 -3.268 -6.910) 8.702 20.931 ( 5.227 -7.911 2.204) 9.734 21.122 ( -2.595 1.439 6.998) 7.601 21.627 ( -8.040 -3.504 -6.300) 10.799 21.828 ( 7.578 1.342 3.216) 8.341 22.314 ( 4.697 -5.160 -0.671) 7.009 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.840 ( 3.706 10.799 1.165) 11.476 2.218 ( -12.427 -4.712 4.456) 14.017 2.588 ( 3.727 0.897 2.786) 4.739 2.755 ( 1.162 2.890 -3.528) 4.706 2.986 ( -3.715 -3.635 1.685) 5.465 3.051 ( -2.123 -5.407 -4.817) 7.547 3.161 ( -1.042 -2.951 -1.297) 3.388 3.255 ( 5.438 -2.353 -3.680) 6.975 3.725 ( 6.614 7.294 -3.300) 10.384 3.876 ( -3.294 5.199 -1.095) 6.252 3.984 ( -1.455 -6.106 -0.281) 6.283 4.117 ( 1.696 1.280 -2.366) 3.181 4.198 ( -0.807 -1.644 -0.540) 1.910 4.311 ( 2.455 -2.979 1.102) 4.015 4.457 ( 0.481 -11.425 0.234) 11.437 4.549 ( -3.965 -2.258 9.105) 10.184 4.674 ( -0.129 -1.060 -0.351) 1.125 4.893 ( 1.239 -0.736 -2.680) 3.043 5.009 ( -5.376 5.240 2.903) 8.049 5.070 ( -2.995 13.585 6.804) 15.486 5.363 ( -1.552 6.514 -7.217) 9.845 5.491 ( 1.680 0.148 0.505) 1.761 5.669 ( 2.922 2.521 1.028) 3.993 5.874 ( -1.847 -3.335 2.074) 4.339 5.956 ( 3.648 -7.130 -3.752) 8.845 6.176 ( -2.391 -0.249 3.170) 3.978 6.519 ( 2.685 0.375 -3.891) 4.743 6.867 ( -6.067 0.667 -2.404) 6.559 7.590 ( 12.461 0.978 -0.263) 12.502 7.974 ( -4.093 2.301 -4.113) 6.242 8.062 ( 0.153 -3.929 -0.857) 4.024 8.386 ( -2.699 5.748 -1.225) 6.467 8.640 ( 9.269 0.338 2.491) 9.604 8.765 ( 7.294 -4.693 3.515) 9.358 8.785 ( -2.676 -4.288 -1.743) 5.347 8.872 ( 3.598 -5.712 -1.421) 6.899 9.240 ( -4.772 8.416 5.242) 11.004 9.297 ( -5.110 -2.190 10.217) 11.632 9.483 ( 1.980 0.422 -5.038) 5.430 10.126 ( 2.382 2.317 -0.826) 3.424 10.142 ( -11.681 5.667 4.614) 13.779 10.334 ( -1.509 -2.971 -4.019) 5.221 10.580 ( 0.062 1.489 0.722) 1.656 10.873 ( -0.350 0.121 -7.249) 7.259 11.316 ( -3.743 -1.309 8.258) 9.161 11.614 ( 4.698 -7.405 -6.055) 10.657 11.830 ( 5.823 6.791 -0.893) 8.990 12.165 ( 3.924 -3.311 3.050) 5.972 12.271 ( -2.979 -4.188 0.642) 5.179 12.503 ( -6.099 1.972 -0.533) 6.431 12.705 ( -1.265 2.493 -3.932) 4.825 13.169 ( 9.476 -0.911 -0.023) 9.520 13.459 ( 1.959 -0.358 2.734) 3.382 13.668 ( 1.656 2.282 -2.247) 3.606 13.907 ( -0.392 -4.616 4.537) 6.485 14.107 ( 1.523 5.868 -0.482) 6.082 14.240 ( -0.134 -4.277 -0.208) 4.284 14.705 ( -6.184 2.757 1.070) 6.854 15.657 ( 4.792 -0.524 0.232) 4.826 16.127 ( 0.901 -1.840 -2.226) 3.025 16.509 ( -3.050 3.114 3.933) 5.871 16.724 ( 4.414 -4.170 -0.014) 6.072 17.454 ( 0.981 9.844 -16.465) 19.208 17.882 ( -10.330 -3.624 6.096) 12.530 18.356 ( -10.642 -6.107 2.630) 12.548 19.204 ( 10.976 1.921 6.559) 12.930 19.349 ( -0.008 -4.605 -5.270) 6.999 19.635 ( -2.444 2.565 3.043) 4.670 20.100 ( -1.125 5.546 1.226) 5.790 20.732 ( -4.886 -12.325 -2.738) 13.538 20.952 ( -1.104 4.343 0.911) 4.573 21.149 ( 2.410 3.694 -8.178) 9.292 21.512 ( 1.138 -3.246 -1.824) 3.893 21.953 ( 3.050 -0.430 6.138) 6.867 22.386 ( 3.581 3.948 1.980) 5.686 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 ( -6.861 -14.648 3.099) 16.470 2.073 ( 5.334 10.267 3.577) 12.110 2.625 ( 0.405 -11.649 -7.320) 13.763 2.682 ( -3.290 1.370 6.357) 7.288 2.881 ( -6.826 -3.609 -5.599) 9.537 2.965 ( -1.295 5.504 -2.261) 6.089 3.210 ( 8.844 -3.073 -8.718) 12.793 3.357 ( 6.437 0.736 5.108) 8.250 3.768 ( -4.532 -7.729 -1.276) 9.050 3.874 ( 7.347 -2.696 -5.885) 9.792 3.900 ( -2.856 -2.616 0.390) 3.893 4.116 ( 1.221 -12.453 -6.231) 13.978 4.174 ( 0.754 6.636 -1.565) 6.860 4.250 ( -8.633 -2.853 7.852) 12.013 4.390 ( 4.418 -6.635 0.924) 8.025 4.588 ( 4.324 4.131 7.030) 9.230 4.674 ( 0.355 0.197 -1.301) 1.363 4.895 ( -2.313 3.054 0.034) 3.831 4.987 ( -6.727 5.652 3.870) 9.601 5.176 ( -0.277 5.817 4.971) 7.657 5.361 ( -1.527 7.157 -7.902) 10.770 5.487 ( 0.143 2.001 2.478) 3.188 5.725 ( -1.355 -2.997 1.991) 3.845 5.867 ( 2.694 -0.678 2.802) 3.946 5.962 ( 3.347 -0.257 -4.284) 5.443 6.171 ( -0.067 0.968 2.262) 2.461 6.527 ( 0.295 -0.572 -4.009) 4.060 6.841 ( 0.302 6.584 -2.859) 7.185 7.678 ( -0.892 -9.694 -1.332) 9.825 7.920 ( -1.701 -3.066 -1.759) 3.923 8.003 ( 3.502 -2.460 -2.075) 4.756 8.399 ( -2.638 4.437 -1.710) 5.438 8.606 ( 0.676 -6.779 -5.408) 8.698 8.802 ( 0.372 7.161 4.326) 8.374 8.880 ( -0.368 2.531 -0.910) 2.715 8.978 ( 9.648 -0.736 10.953) 14.615 9.214 ( -8.244 8.522 4.277) 12.604 9.337 ( 1.675 2.332 7.700) 8.218 9.553 ( 7.066 -0.061 -0.634) 7.095 9.963 ( -8.937 -2.890 3.187) 9.918 10.180 ( -1.504 0.584 0.364) 1.654 10.253 ( -1.219 1.102 -7.173) 7.359 10.599 ( -1.155 4.658 1.111) 4.926 10.869 ( 2.892 1.434 -10.015) 10.522 11.303 ( -0.858 -1.133 10.041) 10.142 11.599 ( 4.430 -7.213 -5.411) 10.046 11.891 ( -6.412 -2.663 -0.411) 6.955 12.068 ( 7.394 -10.835 -2.486) 13.351 12.325 ( -1.927 7.776 0.384) 8.021 12.437 ( -2.366 -3.264 2.262) 4.623 12.774 ( 2.882 10.777 -1.595) 11.269 13.311 ( 1.316 6.017 0.508) 6.180 13.495 ( 1.751 1.125 5.296) 5.690 13.707 ( 1.517 0.685 -1.330) 2.131 13.837 ( -2.183 -5.569 1.806) 6.248 14.138 ( -3.438 4.719 0.413) 5.853 14.234 ( 2.079 -2.406 -1.609) 3.564 14.725 ( 3.571 3.452 7.728) 9.187 15.666 ( -3.466 2.763 -3.883) 5.893 16.185 ( 2.213 0.289 -0.862) 2.393 16.315 ( -11.468 3.115 -12.462) 17.220 16.812 ( 4.833 -4.871 7.817) 10.401 17.639 ( 5.634 1.142 -6.664) 8.801 17.708 ( 4.826 1.985 0.042) 5.219 18.181 ( -5.968 -5.195 4.129) 8.925 19.120 ( -8.323 -12.314 -7.555) 16.672 19.377 ( 9.596 -5.503 3.302) 11.544 19.716 ( -0.431 1.948 9.475) 9.683 20.037 ( -5.140 -6.429 -1.253) 8.326 20.525 ( 0.214 -12.736 -6.782) 14.430 20.979 ( -4.741 12.515 -3.789) 13.909 21.240 ( 7.000 4.628 -7.667) 11.367 21.533 ( 1.007 0.190 3.179) 3.340 21.978 ( -1.500 -0.996 4.636) 4.973 22.513 ( -0.352 11.725 4.421) 12.536 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.718 ( 2.323 -18.572 9.816) 21.135 2.249 ( 3.398 -3.413 -0.474) 4.839 2.434 ( -2.313 -1.272 -5.553) 6.149 2.613 ( -7.140 -5.633 3.837) 9.870 2.835 ( 6.252 -0.064 -3.880) 7.359 3.011 ( 1.637 5.405 -3.457) 6.621 3.271 ( 5.763 -2.838 -10.774) 12.544 3.489 ( 4.356 0.316 2.773) 5.173 3.606 ( -5.360 -6.369 1.684) 8.493 3.782 ( 4.062 -15.620 -5.804) 17.151 3.916 ( -0.225 -4.850 0.534) 4.885 3.969 ( 6.444 -16.654 -4.873) 18.511 4.094 ( -7.845 -0.291 5.555) 9.617 4.299 ( 1.077 11.941 -1.308) 12.060 4.487 ( 6.565 2.820 1.001) 7.215 4.612 ( -5.658 0.380 -0.752) 5.720 4.755 ( 3.190 0.587 3.913) 5.082 4.850 ( -5.728 2.669 -4.157) 7.564 4.938 ( -3.652 6.653 6.669) 10.103 5.213 ( 1.103 -2.053 5.690) 6.149 5.454 ( 1.661 9.999 1.403) 10.233 5.547 ( -0.644 5.679 3.249) 6.574 5.641 ( -2.434 -5.782 2.137) 6.627 5.904 ( 3.841 -2.716 -2.368) 5.267 5.996 ( -0.879 4.448 -5.986) 7.509 6.207 ( 1.305 1.371 2.025) 2.772 6.486 ( -2.146 -1.152 -3.266) 4.074 6.976 ( 5.903 10.293 -3.110) 12.267 7.436 ( -8.984 -14.011 0.148) 16.644 7.803 ( -2.469 -5.505 -1.601) 6.242 8.129 ( 7.434 -1.044 3.585) 8.319 8.367 ( -3.224 4.287 0.543) 5.392 8.652 ( 6.808 4.315 -11.050) 13.678 8.807 ( -3.215 -0.960 -0.214) 3.362 8.902 ( -4.226 7.347 -0.046) 8.476 9.051 ( -4.758 -0.187 2.818) 5.533 9.199 ( -3.818 9.115 4.793) 10.983 9.474 ( 3.915 5.273 12.085) 13.754 9.660 ( 2.412 -3.192 6.744) 7.842 9.876 ( 6.277 -7.431 -1.036) 9.782 10.063 ( -4.261 -3.250 -6.705) 8.583 10.297 ( -0.642 6.774 1.019) 6.880 10.630 ( -2.869 5.240 2.062) 6.320 10.923 ( 5.443 3.753 -10.060) 12.038 11.334 ( -0.366 -0.436 9.455) 9.472 11.577 ( 4.467 -5.491 -9.366) 11.740 11.722 ( -5.855 -4.332 3.825) 8.227 12.097 ( 7.274 -9.417 -4.802) 12.832 12.298 ( -5.402 -8.367 2.948) 10.386 12.368 ( -2.655 6.932 -3.116) 8.050 12.970 ( 2.499 15.009 -0.343) 15.220 13.352 ( -3.866 6.566 3.765) 8.498 13.574 ( 1.481 3.423 4.489) 5.836 13.700 ( -0.920 -2.727 1.132) 3.093 13.770 ( -1.850 -1.333 -2.100) 3.100 14.120 ( -4.781 7.181 -0.927) 8.677 14.221 ( 0.713 -3.590 -0.853) 3.758 14.961 ( 11.687 5.564 14.464) 19.410 15.557 ( -11.197 3.327 -6.629) 13.431 16.002 ( -4.427 1.768 -17.171) 17.821 16.359 ( 2.038 5.829 -3.103) 6.910 16.796 ( -3.249 -9.903 12.501) 16.276 17.615 ( 3.692 0.846 -6.605) 7.614 17.934 ( 1.905 -8.485 12.168) 14.956 18.151 ( 11.591 -1.104 -9.014) 14.725 18.874 ( 0.482 -9.137 -4.598) 10.240 19.447 ( 5.665 -11.850 -1.763) 13.252 19.697 ( -8.590 5.396 9.572) 13.947 19.843 ( -0.806 -13.947 1.201) 14.021 20.433 ( 8.036 -15.598 -10.082) 20.236 21.015 ( -3.782 12.420 -3.261) 13.386 21.368 ( 3.700 4.376 -8.540) 10.284 21.549 ( -4.712 3.483 10.081) 11.660 21.948 ( -2.079 1.870 0.294) 2.811 22.630 ( -4.771 15.606 4.929) 17.047 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 ( 11.972 -17.406 16.734) 26.951 2.105 ( 0.987 -14.109 -7.702) 16.105 2.464 ( -3.195 -4.518 1.526) 5.741 2.534 ( 2.936 8.805 -0.047) 9.281 2.950 ( 8.522 -2.210 -2.132) 9.058 3.063 ( -0.418 0.858 -2.557) 2.729 3.291 ( 4.650 -0.342 -7.205) 8.582 3.407 ( -11.332 -4.368 -1.913) 12.294 3.548 ( 3.130 -0.780 -0.994) 3.376 3.702 ( 10.981 -18.691 -6.987) 22.776 3.848 ( 4.377 -9.995 -0.227) 10.914 3.984 ( -2.018 -1.443 -0.866) 2.628 4.061 ( 8.186 -1.088 4.527) 9.417 4.361 ( -8.333 5.136 -2.954) 10.225 4.508 ( -2.926 6.162 0.726) 6.860 4.608 ( 0.360 3.936 -0.789) 4.030 4.745 ( -1.929 -1.304 0.799) 2.462 4.808 ( -0.696 4.149 -0.284) 4.216 5.037 ( 2.383 0.050 12.895) 13.113 5.230 ( -0.893 0.284 5.373) 5.454 5.495 ( -2.460 -1.860 -8.579) 9.116 5.560 ( -4.378 6.423 9.653) 12.394 5.649 ( 1.441 2.550 6.259) 6.910 5.929 ( -1.383 4.681 -11.391) 12.393 5.989 ( 3.760 -2.903 0.324) 4.761 6.223 ( -0.360 -1.460 -4.001) 4.274 6.420 ( -3.531 1.237 0.736) 3.813 7.120 ( -10.152 -0.678 -0.634) 10.195 7.220 ( 8.512 -0.397 -0.377) 8.529 7.752 ( 2.407 -3.422 -0.000) 4.184 8.190 ( 0.295 -5.236 2.687) 5.893 8.405 ( 0.608 5.088 2.291) 5.613 8.682 ( -8.001 6.823 -8.588) 13.576 8.783 ( -3.386 -2.520 2.970) 5.161 8.823 ( -0.048 4.657 -0.511) 4.685 9.056 ( 2.908 11.933 -10.907) 16.426 9.281 ( 1.165 3.762 4.602) 6.057 9.523 ( -2.219 -3.411 -1.756) 4.432 9.697 ( -0.562 -1.997 15.172) 15.313 9.904 ( 0.884 -2.268 -1.508) 2.863 10.016 ( 4.522 -2.593 -0.488) 5.236 10.337 ( 0.458 -2.168 5.394) 5.832 10.611 ( -6.583 8.045 1.424) 10.492 11.029 ( 3.675 5.685 -8.459) 10.835 11.303 ( -5.441 -1.935 1.132) 5.885 11.597 ( 8.020 -4.277 -8.731) 12.603 11.670 ( -1.882 2.876 6.368) 7.237 12.045 ( 2.406 -16.349 -1.229) 16.571 12.176 ( 0.514 -2.698 3.576) 4.509 12.411 ( 2.598 6.081 -6.956) 9.598 13.050 ( -7.751 5.814 1.518) 9.807 13.348 ( -7.804 11.084 0.199) 13.557 13.653 ( 3.635 -4.378 2.781) 6.333 13.667 ( -1.687 1.611 -2.285) 3.265 13.739 ( -0.369 7.366 2.479) 7.781 14.111 ( -4.081 7.761 -3.551) 9.460 14.194 ( 1.028 -4.561 1.667) 4.964 15.197 ( 0.246 -5.808 0.348) 5.823 15.441 ( -0.982 16.953 3.230) 17.286 15.987 ( 1.416 2.941 -4.533) 5.586 16.360 ( -6.708 0.809 3.907) 7.805 16.666 ( 1.220 -10.108 -1.832) 10.345 17.638 ( 0.049 2.266 -13.832) 14.016 17.925 ( 1.098 -7.896 23.756) 25.058 18.164 ( 3.649 -13.451 -10.262) 17.307 19.028 ( 17.602 1.673 -2.400) 17.843 19.264 ( -2.856 -19.845 -4.427) 20.532 19.683 ( -2.892 9.875 5.180) 11.521 19.860 ( 12.294 -9.707 2.953) 15.940 20.361 ( 7.096 -17.122 -8.799) 20.517 21.057 ( -4.400 8.454 2.682) 9.901 21.334 ( -9.287 4.436 -0.882) 10.329 21.518 ( -5.008 2.606 1.115) 5.755 21.993 ( 3.491 4.754 -1.789) 6.163 22.692 ( -8.602 15.716 4.145) 18.389 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.818 ( 19.140 -1.976 -4.872) 19.849 2.256 ( 11.213 -7.353 -0.759) 13.430 2.370 ( -11.072 5.091 2.625) 12.466 2.648 ( 3.303 -8.835 -1.944) 9.630 2.816 ( 3.923 3.765 0.005) 5.437 2.986 ( -3.052 2.450 1.244) 4.107 3.160 ( 5.232 5.559 4.625) 8.926 3.509 ( 6.592 -1.311 -0.374) 6.732 3.601 ( -0.051 -7.845 3.303) 8.513 3.685 ( 15.145 -3.116 6.889) 16.928 3.904 ( 7.170 1.564 3.279) 8.037 3.953 ( 11.383 -4.191 -2.995) 12.494 4.186 ( -1.942 -6.172 -5.755) 8.660 4.294 ( -11.002 4.089 -1.958) 11.900 4.503 ( -1.351 5.089 -1.674) 5.525 4.608 ( -0.456 -3.286 -0.441) 3.347 4.768 ( -0.856 -4.110 5.832) 7.186 4.803 ( -1.047 2.619 -1.554) 3.221 5.019 ( -8.009 4.344 -4.415) 10.124 5.294 ( 1.630 0.362 -6.936) 7.134 5.413 ( -7.908 9.178 5.038) 13.121 5.611 ( -0.708 -2.160 -3.843) 4.465 5.679 ( -6.195 -0.315 -4.961) 7.943 5.812 ( -0.037 -0.067 11.162) 11.162 5.993 ( 4.998 -0.310 -4.096) 6.469 6.209 ( 2.641 -0.235 1.930) 3.280 6.447 ( -3.117 -0.386 2.516) 4.025 6.932 ( -5.020 10.270 3.554) 11.971 7.432 ( 6.236 -12.427 0.762) 13.925 7.803 ( 4.622 -4.860 -1.514) 6.875 8.173 ( 2.559 9.860 -1.922) 10.367 8.370 ( -1.169 -2.224 -0.373) 2.540 8.505 ( -4.904 5.162 9.461) 11.841 8.775 ( -2.865 -3.950 4.301) 6.505 8.950 ( -6.678 -0.490 -6.109) 9.063 9.086 ( -2.978 -10.924 -1.937) 11.487 9.261 ( -9.296 2.180 -4.616) 10.605 9.525 ( 3.572 2.654 2.670) 5.189 9.766 ( 1.625 5.352 -6.257) 8.393 9.883 ( 10.702 1.632 0.138) 10.827 10.014 ( -1.400 -3.388 -2.401) 4.383 10.326 ( -9.447 4.927 -3.354) 11.170 10.654 ( -5.062 0.641 -1.784) 5.405 10.803 ( -0.435 4.530 7.280) 8.585 11.407 ( 4.952 4.965 5.198) 8.729 11.475 ( 0.193 -7.511 -0.487) 7.529 11.795 ( -0.533 -4.616 -7.266) 8.625 12.019 ( 16.135 1.771 6.543) 17.501 12.280 ( 2.532 -1.592 4.776) 5.635 12.382 ( -5.107 -7.285 -3.821) 9.683 12.955 ( -10.677 9.525 2.202) 14.476 13.387 ( -8.631 1.091 -1.423) 8.816 13.621 ( -1.911 1.074 -2.780) 3.541 13.736 ( 0.492 -4.965 2.183) 5.446 13.754 ( 1.923 0.763 -6.553) 6.872 14.073 ( -8.590 -1.859 5.352) 10.291 14.239 ( 3.519 0.262 -2.470) 4.307 15.153 ( 0.365 13.012 -14.957) 19.828 15.458 ( -6.946 -12.353 9.358) 16.983 15.819 ( -3.944 4.497 9.921) 11.584 16.292 ( -3.003 2.099 6.800) 7.724 17.002 ( 8.833 -6.950 -18.958) 22.040 17.496 ( -4.249 -1.540 11.486) 12.343 17.934 ( 5.163 12.100 8.987) 15.932 18.179 ( 8.950 1.124 -9.105) 12.817 18.841 ( 13.107 -3.911 -0.237) 13.680 19.409 ( 10.313 -4.825 3.980) 12.062 19.749 ( -7.972 -6.202 1.130) 10.163 19.915 ( 12.465 -5.902 -8.200) 16.045 20.367 ( 17.486 -0.539 -1.081) 17.528 20.966 ( -11.582 5.831 4.539) 13.739 21.270 ( -5.716 4.148 6.833) 9.826 21.638 ( -5.045 3.103 -3.519) 6.889 21.964 ( -0.307 -5.859 -2.678) 6.450 22.675 ( -16.443 3.795 -1.887) 16.980 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.014 ( 0.867 0.658 -6.883) 6.969 2.274 ( 1.970 2.870 0.301) 3.494 2.298 ( 1.124 1.192 0.139) 1.645 2.740 ( 12.664 -6.155 -1.287) 14.139 2.924 ( -5.443 3.138 3.260) 7.078 2.976 ( 4.350 6.254 0.501) 7.634 3.305 ( 3.934 0.922 7.414) 8.443 3.439 ( -4.321 -6.325 0.674) 7.689 3.567 ( -1.142 -2.441 0.882) 2.835 3.918 ( 1.101 -2.413 -5.319) 5.944 4.010 ( 2.025 -0.139 3.293) 3.868 4.056 ( 8.972 -2.351 -3.518) 9.919 4.199 ( -2.138 5.254 4.604) 7.306 4.276 ( 15.437 -1.164 4.387) 16.090 4.357 ( -8.040 -0.505 -0.909) 8.107 4.616 ( -0.293 -5.858 2.798) 6.498 4.697 ( -6.892 -3.935 -3.996) 8.885 4.824 ( 7.644 2.629 -1.056) 8.152 4.971 ( -3.470 8.122 -4.870) 10.086 5.274 ( -2.975 1.264 -2.049) 3.827 5.402 ( -6.640 7.242 2.209) 10.071 5.458 ( -7.341 2.715 -9.208) 12.085 5.673 ( 6.278 -5.895 -0.868) 8.655 5.792 ( -4.501 -2.793 11.093) 12.293 6.134 ( 9.473 2.106 -4.250) 10.594 6.198 ( -3.619 0.447 -1.872) 4.099 6.394 ( -2.490 -3.455 5.077) 6.627 7.012 ( 1.263 9.095 2.138) 9.428 7.335 ( -2.242 -10.924 -0.461) 11.161 7.924 ( 12.598 -4.118 -0.265) 13.257 8.235 ( -2.251 6.094 -1.255) 6.616 8.291 ( -6.213 1.058 -1.855) 6.569 8.517 ( -4.269 -2.202 7.123) 8.591 8.695 ( -7.028 4.162 3.414) 8.852 8.837 ( -4.013 -1.147 -2.910) 5.088 8.913 ( 1.224 -12.814 0.911) 12.904 9.159 ( -3.623 6.404 -3.184) 8.017 9.563 ( -0.488 3.947 -5.267) 6.599 9.846 ( 4.123 -1.635 -11.504) 12.329 9.880 ( -4.717 -6.084 10.256) 12.824 10.113 ( 8.735 2.820 -0.069) 9.179 10.296 ( -0.901 10.210 -2.190) 10.481 10.575 ( -1.303 -2.084 -2.984) 3.866 10.894 ( -0.179 4.119 8.527) 9.472 11.394 ( 3.871 -6.602 -2.228) 7.971 11.583 ( -0.467 3.346 3.032) 4.540 11.716 ( 2.813 -3.780 0.252) 4.718 12.132 ( -10.166 -2.430 -4.646) 11.439 12.330 ( 7.639 -2.144 0.749) 7.970 12.394 ( 11.055 4.782 5.355) 13.182 12.878 ( -5.214 4.485 0.047) 6.878 13.187 ( -11.367 -3.057 -1.656) 11.887 13.425 ( -12.265 -7.870 -1.002) 14.608 13.766 ( -0.314 1.000 -1.288) 1.660 13.787 ( 5.879 -1.684 -1.911) 6.407 13.967 ( -4.119 1.788 3.850) 5.915 14.298 ( 3.971 -1.003 -1.601) 4.398 15.156 ( -9.218 10.300 -9.926) 17.017 15.330 ( 3.613 -9.460 5.722) 11.631 15.924 ( 3.457 6.522 7.135) 10.266 16.298 ( -1.686 1.455 4.097) 4.663 16.930 ( 4.381 -11.624 -14.940) 19.430 17.497 ( -3.428 5.422 14.750) 16.084 18.114 ( 3.622 -2.936 -2.778) 5.427 18.394 ( 13.795 7.638 -0.163) 15.770 18.985 ( 3.248 4.681 -3.103) 6.487 19.398 ( -9.588 -6.894 0.107) 11.809 19.707 ( 9.625 4.236 1.225) 10.587 20.010 ( 4.623 -3.346 -3.736) 6.821 20.629 ( 12.339 -2.100 5.021) 13.486 20.872 ( -7.021 5.499 -1.691) 9.077 21.248 ( -4.387 -1.932 9.785) 10.896 21.555 ( 2.356 -4.390 -6.308) 8.038 21.909 ( -2.441 1.387 -1.351) 3.116 22.411 ( -13.636 0.018 -2.170) 13.808 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 ( -6.854 3.042 0.966) 7.560 2.360 ( 9.097 -2.440 -1.328) 9.512 2.444 ( 2.756 10.058 -0.627) 10.448 2.831 ( -9.054 3.365 1.947) 9.853 2.874 ( 8.714 -4.866 -4.116) 10.796 3.056 ( -0.395 -8.383 4.879) 9.707 3.281 ( -0.899 -1.691 -0.575) 1.999 3.412 ( -7.379 -4.406 -0.485) 8.609 3.483 ( 3.866 3.423 0.452) 5.184 3.885 ( 1.920 3.024 -1.521) 3.892 4.037 ( 0.032 -3.064 -0.949) 3.208 4.133 ( -2.821 -5.257 -1.847) 6.246 4.181 ( -1.129 6.755 1.450) 7.001 4.318 ( 5.798 1.795 0.558) 6.095 4.408 ( -4.121 -10.058 1.413) 10.961 4.582 ( -0.341 -3.028 2.310) 3.823 4.654 ( 4.251 7.695 -1.673) 8.949 4.909 ( -2.749 -1.343 -1.385) 3.359 5.062 ( 10.460 -0.113 1.146) 10.524 5.211 ( -1.055 4.145 -1.784) 4.635 5.343 ( -6.914 7.791 5.503) 11.781 5.408 ( -2.506 4.938 -6.466) 8.513 5.694 ( 1.130 -11.275 6.777) 13.203 5.749 ( 1.628 1.545 -3.825) 4.435 6.091 ( -6.945 0.713 -1.529) 7.147 6.287 ( 1.916 1.936 0.895) 2.867 6.339 ( 2.901 -4.282 -0.178) 5.175 7.148 ( 5.270 -6.912 0.020) 8.692 7.184 ( -4.647 6.041 0.023) 7.622 8.099 ( 3.151 -0.421 -0.384) 3.202 8.133 ( 0.226 -7.245 0.806) 7.293 8.266 ( -2.436 9.720 -0.846) 10.057 8.490 ( 1.740 -1.196 0.749) 2.241 8.631 ( -6.407 6.610 -0.208) 9.207 8.737 ( -0.095 -8.147 3.967) 9.062 8.834 ( 0.683 -6.492 -6.704) 9.358 9.255 ( 1.480 9.975 7.116) 12.343 9.556 ( -3.042 5.688 -9.241) 11.270 9.649 ( -8.524 -9.423 3.024) 13.061 9.969 ( 5.977 0.474 2.739) 6.592 10.201 ( 2.129 1.218 0.571) 2.518 10.442 ( 4.825 5.016 -2.125) 7.277 10.551 ( -0.165 1.392 -0.688) 1.561 10.901 ( -2.036 -2.174 1.340) 3.266 11.439 ( 6.211 -5.325 1.388) 8.298 11.486 ( -5.345 -3.365 -1.920) 6.602 11.782 ( -2.200 3.973 1.208) 4.700 11.992 ( -0.188 1.983 -1.057) 2.255 12.473 ( 8.581 0.545 -0.184) 8.600 12.487 ( -5.685 -1.680 0.454) 5.946 12.942 ( -2.029 -8.419 0.980) 8.715 12.970 ( 0.734 3.119 -1.072) 3.378 13.184 ( -4.058 2.998 -0.004) 5.046 13.722 ( -4.169 1.420 -0.796) 4.475 13.856 ( 3.543 -2.883 2.724) 5.318 13.997 ( 2.483 3.963 -2.129) 5.139 14.320 ( -0.265 -1.524 0.221) 1.563 15.017 ( -9.743 2.182 -0.114) 9.985 15.399 ( 6.989 -0.032 -0.206) 6.992 16.070 ( 5.052 -1.113 6.302) 8.153 16.293 ( 1.529 2.230 -8.428) 8.851 16.835 ( -1.110 -6.639 2.521) 7.188 17.590 ( -1.780 10.667 1.604) 10.933 18.028 ( -0.338 -12.727 -2.426) 12.960 18.678 ( 9.951 -2.414 0.937) 10.282 19.014 ( -10.001 9.589 0.247) 13.858 19.192 ( -1.583 0.513 -0.404) 1.712 19.946 ( -7.407 -1.513 -0.259) 7.565 19.976 ( 12.307 1.686 0.290) 12.425 20.775 ( -1.421 1.910 -0.883) 2.539 20.824 ( 4.434 -1.029 0.847) 4.630 21.138 ( -0.943 -8.783 0.173) 8.836 21.616 ( 5.887 -2.723 -0.350) 6.496 21.868 ( -7.320 7.146 0.206) 10.232 22.256 ( -1.224 1.218 -0.013) 1.726 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 ( -0.811 3.963 2.809) 4.925 2.447 ( -11.176 -3.507 4.950) 12.716 2.506 ( 3.962 -2.793 3.874) 6.206 2.685 ( 1.271 -1.968 -10.283) 10.546 2.907 ( 4.898 -4.693 -6.877) 9.659 2.990 ( 0.657 -4.620 6.889) 8.321 3.196 ( -7.937 0.447 -4.184) 8.984 3.290 ( -2.614 0.299 3.079) 4.050 3.635 ( 7.061 2.526 -3.136) 8.128 3.926 ( -3.460 -8.793 -1.909) 9.640 3.962 ( 1.498 1.826 0.248) 2.375 4.053 ( -1.017 -3.973 -1.262) 4.291 4.203 ( -2.085 -2.727 -1.427) 3.717 4.296 ( 0.360 1.590 -0.192) 1.641 4.356 ( -1.324 -1.982 -2.157) 3.215 4.579 ( 1.636 -1.877 2.321) 3.404 4.727 ( -2.165 0.944 6.759) 7.159 4.829 ( 1.025 -0.055 -4.593) 4.706 5.148 ( -0.173 6.352 -1.556) 6.542 5.306 ( -6.013 8.141 4.475) 11.066 5.409 ( 1.155 1.810 3.690) 4.269 5.436 ( 5.469 2.748 1.761) 6.369 5.621 ( 2.141 -4.430 3.541) 6.062 5.786 ( 4.001 -0.241 -8.794) 9.664 5.978 ( -6.539 1.086 2.378) 7.042 6.223 ( -3.497 -3.038 1.674) 4.925 6.433 ( 5.495 0.671 -3.571) 6.587 7.025 ( -7.871 3.962 -2.078) 9.054 7.335 ( 11.312 -3.891 0.474) 11.972 7.946 ( -2.994 -7.328 -4.288) 9.003 8.209 ( -8.064 8.096 2.016) 11.603 8.356 ( 9.952 -2.946 3.490) 10.950 8.560 ( 5.304 -1.541 -4.778) 7.303 8.587 ( 0.639 0.572 2.540) 2.681 8.723 ( 2.873 -3.019 2.704) 4.968 8.825 ( 1.538 4.619 1.033) 4.976 9.393 ( 0.074 5.614 5.870) 8.123 9.422 ( -8.278 -4.970 4.894) 10.825 9.506 ( -4.091 4.683 -5.800) 8.503 10.100 ( 4.666 4.604 0.616) 6.584 10.238 ( 2.099 -3.028 -0.815) 3.773 10.477 ( -11.022 4.644 0.992) 12.002 10.555 ( 4.619 0.535 -1.099) 4.778 10.850 ( 0.165 -2.080 -4.285) 4.766 11.372 ( -1.974 -1.913 -4.640) 5.393 11.455 ( 1.395 -7.525 6.277) 9.898 11.803 ( 1.934 4.156 -2.566) 5.253 12.110 ( 5.644 5.000 3.542) 8.331 12.267 ( -8.506 -11.035 0.113) 13.933 12.481 ( -1.076 -10.237 -2.714) 10.645 12.906 ( -5.536 6.172 -0.907) 8.341 13.016 ( 7.682 11.988 0.529) 14.248 13.386 ( 9.293 5.618 2.647) 11.177 13.672 ( -1.565 0.002 0.056) 1.566 13.884 ( 1.264 -2.169 4.821) 5.435 14.075 ( 4.119 2.780 -7.776) 9.228 14.260 ( -3.962 -2.206 2.659) 5.257 14.875 ( -8.939 1.118 3.841) 9.794 15.554 ( 8.111 3.471 -0.319) 8.828 16.098 ( 0.045 -0.733 -1.181) 1.391 16.386 ( 13.062 -4.276 -6.993) 15.421 16.778 ( -7.218 2.693 9.113) 11.933 17.546 ( -8.133 5.811 -18.965) 21.438 17.931 ( 0.999 -11.211 12.065) 16.500 18.557 ( -14.930 -0.377 -5.763) 16.009 19.014 ( 8.549 -10.603 10.188) 17.009 19.301 ( 1.195 7.341 -1.737) 7.637 19.712 ( -7.499 -9.993 0.551) 12.506 20.121 ( 1.935 -2.239 -0.627) 3.025 20.688 ( -4.615 -1.342 -9.913) 11.016 20.944 ( 5.721 1.765 6.617) 8.924 21.134 ( 5.696 0.874 -3.570) 6.779 21.564 ( -8.839 4.943 -7.262) 12.462 21.883 ( 4.392 -2.593 7.525) 9.090 22.390 ( 6.119 10.704 3.163) 12.729 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.897 ( -5.394 -10.362 0.052) 11.682 2.141 ( -6.131 -6.703 3.572) 9.760 2.440 ( 0.546 -10.460 -4.138) 11.262 2.773 ( -0.173 0.275 7.898) 7.905 2.933 ( 3.650 3.020 -10.129) 11.182 2.959 ( 1.266 -6.258 0.452) 6.401 3.094 ( -6.306 4.588 -6.641) 10.243 3.293 ( 3.336 -0.737 6.933) 7.728 3.669 ( 1.265 -10.507 -8.055) 13.300 3.777 ( -4.693 -5.962 -0.453) 7.601 3.872 ( 2.466 -21.339 -4.023) 21.854 3.964 ( -2.955 2.093 -1.165) 3.804 4.215 ( 0.619 1.628 -1.861) 2.549 4.277 ( 3.202 2.540 -0.652) 4.139 4.408 ( -3.101 6.745 5.198) 9.063 4.580 ( 1.589 -2.213 4.725) 5.454 4.729 ( -1.207 3.355 3.707) 5.143 4.896 ( 2.827 3.991 -3.193) 5.841 5.189 ( -2.832 6.392 4.657) 8.400 5.258 ( -5.911 -1.993 -2.238) 6.628 5.429 ( -1.199 7.511 -6.901) 10.270 5.475 ( 2.099 -2.692 13.224) 13.658 5.712 ( 0.703 -1.565 0.578) 1.811 5.843 ( 5.144 3.327 -5.937) 8.531 5.939 ( -1.200 4.224 5.439) 6.990 6.159 ( -0.147 -2.204 -2.992) 3.719 6.489 ( 1.919 0.099 -2.465) 3.126 6.966 ( -5.526 10.248 -3.592) 12.184 7.444 ( 9.036 -13.968 0.529) 16.644 7.856 ( 2.313 -3.427 -2.817) 5.003 8.083 ( -10.018 3.004 -3.530) 11.038 8.490 ( 1.896 6.820 0.622) 7.106 8.510 ( -1.584 -7.184 -0.231) 7.360 8.761 ( 11.832 -6.301 11.511) 17.669 8.805 ( 8.329 0.396 -0.146) 8.340 8.943 ( 0.428 10.626 4.206) 11.436 9.288 ( -1.699 -4.346 6.687) 8.154 9.462 ( -4.719 7.036 4.268) 9.486 9.514 ( 2.121 7.476 -4.747) 9.106 10.115 ( -2.251 -7.959 -5.118) 9.727 10.203 ( -9.996 -2.066 -0.503) 10.220 10.339 ( -1.603 10.460 4.504) 11.501 10.671 ( 2.146 8.422 -3.130) 9.238 10.813 ( -0.292 -0.327 -5.292) 5.310 11.334 ( -0.384 -0.532 -0.464) 0.803 11.438 ( 3.112 -6.840 4.001) 8.513 11.857 ( 3.665 -7.167 -2.290) 8.369 11.988 ( -7.949 -3.010 -0.568) 8.519 12.333 ( 3.295 -4.277 -1.786) 5.686 12.350 ( 5.766 -4.340 3.998) 8.250 12.920 ( -3.152 14.625 -1.980) 15.092 13.311 ( 7.553 11.564 0.412) 13.818 13.509 ( 0.821 2.156 5.815) 6.256 13.677 ( 1.568 0.361 -1.726) 2.360 13.855 ( -4.636 -4.361 2.976) 7.026 14.131 ( 5.650 -1.731 -4.426) 7.383 14.233 ( -1.068 5.087 0.136) 5.199 14.787 ( -3.832 1.058 8.173) 9.089 15.713 ( 3.139 7.401 -2.208) 8.337 16.137 ( 4.050 4.433 -1.086) 6.102 16.546 ( 6.586 -6.456 0.513) 9.237 16.616 ( -10.015 0.905 -8.790) 13.356 17.471 ( 5.185 3.128 -7.426) 9.582 17.827 ( -8.227 -6.424 6.052) 12.066 18.296 ( -10.992 -0.222 -2.040) 11.182 19.043 ( -0.291 -17.659 0.372) 17.665 19.187 ( 0.085 -11.155 1.587) 11.267 19.679 ( 4.984 -3.426 9.301) 11.095 20.009 ( -2.140 -14.399 -1.559) 14.640 20.493 ( -9.660 -2.534 -13.618) 16.888 21.128 ( 6.839 6.989 3.045) 10.241 21.221 ( -3.145 11.961 -8.460) 14.984 21.510 ( 1.651 5.187 -1.661) 5.691 21.966 ( 3.577 -2.330 6.276) 7.591 22.641 ( 4.310 15.316 4.808) 16.622 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.550 ( -6.211 -22.441 1.068) 23.309 2.057 ( 3.165 -22.735 -2.867) 23.133 2.394 ( 2.448 0.315 2.674) 3.639 2.732 ( -1.821 -2.913 2.628) 4.325 2.843 ( -9.024 -0.288 -3.604) 9.721 2.996 ( 1.020 1.019 -1.561) 2.125 3.079 ( 7.391 1.385 -12.372) 14.478 3.351 ( 0.705 -10.466 1.686) 10.624 3.496 ( 2.936 -15.799 -5.356) 16.939 3.655 ( 1.023 -2.165 6.577) 6.999 3.757 ( 0.950 -10.264 -4.083) 11.087 3.928 ( -3.016 -0.432 -0.641) 3.114 4.236 ( -1.304 -1.657 0.616) 2.197 4.347 ( 1.686 1.461 4.481) 5.006 4.423 ( -0.759 9.447 0.826) 9.514 4.686 ( 4.507 2.553 2.187) 5.623 4.759 ( -0.489 4.142 0.935) 4.274 4.933 ( -2.638 3.964 -5.014) 6.915 5.075 ( -6.251 -4.751 0.033) 7.852 5.245 ( -1.178 5.366 6.490) 8.503 5.498 ( 2.658 4.882 -6.066) 8.227 5.556 ( 3.041 -2.729 16.106) 16.616 5.652 ( -3.105 -1.274 0.783) 3.447 5.902 ( -1.070 7.314 -4.939) 8.890 6.019 ( 0.869 3.887 -1.932) 4.427 6.151 ( 3.485 -2.622 -4.268) 6.103 6.491 ( -0.353 -0.378 -0.567) 0.768 7.003 ( 0.514 7.691 -4.245) 8.799 7.370 ( -0.591 -11.056 0.831) 11.103 7.881 ( -5.263 1.461 -2.047) 5.833 7.996 ( 5.457 0.261 0.626) 5.499 8.402 ( -0.835 -3.168 -4.842) 5.846 8.608 ( 1.002 10.408 0.852) 10.491 8.830 ( 0.724 -5.159 4.538) 6.909 8.956 ( 2.017 -3.415 5.121) 6.478 9.089 ( 4.844 7.035 4.162) 9.502 9.340 ( 9.276 -3.160 3.540) 10.419 9.417 ( -7.511 3.563 2.973) 8.829 9.664 ( 4.268 8.633 2.983) 10.082 9.876 ( -10.451 -3.789 -4.793) 12.106 10.053 ( -2.546 -5.501 -1.695) 6.294 10.467 ( -4.168 12.931 6.128) 14.904 10.753 ( -1.635 9.261 -0.641) 9.426 10.826 ( 4.233 3.653 -8.608) 10.265 11.343 ( 2.169 -0.288 0.412) 2.226 11.448 ( 2.300 -4.204 3.540) 5.958 11.736 ( -1.195 -10.229 -0.386) 10.306 11.923 ( -0.920 -2.245 -2.637) 3.584 12.243 ( 1.126 -8.829 -3.527) 9.574 12.461 ( 0.153 0.202 1.877) 1.894 13.070 ( 2.442 15.213 -1.482) 15.479 13.430 ( 0.219 0.339 4.005) 4.025 13.589 ( -1.243 1.845 3.265) 3.951 13.696 ( -0.312 -0.508 0.947) 1.119 13.775 ( 3.119 3.417 -1.119) 4.760 14.178 ( 1.200 -0.216 -0.262) 1.247 14.269 ( -2.680 8.034 -2.679) 8.883 14.879 ( 7.830 1.320 14.185) 16.256 15.773 ( -6.954 10.637 -4.450) 13.466 16.140 ( -15.537 3.705 -16.536) 22.991 16.351 ( 3.126 7.648 -5.405) 9.873 16.705 ( 8.788 -12.976 8.520) 17.838 17.588 ( -2.436 -1.249 -2.231) 3.531 17.737 ( 11.057 -0.765 3.495) 11.622 18.126 ( -7.897 -1.584 -0.073) 8.054 18.726 ( -3.639 -17.821 -8.551) 20.099 19.195 ( 7.960 -14.797 4.081) 17.291 19.642 ( -1.991 -21.067 10.461) 23.605 19.916 ( 5.920 -6.710 5.016) 10.258 20.202 ( -11.170 -3.674 -18.276) 21.732 21.223 ( -6.190 14.117 -6.543) 16.746 21.314 ( 5.470 6.323 -1.552) 8.503 21.651 ( 3.411 7.561 3.392) 8.962 21.994 ( -0.996 -0.281 2.443) 2.653 22.866 ( -0.212 17.335 4.504) 17.912 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.371 ( 10.617 -22.457 9.412) 26.564 1.793 ( 2.204 -28.549 -5.494) 29.156 2.455 ( 8.549 -11.811 -3.960) 15.109 2.660 ( -7.858 2.165 4.303) 9.217 2.749 ( 3.092 0.482 -3.355) 4.588 3.044 ( 2.058 -0.239 -1.692) 2.675 3.156 ( 5.058 -2.794 -2.808) 6.424 3.256 ( 7.347 -8.866 -8.351) 14.225 3.399 ( 2.298 -8.672 -1.709) 9.132 3.595 ( -8.169 -4.880 -1.085) 9.577 3.806 ( 6.768 0.290 6.293) 9.247 3.860 ( -0.236 -0.488 -3.615) 3.655 4.136 ( -6.438 -2.472 6.429) 9.428 4.475 ( 6.848 -0.192 2.959) 7.462 4.524 ( 1.138 7.902 0.405) 7.993 4.703 ( -6.245 6.549 -3.921) 9.862 4.757 ( -4.070 -2.798 -6.667) 8.297 4.875 ( -0.368 3.966 0.916) 4.088 5.038 ( 1.514 -2.902 9.494) 10.043 5.302 ( -1.634 5.575 5.829) 8.230 5.487 ( -2.318 -1.834 -6.225) 6.891 5.611 ( 4.488 -7.075 9.950) 13.007 5.710 ( 0.828 8.404 6.168) 10.457 5.920 ( -2.248 4.954 -2.198) 5.868 6.015 ( -2.219 4.521 -10.675) 11.803 6.157 ( 2.185 -3.803 -5.106) 6.731 6.476 ( -1.104 0.011 1.765) 2.082 7.044 ( 4.554 -8.943 -0.676) 10.058 7.300 ( -5.021 9.448 -1.726) 10.838 7.781 ( -5.612 2.982 0.981) 6.430 8.127 ( 4.902 -2.757 6.920) 8.917 8.415 ( 3.748 3.181 -9.176) 10.410 8.728 ( 4.421 5.084 -4.197) 7.937 8.776 ( -1.963 0.090 -1.063) 2.234 8.880 ( -6.613 -1.793 -0.606) 6.878 9.149 ( -1.725 -4.115 4.596) 6.405 9.334 ( -6.611 5.187 0.076) 8.404 9.549 ( 9.904 1.981 2.300) 10.359 9.741 ( 0.523 -1.276 0.028) 1.380 9.780 ( -1.677 0.907 3.977) 4.410 9.982 ( 0.724 -2.192 1.804) 2.930 10.471 ( -8.947 6.594 9.733) 14.774 10.800 ( -3.488 9.567 -1.635) 10.314 10.967 ( 6.141 9.226 -8.799) 14.151 11.390 ( 3.269 -1.192 -1.153) 3.666 11.444 ( -3.214 0.899 -0.123) 3.340 11.700 ( 5.921 -5.097 8.275) 11.381 11.833 ( -1.962 -7.226 -7.175) 10.370 12.131 ( -2.012 -8.584 -1.029) 8.877 12.441 ( 0.040 1.664 -5.049) 5.316 13.206 ( -2.072 7.104 -1.102) 7.482 13.441 ( 1.930 -1.532 2.301) 3.372 13.563 ( 2.924 -5.293 5.851) 8.414 13.689 ( -3.680 2.701 -1.197) 4.720 13.917 ( -1.231 12.668 0.079) 12.728 14.170 ( -2.534 2.143 -2.091) 3.922 14.285 ( -4.005 8.651 0.340) 9.539 15.101 ( 5.909 -5.329 6.631) 10.358 15.643 ( -3.891 12.598 -6.087) 14.522 16.025 ( -3.135 11.789 -7.655) 14.402 16.461 ( -0.458 9.699 -8.435) 12.862 16.607 ( -6.183 -20.189 15.040) 25.923 17.597 ( 4.337 3.519 -7.204) 9.115 17.872 ( 2.465 -10.184 16.864) 19.854 17.984 ( -1.314 -5.973 -7.111) 9.380 18.680 ( 16.470 -5.256 -6.348) 18.417 19.088 ( -2.214 -20.536 -3.594) 20.965 19.486 ( 10.132 -22.211 3.943) 24.729 19.923 ( -8.756 6.406 -15.943) 19.284 20.016 ( 8.503 -14.181 13.924) 21.617 21.245 ( -4.585 11.629 -1.928) 12.648 21.424 ( 0.585 6.019 -2.572) 6.572 21.722 ( -6.927 4.930 7.283) 11.195 21.987 ( 0.942 3.287 -4.376) 5.553 23.005 ( -5.809 16.716 3.114) 17.969 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.841 ( -0.000 0.000 32.058) 32.058 0.841 ( -0.000 0.000 32.058) 32.058 1.524 ( -0.000 0.000 59.206) 59.206 2.530 ( 0.000 -0.000 -17.684) 17.684 2.530 ( 0.000 -0.000 -17.684) 17.684 3.105 ( -0.000 0.000 5.705) 5.705 3.105 ( -0.000 0.000 5.705) 5.705 3.245 ( -0.000 0.000 1.136) 1.136 3.605 ( 0.000 0.000 -2.559) 2.559 3.605 ( 0.000 -0.000 -2.559) 2.559 3.735 ( 0.000 -0.000 -5.817) 5.817 3.809 ( 0.000 -0.000 -2.640) 2.640 3.809 ( 0.000 -0.000 -2.640) 2.640 4.272 ( -0.000 0.000 2.861) 2.861 4.685 ( -0.000 0.000 1.818) 1.818 4.785 ( 0.000 -0.000 -33.778) 33.778 4.842 ( -0.000 0.000 3.496) 3.496 4.842 ( -0.000 0.000 3.496) 3.496 5.210 ( -0.000 0.000 7.560) 7.560 5.210 ( -0.000 0.000 7.560) 7.560 5.461 ( 0.000 -0.000 -1.875) 1.875 5.461 ( 0.000 -0.000 -1.875) 1.875 5.957 ( 0.000 -0.000 -4.309) 4.309 5.957 ( 0.000 -0.000 -4.309) 4.309 5.995 ( -0.000 0.000 0.604) 0.604 6.141 ( 0.000 -0.000 -6.047) 6.047 6.624 ( -0.000 0.000 5.948) 5.948 6.745 ( -0.000 0.000 2.046) 2.046 7.826 ( -0.000 0.000 11.255) 11.255 7.985 ( 0.000 -0.000 -8.352) 8.352 7.985 ( 0.000 -0.000 -8.352) 8.352 8.462 ( -0.000 0.000 5.008) 5.008 8.462 ( -0.000 0.000 5.008) 5.008 8.776 ( 0.000 -0.000 -6.390) 6.390 9.058 ( 0.000 -0.000 -0.967) 0.967 9.058 ( 0.000 -0.000 -0.967) 0.967 9.251 ( -0.000 0.000 7.157) 7.157 9.251 ( -0.000 0.000 7.157) 7.157 9.441 ( -0.000 0.000 5.678) 5.678 9.997 ( -0.000 0.000 6.520) 6.520 9.997 ( -0.000 0.000 6.520) 6.520 10.885 ( 0.000 -0.000 -19.779) 19.779 11.173 ( 0.000 -0.000 -7.556) 7.556 11.173 ( 0.000 -0.000 -7.556) 7.556 11.265 ( 0.000 -0.000 -5.073) 5.073 11.265 ( 0.000 -0.000 -5.073) 5.073 11.740 ( 0.000 -0.000 -1.133) 1.133 11.837 ( -0.000 0.000 2.486) 2.486 11.837 ( -0.000 0.000 2.486) 2.486 12.231 ( -0.000 0.000 22.559) 22.559 13.126 ( -0.000 0.000 1.469) 1.469 13.531 ( 0.000 -0.000 -5.946) 5.946 13.575 ( -0.000 0.000 2.143) 2.143 13.575 ( -0.000 0.000 2.143) 2.143 14.251 ( -0.000 0.000 1.248) 1.248 14.579 ( 0.000 -0.000 -4.250) 4.250 14.681 ( -0.000 0.000 0.925) 0.925 14.681 ( -0.000 0.000 0.925) 0.925 15.620 ( 0.000 -0.000 -0.749) 0.749 17.063 ( -0.000 0.000 2.622) 2.622 17.063 ( -0.000 0.000 2.622) 2.622 17.463 ( 0.000 -0.000 -5.469) 5.469 17.463 ( 0.000 -0.000 -5.469) 5.469 17.519 ( -0.000 0.000 1.588) 1.588 17.705 ( -0.000 0.000 0.390) 0.390 18.167 ( 0.000 -0.000 -0.926) 0.926 18.167 ( 0.000 -0.000 -0.926) 0.926 18.401 ( -0.000 0.000 1.391) 1.391 18.401 ( -0.000 0.000 1.391) 1.391 21.558 ( -0.000 0.000 1.694) 1.694 21.558 ( -0.000 0.000 1.694) 1.694 21.816 ( 0.000 -0.000 -0.964) 0.964 21.958 ( 0.000 -0.000 -0.985) 0.985 21.958 ( 0.000 -0.000 -0.985) 0.985 23.608 ( -0.000 0.000 0.879) 0.879 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.968 ( -1.577 12.040 28.005) 30.524 1.186 ( 18.058 2.196 24.594) 30.591 2.026 ( 18.482 6.268 35.414) 40.436 2.445 ( 1.667 5.616 -9.424) 11.096 2.555 ( 5.522 3.676 -14.801) 16.219 3.101 ( -0.422 -2.132 4.230) 4.756 3.171 ( 3.494 0.401 4.887) 6.021 3.249 ( -1.367 0.512 3.491) 3.784 3.394 ( -7.308 -5.653 -1.083) 9.303 3.642 ( -4.203 1.139 3.821) 5.794 3.698 ( 2.755 0.717 -7.272) 7.810 3.786 ( 5.335 -4.210 -4.743) 8.287 3.996 ( 6.275 10.575 -4.771) 13.190 4.304 ( 1.350 1.631 0.539) 2.185 4.663 ( 0.228 -0.850 -8.378) 8.424 4.697 ( 2.925 0.842 -21.248) 21.465 4.817 ( -4.245 1.143 3.717) 5.757 4.861 ( 1.145 -4.356 4.256) 6.197 5.148 ( -6.218 -3.391 5.252) 8.818 5.239 ( -3.055 1.178 6.487) 7.267 5.313 ( -3.560 -2.021 -7.414) 8.469 5.592 ( 4.204 2.006 2.717) 5.392 5.896 ( -5.398 0.786 -4.887) 7.324 5.926 ( 2.861 -5.298 -4.305) 7.402 6.019 ( 1.719 2.054 2.747) 3.836 6.215 ( 6.217 3.677 -5.594) 9.136 6.581 ( -6.617 -4.335 12.017) 14.387 6.722 ( 1.500 1.074 -2.751) 3.312 7.808 ( -2.582 -3.885 4.881) 6.752 7.887 ( -5.332 3.766 1.850) 6.785 8.111 ( 1.964 0.265 -13.099) 13.248 8.383 ( 4.039 -14.801 0.601) 15.354 8.462 ( -8.253 5.983 0.928) 10.236 8.694 ( 4.067 0.165 -1.808) 4.454 9.024 ( 2.675 -6.362 -3.821) 7.889 9.119 ( 1.526 -11.192 3.119) 11.718 9.236 ( -3.676 14.259 1.154) 14.770 9.430 ( 7.254 10.867 1.236) 13.124 9.642 ( 10.633 -0.897 5.537) 12.022 9.923 ( -8.511 -1.642 6.071) 10.582 10.065 ( 2.418 0.472 7.013) 7.433 10.630 ( -13.297 -1.531 -14.067) 19.418 11.101 ( -1.955 -4.286 -3.958) 6.153 11.168 ( -0.955 -4.619 -5.359) 7.139 11.237 ( 3.102 3.102 -7.373) 8.579 11.323 ( 2.736 3.488 -7.854) 9.019 11.689 ( -3.626 2.456 -0.555) 4.415 11.809 ( 0.019 -2.911 2.575) 3.886 11.944 ( 4.155 2.863 2.408) 5.591 12.385 ( 6.636 -2.202 17.465) 18.813 13.166 ( 2.699 1.626 0.373) 3.173 13.359 ( -4.277 0.651 -1.162) 4.480 13.580 ( -0.673 -0.906 1.833) 2.153 13.786 ( 5.242 5.151 -2.819) 7.871 14.254 ( -2.313 -0.058 2.049) 3.091 14.466 ( -8.826 -6.150 -3.421) 11.289 14.558 ( -0.576 -6.825 -4.438) 8.161 14.623 ( -4.578 -3.237 1.394) 5.777 15.763 ( 9.685 3.796 0.355) 10.409 16.679 ( -20.032 -4.268 8.555) 22.196 16.852 ( -20.948 -5.532 5.585) 22.375 17.052 ( -15.301 -19.376 5.405) 25.274 17.508 ( 1.878 -5.079 -1.382) 5.589 17.617 ( -4.835 15.380 -9.368) 18.646 17.840 ( 14.296 13.324 1.500) 19.600 18.206 ( 7.157 -6.017 0.162) 9.352 18.489 ( 23.383 -3.516 -2.224) 23.750 18.565 ( 11.647 18.132 -1.336) 21.592 18.898 ( 28.332 14.214 -4.496) 32.015 21.399 ( -25.253 -4.349 20.110) 32.573 21.457 ( -6.608 -3.785 1.096) 7.694 21.652 ( -1.385 2.274 -2.508) 3.657 21.852 ( -7.636 -3.945 -1.386) 8.706 22.013 ( 4.706 -4.869 -1.394) 6.914 23.454 ( -11.408 -6.668 -0.717) 13.233 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.241 ( 5.171 15.245 16.087) 22.758 1.656 ( 19.523 6.135 13.386) 24.454 2.188 ( 3.713 -1.548 -14.118) 14.680 2.615 ( 3.938 8.528 -14.152) 16.985 2.895 ( 13.131 7.788 25.626) 29.829 3.089 ( 3.738 -3.713 7.927) 9.518 3.165 ( -3.793 -1.045 5.440) 6.714 3.281 ( 6.476 0.749 5.741) 8.686 3.381 ( 4.255 2.653 0.456) 5.035 3.597 ( -0.220 -3.020 -2.518) 3.938 3.746 ( 2.883 0.546 1.561) 3.324 3.821 ( 3.389 1.695 -0.856) 3.884 4.185 ( 5.363 10.815 -8.017) 14.491 4.337 ( 0.561 2.039 -3.236) 3.865 4.588 ( -2.412 -6.526 -0.237) 6.962 4.711 ( 1.589 3.424 -14.934) 15.404 4.745 ( -6.069 0.798 6.027) 8.590 4.858 ( 6.415 -4.369 -8.252) 11.329 4.982 ( -8.551 -3.070 0.590) 9.105 5.207 ( -5.010 0.212 2.240) 5.493 5.250 ( -0.030 1.321 -1.507) 2.004 5.621 ( -3.071 -1.278 -4.548) 5.635 5.750 ( -5.379 -3.401 -0.686) 6.401 5.965 ( 4.725 -0.096 0.525) 4.755 6.097 ( 3.155 0.283 3.637) 4.823 6.326 ( 3.984 2.854 -3.186) 5.845 6.440 ( -7.856 -5.553 7.688) 12.315 6.800 ( 5.108 3.334 -2.690) 6.666 7.652 ( -13.535 -9.517 5.239) 17.356 7.831 ( -2.142 5.063 -0.545) 5.524 8.021 ( -0.606 -0.091 0.908) 1.095 8.395 ( 10.040 -7.808 -13.956) 18.882 8.503 ( 2.537 2.235 6.078) 6.955 8.736 ( 2.519 -0.928 -3.609) 4.498 8.943 ( -3.356 -0.692 -1.729) 3.838 9.101 ( 4.771 -5.611 -3.571) 8.185 9.353 ( 2.593 8.043 0.557) 8.469 9.550 ( -4.114 2.917 -1.971) 5.414 9.671 ( -6.649 -8.420 7.720) 13.217 9.855 ( 4.595 -0.612 3.513) 5.816 10.136 ( -0.506 3.187 7.768) 8.411 10.351 ( -12.341 2.247 -9.685) 15.848 10.958 ( -7.567 -4.069 -3.751) 9.375 11.057 ( -2.570 -4.969 -6.827) 8.827 11.290 ( 2.880 -2.653 1.230) 4.105 11.426 ( 9.117 4.509 -5.132) 11.393 11.685 ( -0.606 5.202 1.205) 5.374 11.808 ( -0.284 1.731 0.354) 1.790 12.043 ( 3.820 0.295 3.822) 5.412 12.513 ( 6.119 -6.411 8.288) 12.134 13.192 ( -3.553 -1.587 0.580) 3.935 13.346 ( 2.200 2.892 -4.145) 5.512 13.571 ( -1.545 1.624 0.265) 2.257 13.818 ( -4.613 2.072 2.756) 5.759 14.147 ( -5.923 -4.501 0.933) 7.497 14.193 ( -9.317 -5.803 -1.328) 11.057 14.475 ( -6.981 -2.984 1.919) 7.831 14.617 ( 11.772 -4.082 -12.498) 17.648 15.872 ( -0.772 -3.679 4.800) 6.097 16.389 ( -15.966 -7.022 10.276) 20.244 16.520 ( -13.530 0.359 1.854) 13.662 16.779 ( -4.638 3.817 3.988) 7.210 17.409 ( 5.985 -19.314 -7.530) 21.577 17.676 ( -7.602 22.341 -6.734) 24.540 18.255 ( 4.536 14.371 12.569) 19.624 18.338 ( 21.225 -7.250 1.292) 22.467 18.806 ( 16.925 6.357 -4.771) 18.699 19.065 ( 22.049 12.751 -6.262) 26.229 19.444 ( 23.729 6.203 -0.628) 24.534 21.050 ( -22.117 3.971 19.022) 29.441 21.265 ( -11.524 -4.816 3.888) 13.081 21.611 ( -10.130 -6.089 -6.040) 13.272 21.655 ( -1.855 -1.402 3.266) 4.009 22.023 ( 3.458 -4.448 -2.911) 6.342 23.117 ( -15.571 -9.140 -4.457) 18.597 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.552 ( 8.910 12.229 3.934) 15.634 2.015 ( 8.929 5.789 0.177) 10.643 2.281 ( 11.173 4.840 -2.425) 12.416 2.704 ( 3.059 6.359 -7.458) 10.267 2.857 ( -7.436 -7.768 4.883) 11.811 3.132 ( -1.555 -1.016 6.495) 6.755 3.292 ( 3.961 1.382 5.261) 6.729 3.463 ( 0.229 -1.277 -3.718) 3.938 3.534 ( 8.156 4.286 3.666) 9.916 3.596 ( 8.116 -3.681 0.857) 8.952 3.809 ( 2.599 0.237 6.221) 6.746 4.067 ( 14.864 11.214 13.605) 23.061 4.234 ( -3.920 -0.881 -5.220) 6.587 4.396 ( 6.385 4.201 -3.835) 8.551 4.506 ( 0.312 -3.031 -3.623) 4.734 4.626 ( -9.396 5.840 -0.082) 11.063 4.677 ( -4.329 -3.903 2.296) 6.265 4.827 ( -5.049 -0.323 0.246) 5.065 4.976 ( 11.846 1.259 -16.330) 20.213 5.101 ( -4.579 -2.327 -0.455) 5.157 5.305 ( 0.406 5.258 2.293) 5.751 5.385 ( -12.452 -7.049 -7.469) 16.141 5.696 ( 0.524 -1.820 -0.274) 1.914 6.057 ( 3.590 -0.951 2.693) 4.588 6.140 ( 0.791 -0.501 2.253) 2.440 6.263 ( -8.000 -5.337 4.186) 10.489 6.386 ( 1.185 1.389 -0.745) 1.972 6.869 ( -1.522 -1.040 0.972) 2.084 7.424 ( -1.829 -1.092 0.589) 2.210 7.878 ( 0.247 5.003 1.699) 5.290 8.080 ( 4.557 -0.860 6.805) 8.235 8.361 ( 0.909 -8.092 -11.451) 14.051 8.598 ( 3.230 2.853 4.405) 6.162 8.783 ( 4.550 -0.313 0.447) 4.583 8.956 ( 4.376 4.981 -7.319) 9.876 9.078 ( -0.994 -2.057 -7.417) 7.761 9.277 ( -19.317 -4.024 1.348) 19.778 9.456 ( 2.433 2.325 -3.003) 4.510 9.610 ( 4.823 -8.866 2.229) 10.336 9.923 ( 0.135 0.972 3.303) 3.446 10.150 ( -5.267 4.382 5.349) 8.693 10.213 ( -2.511 1.747 -1.624) 3.463 10.749 ( -9.693 -2.047 -3.974) 10.674 10.930 ( -3.373 -3.291 -6.820) 8.290 11.318 ( 2.986 -4.740 6.839) 8.841 11.640 ( 10.710 2.178 -1.912) 11.095 11.769 ( 3.183 -1.522 3.453) 4.936 11.857 ( 1.433 12.176 -0.626) 12.276 12.130 ( 4.265 1.772 1.982) 5.026 12.539 ( 2.244 -6.361 -0.055) 6.745 12.989 ( -12.563 -7.038 1.561) 14.484 13.418 ( 0.144 0.818 -1.762) 1.948 13.527 ( -0.637 -0.665 -2.892) 3.035 13.721 ( -6.505 0.299 -0.449) 6.527 14.023 ( -1.372 -3.942 -0.943) 4.279 14.097 ( -2.746 2.715 0.863) 3.956 14.339 ( -5.346 -3.584 4.545) 7.879 14.721 ( 9.896 -2.907 -15.145) 18.324 15.765 ( -6.269 -4.056 3.582) 8.281 16.121 ( -17.482 3.144 18.094) 25.355 16.323 ( -4.876 -7.497 1.645) 9.093 16.917 ( 5.622 10.743 -4.130) 12.809 17.319 ( 9.692 -18.146 -5.845) 21.387 17.727 ( -7.252 18.195 -5.350) 20.305 18.334 ( 1.596 -8.245 12.842) 15.344 18.810 ( 17.466 16.807 3.753) 24.528 19.150 ( 15.027 7.687 -5.166) 17.652 19.455 ( 15.102 3.762 -8.002) 17.500 19.872 ( 18.606 4.716 1.475) 19.251 20.848 ( -13.449 3.696 8.080) 16.119 21.003 ( -14.580 -4.639 8.649) 17.576 21.319 ( -11.038 -6.852 -2.257) 13.186 21.606 ( -2.843 -4.938 4.063) 6.999 22.051 ( 4.826 0.632 -5.832) 7.596 22.730 ( -14.677 -8.368 -5.647) 17.813 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.827 ( 11.442 5.296 -0.906) 12.641 2.145 ( -0.683 8.147 -3.388) 8.850 2.527 ( 7.366 -3.037 6.822) 10.489 2.672 ( -6.792 3.733 2.572) 8.165 2.788 ( 2.767 3.467 -2.923) 5.313 3.122 ( -0.655 -3.457 5.744) 6.736 3.228 ( -9.844 -6.802 -2.516) 12.227 3.441 ( 4.686 -1.585 -6.600) 8.248 3.673 ( 3.545 1.188 2.783) 4.661 3.752 ( 9.263 1.906 2.520) 9.787 3.871 ( -0.144 0.262 7.334) 7.340 4.122 ( -2.024 -2.877 1.000) 3.657 4.301 ( -5.582 -4.373 -2.208) 7.427 4.447 ( -1.140 -3.040 -5.362) 6.268 4.537 ( -1.080 2.377 0.489) 2.657 4.620 ( -1.574 5.608 -1.056) 5.920 4.644 ( 7.535 3.288 3.221) 8.830 4.839 ( 6.776 5.760 5.446) 10.428 4.979 ( -7.563 -3.903 -2.094) 8.765 5.026 ( -11.052 0.304 5.096) 12.174 5.163 ( 10.916 1.040 -15.094) 18.657 5.416 ( 4.075 4.935 -0.476) 6.418 5.710 ( 2.240 -0.252 0.060) 2.255 5.993 ( -6.616 -6.842 4.044) 10.341 6.096 ( -3.442 -4.394 -3.849) 6.780 6.197 ( 1.238 2.118 -1.773) 3.027 6.413 ( 0.510 0.186 5.804) 5.829 6.775 ( -3.446 -2.628 2.592) 5.049 7.545 ( 7.139 5.453 2.134) 9.233 7.936 ( 2.146 0.149 1.623) 2.695 8.168 ( -0.983 -9.674 3.985) 10.509 8.216 ( -1.093 2.935 -0.725) 3.215 8.728 ( 4.924 5.393 1.598) 7.475 8.818 ( -1.581 -1.586 -2.834) 3.612 8.858 ( -16.978 -3.152 3.355) 17.591 9.086 ( 0.789 11.115 -6.726) 13.015 9.112 ( 12.977 -3.841 -12.749) 18.593 9.443 ( -1.904 -1.019 -4.656) 5.132 9.614 ( 4.383 -9.635 -2.085) 10.789 9.965 ( -0.036 6.063 9.290) 11.093 10.152 ( 0.294 -2.086 -1.969) 2.883 10.171 ( -4.905 2.770 4.105) 6.970 10.595 ( -4.514 1.182 -2.375) 5.236 10.832 ( -2.667 -0.999 -3.562) 4.561 11.347 ( 1.841 -4.363 7.082) 8.519 11.700 ( -2.866 -1.688 -2.260) 4.021 11.831 ( 5.659 -2.751 2.961) 6.954 12.108 ( 8.054 14.547 2.161) 16.767 12.230 ( 0.958 -0.414 2.340) 2.562 12.436 ( -4.552 -1.605 -8.192) 9.508 12.762 ( -3.126 -7.915 3.773) 9.309 13.296 ( -4.941 -3.157 -0.135) 5.865 13.574 ( 2.644 0.359 -5.929) 6.502 13.666 ( 1.513 0.104 -0.882) 1.755 13.965 ( -3.410 -1.901 0.769) 3.979 14.087 ( -2.732 5.488 -2.146) 6.496 14.269 ( -0.960 -4.461 4.596) 6.477 14.785 ( 7.898 -2.172 -13.802) 16.050 15.655 ( -3.733 -0.724 0.337) 3.817 16.005 ( -13.793 11.100 22.404) 28.555 16.222 ( 0.096 -5.894 2.003) 6.225 17.021 ( 4.122 -2.948 -11.241) 12.331 17.376 ( 13.100 -9.697 4.200) 16.831 17.742 ( -6.642 12.842 -4.106) 15.029 18.292 ( -2.628 -5.923 7.993) 10.289 19.183 ( 2.173 11.520 -0.184) 11.724 19.392 ( 7.579 2.656 -3.351) 8.702 19.639 ( 9.222 1.212 -3.986) 10.120 20.141 ( 6.077 -0.601 -1.019) 6.191 20.685 ( -8.958 1.448 -0.221) 9.077 20.792 ( -7.412 -3.024 8.695) 11.819 21.142 ( -3.065 -1.867 2.941) 4.640 21.519 ( -1.113 -6.562 6.029) 8.980 22.133 ( 2.537 3.554 -9.950) 10.866 22.452 ( -4.879 -2.815 -2.079) 6.004 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.928 ( -9.820 -4.452 1.164) 10.844 2.153 ( 5.784 3.167 -7.914) 10.301 2.498 ( -5.721 -3.466 11.626) 13.413 2.757 ( -0.133 6.875 -3.864) 7.888 2.830 ( -3.919 2.995 1.134) 5.061 2.977 ( -2.915 -2.262 -1.282) 3.906 3.077 ( -0.281 -8.089 6.185) 10.187 3.465 ( 3.373 -3.310 -8.610) 9.822 3.725 ( -2.591 -0.431 5.208) 5.833 3.784 ( -7.734 -6.829 6.520) 12.205 3.891 ( 0.044 -0.763 3.515) 3.597 4.069 ( -12.345 -7.595 -0.038) 14.494 4.152 ( 6.006 2.370 1.823) 6.709 4.360 ( -4.488 4.886 -8.579) 10.845 4.409 ( -3.432 -8.094 -2.514) 9.144 4.658 ( 0.124 2.218 0.479) 2.272 4.685 ( 3.714 -0.970 -5.934) 7.067 4.860 ( 0.040 0.809 5.054) 5.118 5.026 ( 1.139 11.391 -1.274) 11.519 5.231 ( 6.039 2.924 3.031) 7.363 5.245 ( 9.785 2.205 1.470) 10.138 5.554 ( 6.113 5.140 -7.408) 10.894 5.725 ( -2.161 -0.989 1.460) 2.789 5.851 ( -2.921 -4.261 5.404) 7.477 5.981 ( -1.477 -1.343 -6.380) 6.685 6.196 ( -0.330 -2.220 -1.598) 2.755 6.463 ( 1.233 0.693 5.818) 5.987 6.801 ( 5.473 2.701 3.273) 6.926 7.634 ( -6.106 -1.787 4.769) 7.951 7.925 ( -6.481 -3.867 -2.016) 7.812 7.979 ( 2.051 -4.153 1.851) 4.987 8.368 ( 7.121 5.111 2.934) 9.243 8.562 ( -11.381 -1.149 1.037) 11.485 8.833 ( 2.620 0.251 0.907) 2.784 8.876 ( 6.786 4.908 -2.221) 8.664 9.136 ( 1.792 -6.888 -12.823) 14.666 9.270 ( 3.676 13.065 -4.744) 14.378 9.414 ( 3.433 -2.896 -3.460) 5.670 9.562 ( 4.512 -8.742 -2.331) 10.110 9.990 ( -9.703 3.283 1.318) 10.328 10.128 ( -3.653 2.107 6.347) 7.620 10.217 ( 8.368 5.586 -0.935) 10.105 10.605 ( 3.886 2.051 -0.111) 4.395 10.789 ( -1.020 -0.045 1.577) 1.879 11.351 ( 0.707 -3.799 4.683) 6.071 11.581 ( -5.389 -2.898 -4.497) 7.594 11.883 ( -1.799 3.113 0.908) 3.708 12.023 ( -8.692 -11.922 4.005) 15.287 12.323 ( 0.203 4.613 1.349) 4.811 12.473 ( 0.208 3.577 -4.029) 5.392 12.757 ( 10.892 0.269 1.347) 10.978 13.313 ( 7.189 1.660 0.065) 7.379 13.570 ( 1.527 -0.891 -6.149) 6.398 13.699 ( 1.483 -1.621 -0.028) 2.197 13.862 ( -6.686 0.205 -2.392) 7.104 14.128 ( 1.488 5.958 1.884) 6.423 14.217 ( -0.957 -4.817 1.429) 5.115 14.851 ( 8.132 -2.269 -12.558) 15.132 15.636 ( 0.129 3.923 0.626) 3.974 16.032 ( -9.388 14.826 21.483) 27.739 16.227 ( 4.135 -2.026 2.873) 5.428 16.935 ( 0.202 -11.295 -11.030) 15.788 17.540 ( 9.250 -5.798 7.429) 13.205 17.730 ( -2.339 4.906 -3.260) 6.338 18.203 ( -5.438 -1.077 1.991) 5.890 19.061 ( -17.084 -1.169 1.244) 17.169 19.417 ( -1.160 -7.254 -3.059) 7.957 19.813 ( 6.553 5.297 -4.436) 9.522 20.044 ( -11.022 -3.568 -3.133) 12.001 20.444 ( -13.846 -8.831 5.269) 17.247 20.907 ( 8.357 10.160 7.113) 14.955 21.180 ( 6.327 -0.754 2.541) 6.860 21.530 ( 5.417 -2.447 2.980) 6.649 22.059 ( -4.702 0.309 -7.661) 8.994 22.560 ( 11.398 6.954 -2.557) 13.595 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.064 ( 8.594 2.477 27.684) 29.093 1.331 ( -5.158 17.096 25.036) 30.752 2.112 ( -5.738 5.303 16.858) 18.581 2.407 ( 7.165 4.522 -16.502) 18.550 2.534 ( -0.986 15.990 8.957) 18.354 3.158 ( -2.601 0.568 4.221) 4.991 3.160 ( -0.217 1.960 5.114) 5.481 3.255 ( 1.277 0.081 3.068) 3.324 3.490 ( -4.253 -3.070 -1.030) 5.346 3.553 ( 3.799 -3.526 -2.895) 5.937 3.634 ( 0.109 -5.311 -3.120) 6.160 3.781 ( -3.154 4.491 -0.923) 5.564 3.997 ( 3.939 11.061 -5.548) 12.986 4.292 ( 0.696 -0.589 -0.332) 0.971 4.541 ( -0.264 6.873 -34.976) 35.646 4.677 ( -1.027 -3.407 1.253) 3.773 4.815 ( 0.486 -5.246 5.631) 7.712 4.930 ( -1.764 3.283 6.887) 7.830 5.160 ( 0.713 -5.511 0.323) 5.567 5.272 ( 0.998 -7.806 -5.201) 9.433 5.291 ( 1.108 -0.022 7.226) 7.311 5.598 ( -0.413 4.432 2.287) 5.004 5.814 ( 0.247 -6.266 -5.760) 8.514 5.968 ( -4.487 1.408 -2.090) 5.146 6.038 ( 2.840 4.025 0.500) 4.951 6.183 ( -0.126 7.258 -5.336) 9.009 6.630 ( -0.333 -6.911 9.965) 12.131 6.708 ( 0.105 0.894 -2.236) 2.411 7.845 ( -1.902 -4.495 5.591) 7.422 7.909 ( 5.815 0.996 -2.594) 6.445 8.089 ( -1.513 8.530 -9.619) 12.945 8.271 ( -4.082 -15.809 1.170) 16.369 8.564 ( -0.499 -3.311 -1.067) 3.514 8.663 ( -1.352 5.922 -0.320) 6.082 8.984 ( -4.429 -5.796 2.318) 7.654 9.110 ( -10.540 -3.676 2.359) 11.409 9.263 ( 13.979 2.976 -0.551) 14.303 9.405 ( 2.234 7.533 2.775) 8.333 9.691 ( -4.601 11.141 4.919) 13.019 10.001 ( 5.645 -4.278 5.990) 9.276 10.056 ( -4.026 0.227 6.241) 7.430 10.592 ( 5.129 -9.182 -15.259) 18.533 11.053 ( -4.407 -3.193 -5.828) 7.974 11.102 ( 0.321 -6.801 -2.635) 7.301 11.260 ( -1.186 5.344 -6.263) 8.319 11.289 ( 2.343 4.629 -7.064) 8.765 11.676 ( 2.632 -2.008 -0.182) 3.315 11.829 ( -2.187 -3.156 1.836) 4.256 11.940 ( 0.387 6.397 2.069) 6.734 12.485 ( -3.945 5.586 16.906) 18.237 13.169 ( -0.292 3.547 -0.847) 3.658 13.350 ( 3.398 -4.214 -1.911) 5.741 13.538 ( -0.992 -4.106 2.352) 4.835 13.805 ( 1.175 8.576 -1.172) 8.735 14.269 ( 1.223 0.083 1.809) 2.185 14.461 ( -0.796 -10.595 -2.675) 10.956 14.496 ( -4.314 -11.478 -2.349) 12.485 14.642 ( -0.659 -3.823 -0.014) 3.880 15.788 ( -1.031 14.557 -1.254) 14.647 16.736 ( 3.587 -19.092 5.753) 20.260 16.851 ( 3.675 -21.319 1.719) 21.702 17.083 ( -7.735 -20.032 9.748) 23.583 17.485 ( 12.017 -3.670 -6.270) 14.042 17.566 ( -1.454 2.929 -1.658) 3.666 17.828 ( 2.599 16.764 -0.915) 16.989 18.298 ( -11.375 10.122 -1.751) 15.327 18.446 ( 5.540 23.886 -2.462) 24.643 18.530 ( -4.906 9.552 -0.166) 10.739 18.895 ( -0.610 32.871 -2.796) 32.996 21.411 ( 4.191 -21.047 13.777) 25.502 21.536 ( 7.546 -8.902 -1.966) 11.834 21.603 ( -2.201 -1.635 4.400) 5.184 21.873 ( 1.115 -5.930 -0.806) 6.088 22.003 ( -6.134 0.943 -3.166) 6.967 23.452 ( -0.068 -14.045 -0.411) 14.052 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.449 ( 12.699 9.796 18.003) 24.111 1.517 ( -1.271 15.245 17.941) 23.578 2.071 ( 1.337 1.967 -15.915) 16.092 2.509 ( 7.174 4.492 -16.140) 18.225 2.957 ( 9.237 17.808 30.657) 36.638 3.085 ( -2.704 -1.991 7.085) 7.840 3.253 ( -0.194 2.054 4.592) 5.035 3.273 ( -2.442 4.253 5.146) 7.108 3.370 ( -0.033 1.748 -0.909) 1.970 3.545 ( -1.755 -6.879 0.401) 7.111 3.642 ( 6.762 0.095 -2.786) 7.314 3.842 ( 2.152 6.618 2.700) 7.464 4.158 ( 4.674 9.930 -8.782) 14.056 4.301 ( 2.082 -1.606 -3.659) 4.506 4.539 ( 6.251 10.193 -31.940) 34.105 4.588 ( -3.679 -6.879 1.720) 7.988 4.765 ( -0.591 -8.238 4.649) 9.477 4.926 ( -4.985 1.975 6.426) 8.369 5.074 ( -4.849 -3.649 0.139) 6.070 5.195 ( 0.020 -3.400 -4.699) 5.800 5.311 ( -1.466 -0.313 5.792) 5.983 5.617 ( -0.546 -1.041 -5.117) 5.250 5.757 ( -0.216 -4.925 -2.449) 5.504 5.908 ( -0.536 0.592 2.099) 2.246 6.114 ( 0.667 4.085 2.568) 4.871 6.277 ( 3.688 6.068 -4.412) 8.360 6.521 ( -5.400 -9.574 8.254) 13.746 6.768 ( 3.161 6.880 -3.013) 8.149 7.738 ( -6.301 -11.798 6.387) 14.822 7.949 ( -3.177 5.859 -4.774) 8.198 8.062 ( -3.301 -8.107 3.243) 9.335 8.139 ( 4.272 3.358 -11.401) 12.630 8.505 ( 0.699 -3.172 7.466) 8.142 8.682 ( -1.095 1.592 -4.687) 5.070 8.932 ( -0.180 -2.819 3.172) 4.248 8.969 ( 0.646 -5.533 1.787) 5.851 9.423 ( 0.747 2.893 -6.975) 7.588 9.564 ( 8.780 1.999 3.115) 9.528 9.709 ( -5.328 2.958 6.643) 9.015 9.927 ( -7.674 -1.906 3.947) 8.838 10.126 ( 5.612 0.848 3.719) 6.786 10.479 ( -4.797 -3.153 -11.819) 13.140 10.927 ( -1.007 -9.007 -3.151) 9.595 11.037 ( -1.023 -1.730 -3.712) 4.221 11.262 ( -1.479 -0.248 -1.434) 2.074 11.349 ( 3.567 7.008 -4.826) 9.226 11.728 ( 2.865 0.308 0.383) 2.907 11.802 ( 0.825 0.408 -0.031) 0.921 12.015 ( 1.276 3.929 2.184) 4.673 12.497 ( -4.388 -0.746 13.403) 14.122 13.204 ( 0.616 2.051 -1.456) 2.590 13.342 ( -0.687 -1.703 -2.091) 2.782 13.572 ( 5.435 1.541 -0.032) 5.650 13.868 ( -0.246 0.322 1.164) 1.233 14.171 ( -8.488 -18.346 3.279) 20.478 14.265 ( -4.809 -6.014 -0.095) 7.701 14.403 ( 3.751 3.074 -6.660) 8.238 14.552 ( -3.887 -4.710 0.830) 6.163 15.926 ( -0.433 8.587 0.078) 8.598 16.506 ( -7.130 -12.460 6.157) 15.620 16.598 ( -6.902 -14.965 1.210) 16.524 16.987 ( 3.010 -8.578 4.642) 10.207 17.227 ( -14.803 -1.515 -6.977) 16.434 17.903 ( 21.029 -2.382 -2.375) 21.296 18.036 ( -3.043 20.903 -2.880) 21.318 18.364 ( 3.236 14.107 5.913) 15.635 18.562 ( 7.822 10.456 0.310) 13.062 18.978 ( 17.661 21.656 -2.383) 28.045 19.211 ( 6.447 17.813 -0.488) 18.951 21.282 ( -3.740 -12.646 7.199) 15.024 21.475 ( -7.355 -6.026 10.782) 14.376 21.600 ( 2.086 -2.562 -6.987) 7.729 21.724 ( -8.174 -7.132 1.005) 10.894 21.906 ( -0.776 -3.757 -1.766) 4.224 23.197 ( -9.219 -16.148 -2.812) 18.805 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.615 ( -1.660 10.789 1.353) 10.999 1.902 ( 15.069 9.049 7.310) 19.037 2.153 ( 7.600 9.650 -8.001) 14.660 2.614 ( 7.249 2.343 -11.484) 13.781 2.973 ( -7.020 -1.732 11.093) 13.241 3.173 ( -2.588 -3.111 5.619) 6.924 3.336 ( -0.194 3.237 1.900) 3.758 3.399 ( 7.321 -1.061 11.330) 13.531 3.455 ( -1.762 1.201 -2.508) 3.292 3.482 ( 6.217 6.351 -1.107) 8.956 3.823 ( 4.273 7.130 11.595) 14.266 4.026 ( 9.210 9.785 9.403) 16.401 4.262 ( 0.232 4.778 -9.648) 10.769 4.283 ( 2.335 -2.690 -3.948) 5.317 4.473 ( -0.768 -5.064 1.197) 5.260 4.646 ( 1.406 -2.176 -4.899) 5.542 4.710 ( 8.358 3.593 -18.879) 20.957 4.853 ( -4.425 -1.369 1.320) 4.816 4.964 ( -9.008 5.998 1.674) 10.951 5.134 ( -1.846 -5.017 0.632) 5.384 5.310 ( 0.329 -0.437 1.309) 1.418 5.517 ( -6.291 -2.610 -8.982) 11.272 5.654 ( -2.281 -4.437 0.671) 5.034 5.975 ( 4.031 -1.681 4.447) 6.233 6.168 ( 0.073 3.172 2.834) 4.254 6.340 ( -5.112 -5.837 0.055) 7.760 6.370 ( 0.601 0.196 2.278) 2.364 6.908 ( 2.292 9.123 -0.638) 9.428 7.463 ( -8.032 -11.460 2.207) 14.167 7.948 ( -2.131 4.950 -1.821) 5.689 8.024 ( 2.646 -4.950 6.808) 8.823 8.196 ( 3.761 3.494 -11.229) 12.347 8.584 ( 7.210 -2.880 6.790) 10.314 8.654 ( 0.007 -0.768 -0.494) 0.913 8.887 ( -0.152 -3.281 -3.719) 4.961 9.028 ( 5.561 -1.375 3.051) 6.490 9.391 ( -0.464 -6.026 -5.477) 8.156 9.556 ( -8.572 -3.650 0.243) 9.320 9.639 ( -7.513 5.350 3.992) 10.050 9.916 ( 2.524 5.100 4.117) 7.023 10.243 ( 2.602 1.816 -1.018) 3.333 10.273 ( -7.437 -3.478 -4.831) 9.526 10.789 ( -3.261 -8.435 -3.881) 9.841 10.982 ( -4.161 3.028 -5.511) 7.540 11.254 ( 2.028 -1.916 5.391) 6.070 11.508 ( 7.273 6.700 -3.321) 10.432 11.741 ( -0.068 -5.248 5.705) 7.752 11.883 ( 5.125 6.969 -1.461) 8.773 12.101 ( 3.529 4.672 -0.741) 5.902 12.453 ( -1.545 -5.331 7.518) 9.345 13.123 ( -7.967 -6.009 0.960) 10.025 13.370 ( 4.225 2.856 -2.460) 5.663 13.599 ( -7.132 -1.032 -2.188) 7.531 13.827 ( -5.307 -4.285 3.062) 7.477 13.917 ( 2.864 -11.207 -2.065) 11.749 14.134 ( -1.922 -3.275 -0.868) 3.895 14.410 ( -5.035 -4.567 3.101) 7.472 14.541 ( 5.355 5.684 -6.843) 10.383 15.878 ( -7.091 -2.442 1.770) 7.706 16.301 ( -6.132 -10.827 5.992) 13.811 16.454 ( -5.906 1.410 11.090) 12.643 16.937 ( 4.270 -18.017 -10.318) 21.197 17.058 ( -4.294 15.095 -5.742) 16.711 18.058 ( -8.239 18.938 -8.600) 22.372 18.203 ( 8.776 -2.249 11.293) 14.478 18.718 ( 19.542 7.096 4.370) 21.245 18.905 ( 13.520 14.705 1.185) 20.010 19.363 ( 2.795 17.392 -3.833) 18.027 19.558 ( 21.215 5.433 0.220) 21.901 21.101 ( -9.058 -4.478 2.633) 10.442 21.257 ( -13.750 -6.393 4.868) 15.926 21.426 ( -9.950 -6.111 0.591) 11.692 21.620 ( -2.779 -3.514 1.180) 4.633 21.895 ( 6.527 -4.862 -2.894) 8.638 22.831 ( -11.880 -14.178 -4.483) 19.033 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.715 ( 5.372 6.331 -6.604) 10.609 2.198 ( 5.970 10.388 -0.052) 11.981 2.412 ( 9.528 7.516 1.881) 12.281 2.711 ( 6.906 -0.670 -6.935) 9.811 2.872 ( -9.175 2.584 11.434) 14.887 3.112 ( -1.728 -7.415 8.349) 11.299 3.320 ( -5.153 -0.888 -1.083) 5.340 3.372 ( -2.042 0.388 -5.710) 6.076 3.545 ( 7.241 -2.301 1.873) 7.825 3.682 ( 7.588 8.376 -1.691) 11.428 3.934 ( -1.246 3.302 10.479) 11.058 4.134 ( -1.680 -3.429 -1.830) 4.234 4.257 ( 2.557 -4.592 -3.266) 6.188 4.409 ( -2.050 -1.028 0.699) 2.397 4.498 ( 6.074 2.512 7.142) 9.706 4.594 ( 3.352 0.591 2.107) 4.003 4.807 ( 1.743 -0.070 -1.788) 2.498 4.834 ( -3.247 9.205 -6.797) 11.895 4.956 ( 4.289 7.084 -8.145) 11.616 5.048 ( -3.154 -2.408 0.004) 3.968 5.205 ( -7.931 -2.929 -5.220) 9.936 5.422 ( 0.461 2.784 2.837) 4.002 5.628 ( 2.938 -3.135 -0.057) 4.297 5.987 ( -0.681 -4.873 0.726) 4.973 6.147 ( -7.134 -6.340 -0.115) 9.544 6.212 ( -0.349 3.043 0.289) 3.076 6.410 ( 1.606 -0.568 3.586) 3.970 6.902 ( -9.125 2.826 2.727) 9.934 7.429 ( 9.206 -0.354 0.579) 9.231 7.941 ( -0.857 0.370 -1.017) 1.380 8.063 ( 3.279 -4.987 5.179) 7.902 8.257 ( 1.353 6.302 -3.465) 7.318 8.671 ( 7.713 -6.698 -3.287) 10.731 8.733 ( 4.235 -0.008 8.288) 9.308 8.828 ( 1.282 -4.333 -3.334) 5.616 9.094 ( -1.967 -5.841 -2.584) 6.683 9.182 ( -7.258 0.132 -1.181) 7.355 9.439 ( -2.210 -0.559 -3.601) 4.262 9.597 ( -6.080 6.723 -1.997) 9.281 10.027 ( 0.554 2.207 2.013) 3.038 10.096 ( 0.722 -1.665 -2.069) 2.752 10.308 ( -2.725 3.281 3.543) 5.545 10.641 ( -2.729 -4.894 -3.616) 6.668 10.910 ( -5.875 5.126 -5.021) 9.274 11.316 ( 2.127 -0.782 6.974) 7.333 11.668 ( 5.305 2.649 -4.764) 7.606 11.690 ( 1.619 -8.278 6.406) 10.592 12.107 ( 8.763 9.501 2.608) 13.186 12.224 ( 6.170 4.522 -4.879) 9.073 12.402 ( -1.870 -3.083 3.825) 5.256 12.858 ( -13.072 -7.499 2.519) 15.279 13.341 ( -7.917 -8.668 -0.623) 11.756 13.497 ( 3.797 0.433 -4.968) 6.267 13.664 ( -3.225 -4.115 -0.719) 5.277 13.948 ( 3.297 -4.122 4.219) 6.757 14.108 ( 0.760 0.514 -7.677) 7.732 14.299 ( -4.145 -3.164 4.732) 7.041 14.656 ( 3.832 6.155 -6.369) 9.651 15.731 ( -5.306 -3.753 0.999) 6.575 16.152 ( -2.888 -7.332 5.588) 9.660 16.439 ( -8.684 10.431 14.077) 19.555 16.809 ( 5.076 -15.025 -7.435) 17.515 17.182 ( 5.043 8.982 -6.538) 12.200 18.038 ( -10.424 16.619 -7.296) 20.930 18.318 ( 0.322 -1.007 13.765) 13.806 19.110 ( 21.270 -5.018 -4.150) 22.244 19.278 ( 6.104 17.445 2.676) 18.675 19.497 ( 4.124 3.942 -1.714) 5.957 19.944 ( 15.219 4.879 -2.775) 16.221 20.917 ( -10.968 4.385 -0.236) 11.814 20.954 ( -11.471 -10.900 5.795) 16.852 21.227 ( -8.662 -1.215 0.873) 8.790 21.512 ( -3.648 -6.807 5.433) 9.443 21.999 ( 9.386 -0.926 -6.533) 11.473 22.501 ( -8.561 -9.676 -3.180) 13.306 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.873 ( 8.567 2.611 -3.640) 9.667 2.286 ( -8.669 9.550 -6.065) 14.252 2.538 ( 0.249 -2.028 10.907) 11.097 2.768 ( 4.285 -2.228 -5.683) 7.458 2.914 ( 1.873 9.268 8.492) 12.708 3.004 ( -5.143 -9.867 6.883) 13.084 3.126 ( -9.917 -0.855 -4.178) 10.795 3.336 ( 0.994 -1.907 -7.983) 8.268 3.671 ( 7.011 -2.773 4.859) 8.970 3.856 ( 1.337 4.421 2.079) 5.065 3.947 ( -2.690 0.446 5.083) 5.768 4.097 ( 0.294 -0.804 0.580) 1.034 4.196 ( -4.876 -2.267 -1.092) 5.488 4.330 ( 1.668 -4.060 -1.851) 4.764 4.439 ( -7.535 -7.743 0.583) 10.820 4.653 ( -1.718 -2.538 -0.399) 3.091 4.737 ( -6.051 7.765 -11.465) 15.111 4.847 ( -0.824 -5.823 2.571) 6.419 5.038 ( 8.110 7.416 -0.528) 11.002 5.137 ( 7.110 7.788 -2.099) 10.752 5.257 ( 3.160 9.080 6.795) 11.773 5.491 ( 2.627 1.907 -0.474) 3.280 5.681 ( 5.331 -1.743 -0.501) 5.631 5.870 ( -4.279 -7.276 2.279) 8.743 5.986 ( -4.304 -1.859 -6.880) 8.326 6.204 ( -2.589 0.997 -1.358) 3.089 6.455 ( 2.250 -1.660 6.051) 6.666 6.833 ( -2.664 5.943 2.695) 7.049 7.575 ( 6.913 -8.223 2.074) 10.941 7.924 ( -2.766 0.820 3.054) 4.201 8.056 ( -1.857 -0.035 0.167) 1.865 8.352 ( 1.887 6.776 3.499) 7.856 8.674 ( 2.258 -9.345 -1.370) 9.712 8.757 ( 0.272 -4.453 1.002) 4.572 8.840 ( -2.333 -4.504 -3.235) 6.017 8.883 ( 5.155 -3.537 -6.448) 8.980 9.287 ( 5.314 9.696 -4.080) 11.786 9.400 ( -0.481 -0.225 -0.703) 0.881 9.481 ( -6.222 -0.931 -7.947) 10.136 10.091 ( 6.606 -0.183 5.373) 8.517 10.192 ( 1.194 9.791 -3.294) 10.399 10.261 ( -7.098 2.712 6.764) 10.173 10.580 ( 0.267 -1.075 -0.058) 1.110 10.846 ( -4.149 2.938 -2.813) 5.810 11.343 ( -0.523 -1.603 5.652) 5.898 11.590 ( -3.338 -5.214 -3.605) 7.164 11.807 ( 7.852 -2.232 2.449) 8.523 12.176 ( -8.444 -3.574 1.566) 9.302 12.314 ( 3.241 0.177 -6.241) 7.034 12.471 ( 0.890 6.664 4.060) 7.854 12.666 ( 0.316 1.171 2.206) 2.518 13.174 ( 3.356 -8.001 -0.692) 8.704 13.509 ( 2.316 -2.698 -4.868) 6.028 13.660 ( 2.028 0.288 -0.945) 2.256 13.936 ( -2.634 -1.524 0.536) 3.090 14.107 ( 3.434 -2.086 -1.258) 4.210 14.233 ( -3.637 -0.206 1.460) 3.924 14.747 ( 2.115 6.276 -5.853) 8.838 15.651 ( -0.070 -2.336 0.526) 2.395 16.097 ( 0.989 -4.201 3.701) 5.685 16.486 ( -7.126 15.979 10.466) 20.388 16.720 ( 3.661 -15.535 -2.427) 16.144 17.336 ( 7.142 2.198 1.239) 7.574 17.965 ( -10.776 11.231 -6.910) 17.029 18.322 ( -5.180 2.344 8.260) 10.028 19.288 ( 7.150 -6.086 -5.867) 11.071 19.317 ( -8.633 -1.111 -0.870) 8.748 19.662 ( 6.779 2.526 -0.958) 7.297 20.119 ( 1.517 2.183 -1.841) 3.233 20.661 ( -13.272 -6.333 6.799) 16.201 20.934 ( 3.289 9.338 4.120) 10.723 21.115 ( -1.585 -0.698 -1.669) 2.405 21.450 ( 0.979 -4.526 6.712) 8.154 22.051 ( 0.461 -3.305 -8.695) 9.313 22.411 ( 7.415 -0.249 -1.723) 7.617 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.150 ( -2.884 2.585 23.108) 23.430 1.695 ( -6.205 17.327 16.611) 24.792 2.218 ( 2.792 3.880 -14.865) 15.615 2.351 ( -9.146 1.363 -14.145) 16.899 2.935 ( -9.282 17.373 29.068) 35.113 3.187 ( 0.889 4.271 3.099) 5.352 3.238 ( 4.169 0.099 6.151) 7.431 3.296 ( -6.959 4.964 5.782) 10.320 3.374 ( 4.276 2.038 -0.792) 4.803 3.583 ( -0.369 -2.904 -4.109) 5.045 3.646 ( -8.422 -0.769 1.445) 8.579 3.869 ( -1.715 3.811 -0.934) 4.283 4.031 ( -0.650 5.486 -2.453) 6.045 4.279 ( -1.632 -1.170 -3.668) 4.181 4.541 ( -5.168 8.736 -29.632) 31.322 4.643 ( 0.881 -3.108 -1.899) 3.747 4.770 ( 1.960 -4.620 5.182) 7.213 4.996 ( 3.356 5.984 4.910) 8.437 5.019 ( 5.749 -7.988 -2.876) 10.253 5.145 ( 0.135 -8.438 1.501) 8.572 5.277 ( 2.642 -1.086 3.591) 4.588 5.619 ( 1.272 -1.894 -5.042) 5.534 5.747 ( -0.582 -4.521 -0.459) 4.582 6.006 ( 3.381 3.176 0.461) 4.661 6.088 ( -5.750 3.732 0.437) 6.869 6.278 ( -2.732 6.529 -4.200) 8.230 6.538 ( 4.950 -8.562 7.578) 12.459 6.761 ( -3.021 6.461 -2.684) 7.621 7.770 ( 4.320 -11.603 4.636) 13.220 7.831 ( 7.056 -2.330 4.357) 8.614 8.000 ( 0.659 -1.486 -4.779) 5.048 8.304 ( -7.864 1.898 -10.149) 12.979 8.614 ( 0.637 8.699 -4.120) 9.646 8.708 ( -0.687 -0.056 -1.177) 1.365 8.982 ( 0.849 -8.750 1.505) 8.919 9.072 ( 2.526 2.789 -0.839) 3.855 9.302 ( -4.764 2.366 -3.006) 6.110 9.490 ( -3.695 1.031 5.132) 6.407 9.848 ( 5.591 -5.562 6.774) 10.396 9.874 ( -1.237 6.828 4.717) 8.391 10.125 ( -1.201 -1.421 6.250) 6.521 10.293 ( 8.546 -9.249 -9.825) 15.972 10.966 ( 3.553 -9.981 -3.631) 11.200 11.094 ( -1.572 -2.188 -6.434) 6.975 11.260 ( -1.708 5.048 -3.786) 6.537 11.358 ( -3.654 6.174 -4.336) 8.383 11.641 ( -0.368 0.361 2.551) 2.603 11.833 ( 1.201 0.072 1.155) 1.668 12.031 ( -2.715 4.689 1.386) 5.593 12.632 ( -0.186 1.937 7.920) 8.156 13.217 ( 0.045 1.961 0.007) 1.962 13.282 ( -0.968 0.786 -2.752) 3.021 13.542 ( -2.377 -2.844 1.808) 4.124 13.823 ( 3.360 -0.317 3.114) 4.592 14.195 ( 4.938 -6.261 2.412) 8.331 14.247 ( 5.996 -13.308 -2.624) 14.830 14.482 ( -0.714 -3.779 -2.721) 4.711 14.620 ( -2.275 2.440 -8.276) 8.923 15.986 ( -2.888 11.337 -2.932) 12.061 16.447 ( 10.629 -17.378 14.229) 24.848 16.513 ( 9.664 -14.122 5.534) 17.985 16.924 ( 9.286 -9.134 3.891) 13.594 17.269 ( -5.740 -7.647 -9.975) 13.817 17.725 ( 2.076 7.704 0.849) 8.024 18.001 ( -9.221 9.797 5.426) 14.507 18.549 ( -2.714 20.348 -1.418) 20.577 18.626 ( -11.677 10.171 -5.159) 16.323 18.958 ( -14.743 22.184 -1.637) 26.686 19.317 ( -12.369 22.723 -5.551) 26.460 21.054 ( 9.797 -24.149 21.651) 33.881 21.359 ( 7.356 -6.690 2.310) 10.208 21.611 ( 0.204 -2.923 -3.525) 4.584 21.741 ( 6.238 -6.020 3.548) 9.367 22.045 ( -0.962 -0.664 -5.100) 5.232 23.200 ( 9.165 -16.066 -2.866) 18.717 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.362 ( 10.299 6.857 17.007) 21.031 1.868 ( -5.353 16.921 13.836) 22.504 2.074 ( -5.600 4.533 -16.142) 17.677 2.380 ( 5.376 6.816 -12.554) 15.263 3.091 ( 0.290 5.294 8.999) 10.445 3.213 ( -6.545 1.435 10.769) 12.683 3.270 ( 2.975 0.369 6.040) 6.743 3.358 ( -1.187 5.085 1.225) 5.364 3.476 ( -0.588 2.771 2.802) 3.985 3.529 ( 4.002 9.558 7.980) 13.079 3.575 ( -3.743 2.520 3.453) 5.682 3.878 ( 0.659 4.644 1.022) 4.801 4.153 ( 4.102 8.979 -4.900) 11.021 4.227 ( 0.248 -2.543 -4.835) 5.469 4.486 ( -0.243 12.817 -26.860) 29.762 4.585 ( -1.844 -4.429 -2.021) 5.206 4.720 ( -2.366 -9.036 6.465) 11.360 4.951 ( -1.287 -7.917 -3.332) 8.685 5.051 ( 2.191 -3.807 -2.194) 4.910 5.178 ( 2.584 3.594 3.584) 5.696 5.314 ( 1.152 -3.930 6.429) 7.623 5.555 ( -0.085 -6.382 -8.851) 10.912 5.715 ( 0.292 -0.967 1.032) 1.444 5.999 ( -6.249 2.229 0.417) 6.648 6.108 ( 4.281 0.803 2.283) 4.918 6.314 ( -0.603 8.281 -4.124) 9.271 6.499 ( -0.915 -10.537 5.913) 12.118 6.809 ( 0.382 10.110 -3.176) 10.604 7.671 ( -0.479 -18.531 4.057) 18.976 7.929 ( 0.869 1.479 -0.952) 1.962 8.008 ( 5.410 -1.051 1.165) 5.633 8.207 ( -3.676 6.927 -8.500) 11.565 8.576 ( -6.629 2.162 1.652) 7.166 8.712 ( -0.474 1.397 -2.799) 3.164 8.901 ( -0.679 -3.303 0.516) 3.411 9.061 ( -9.442 -2.702 2.834) 10.222 9.328 ( 6.939 2.789 -2.862) 8.007 9.455 ( 0.952 -4.811 4.736) 6.818 9.830 ( 0.293 -5.612 2.968) 6.355 9.965 ( 1.790 2.687 0.316) 3.244 10.098 ( -1.855 -1.596 5.012) 5.578 10.357 ( 6.598 -2.688 -8.115) 10.798 10.848 ( -1.852 -10.792 -1.747) 11.088 11.012 ( -0.208 -2.193 -4.163) 4.710 11.300 ( -0.989 2.691 -0.453) 2.903 11.382 ( 0.741 7.889 -2.346) 8.264 11.678 ( 1.806 1.304 2.532) 3.372 11.808 ( -2.601 2.587 -1.402) 3.927 12.082 ( -0.018 5.513 0.733) 5.562 12.633 ( -3.057 -2.158 6.918) 7.865 13.222 ( -0.866 0.740 -1.828) 2.154 13.302 ( 1.380 0.755 -2.661) 3.091 13.486 ( 1.434 -2.109 3.294) 4.166 13.885 ( -0.247 -0.889 1.957) 2.164 14.086 ( -2.127 -19.349 2.843) 19.672 14.229 ( 1.833 -5.567 -0.182) 5.863 14.410 ( -1.246 2.533 -3.741) 4.686 14.545 ( -1.795 -3.826 -2.953) 5.156 16.011 ( -0.904 3.260 -3.445) 4.829 16.469 ( 0.720 -13.019 5.689) 14.226 16.520 ( 1.061 -6.324 2.997) 7.078 16.817 ( -1.081 -13.723 4.501) 14.482 17.373 ( 14.004 0.511 -9.272) 16.804 17.603 ( -7.493 1.998 0.168) 7.757 18.184 ( 4.159 13.507 6.922) 15.737 18.605 ( -5.518 18.554 0.778) 19.373 18.728 ( -5.508 12.916 -4.109) 14.630 18.928 ( 1.851 23.660 -2.612) 23.875 19.477 ( -2.869 25.565 -1.310) 25.759 21.065 ( 8.719 -21.490 13.956) 27.067 21.408 ( 4.828 -5.824 0.698) 7.598 21.545 ( -1.157 -6.711 -3.061) 7.466 21.751 ( -0.723 -6.268 6.784) 9.264 21.943 ( -4.855 -2.416 -6.443) 8.421 23.081 ( -0.105 -19.712 -2.946) 19.931 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.724 ( 14.585 7.209 1.106) 16.307 1.820 ( -8.214 8.523 -1.430) 11.923 2.189 ( 2.591 17.170 1.277) 17.411 2.478 ( 4.627 3.747 -9.570) 11.271 3.057 ( -1.025 -6.610 3.494) 7.547 3.216 ( -2.208 1.739 6.436) 7.023 3.335 ( 2.956 -3.628 2.064) 5.115 3.377 ( -2.525 3.973 7.178) 8.584 3.489 ( -0.096 4.439 2.981) 5.348 3.545 ( -1.468 6.100 -8.537) 10.594 3.929 ( 4.913 17.115 23.392) 29.398 3.988 ( 6.578 5.241 4.112) 9.361 4.196 ( 2.430 1.763 -6.878) 7.505 4.290 ( 2.066 5.800 -3.752) 7.210 4.442 ( -3.756 -6.967 2.064) 8.179 4.580 ( 3.604 13.991 -20.900) 25.407 4.600 ( -0.571 -10.202 2.351) 10.485 4.843 ( -0.573 -5.443 -4.776) 7.264 5.040 ( 1.949 -4.877 0.439) 5.271 5.221 ( -6.265 7.155 -0.723) 9.537 5.277 ( 0.561 -6.851 2.075) 7.181 5.457 ( 0.454 -6.739 -8.479) 10.840 5.690 ( -2.178 -1.977 -0.196) 2.948 5.966 ( -1.201 1.705 5.537) 5.916 6.178 ( 2.622 -1.037 3.906) 4.817 6.342 ( -1.998 -4.565 -1.602) 5.234 6.395 ( -2.022 0.679 1.221) 2.457 6.953 ( 4.530 12.125 -3.396) 13.382 7.449 ( -5.532 -16.007 2.601) 17.134 7.914 ( 0.368 -2.092 -1.204) 2.441 8.096 ( -1.616 6.064 -0.796) 6.326 8.232 ( -0.731 9.489 -3.413) 10.111 8.503 ( -2.433 -2.592 5.415) 6.478 8.709 ( -1.982 2.489 4.235) 5.297 8.873 ( -1.749 -2.980 -3.872) 5.190 8.932 ( 1.354 -1.992 4.743) 5.319 9.299 ( -0.562 -9.616 -2.838) 10.042 9.519 ( 3.920 -6.168 0.585) 7.331 9.795 ( -0.344 -3.320 5.102) 6.097 9.987 ( -1.922 8.284 -1.084) 8.573 10.162 ( 6.929 1.659 -0.835) 7.174 10.300 ( -4.917 -5.728 -7.411) 10.579 10.714 ( -1.326 -9.617 -1.141) 9.775 11.006 ( 2.224 0.503 -5.572) 6.021 11.290 ( -2.545 2.023 5.657) 6.525 11.510 ( 3.027 10.119 0.917) 10.602 11.697 ( -0.958 -2.114 4.545) 5.103 11.852 ( 3.794 5.225 -4.712) 7.994 12.122 ( -0.842 4.319 -0.593) 4.440 12.538 ( -6.287 -3.418 6.819) 9.885 13.138 ( -2.720 -8.599 -0.948) 9.069 13.342 ( 2.029 4.428 -0.435) 4.890 13.624 ( 11.785 0.047 -1.053) 11.832 13.709 ( -9.491 -13.031 -1.089) 16.157 13.926 ( -5.125 -6.550 5.959) 10.231 14.130 ( -3.498 -4.408 -3.345) 6.547 14.432 ( -1.413 -5.416 3.233) 6.464 14.528 ( 3.446 7.278 -2.744) 8.507 15.927 ( -4.176 -8.209 -1.390) 9.314 16.338 ( -4.343 -8.297 5.681) 10.953 16.509 ( -0.319 -0.676 -3.498) 3.577 16.699 ( 1.882 -8.094 0.636) 8.334 17.322 ( -11.148 9.550 -5.897) 15.820 17.854 ( 23.406 0.960 -2.946) 23.610 18.420 ( 5.428 8.180 10.516) 14.386 18.556 ( -10.155 9.992 -3.795) 14.743 18.946 ( 7.705 22.099 2.327) 23.519 19.315 ( 14.343 12.250 -1.669) 18.936 19.619 ( -6.673 21.703 1.123) 22.734 21.036 ( 5.025 -15.999 4.825) 17.450 21.335 ( -6.135 -11.911 -4.196) 14.040 21.452 ( 2.298 -3.354 -6.220) 7.431 21.678 ( -5.340 -2.779 11.341) 12.840 21.813 ( -3.495 -3.651 -3.022) 5.888 22.812 ( -6.197 -17.816 -3.139) 19.122 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.734 ( -2.677 8.468 -10.646) 13.864 2.105 ( 13.605 7.141 1.826) 15.473 2.414 ( 3.546 14.239 1.691) 14.771 2.540 ( 5.343 -1.680 -4.907) 7.446 3.025 ( 0.809 -5.873 7.459) 9.528 3.186 ( -7.863 3.058 5.966) 10.333 3.315 ( 2.651 -5.613 3.672) 7.213 3.384 ( -1.941 0.350 3.578) 4.085 3.536 ( -3.362 5.948 -8.519) 10.921 3.640 ( 6.071 9.897 -2.535) 11.884 4.045 ( 0.754 0.053 4.383) 4.448 4.102 ( -3.202 0.269 6.462) 7.217 4.197 ( -2.126 -2.923 -6.976) 7.857 4.427 ( 2.667 -0.644 0.261) 2.756 4.464 ( 3.313 1.512 10.101) 10.737 4.546 ( 4.747 1.425 8.720) 10.030 4.700 ( 4.841 3.992 -8.348) 10.443 4.830 ( 3.423 6.271 -11.628) 13.648 5.037 ( 0.908 -1.473 4.863) 5.161 5.116 ( -5.929 3.991 -10.035) 12.320 5.228 ( -3.774 -2.775 -0.997) 4.790 5.357 ( 2.979 -7.320 -7.532) 10.917 5.643 ( -2.605 0.372 5.803) 6.372 5.981 ( -1.594 -0.079 3.048) 3.440 6.179 ( -5.202 -8.970 -0.087) 10.369 6.234 ( 2.321 -0.069 3.807) 4.460 6.406 ( -0.870 2.148 -0.983) 2.517 7.135 ( -4.118 11.571 0.596) 12.296 7.231 ( 3.163 -11.358 -0.818) 11.819 7.919 ( 1.869 1.696 -1.596) 2.986 8.089 ( -3.752 3.164 1.494) 5.130 8.307 ( -0.168 9.466 -0.768) 9.499 8.468 ( 2.332 -7.317 -0.359) 7.688 8.700 ( -0.921 -5.390 5.537) 7.782 8.854 ( 0.000 3.626 6.076) 7.076 9.014 ( 3.596 -3.274 1.247) 5.021 9.153 ( 0.525 -9.390 -4.857) 10.585 9.454 ( -2.066 -5.617 -1.422) 6.152 9.805 ( -2.762 6.051 4.750) 8.174 10.024 ( -5.822 -3.194 -7.097) 9.719 10.117 ( -0.893 3.227 -0.547) 3.392 10.310 ( 6.811 3.064 -2.112) 7.762 10.588 ( -1.417 -7.706 -2.540) 8.236 11.015 ( -1.294 2.635 -6.138) 6.804 11.328 ( 0.602 2.687 8.500) 8.935 11.634 ( -0.110 4.983 2.699) 5.668 11.660 ( -1.753 -3.342 2.733) 4.659 12.016 ( 10.891 7.490 -3.186) 13.596 12.127 ( 0.110 -1.532 -2.638) 3.053 12.483 ( -1.378 2.880 6.428) 7.177 12.980 ( -6.528 -7.154 -0.154) 9.686 13.380 ( -8.162 -15.859 -0.075) 17.836 13.424 ( 1.661 1.450 0.582) 2.281 13.722 ( -9.413 -5.526 -0.594) 10.932 13.825 ( 7.739 0.338 2.024) 8.006 14.061 ( 0.263 -1.026 -5.613) 5.712 14.350 ( -2.838 -3.555 3.349) 5.649 14.673 ( 3.255 8.727 -0.377) 9.322 15.744 ( -4.729 -10.082 -0.151) 11.137 16.219 ( -5.835 -2.601 7.059) 9.520 16.419 ( 5.203 -10.138 -17.234) 20.661 16.757 ( -0.787 2.130 18.342) 18.482 17.267 ( -4.136 14.065 -12.774) 19.445 18.194 ( 7.849 4.524 -1.133) 9.130 18.501 ( -8.154 17.156 2.513) 19.161 18.642 ( 17.095 -10.260 4.918) 20.536 19.325 ( 7.527 16.378 0.808) 18.043 19.487 ( 3.647 -0.306 -0.480) 3.691 19.840 ( 5.646 20.704 -2.105) 21.563 20.934 ( -1.287 -16.084 4.074) 16.642 21.079 ( -6.802 -5.185 -5.931) 10.408 21.380 ( -6.824 -1.085 -3.283) 7.651 21.596 ( -7.385 0.514 5.808) 9.409 21.783 ( 7.374 -5.439 0.031) 9.163 22.516 ( -7.437 -12.946 -2.288) 15.105 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.790 ( 3.235 7.485 -6.009) 10.129 2.359 ( 7.506 6.078 -1.433) 9.764 2.546 ( 5.285 -4.501 -3.569) 7.806 2.636 ( 2.177 6.363 2.694) 7.245 2.987 ( -1.323 -7.175 7.649) 10.571 3.089 ( -8.948 3.909 8.565) 12.989 3.269 ( -5.133 -2.652 -2.859) 6.446 3.356 ( -5.691 3.153 -6.560) 9.240 3.525 ( 6.410 -1.336 0.853) 6.603 3.833 ( 6.275 6.482 -0.669) 9.047 4.037 ( -4.029 -0.413 5.255) 6.634 4.073 ( 0.826 -1.430 0.010) 1.651 4.175 ( 2.339 -0.002 -0.655) 2.429 4.387 ( -7.699 0.651 1.667) 7.904 4.433 ( 0.034 -7.610 2.947) 8.160 4.631 ( 2.921 -2.148 2.053) 4.167 4.768 ( -4.767 -4.499 -12.658) 14.255 4.904 ( 4.294 0.821 -1.447) 4.605 4.997 ( -4.625 6.130 4.193) 8.749 5.139 ( 3.086 11.333 -5.644) 13.031 5.257 ( 6.826 6.010 3.983) 9.929 5.379 ( 8.675 -6.619 -5.524) 12.230 5.651 ( -1.508 2.495 6.015) 6.684 5.896 ( -6.163 -6.683 1.624) 9.234 6.021 ( -3.863 -1.165 -3.923) 5.628 6.271 ( -1.613 2.655 -1.074) 3.287 6.406 ( 1.689 -3.326 4.074) 5.524 7.021 ( -9.131 6.580 1.989) 11.429 7.337 ( 9.513 -8.264 -0.776) 12.625 8.015 ( 0.670 8.672 0.383) 8.706 8.056 ( -0.600 0.537 2.387) 2.519 8.412 ( 1.372 3.714 -2.536) 4.702 8.453 ( 6.784 -5.625 -0.366) 8.820 8.627 ( 0.332 -9.655 3.032) 10.125 8.862 ( -4.908 -9.537 0.820) 10.758 8.889 ( -4.970 -0.188 3.005) 5.810 9.232 ( 7.981 5.021 -7.417) 11.997 9.397 ( 0.424 -0.873 5.462) 5.548 9.673 ( -14.989 4.782 -12.613) 20.165 9.988 ( 6.289 -1.923 7.424) 9.918 10.198 ( 3.077 3.528 -0.378) 4.696 10.413 ( -0.128 5.280 0.827) 5.346 10.530 ( 2.476 -2.698 -1.770) 4.068 10.947 ( -5.463 0.925 -5.305) 7.671 11.387 ( -1.414 0.337 8.902) 9.020 11.590 ( -2.920 -2.898 -1.983) 4.567 11.689 ( 3.758 1.515 1.135) 4.207 12.082 ( 3.294 -6.578 -4.095) 8.419 12.309 ( 7.662 8.434 1.036) 11.441 12.568 ( 0.408 4.377 4.146) 6.043 12.770 ( -8.903 2.018 1.673) 9.281 13.114 ( -8.030 -10.950 -1.287) 13.640 13.360 ( 2.424 -11.370 -0.836) 11.656 13.642 ( 0.799 3.123 -1.374) 3.504 13.926 ( 2.661 -2.925 5.312) 6.622 14.026 ( 0.901 -1.177 -7.257) 7.406 14.304 ( -2.506 0.662 1.599) 3.046 14.805 ( 0.881 9.919 -0.384) 9.966 15.585 ( -0.795 -9.165 -1.897) 9.392 16.137 ( -4.788 -0.390 5.476) 7.285 16.391 ( 8.887 -10.364 -8.939) 16.319 16.795 ( -5.597 4.623 9.546) 11.992 17.354 ( 1.978 12.189 -0.942) 12.384 18.166 ( -7.957 0.400 -7.211) 10.746 18.551 ( -8.331 10.874 12.033) 18.234 18.938 ( 22.149 -3.310 -5.552) 23.073 19.317 ( -3.320 -8.522 -2.333) 9.439 19.718 ( 4.279 13.549 0.380) 14.214 20.067 ( 4.414 6.237 -2.795) 8.136 20.755 ( -3.879 -10.141 7.167) 13.010 20.967 ( -1.165 -1.836 -2.515) 3.325 21.206 ( -8.307 -0.525 -3.189) 8.914 21.516 ( -5.992 3.683 8.093) 10.722 21.893 ( 8.846 -4.195 -5.932) 11.447 22.316 ( -1.297 -6.296 -0.822) 6.480 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.382 ( -10.434 3.711 13.878) 17.755 1.981 ( -3.313 10.624 -0.458) 11.138 2.228 ( -4.431 9.717 -2.689) 11.013 2.492 ( -10.581 0.223 -9.861) 14.466 3.071 ( 10.893 2.112 2.743) 11.430 3.173 ( 1.228 -2.085 10.549) 10.823 3.292 ( -3.778 5.948 2.022) 7.330 3.417 ( -5.005 1.895 0.841) 5.418 3.529 ( 1.886 -1.016 -5.288) 5.706 3.598 ( -7.463 5.667 1.260) 9.455 3.900 ( 2.887 5.748 5.898) 8.727 3.924 ( -16.675 12.470 17.759) 27.367 4.123 ( -6.760 -0.479 -2.566) 7.246 4.302 ( -2.979 0.301 -2.774) 4.081 4.534 ( 0.412 -5.403 -7.072) 8.909 4.602 ( 4.795 3.606 -8.691) 10.561 4.716 ( -2.098 -0.236 -3.695) 4.255 4.818 ( 6.885 -3.492 -5.242) 9.331 5.006 ( 2.886 6.006 -0.337) 6.672 5.104 ( -1.249 -7.788 4.142) 8.909 5.238 ( -0.096 -1.730 2.572) 3.101 5.467 ( 7.546 -6.004 -7.606) 12.282 5.719 ( 0.898 -0.993 0.366) 1.388 6.022 ( -2.520 0.428 1.792) 3.121 6.202 ( -1.182 3.643 1.300) 4.045 6.331 ( 0.939 -1.930 -2.762) 3.498 6.382 ( 4.773 -3.203 4.123) 7.074 6.905 ( -3.005 9.198 -0.093) 9.677 7.467 ( 8.955 -12.201 0.958) 15.165 7.812 ( -1.762 -0.479 4.752) 5.090 8.069 ( -4.947 3.214 0.778) 5.950 8.383 ( -3.813 0.194 -10.280) 10.966 8.605 ( 2.038 -0.687 -5.460) 5.868 8.743 ( -0.907 4.519 2.879) 5.434 8.882 ( 0.875 -2.771 -2.931) 4.128 9.078 ( 0.465 2.144 -7.437) 7.754 9.312 ( 4.586 -8.543 -3.894) 10.448 9.460 ( 2.921 -0.456 4.191) 5.129 9.815 ( -0.048 2.500 10.395) 10.691 9.932 ( 2.368 0.845 -1.745) 3.060 10.112 ( 1.961 -4.418 7.502) 8.924 10.145 ( -2.235 -0.001 -2.140) 3.094 10.754 ( 6.413 -10.309 -3.411) 12.611 11.009 ( 5.124 0.208 -5.435) 7.473 11.365 ( -4.235 2.164 0.001) 4.756 11.537 ( -12.003 6.054 -2.371) 13.651 11.728 ( -3.627 4.637 4.641) 7.497 11.790 ( 3.992 1.927 -1.519) 4.685 12.122 ( -2.373 1.644 0.689) 2.968 12.610 ( 1.749 -3.500 0.663) 3.969 13.115 ( 8.792 -5.673 0.741) 10.490 13.371 ( -4.543 4.961 -2.956) 7.348 13.598 ( 0.541 5.975 1.543) 6.194 13.674 ( 5.839 -11.743 1.592) 13.210 14.015 ( 1.987 -10.454 -1.932) 10.815 14.091 ( 3.255 -3.778 0.064) 4.987 14.402 ( 3.360 -4.158 3.735) 6.522 14.698 ( -4.529 6.966 -14.231) 16.479 15.937 ( 9.817 -2.678 -2.094) 10.389 16.139 ( 11.212 -13.934 17.718) 25.175 16.395 ( 1.022 -5.619 3.618) 6.760 16.842 ( -0.909 9.387 -0.382) 9.439 17.297 ( -11.691 -12.226 -8.702) 19.023 17.735 ( 9.405 17.486 3.508) 20.162 18.331 ( -14.804 0.203 11.326) 18.640 18.763 ( 1.848 17.957 -8.736) 20.055 18.940 ( -15.866 11.003 -0.473) 19.314 19.387 ( -8.375 18.540 -6.111) 21.242 19.682 ( -18.009 4.880 -3.565) 18.996 20.872 ( 3.290 -7.809 20.863) 22.518 21.132 ( 11.163 -8.634 4.130) 14.705 21.420 ( 9.589 -8.502 -3.829) 13.375 21.679 ( 0.799 -1.184 5.111) 5.307 22.001 ( 0.161 -2.681 -8.028) 8.466 22.831 ( 12.108 -14.497 -4.470) 19.410 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.396 ( -0.026 6.041 13.043) 14.374 2.087 ( 0.262 11.537 -2.330) 11.773 2.210 ( -7.558 9.706 -7.370) 14.341 2.399 ( -0.569 9.485 -0.445) 9.512 3.151 ( -2.448 -1.627 4.157) 5.091 3.259 ( -1.924 -4.028 7.398) 8.640 3.325 ( 6.462 1.987 -4.855) 8.323 3.369 ( -1.706 3.006 0.145) 3.459 3.455 ( -3.099 3.482 -4.478) 6.464 3.577 ( 0.539 -0.347 -2.094) 2.190 3.937 ( -8.659 18.850 22.026) 30.257 3.960 ( -4.625 4.371 6.555) 9.136 4.125 ( 3.851 2.545 4.991) 6.799 4.248 ( -3.190 5.180 -8.612) 10.544 4.483 ( 1.345 -2.427 -4.539) 5.320 4.601 ( -3.574 10.089 -18.566) 21.430 4.694 ( 1.483 -5.387 0.540) 5.614 4.862 ( 1.222 -5.313 1.120) 5.566 4.962 ( -1.702 -8.030 -1.984) 8.444 5.149 ( 5.111 2.525 1.108) 5.807 5.262 ( 3.312 -3.283 6.741) 8.197 5.450 ( 0.973 -5.909 -7.025) 9.231 5.708 ( -0.308 -1.338 -1.050) 1.729 6.034 ( 3.084 -1.394 0.773) 3.472 6.143 ( -6.426 1.327 1.894) 6.830 6.334 ( 2.259 -4.284 -1.177) 4.984 6.433 ( 1.743 -0.193 0.482) 1.818 6.940 ( -4.393 11.375 -3.064) 12.573 7.458 ( 5.505 -15.573 2.602) 16.721 7.886 ( 7.082 1.510 5.719) 9.227 8.005 ( -5.133 2.953 -0.650) 5.958 8.279 ( -2.949 2.819 -9.901) 10.708 8.608 ( 3.787 -1.332 -2.157) 4.557 8.782 ( -4.545 6.492 -3.915) 8.839 8.872 ( 1.487 -2.639 -2.332) 3.823 9.108 ( 1.757 0.585 -2.524) 3.130 9.299 ( 1.453 -0.410 -0.128) 1.516 9.449 ( -3.212 -9.699 8.109) 13.044 9.716 ( -1.463 -10.636 0.433) 10.745 9.969 ( -1.480 1.774 2.067) 3.100 10.116 ( 1.403 -2.434 2.743) 3.926 10.249 ( 4.874 5.923 0.555) 7.690 10.730 ( 3.034 -9.895 -0.209) 10.352 10.985 ( -2.611 -3.337 -5.569) 6.998 11.326 ( -0.833 1.674 -0.407) 1.913 11.461 ( -1.992 6.970 -0.074) 7.250 11.736 ( -2.520 4.348 4.313) 6.623 11.915 ( 0.003 9.347 -2.527) 9.683 12.105 ( 0.424 1.875 -0.736) 2.058 12.577 ( 2.255 -6.804 -0.748) 7.207 13.163 ( 3.173 -7.428 -1.803) 8.276 13.355 ( -2.566 6.111 -1.701) 6.842 13.511 ( -4.294 -5.922 3.891) 8.286 13.837 ( 7.996 1.552 4.393) 9.254 13.896 ( 1.563 -15.367 -1.543) 15.523 14.116 ( 4.018 -4.163 -0.900) 5.856 14.408 ( 0.941 -4.201 3.168) 5.345 14.582 ( -6.894 2.959 -9.876) 12.402 15.936 ( 3.552 -10.561 -0.499) 11.154 16.348 ( 0.857 -8.007 1.611) 8.212 16.422 ( 12.847 1.708 8.670) 15.593 16.845 ( -9.806 -4.519 10.221) 14.868 17.095 ( 7.338 3.450 -18.109) 19.842 17.863 ( -12.137 3.050 6.325) 14.022 18.291 ( -0.048 12.195 4.540) 13.013 18.808 ( -0.674 11.069 -1.926) 11.255 18.971 ( -6.075 21.445 -4.514) 22.741 19.333 ( -19.654 14.742 -1.644) 24.623 19.626 ( 8.815 13.809 -4.912) 17.103 20.889 ( -2.000 -10.288 20.159) 22.721 21.242 ( 7.934 -6.413 2.191) 10.434 21.420 ( 3.239 -10.874 -5.875) 12.777 21.701 ( 2.645 -3.599 6.854) 8.181 21.932 ( -0.622 -3.394 -8.175) 8.873 22.811 ( 6.319 -18.155 -3.117) 19.475 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.593 ( 8.856 8.618 2.855) 12.683 2.029 ( -8.399 5.968 -4.760) 11.349 2.339 ( 2.744 17.081 -1.939) 17.409 2.501 ( -1.639 8.925 3.168) 9.611 3.011 ( -4.801 -8.093 -6.271) 11.308 3.253 ( 1.914 -3.468 9.057) 9.885 3.293 ( -1.696 -2.228 3.012) 4.112 3.448 ( 4.277 1.556 -7.438) 8.720 3.527 ( 1.583 9.493 -5.692) 11.181 3.582 ( -1.060 2.747 5.178) 5.956 3.966 ( -0.089 3.018 0.794) 3.122 4.158 ( 2.012 7.712 4.849) 9.329 4.181 ( 0.824 8.883 11.450) 14.515 4.306 ( 0.715 8.928 4.439) 9.997 4.451 ( -0.366 -6.013 2.732) 6.614 4.580 ( -7.534 -6.024 3.174) 10.155 4.628 ( -0.345 15.533 -16.247) 22.480 4.763 ( -0.019 -5.236 -3.817) 6.480 4.934 ( 3.495 -3.358 -3.924) 6.236 5.169 ( 2.080 -10.507 2.260) 10.947 5.330 ( 1.817 -7.262 -6.276) 9.769 5.364 ( -2.727 5.380 0.212) 6.036 5.683 ( 0.136 -1.258 -1.610) 2.048 6.046 ( -1.046 -0.812 3.455) 3.700 6.114 ( 1.453 -1.253 4.428) 4.826 6.282 ( 0.135 -9.410 -0.368) 9.418 6.455 ( -0.929 4.445 -2.840) 5.356 6.951 ( 0.780 0.990 -5.101) 5.255 7.416 ( -0.689 -1.301 1.587) 2.165 7.940 ( -2.769 1.590 -1.431) 3.499 8.093 ( 6.369 2.554 5.955) 9.086 8.272 ( 2.411 5.300 -6.187) 8.496 8.653 ( -6.292 4.001 0.812) 7.500 8.755 ( 2.197 4.078 3.016) 5.527 8.844 ( -1.039 -0.934 -2.445) 2.816 9.024 ( -8.655 -3.049 -0.904) 9.221 9.221 ( -5.571 -13.391 5.342) 15.456 9.392 ( 4.732 -3.962 -0.123) 6.173 9.658 ( 5.846 -6.678 0.130) 8.877 9.999 ( 4.051 -0.290 -0.970) 4.176 10.132 ( 0.251 2.372 1.370) 2.750 10.309 ( -2.241 -0.061 -2.726) 3.530 10.655 ( -1.674 -7.725 1.465) 8.039 10.913 ( 2.184 -2.503 -6.067) 6.917 11.333 ( 0.762 -1.163 5.102) 5.289 11.578 ( 2.303 9.978 2.500) 10.541 11.776 ( 0.386 5.354 2.174) 5.791 11.920 ( -7.538 9.964 -3.810) 13.062 12.155 ( 1.158 2.770 -1.607) 3.406 12.548 ( 1.429 -7.818 0.889) 7.997 13.057 ( -0.845 -12.142 -2.766) 12.481 13.386 ( -0.480 5.182 1.910) 5.543 13.453 ( 2.781 -5.602 0.381) 6.266 13.727 ( -3.753 -8.582 -0.894) 9.409 13.958 ( 0.038 -0.769 7.747) 7.785 14.105 ( 0.315 -4.228 -3.708) 5.632 14.390 ( 0.721 -5.419 2.346) 5.948 14.533 ( 1.202 5.514 -1.864) 5.943 15.861 ( -0.542 -9.540 -3.356) 10.127 16.292 ( 1.502 -7.414 3.676) 8.410 16.485 ( -5.066 -6.532 -7.925) 11.451 16.729 ( -2.420 4.153 8.088) 9.409 17.367 ( 20.045 6.557 -9.416) 23.097 17.659 ( -11.262 2.694 0.840) 11.610 18.386 ( 1.526 -1.303 8.774) 9.001 18.953 ( -13.220 19.203 -7.789) 24.580 19.059 ( 5.207 17.477 3.571) 18.582 19.322 ( 1.152 15.704 0.281) 15.748 19.897 ( 2.056 16.668 -0.383) 16.799 20.799 ( 1.145 -13.901 8.665) 16.421 21.252 ( -2.429 -13.669 -3.572) 14.336 21.307 ( 5.235 -5.915 -6.022) 9.933 21.728 ( 1.499 -6.656 7.350) 10.028 21.861 ( -3.911 2.453 -2.280) 5.150 22.673 ( 0.088 -16.905 -1.716) 16.992 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.812 ( 2.557 10.584 -10.576) 15.179 2.008 ( 3.069 5.403 4.576) 7.716 2.497 ( -2.086 2.850 -2.191) 4.156 2.557 ( -0.708 13.929 3.049) 14.276 2.895 ( 4.614 -7.479 -2.263) 9.075 3.195 ( -0.967 -8.359 2.281) 8.719 3.345 ( 1.436 0.467 6.486) 6.659 3.454 ( -0.218 -0.637 -4.691) 4.739 3.601 ( -2.233 7.616 -3.974) 8.876 3.674 ( 1.751 11.457 1.639) 11.706 4.002 ( 2.128 0.066 -1.120) 2.406 4.178 ( -0.276 0.728 -3.886) 3.963 4.272 ( -9.346 -4.079 7.768) 12.819 4.358 ( 1.901 -4.949 2.207) 5.743 4.420 ( 2.535 -1.831 2.845) 4.228 4.565 ( 4.477 7.984 13.538) 16.342 4.716 ( -2.853 6.423 -1.125) 7.117 4.783 ( 4.489 8.770 -13.269) 16.527 4.985 ( 5.815 0.434 2.399) 6.306 5.091 ( 1.174 -6.041 -3.750) 7.206 5.188 ( -1.258 -10.827 -6.831) 12.863 5.347 ( -5.406 4.061 -4.203) 7.961 5.690 ( 0.045 1.193 2.571) 2.835 6.059 ( -1.897 2.455 5.347) 6.182 6.136 ( 0.775 -8.316 4.020) 9.269 6.168 ( 0.856 -6.343 -0.523) 6.421 6.462 ( -1.837 3.835 -3.902) 5.771 6.967 ( 7.359 -7.238 -3.847) 11.016 7.402 ( -7.165 9.292 -0.128) 11.734 7.937 ( -0.035 5.285 -1.316) 5.446 8.153 ( -0.492 -0.483 1.372) 1.536 8.376 ( 2.708 1.524 -2.844) 4.213 8.529 ( -10.420 4.423 3.015) 11.715 8.758 ( -9.724 -2.229 1.990) 10.173 8.867 ( 4.001 1.100 -1.036) 4.277 8.945 ( 3.196 -0.076 9.672) 10.187 9.029 ( 0.143 -9.620 -0.978) 9.671 9.400 ( 0.536 -4.670 0.806) 4.770 9.760 ( 8.277 -3.640 7.388) 11.676 10.084 ( 6.485 1.240 -5.478) 8.579 10.158 ( -9.371 1.311 -8.619) 12.800 10.199 ( 3.167 -0.997 0.874) 3.433 10.548 ( -2.265 -4.492 -0.691) 5.077 10.944 ( 4.942 -1.327 -6.210) 8.047 11.374 ( 1.482 -0.972 9.072) 9.243 11.681 ( -1.192 1.653 5.266) 5.646 11.828 ( -9.662 8.769 -2.522) 13.289 11.926 ( 6.891 9.619 -2.298) 12.054 12.152 ( -3.774 1.211 -1.940) 4.413 12.492 ( 2.060 -5.771 2.962) 6.807 12.942 ( 0.903 -6.964 -2.204) 7.360 13.335 ( -6.513 -14.129 -0.126) 15.559 13.459 ( 0.990 3.331 5.097) 6.169 13.692 ( 4.108 1.774 -2.021) 4.910 13.899 ( -8.014 -1.651 5.404) 9.806 14.034 ( -1.497 -2.260 -4.830) 5.539 14.349 ( -0.290 -3.799 1.902) 4.259 14.677 ( 5.887 6.325 4.029) 9.534 15.714 ( -3.445 -9.509 -0.871) 10.152 16.207 ( -3.721 -7.135 -17.801) 19.535 16.298 ( -0.989 -3.977 3.204) 5.202 16.833 ( 2.057 4.498 12.684) 13.615 17.456 ( -8.099 9.112 -8.824) 15.050 17.887 ( 25.750 5.643 -5.905) 27.014 18.398 ( 2.424 -11.427 10.684) 15.830 18.887 ( -11.488 16.741 -1.490) 20.358 19.354 ( 8.290 15.901 -2.649) 18.127 19.465 ( -2.122 3.530 4.090) 5.804 20.041 ( -2.290 16.312 0.651) 16.485 20.747 ( 4.614 -14.075 3.435) 15.205 21.030 ( -2.312 -10.821 -8.851) 14.169 21.335 ( 5.029 -1.759 -9.493) 10.886 21.674 ( -0.828 -8.282 5.719) 10.099 21.813 ( -7.730 5.376 6.246) 11.299 22.484 ( -4.001 -11.621 -0.479) 12.300 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.859 ( -2.251 10.354 -4.428) 11.484 2.219 ( 11.194 4.101 -2.077) 12.101 2.425 ( -0.926 -7.421 3.948) 8.457 2.713 ( 1.682 12.557 -2.129) 12.847 2.933 ( 2.776 -6.271 4.758) 8.347 3.125 ( 4.554 -8.711 -4.481) 10.803 3.361 ( -5.837 3.170 5.744) 8.781 3.429 ( 1.246 -0.671 -0.855) 1.653 3.542 ( -8.396 3.601 -6.741) 11.353 3.818 ( 1.366 6.356 2.646) 7.019 4.037 ( 0.837 1.127 2.321) 2.712 4.085 ( 0.576 -1.839 -3.863) 4.317 4.221 ( -4.632 3.642 4.177) 7.222 4.308 ( 2.755 -10.933 3.174) 11.713 4.488 ( 5.787 1.331 -0.044) 5.938 4.625 ( -9.252 -1.419 2.721) 9.748 4.758 ( -3.323 -4.217 -10.097) 11.436 4.803 ( 5.925 3.081 4.201) 7.890 5.070 ( 8.644 -13.055 -5.037) 16.448 5.121 ( 3.410 11.846 -8.640) 15.054 5.214 ( 3.335 9.094 6.122) 11.458 5.272 ( -3.360 2.934 3.339) 5.572 5.714 ( -0.261 1.829 2.448) 3.067 5.943 ( -7.000 -8.520 -2.797) 11.376 6.081 ( -2.600 3.445 2.109) 4.804 6.221 ( 5.877 -4.659 4.653) 8.826 6.426 ( -3.509 1.370 -3.891) 5.416 7.042 ( 9.599 -5.074 -1.761) 10.999 7.318 ( -10.815 5.090 0.372) 11.959 8.050 ( 3.699 10.762 -1.785) 11.519 8.123 ( -0.836 -2.168 1.782) 2.928 8.301 ( -3.817 -7.755 -2.109) 8.897 8.509 ( -1.922 9.171 1.561) 9.499 8.578 ( -3.915 -5.460 -1.506) 6.885 8.848 ( -2.244 -7.156 6.764) 10.099 9.026 ( -7.790 -1.500 5.661) 9.745 9.065 ( 10.714 3.594 -7.190) 13.394 9.396 ( 3.008 1.305 7.703) 8.372 9.871 ( -1.726 -5.767 4.373) 7.441 9.940 ( -5.507 4.784 -6.725) 9.922 10.175 ( 1.715 1.985 -3.091) 4.054 10.284 ( 10.834 -4.547 -1.281) 11.820 10.521 ( 0.128 2.830 -0.818) 2.949 10.961 ( 0.937 -1.623 -6.627) 6.887 11.432 ( 1.392 -2.228 12.252) 12.531 11.615 ( -5.138 -0.571 -7.375) 9.006 11.750 ( -3.924 2.444 3.407) 5.743 12.024 ( -3.776 -0.976 -0.591) 3.944 12.237 ( 9.694 12.282 -0.747) 15.665 12.539 ( 4.882 -3.512 0.579) 6.042 12.935 ( 1.822 2.162 -0.920) 2.973 13.048 ( -8.151 -11.446 1.683) 14.152 13.417 ( -12.616 -4.325 4.116) 13.957 13.693 ( -2.943 3.683 -1.386) 4.914 13.854 ( 3.566 -1.626 4.794) 6.192 13.981 ( -0.152 -0.946 -7.536) 7.596 14.331 ( 0.013 -1.240 2.131) 2.466 14.870 ( 4.537 9.044 5.417) 11.477 15.531 ( -5.442 -9.317 -1.833) 10.944 16.088 ( 6.506 -6.629 -15.680) 18.224 16.262 ( -3.078 1.007 4.182) 5.289 16.927 ( -2.053 -1.641 14.586) 14.821 17.432 ( -0.159 12.168 -12.995) 17.803 18.212 ( -0.158 -4.335 0.435) 4.360 18.476 ( 22.009 -2.728 -1.291) 22.215 18.867 ( -7.359 10.508 7.002) 14.615 19.348 ( -8.894 -4.181 1.403) 9.927 19.663 ( 12.189 11.593 -4.157) 17.327 20.119 ( -2.759 2.023 -0.743) 3.501 20.712 ( 2.051 -3.692 5.064) 6.594 20.900 ( 0.555 -7.622 -6.413) 9.977 21.308 ( -4.431 0.033 -9.819) 10.772 21.643 ( 3.756 -7.798 5.835) 10.438 21.768 ( -5.009 7.382 4.472) 9.979 22.317 ( -5.011 -4.307 0.351) 6.617 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.693 ( -13.529 6.609 7.495) 16.819 2.065 ( -0.851 4.685 -4.151) 6.317 2.467 ( -8.099 6.446 2.091) 10.560 2.617 ( -7.084 -1.209 -5.132) 8.831 2.875 ( 11.759 3.328 0.951) 12.257 3.171 ( 3.092 -3.315 6.347) 7.799 3.362 ( 2.473 0.470 4.122) 4.829 3.435 ( 1.254 1.228 -6.998) 7.215 3.582 ( -7.002 0.404 1.872) 7.260 3.719 ( -7.528 4.721 -3.732) 9.638 3.942 ( 1.790 4.500 7.058) 8.560 4.167 ( -1.063 -2.153 -1.358) 2.759 4.337 ( -2.435 -7.661 -1.992) 8.282 4.366 ( 0.324 2.758 3.299) 4.312 4.463 ( 4.489 -2.609 -4.633) 6.959 4.561 ( -12.834 11.676 8.556) 19.346 4.685 ( 2.657 3.166 0.985) 4.249 4.769 ( -3.025 -1.233 -3.570) 4.838 5.008 ( 2.428 -5.372 6.732) 8.948 5.064 ( 2.822 4.628 -10.341) 11.675 5.175 ( 6.419 -2.673 -2.734) 7.471 5.324 ( -3.916 -0.353 -1.562) 4.231 5.709 ( -0.426 0.293 0.146) 0.537 6.081 ( -0.870 -2.983 1.515) 3.457 6.152 ( 4.066 -5.371 0.045) 6.737 6.199 ( 5.842 2.573 -3.389) 7.228 6.409 ( -2.373 0.040 4.023) 4.671 6.920 ( 9.216 3.667 3.260) 10.441 7.404 ( -9.011 -1.625 -0.371) 9.164 7.902 ( -5.291 2.534 3.876) 7.031 8.172 ( -2.349 0.503 -0.699) 2.502 8.350 ( 4.980 -0.197 0.841) 5.054 8.578 ( -6.779 -5.084 -4.844) 9.760 8.783 ( 1.913 -12.744 -1.883) 13.024 8.832 ( -0.903 5.903 3.875) 7.119 9.028 ( 9.167 -7.115 -4.377) 12.403 9.110 ( -3.551 7.293 -12.311) 14.743 9.428 ( 1.827 -1.465 -3.470) 4.186 9.847 ( 8.397 8.901 -6.177) 13.707 9.949 ( -4.935 -0.021 15.351) 16.125 10.074 ( -0.975 -5.012 4.904) 7.080 10.211 ( 0.724 2.906 -0.728) 3.082 10.554 ( 2.816 -6.589 -1.523) 7.326 10.908 ( 5.469 1.620 -0.683) 5.745 11.436 ( 0.057 3.698 -0.264) 3.708 11.699 ( 0.640 -5.830 1.789) 6.132 11.831 ( -8.552 0.558 -3.088) 9.110 11.895 ( -8.336 11.164 2.780) 14.207 12.149 ( -3.348 -1.938 -1.012) 3.999 12.527 ( 6.808 -1.480 -2.829) 7.519 12.907 ( 6.958 -2.195 3.129) 7.938 13.332 ( 7.661 -10.732 0.287) 13.189 13.531 ( -3.083 2.546 -5.825) 7.066 13.677 ( 0.356 3.882 0.451) 3.924 13.934 ( -4.918 -9.434 0.020) 10.639 14.001 ( 3.555 -3.809 0.095) 5.211 14.346 ( 2.199 -0.533 2.552) 3.411 14.780 ( -2.849 8.020 -12.563) 15.175 15.717 ( 7.385 -6.317 -1.348) 9.811 15.953 ( 5.853 -8.727 20.795) 23.299 16.322 ( 2.813 -1.927 0.970) 3.545 16.993 ( -2.464 9.862 -10.598) 14.685 17.369 ( -11.835 -9.818 2.938) 15.655 17.808 ( 7.830 22.477 6.197) 24.595 18.444 ( 5.958 -1.690 3.997) 7.371 18.933 ( -13.281 4.135 -8.511) 16.307 19.306 ( -9.807 11.120 3.592) 15.255 19.542 ( -5.736 -0.600 -7.024) 9.089 20.048 ( -14.734 5.389 -0.297) 15.692 20.782 ( 13.156 -0.245 -1.185) 13.212 20.899 ( 6.297 -5.967 11.363) 14.296 21.220 ( 4.571 -2.889 7.551) 9.288 21.655 ( 4.677 -0.086 4.628) 6.580 21.962 ( -5.922 -4.725 -12.554) 14.663 22.498 ( 8.271 -9.802 -2.659) 13.098 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.591 ( -8.716 6.116 10.515) 14.965 2.149 ( 2.083 10.797 -4.333) 11.819 2.449 ( -9.756 9.748 -2.400) 13.998 2.493 ( 0.526 4.195 1.570) 4.510 3.113 ( 11.623 1.253 -5.366) 12.864 3.197 ( -1.439 -2.714 5.127) 5.977 3.317 ( -5.031 -3.821 2.285) 6.718 3.442 ( -3.117 -2.965 -4.392) 6.148 3.479 ( 0.381 0.045 -1.071) 1.137 3.627 ( -5.937 8.269 -1.160) 10.245 4.056 ( 3.467 3.891 3.400) 6.223 4.087 ( -2.946 -1.942 5.339) 6.399 4.219 ( -3.006 -3.884 -7.381) 8.865 4.440 ( 0.315 2.767 -1.469) 3.149 4.501 ( -6.403 11.165 14.382) 19.301 4.551 ( 3.431 0.466 -2.092) 4.045 4.680 ( -3.324 1.126 -5.347) 6.396 4.789 ( 4.934 3.889 -3.869) 7.378 4.982 ( -4.363 -5.262 9.995) 12.109 5.102 ( -0.792 1.068 -5.402) 5.563 5.217 ( 1.396 -0.195 1.194) 1.847 5.322 ( 6.806 -2.269 -2.942) 7.755 5.695 ( -0.799 -0.844 -1.916) 2.241 6.004 ( -2.067 -2.559 -0.572) 3.339 6.174 ( 5.348 -9.819 0.185) 11.183 6.251 ( -2.532 0.904 1.277) 2.976 6.411 ( 2.011 2.019 -1.492) 3.217 7.139 ( -3.776 9.973 0.086) 10.664 7.221 ( 4.897 -9.573 0.395) 10.760 7.879 ( -1.827 3.268 4.505) 5.858 8.114 ( -3.690 0.627 -2.257) 4.371 8.329 ( -5.422 1.832 -2.852) 6.394 8.481 ( 5.381 -3.581 -3.574) 7.386 8.757 ( 6.017 -5.139 -3.604) 8.695 8.921 ( -3.463 8.392 -2.801) 9.500 9.051 ( 1.404 -3.547 -3.870) 5.434 9.111 ( 9.445 -6.013 -0.440) 11.206 9.451 ( 2.070 -2.185 -1.043) 3.186 9.757 ( -12.504 -8.927 12.119) 19.568 10.010 ( 5.910 0.556 -4.553) 7.481 10.095 ( -3.296 3.072 3.184) 5.517 10.285 ( 1.116 8.407 2.020) 8.718 10.564 ( 5.384 -6.149 1.194) 8.260 10.975 ( 0.061 -1.308 -0.154) 1.319 11.397 ( -5.143 2.342 -2.274) 6.092 11.590 ( -5.915 0.745 3.353) 6.840 11.767 ( 2.194 -2.598 -7.237) 7.996 11.970 ( 1.527 12.628 3.029) 13.076 12.119 ( 0.439 0.609 -0.590) 0.955 12.539 ( -2.951 0.191 -2.341) 3.772 12.982 ( 5.381 -8.058 -0.534) 9.705 13.360 ( 7.875 -12.757 1.734) 15.092 13.464 ( -2.786 -0.204 -4.313) 5.139 13.719 ( 1.430 -11.605 -0.490) 11.703 13.822 ( 1.349 8.182 3.123) 8.861 14.019 ( 2.520 -3.394 0.524) 4.260 14.362 ( 0.699 -2.902 1.503) 3.342 14.717 ( -7.032 5.433 -7.655) 11.729 15.733 ( 6.314 -11.008 2.245) 12.888 16.218 ( 15.376 2.227 13.544) 20.611 16.284 ( -1.129 -5.299 -2.449) 5.946 16.996 ( -3.629 -3.584 -17.480) 18.209 17.114 ( -10.318 8.753 9.177) 16.349 18.103 ( -4.381 8.212 10.319) 13.897 18.486 ( -4.102 10.793 4.626) 12.439 18.790 ( 3.069 0.158 -14.923) 15.236 19.319 ( -10.230 16.672 1.498) 19.618 19.491 ( 6.141 -0.921 -1.360) 6.357 19.827 ( -16.998 13.490 0.006) 21.701 20.959 ( 3.523 -7.593 8.068) 11.626 21.007 ( 9.772 -1.060 -1.175) 9.899 21.257 ( 0.231 -7.373 10.018) 12.441 21.681 ( -3.183 -2.415 -0.925) 4.101 21.825 ( 4.768 -3.532 -8.447) 10.322 22.511 ( 7.424 -13.221 -1.497) 15.237 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.629 ( 0.225 9.609 6.249) 11.464 2.204 ( -6.326 5.992 -1.288) 8.808 2.448 ( -0.167 13.141 -3.433) 13.583 2.626 ( 2.265 7.813 6.060) 10.144 3.019 ( -8.092 -6.360 -10.901) 14.991 3.228 ( 5.722 -6.452 -2.096) 8.875 3.270 ( 1.359 -0.376 4.894) 5.093 3.304 ( -3.502 -7.564 -1.460) 8.462 3.572 ( 5.579 5.508 -1.986) 8.087 3.663 ( -2.714 11.950 0.864) 12.285 4.036 ( -3.841 0.194 -1.707) 4.207 4.126 ( 1.457 -1.977 -2.987) 3.867 4.206 ( 5.449 2.424 3.579) 6.955 4.390 ( -1.739 -4.547 2.119) 5.309 4.583 ( -2.174 2.182 1.630) 3.485 4.598 ( -2.271 3.187 8.907) 9.728 4.677 ( 2.238 5.120 -4.221) 7.003 4.855 ( -8.721 3.728 8.369) 12.649 4.875 ( 0.148 6.227 -4.910) 7.931 5.038 ( 1.083 -10.260 0.618) 10.335 5.226 ( 0.434 -1.218 -7.334) 7.447 5.426 ( 2.089 4.334 2.094) 5.247 5.654 ( 0.122 -1.058 -3.420) 3.582 5.979 ( 2.421 -4.210 1.633) 5.124 6.138 ( 2.147 -9.618 1.044) 9.910 6.198 ( -3.348 -0.597 2.197) 4.049 6.467 ( 2.060 2.681 -4.574) 5.688 6.943 ( -6.450 -6.987 -3.641) 10.183 7.432 ( 6.334 9.750 0.184) 11.628 7.933 ( 2.419 0.433 1.052) 2.673 8.085 ( 0.995 2.073 0.798) 2.434 8.268 ( -2.716 3.993 -4.686) 6.729 8.622 ( 10.248 2.394 3.048) 10.956 8.805 ( 3.567 -2.839 -1.694) 4.864 8.844 ( -5.087 2.838 -6.500) 8.728 9.068 ( 2.563 -3.466 0.812) 4.387 9.170 ( 1.324 -10.347 0.960) 10.475 9.378 ( -8.262 -1.119 7.243) 11.044 9.553 ( -0.964 -6.452 3.073) 7.211 10.046 ( -6.191 4.625 2.086) 8.004 10.086 ( 4.495 -0.191 -2.720) 5.257 10.344 ( -1.643 1.345 -1.488) 2.593 10.601 ( 2.554 -3.752 2.392) 5.131 10.887 ( -4.393 -2.690 -1.779) 5.450 11.347 ( -1.902 0.557 1.784) 2.667 11.626 ( 2.371 7.037 1.687) 7.615 11.761 ( 4.254 -2.986 -4.067) 6.600 12.148 ( -2.398 6.927 -0.242) 7.335 12.161 ( 2.856 11.780 0.628) 12.138 12.446 ( -3.070 -4.209 -2.336) 5.709 12.899 ( 1.043 -14.699 -3.629) 15.176 13.326 ( 3.730 -11.731 1.972) 12.466 13.456 ( 0.031 3.209 0.935) 3.343 13.661 ( 2.152 -5.113 -0.405) 5.562 13.986 ( 3.457 6.302 4.696) 8.586 14.021 ( 1.770 -4.421 -0.310) 4.773 14.329 ( 0.274 -4.825 -0.040) 4.833 14.622 ( -5.878 5.100 -0.992) 7.845 15.743 ( 3.490 -7.288 -0.151) 8.082 16.198 ( 1.054 -5.909 -2.202) 6.393 16.494 ( 1.653 0.139 3.652) 4.011 16.797 ( -0.871 -4.025 -0.517) 4.150 17.171 ( 2.978 11.973 -7.747) 14.568 17.948 ( -15.852 -0.259 6.851) 17.271 18.433 ( -5.933 0.079 -3.825) 7.059 19.055 ( 14.164 12.620 4.288) 19.449 19.302 ( -8.160 11.367 -2.216) 14.166 19.505 ( -5.278 7.101 -2.213) 9.120 19.908 ( 5.886 13.891 2.729) 15.332 20.866 ( -9.829 -4.809 6.561) 12.759 21.072 ( 5.492 -11.384 -11.222) 16.902 21.176 ( -0.734 -7.840 6.455) 10.182 21.605 ( 3.313 -6.799 -5.322) 9.248 21.919 ( 2.897 4.853 4.506) 7.228 22.480 ( 4.137 -11.784 0.028) 12.489 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.819 ( 5.652 12.732 0.257) 13.932 2.104 ( -7.310 0.147 2.916) 7.871 2.588 ( 2.725 9.647 -2.309) 10.287 2.694 ( -5.516 0.240 0.724) 5.569 2.799 ( -3.239 0.457 -6.839) 7.581 3.142 ( -3.414 -11.963 3.746) 12.993 3.271 ( 7.697 -5.602 -7.358) 12.032 3.353 ( 4.331 1.753 4.211) 6.290 3.705 ( 0.352 6.788 -1.957) 7.074 3.764 ( 2.190 11.053 0.274) 11.272 3.963 ( -0.803 -1.587 -6.000) 6.258 4.140 ( 2.553 -1.241 -1.906) 3.419 4.260 ( 0.418 -8.908 3.368) 9.533 4.388 ( 0.649 -2.193 3.930) 4.547 4.479 ( -9.636 0.924 9.323) 13.439 4.614 ( 2.312 -0.573 0.544) 2.443 4.699 ( 3.176 -0.477 -4.858) 5.824 4.872 ( -5.319 4.028 4.583) 8.094 4.938 ( 0.046 0.466 0.092) 0.477 5.015 ( 5.032 6.710 5.909) 10.260 5.142 ( -4.235 1.094 -11.613) 12.409 5.439 ( -2.921 2.997 -3.599) 5.520 5.699 ( 2.245 2.790 1.489) 3.878 6.000 ( 4.533 -6.099 5.437) 9.344 6.065 ( 0.408 -9.860 -1.850) 10.041 6.164 ( -1.848 1.320 3.409) 4.096 6.489 ( 0.122 2.071 -5.639) 6.009 6.814 ( 0.659 -4.644 -3.338) 5.757 7.581 ( -1.598 11.137 -3.357) 11.742 7.959 ( 2.242 1.057 -1.916) 3.133 8.138 ( 0.988 -5.608 4.562) 7.296 8.286 ( 3.481 3.244 -7.429) 8.822 8.715 ( -4.354 1.955 2.511) 5.393 8.814 ( -0.442 -3.705 -0.747) 3.805 8.901 ( -3.474 -13.755 -2.738) 14.449 8.956 ( 8.604 7.603 11.253) 16.077 9.024 ( -11.839 6.968 2.338) 13.934 9.372 ( 1.101 -1.193 6.330) 6.535 9.591 ( 8.228 -2.400 1.497) 8.701 10.013 ( -1.753 1.459 2.143) 3.129 10.140 ( 2.769 -1.051 -1.128) 3.169 10.254 ( -5.225 -1.711 -7.978) 9.689 10.568 ( -2.705 -1.847 1.593) 3.642 10.836 ( 2.020 -0.956 -4.205) 4.762 11.358 ( 1.376 -0.751 5.101) 5.336 11.695 ( 1.597 -2.176 -1.065) 2.902 11.863 ( 5.078 3.263 -2.060) 6.378 12.125 ( -9.327 11.672 -0.027) 14.941 12.268 ( -0.817 8.660 -3.663) 9.439 12.355 ( 0.221 -10.847 3.913) 11.533 12.803 ( 4.614 -8.382 -2.470) 9.882 13.296 ( 0.768 -5.766 -0.084) 5.817 13.498 ( 0.323 2.086 5.525) 5.914 13.665 ( 1.212 1.423 -0.757) 2.016 13.969 ( -1.854 -5.893 2.171) 6.548 14.058 ( -2.562 3.102 0.605) 4.068 14.301 ( 1.834 -3.880 -0.507) 4.321 14.661 ( 3.410 5.219 5.899) 8.583 15.677 ( -2.124 -4.815 -3.066) 6.091 16.220 ( 5.531 -3.317 1.316) 6.583 16.255 ( -15.021 -3.589 -15.578) 21.936 16.883 ( 3.569 1.477 9.867) 10.596 17.459 ( 19.119 9.099 -8.951) 22.988 17.707 ( -11.111 0.691 1.737) 11.267 18.330 ( -1.778 -6.771 2.222) 7.345 19.197 ( -10.947 5.618 -3.075) 12.683 19.360 ( 6.202 8.178 2.118) 10.480 19.587 ( 0.318 10.178 3.936) 10.917 20.120 ( 4.577 2.853 2.105) 5.790 20.670 ( -6.362 -3.287 1.648) 7.348 20.910 ( -1.388 -10.546 -8.873) 13.852 21.185 ( 4.974 -2.275 -4.457) 7.056 21.589 ( 3.208 -5.431 -3.503) 7.215 21.999 ( -3.129 3.645 9.811) 10.924 22.432 ( 0.090 -4.600 1.002) 4.709 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.001 ( -3.649 3.836 6.091) 8.071 2.067 ( 8.577 4.907 -4.402) 10.818 2.475 ( -9.574 -4.719 0.019) 10.674 2.743 ( 5.700 3.433 -4.438) 7.998 2.844 ( 3.885 3.646 -0.810) 5.389 2.979 ( -2.483 -11.985 4.425) 13.015 3.306 ( 6.190 -4.788 -10.477) 13.077 3.450 ( 0.493 3.203 5.723) 6.576 3.678 ( -5.554 1.279 -4.450) 7.231 3.911 ( 0.663 2.077 2.024) 2.975 3.979 ( 7.157 4.445 -4.294) 9.456 4.123 ( -6.498 -3.452 1.292) 7.470 4.169 ( 1.404 -8.079 1.597) 8.354 4.274 ( 0.790 -5.291 1.989) 5.708 4.435 ( -4.841 -0.723 1.499) 5.119 4.712 ( 5.597 -7.022 -3.635) 9.688 4.749 ( 5.104 3.447 3.720) 7.195 4.801 ( -5.654 3.624 4.900) 8.313 4.860 ( -4.459 -6.275 -3.182) 8.330 5.150 ( 2.495 14.981 -11.345) 18.957 5.238 ( 5.593 6.388 10.798) 13.736 5.412 ( -4.222 5.934 1.533) 7.442 5.731 ( -0.532 -0.280 0.198) 0.633 5.935 ( -3.264 -6.599 -6.617) 9.899 6.065 ( 6.525 -6.720 6.668) 11.497 6.175 ( -1.422 3.082 3.784) 5.083 6.465 ( -1.717 0.979 -6.330) 6.631 6.849 ( 7.056 0.249 -2.749) 7.577 7.542 ( -9.441 2.774 -2.038) 10.049 8.043 ( -0.307 -13.219 1.543) 13.312 8.066 ( 5.602 6.662 -1.050) 8.768 8.312 ( -1.572 0.984 -3.451) 3.918 8.587 ( -2.516 -3.147 -4.977) 6.404 8.725 ( -9.050 6.055 -0.926) 10.928 8.834 ( 0.026 -2.752 1.845) 3.314 9.003 ( -0.366 9.801 5.367) 11.180 9.150 ( -3.808 -1.454 8.315) 9.261 9.401 ( 2.947 4.160 8.467) 9.883 9.760 ( 9.625 -3.136 6.345) 11.947 10.045 ( 6.817 -4.928 -1.715) 8.585 10.076 ( -8.339 -1.310 -7.060) 11.004 10.161 ( 1.140 2.482 -2.742) 3.870 10.553 ( -0.394 3.535 0.714) 3.628 10.861 ( 3.979 -1.344 -6.502) 7.740 11.412 ( 2.662 -2.172 8.106) 8.804 11.637 ( -2.144 -4.356 -7.831) 9.214 11.823 ( -5.151 -3.875 1.552) 6.630 12.177 ( -4.985 8.792 1.371) 10.200 12.289 ( -0.970 7.072 3.916) 8.142 12.322 ( 7.595 -6.520 -6.082) 11.713 12.829 ( 3.634 -3.149 0.074) 4.809 13.214 ( -6.886 3.811 0.995) 7.933 13.550 ( -1.476 0.617 6.067) 6.275 13.723 ( 2.385 2.270 -0.181) 3.298 13.863 ( -3.814 -6.388 1.694) 7.630 13.995 ( -5.392 3.510 -3.922) 7.535 14.301 ( 1.734 -3.120 1.116) 3.740 14.870 ( 8.311 7.340 10.929) 15.569 15.567 ( -6.389 -4.730 -0.615) 7.973 15.925 ( -4.359 -2.493 -21.082) 21.672 16.290 ( 2.014 0.335 -0.757) 2.178 16.979 ( 0.605 -2.142 15.948) 16.103 17.519 ( -5.508 4.912 -10.508) 12.840 17.951 ( 23.700 5.442 -9.144) 25.979 18.255 ( 1.195 -9.061 8.501) 12.482 19.041 ( -6.690 -3.755 1.653) 7.848 19.496 ( 0.148 4.616 -2.833) 5.418 19.622 ( -3.854 4.842 4.985) 7.947 20.118 ( -1.117 -8.944 2.341) 9.313 20.639 ( 5.181 -4.589 -1.653) 7.115 20.809 ( -0.557 1.026 -5.500) 5.623 21.249 ( 4.800 2.530 -10.999) 12.265 21.573 ( 0.441 -2.986 2.495) 3.916 21.961 ( -6.850 0.086 8.497) 10.914 22.408 ( -4.013 5.410 1.886) 6.995 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.228 ( -0.000 0.000 29.130) 29.130 1.228 ( -0.000 0.000 29.130) 29.130 2.250 ( -0.000 0.000 55.737) 55.737 2.289 ( 0.000 -0.000 -20.328) 20.328 2.289 ( 0.000 -0.000 -20.328) 20.328 3.162 ( -0.000 0.000 3.378) 3.378 3.162 ( -0.000 0.000 3.378) 3.378 3.261 ( -0.000 0.000 1.268) 1.268 3.573 ( 0.000 -0.000 -2.314) 2.314 3.573 ( 0.000 -0.000 -2.314) 2.314 3.660 ( 0.000 -0.000 -5.620) 5.620 3.778 ( 0.000 -0.000 -2.198) 2.198 3.778 ( 0.000 -0.000 -2.198) 2.198 4.270 ( 0.000 -0.000 -25.553) 25.553 4.336 ( 0.000 -0.000 -12.993) 12.993 4.723 ( -0.000 0.000 2.237) 2.237 4.916 ( -0.000 0.000 7.841) 7.841 4.916 ( -0.000 0.000 7.841) 7.841 5.238 ( 0.000 -0.000 -3.491) 3.491 5.238 ( 0.000 -0.000 -3.491) 3.491 5.480 ( -0.000 0.000 5.029) 5.029 5.480 ( -0.000 0.000 5.029) 5.029 5.896 ( 0.000 -0.000 -5.113) 5.113 5.896 ( 0.000 -0.000 -5.113) 5.113 5.995 ( 0.000 -0.000 -0.386) 0.386 6.073 ( 0.000 -0.000 -4.548) 4.548 6.647 ( 0.000 -0.000 -0.364) 0.364 6.807 ( -0.000 0.000 5.655) 5.655 7.891 ( 0.000 -0.000 -6.228) 6.228 7.891 ( 0.000 -0.000 -6.228) 6.228 7.964 ( -0.000 0.000 9.782) 9.782 8.515 ( -0.000 0.000 3.254) 3.254 8.515 ( -0.000 0.000 3.254) 3.254 8.706 ( 0.000 -0.000 -4.337) 4.337 9.054 ( 0.000 0.000 0.123) 0.123 9.054 ( -0.000 0.000 0.123) 0.123 9.336 ( -0.000 0.000 5.917) 5.917 9.336 ( -0.000 0.000 5.917) 5.917 9.505 ( -0.000 0.000 4.187) 4.187 10.077 ( -0.000 0.000 5.662) 5.662 10.077 ( -0.000 0.000 5.662) 5.662 10.662 ( 0.000 -0.000 -14.881) 14.881 11.072 ( 0.000 -0.000 -7.630) 7.630 11.072 ( 0.000 -0.000 -7.630) 7.630 11.212 ( 0.000 -0.000 -3.451) 3.451 11.212 ( 0.000 -0.000 -3.451) 3.451 11.717 ( 0.000 -0.000 -1.956) 1.956 11.863 ( -0.000 0.000 1.653) 1.653 11.863 ( -0.000 0.000 1.653) 1.653 12.512 ( -0.000 0.000 21.100) 21.100 13.125 ( 0.000 -0.000 -2.115) 2.115 13.458 ( 0.000 -0.000 -5.144) 5.144 13.602 ( -0.000 0.000 1.960) 1.960 13.602 ( -0.000 0.000 1.960) 1.960 14.265 ( -0.000 0.000 0.900) 0.900 14.525 ( 0.000 -0.000 -3.933) 3.933 14.693 ( -0.000 0.000 0.814) 0.814 14.693 ( -0.000 0.000 0.814) 0.814 15.611 ( 0.000 -0.000 -0.667) 0.667 17.102 ( -0.000 0.000 3.456) 3.456 17.102 ( -0.000 0.000 3.456) 3.456 17.388 ( 0.000 -0.000 -6.033) 6.033 17.388 ( 0.000 -0.000 -6.033) 6.033 17.538 ( -0.000 0.000 1.377) 1.377 17.710 ( -0.000 0.000 0.331) 0.331 18.158 ( 0.000 -0.000 -0.524) 0.524 18.158 ( 0.000 -0.000 -0.524) 0.524 18.416 ( -0.000 0.000 0.874) 0.874 18.416 ( -0.000 0.000 0.874) 0.874 21.581 ( -0.000 0.000 1.698) 1.698 21.581 ( -0.000 0.000 1.698) 1.698 21.804 ( 0.000 -0.000 -0.744) 0.744 21.944 ( 0.000 -0.000 -1.047) 1.047 21.944 ( 0.000 -0.000 -1.047) 1.047 23.618 ( -0.000 0.000 0.698) 0.698 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.325 ( -3.305 7.832 28.066) 29.325 1.490 ( 12.104 0.214 22.789) 25.805 2.066 ( -1.332 -8.006 -17.630) 19.409 2.303 ( 3.864 8.889 -18.518) 20.901 2.769 ( 18.133 11.170 42.393) 47.442 3.145 ( -1.329 -1.755 2.786) 3.551 3.216 ( 3.231 0.931 2.251) 4.046 3.285 ( 0.911 0.401 2.193) 2.409 3.390 ( -6.718 -4.434 0.572) 8.070 3.596 ( -0.587 -1.132 -6.845) 6.962 3.708 ( 0.635 7.685 3.426) 8.438 3.739 ( 5.512 -6.118 -1.043) 8.301 3.922 ( 6.273 7.726 -6.470) 11.871 4.224 ( 8.972 4.590 -38.491) 39.789 4.311 ( -1.207 -0.032 -0.110) 1.213 4.693 ( -2.731 -2.354 1.126) 3.778 4.896 ( -3.843 -0.386 7.709) 8.623 4.954 ( -0.656 -3.076 8.969) 9.504 5.130 ( -6.860 -2.209 -6.721) 9.855 5.227 ( -0.090 -1.049 -5.710) 5.807 5.361 ( -5.564 -1.418 10.908) 12.327 5.598 ( 1.486 0.437 -2.409) 2.864 5.845 ( -4.748 0.636 -3.521) 5.945 5.884 ( 5.129 -3.041 -1.552) 6.162 6.040 ( 3.077 2.850 0.780) 4.266 6.152 ( 6.287 3.905 -4.054) 8.439 6.668 ( 1.011 0.676 0.672) 1.390 6.724 ( -6.391 -3.957 4.135) 8.579 7.816 ( -1.246 0.527 0.354) 1.398 7.962 ( 1.532 -2.556 -7.360) 7.940 7.979 ( -2.015 2.202 5.302) 6.084 8.346 ( -9.061 -10.193 -3.922) 14.191 8.511 ( -1.784 3.792 4.683) 6.284 8.671 ( 3.230 -1.695 -1.923) 4.124 9.006 ( -1.039 -5.834 0.250) 5.931 9.165 ( 1.454 -9.107 3.813) 9.980 9.224 ( -3.040 11.515 -2.469) 12.163 9.464 ( 5.293 6.464 2.904) 8.845 9.715 ( 10.401 1.263 5.545) 11.854 9.998 ( -8.337 -2.901 5.314) 10.304 10.138 ( 2.703 0.737 4.034) 4.911 10.466 ( -10.570 -1.694 -10.763) 15.180 11.049 ( -0.358 -4.469 -4.248) 6.176 11.098 ( -1.088 -0.223 -5.508) 5.619 11.163 ( 3.144 2.049 -3.194) 4.928 11.242 ( 2.823 3.168 -4.916) 6.495 11.675 ( -1.992 1.203 -1.222) 2.628 11.837 ( -0.699 -2.907 1.736) 3.457 11.965 ( 4.804 3.819 0.906) 6.203 12.605 ( 1.628 -2.642 16.153) 16.449 13.149 ( 3.049 1.447 -3.361) 4.763 13.340 ( -4.364 0.300 -1.224) 4.542 13.595 ( -1.254 -1.260 0.507) 1.849 13.774 ( 7.228 5.245 0.472) 8.943 14.277 ( -0.855 0.835 1.644) 2.033 14.418 ( -6.626 -4.971 -3.829) 9.126 14.522 ( -8.981 -8.832 -1.657) 12.704 14.636 ( -4.581 -2.403 0.706) 5.221 15.765 ( 10.628 5.174 0.132) 11.821 16.761 ( -15.975 -8.563 5.401) 18.912 16.872 ( -17.400 -7.992 -1.416) 19.200 17.135 ( -19.065 -10.433 6.423) 22.662 17.477 ( 3.320 -17.398 -4.182) 18.199 17.531 ( -5.164 21.151 -3.209) 22.007 17.849 ( 16.799 12.380 -0.015) 20.868 18.214 ( 8.344 -0.025 1.154) 8.424 18.463 ( 23.566 -1.907 -1.849) 23.715 18.548 ( 6.910 16.335 -1.286) 17.783 18.869 ( 27.572 14.169 -0.897) 31.013 21.458 ( -10.061 -4.559 1.112) 11.102 21.604 ( -15.606 0.738 10.980) 19.096 21.617 ( -0.017 -2.098 -2.916) 3.593 21.847 ( -6.423 -4.101 0.795) 7.662 21.980 ( 3.335 -3.362 -3.710) 6.016 23.450 ( -13.088 -7.616 -0.102) 15.143 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.465 ( -1.256 7.311 17.513) 19.019 1.804 ( 11.191 3.867 7.284) 13.901 2.011 ( 9.928 -0.265 -9.978) 14.078 2.429 ( 7.196 9.455 -14.549) 18.784 3.077 ( -4.019 -5.047 5.763) 8.652 3.247 ( 0.690 3.975 8.402) 9.321 3.253 ( -1.471 0.204 8.037) 8.173 3.370 ( 5.922 2.205 -1.328) 6.457 3.410 ( 13.494 2.458 16.326) 21.323 3.528 ( -0.788 -1.492 -6.343) 6.564 3.795 ( 6.339 -2.706 5.604) 8.883 3.870 ( 6.319 9.263 9.390) 14.626 4.081 ( 5.322 7.519 -6.868) 11.490 4.292 ( 1.444 1.052 -5.440) 5.726 4.347 ( 13.020 7.204 -31.169) 34.538 4.597 ( -3.818 -4.270 -0.815) 5.786 4.828 ( -6.579 -0.688 5.942) 8.892 4.870 ( -8.302 -4.883 0.925) 9.676 4.958 ( -3.694 -3.841 -0.595) 5.362 5.230 ( 2.406 -0.622 -0.705) 2.584 5.299 ( -6.533 0.810 9.320) 11.410 5.534 ( -4.717 -2.531 -8.442) 9.996 5.736 ( -3.180 -3.309 -1.426) 4.806 5.987 ( 4.927 2.178 2.160) 5.804 6.131 ( 3.357 0.190 1.565) 3.709 6.281 ( 4.986 3.720 -2.621) 6.751 6.521 ( -9.431 -5.850 4.228) 11.877 6.777 ( 6.210 3.666 -0.906) 7.268 7.693 ( -15.923 -9.975 1.446) 18.845 7.851 ( 0.259 3.827 3.542) 5.221 8.038 ( 2.367 3.848 1.094) 4.648 8.231 ( 6.319 -6.159 -10.483) 13.703 8.571 ( 1.378 2.661 3.841) 4.872 8.697 ( 4.020 -1.466 -2.666) 5.042 8.915 ( -3.113 -2.835 -1.374) 4.429 9.091 ( -3.100 -0.328 0.521) 3.160 9.329 ( 3.984 3.925 -3.158) 6.423 9.541 ( -3.539 0.361 -0.601) 3.607 9.776 ( -6.997 -9.735 8.153) 14.498 9.898 ( 3.838 0.390 3.096) 4.947 10.204 ( -0.268 3.536 -0.352) 3.563 10.257 ( -7.703 1.228 -1.837) 8.014 10.904 ( -7.989 -4.012 -4.642) 10.073 10.988 ( -3.513 -4.689 -3.669) 6.913 11.294 ( 5.695 1.069 -0.117) 5.796 11.374 ( 10.117 5.264 -2.627) 11.703 11.694 ( 1.619 4.097 0.313) 4.416 11.809 ( -1.079 1.089 -0.339) 1.570 12.077 ( 4.109 1.017 1.702) 4.563 12.621 ( -0.191 -6.479 7.749) 10.102 13.199 ( -1.469 -0.994 0.305) 1.800 13.299 ( 0.725 2.481 -2.775) 3.792 13.563 ( -1.689 0.545 -1.701) 2.458 13.859 ( -4.010 1.690 3.379) 5.509 14.138 ( -9.462 -8.332 -1.424) 12.687 14.197 ( -7.448 -1.948 1.090) 7.775 14.455 ( 5.071 -1.383 -6.076) 8.034 14.523 ( -2.791 -3.898 -1.195) 4.941 15.923 ( 0.667 -1.843 3.530) 4.038 16.509 ( -9.558 -3.522 7.389) 12.584 16.529 ( -12.593 -5.165 -0.030) 13.611 16.817 ( -11.041 3.003 2.000) 11.615 17.319 ( 6.013 -19.837 -5.563) 21.461 17.623 ( -6.103 18.196 -2.236) 19.322 18.322 ( 21.480 6.889 -2.101) 22.656 18.420 ( 7.462 5.305 11.485) 14.688 18.748 ( 14.928 6.703 -4.089) 16.867 18.988 ( 20.137 12.223 -5.618) 24.217 19.448 ( 23.731 9.246 0.903) 25.484 21.170 ( -16.494 -3.324 2.887) 17.071 21.380 ( -13.904 -2.311 10.898) 17.816 21.521 ( -7.314 -5.002 -7.033) 11.312 21.729 ( -3.064 -2.541 7.740) 8.704 21.962 ( 1.659 -3.705 -6.718) 7.849 23.073 ( -17.263 -10.074 -2.330) 20.123 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.599 ( 7.203 3.360 2.324) 8.281 2.002 ( 4.944 8.127 -0.646) 9.535 2.292 ( 15.588 5.101 3.592) 16.790 2.593 ( 6.313 7.799 -9.368) 13.727 2.929 ( -9.505 -4.204 6.389) 12.200 3.255 ( -1.547 -1.684 11.160) 11.392 3.319 ( 2.680 0.229 -0.563) 2.748 3.395 ( -3.128 -4.751 -5.418) 7.856 3.523 ( 7.626 5.499 -1.948) 9.602 3.620 ( 5.486 -1.915 -0.161) 5.813 3.915 ( 2.262 1.723 8.605) 9.063 4.158 ( 0.448 1.289 -3.739) 3.981 4.249 ( 12.416 5.141 6.960) 15.133 4.388 ( 12.104 5.305 7.342) 15.118 4.456 ( -1.600 -2.085 -5.172) 5.802 4.559 ( 0.083 8.982 -12.768) 15.611 4.669 ( -3.946 -2.510 -7.572) 8.900 4.742 ( -1.801 3.711 -1.615) 4.429 4.893 ( 0.928 -5.137 2.012) 5.595 5.160 ( -7.160 -4.946 5.337) 10.208 5.297 ( -6.765 -4.676 -3.355) 8.882 5.350 ( -2.292 4.152 2.470) 5.347 5.682 ( 0.625 -2.242 -1.175) 2.607 6.075 ( 2.229 -1.056 -0.458) 2.509 6.151 ( 0.047 -0.184 -0.970) 0.989 6.277 ( -8.389 -5.079 -0.078) 9.807 6.412 ( 2.042 1.773 3.728) 4.605 6.896 ( 0.226 -0.386 3.376) 3.405 7.427 ( -2.423 -0.767 -0.229) 2.552 7.910 ( 0.546 3.267 2.951) 4.436 8.148 ( 3.713 3.520 1.627) 5.369 8.240 ( 6.074 -8.716 -5.036) 11.757 8.639 ( 0.825 5.805 2.366) 6.323 8.791 ( 7.204 -0.562 -0.359) 7.235 8.860 ( 1.239 0.165 -6.253) 6.377 9.023 ( -6.099 3.130 -1.504) 7.018 9.280 ( -19.050 -1.018 -2.320) 19.218 9.404 ( 1.362 -2.653 -2.985) 4.219 9.647 ( 1.365 -9.873 2.114) 10.188 9.966 ( 1.847 0.447 3.497) 3.979 10.156 ( -0.751 -0.167 -2.043) 2.183 10.257 ( -2.802 3.913 5.436) 7.260 10.694 ( -8.923 -1.873 -4.329) 10.093 10.878 ( -2.436 -3.604 -0.883) 4.439 11.364 ( 2.869 -2.229 0.472) 3.664 11.610 ( 11.211 1.906 -2.609) 11.668 11.793 ( 3.121 0.959 0.067) 3.266 11.873 ( 3.646 12.257 2.987) 13.132 12.144 ( 2.781 0.896 0.584) 2.980 12.546 ( -2.908 -6.829 0.838) 7.470 13.019 ( -11.542 -6.311 2.937) 13.479 13.401 ( 4.201 2.682 -0.963) 5.076 13.484 ( -4.205 -3.935 -3.628) 6.806 13.720 ( -8.157 -0.462 0.249) 8.174 14.023 ( 0.565 -1.106 -0.991) 1.589 14.082 ( -4.913 -0.596 -1.384) 5.139 14.387 ( -4.497 -3.273 2.675) 6.172 14.572 ( 7.799 -0.645 -8.056) 11.231 15.811 ( -7.786 -4.379 4.029) 9.799 16.316 ( -9.451 0.550 4.198) 10.356 16.349 ( -9.547 -2.626 9.676) 13.844 16.835 ( 4.254 5.615 -8.270) 10.864 17.292 ( 13.658 -16.689 1.984) 21.656 17.679 ( -5.526 15.007 -2.498) 16.186 18.435 ( 1.285 -7.636 2.123) 8.029 18.864 ( 13.132 21.617 5.520) 25.889 19.097 ( 16.517 6.512 -3.163) 18.034 19.366 ( 14.762 5.203 -5.837) 16.705 19.888 ( 17.420 5.368 1.012) 18.256 20.869 ( -13.576 -3.633 -2.445) 14.264 21.143 ( -14.513 -4.016 10.939) 18.612 21.296 ( -7.239 -5.738 -1.146) 9.308 21.686 ( -3.068 -5.212 7.911) 9.958 21.947 ( 2.872 2.125 -10.239) 10.844 22.678 ( -14.569 -8.386 -2.367) 16.976 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.409 ( 5.419 -0.824 26.402) 26.965 1.628 ( -2.354 12.582 20.428) 24.107 2.008 ( -9.007 -5.444 -19.240) 21.930 2.183 ( 7.249 5.568 -17.427) 19.679 2.937 ( 0.772 16.985 37.792) 41.441 3.199 ( -1.850 2.254 2.835) 4.067 3.213 ( 0.687 3.360 3.647) 5.006 3.290 ( -0.148 2.261 2.420) 3.315 3.490 ( -5.965 -3.215 1.582) 6.958 3.503 ( 5.161 -2.628 -3.488) 6.761 3.612 ( 0.145 -3.227 -1.976) 3.787 3.784 ( -0.922 4.600 0.936) 4.784 3.912 ( 2.149 10.149 -7.805) 12.982 4.071 ( -0.694 11.278 -35.410) 37.169 4.301 ( 0.460 -3.130 0.563) 3.213 4.693 ( -0.396 -4.275 1.123) 4.438 4.905 ( 0.207 -5.967 8.428) 10.329 5.027 ( -1.479 1.018 6.771) 7.005 5.118 ( 2.274 -4.539 -5.610) 7.566 5.182 ( -0.861 -2.439 -6.985) 7.448 5.416 ( 1.008 -4.014 9.961) 10.787 5.590 ( -0.317 -0.012 -4.591) 4.602 5.771 ( 0.341 -4.083 -0.069) 4.098 5.934 ( -3.252 3.806 -3.141) 5.910 6.044 ( 2.323 4.658 0.297) 5.213 6.130 ( -0.266 7.279 -2.801) 7.804 6.671 ( 0.078 3.155 -0.925) 3.289 6.738 ( -0.200 -9.450 4.370) 10.414 7.844 ( 1.474 1.593 -0.440) 2.214 7.905 ( -1.166 1.368 -4.124) 4.499 8.032 ( 0.277 0.520 1.251) 1.383 8.285 ( -1.479 -17.804 1.141) 17.902 8.566 ( 3.352 0.056 0.863) 3.461 8.650 ( -3.885 2.026 -1.358) 4.587 9.009 ( -1.992 -4.538 1.299) 5.123 9.146 ( -9.421 -2.064 3.148) 10.145 9.244 ( 10.792 0.680 -2.184) 11.031 9.451 ( 1.125 5.564 3.731) 6.793 9.749 ( -2.820 11.152 3.630) 12.062 10.054 ( 3.134 -6.097 1.976) 7.135 10.124 ( -2.757 0.894 4.366) 5.240 10.434 ( 3.210 -8.352 -8.966) 12.667 10.997 ( -2.071 -2.649 -2.334) 4.093 11.070 ( 0.360 -3.763 -2.313) 4.432 11.190 ( -1.843 5.852 -4.177) 7.422 11.218 ( 2.350 4.086 -3.884) 6.108 11.668 ( 1.155 -1.152 -0.711) 1.780 11.847 ( -1.450 -2.904 0.968) 3.387 11.961 ( 0.580 6.443 1.118) 6.565 12.682 ( -2.053 0.565 12.663) 12.841 13.132 ( -0.038 3.636 -4.489) 5.777 13.333 ( 1.876 -3.766 -0.557) 4.244 13.569 ( -0.651 -3.675 2.285) 4.376 13.796 ( 0.547 9.890 -0.518) 9.919 14.288 ( 0.884 1.566 1.146) 2.132 14.407 ( -1.072 -7.134 -3.810) 8.158 14.497 ( -1.572 -17.462 0.805) 17.551 14.643 ( 0.017 -4.634 0.033) 4.634 15.775 ( -0.485 13.625 -0.799) 13.657 16.793 ( -0.726 -17.491 3.852) 17.925 16.852 ( 1.524 -20.045 -1.263) 20.142 17.177 ( -3.066 -18.874 4.431) 19.628 17.427 ( 10.631 -7.230 -2.512) 13.100 17.541 ( -3.030 5.866 -2.166) 6.949 17.828 ( 0.005 18.471 0.789) 18.488 18.267 ( -7.012 12.225 -2.749) 14.358 18.434 ( 9.458 21.021 0.192) 23.052 18.529 ( -7.525 9.052 0.107) 11.772 18.873 ( 0.183 31.759 -0.981) 31.775 21.501 ( 1.909 -13.444 -0.987) 13.615 21.527 ( 0.399 -4.934 4.039) 6.389 21.670 ( 3.895 -7.404 4.476) 9.488 21.879 ( -0.287 -4.294 1.961) 4.729 21.949 ( -3.925 -0.438 -5.064) 6.422 23.450 ( -0.038 -15.534 -0.029) 15.534 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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 ( 0.017 6.652 10.582) 12.499 1.704 ( 2.396 -2.966 6.126) 7.216 1.877 ( 3.921 12.196 -3.449) 13.267 2.309 ( 7.695 7.403 -14.675) 18.149 3.157 ( -3.079 0.121 4.834) 5.733 3.217 ( 4.864 -0.615 5.384) 7.282 3.302 ( 0.336 3.049 2.862) 4.195 3.363 ( 1.319 0.471 0.991) 1.715 3.426 ( -3.014 6.722 12.872) 14.831 3.507 ( -0.655 0.569 -1.713) 1.920 3.705 ( 9.242 7.059 14.775) 18.803 3.893 ( 4.416 6.279 5.231) 9.290 4.039 ( 5.275 9.500 -10.338) 14.999 4.115 ( 7.118 13.705 -31.133) 34.753 4.270 ( -0.581 -2.140 -1.844) 2.883 4.609 ( -3.467 -6.216 1.540) 7.283 4.835 ( -2.784 -9.437 5.538) 11.291 4.955 ( -2.342 -5.682 -2.788) 6.748 5.086 ( -7.073 3.980 3.521) 8.847 5.142 ( 3.019 -3.144 -4.354) 6.161 5.400 ( -2.342 -3.614 7.400) 8.562 5.519 ( -1.535 -3.177 -8.810) 9.490 5.742 ( -1.657 -3.223 -0.206) 3.630 5.951 ( 2.437 2.256 3.907) 5.127 6.127 ( 0.814 5.562 -0.696) 5.664 6.236 ( 4.177 5.699 -1.641) 7.254 6.593 ( -5.578 -10.061 3.184) 11.936 6.741 ( 3.379 6.590 -1.199) 7.502 7.792 ( -6.748 -11.888 2.467) 13.890 7.915 ( 0.325 3.283 -1.330) 3.557 8.013 ( 0.822 -0.590 -7.743) 7.809 8.115 ( -2.585 -2.146 5.115) 6.119 8.593 ( 1.947 -3.463 4.503) 6.005 8.634 ( -0.815 4.477 -1.261) 4.722 8.958 ( -6.459 -3.290 2.044) 7.531 9.014 ( 5.137 -6.107 3.678) 8.787 9.344 ( 0.195 2.372 -5.273) 5.785 9.584 ( 4.166 4.001 -0.357) 5.787 9.809 ( -2.387 0.831 8.605) 8.968 9.952 ( -6.473 -2.926 -0.336) 7.112 10.148 ( 5.173 -1.457 -0.228) 5.379 10.351 ( -3.594 -2.205 -8.375) 9.376 10.906 ( -2.484 -8.337 -0.113) 8.700 11.006 ( -2.218 -2.199 -0.744) 3.211 11.239 ( 1.550 3.696 -1.729) 4.365 11.309 ( 3.765 7.691 -1.248) 8.654 11.704 ( 2.580 3.542 -2.874) 5.241 11.819 ( 0.633 -1.892 1.797) 2.685 12.038 ( 1.473 3.584 1.158) 4.044 12.646 ( -4.899 -4.071 9.046) 11.063 13.185 ( 2.187 3.735 -1.191) 4.489 13.314 ( -0.702 -1.936 -2.234) 3.038 13.571 ( 2.611 0.612 -0.361) 2.706 13.876 ( 0.727 0.437 -0.088) 0.853 14.204 ( -9.919 -16.950 1.808) 19.722 14.252 ( -4.265 -8.765 -2.116) 9.975 14.364 ( 2.522 6.289 1.041) 6.856 14.559 ( -3.217 -5.206 0.453) 6.137 15.934 ( 2.274 7.290 1.131) 7.719 16.565 ( -6.634 -11.805 2.561) 13.782 16.613 ( -5.560 -11.422 0.480) 12.712 16.982 ( 1.815 -18.105 -3.258) 18.486 17.179 ( -17.461 1.487 -1.295) 17.572 17.828 ( 14.069 4.550 -6.872) 16.306 18.047 ( 3.642 15.735 1.842) 16.255 18.435 ( 6.986 14.655 5.604) 17.175 18.568 ( 6.757 11.937 0.715) 13.735 18.953 ( 16.253 21.137 -1.467) 26.703 19.222 ( 8.084 18.912 2.082) 20.672 21.315 ( -5.789 -10.615 -1.487) 12.182 21.513 ( -0.069 -4.513 -0.622) 4.557 21.546 ( -8.560 -9.739 -5.240) 13.986 21.793 ( -2.800 -5.082 7.886) 9.790 21.882 ( -1.385 -2.592 -0.657) 3.011 23.174 ( -10.127 -17.591 -0.857) 20.316 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.557 ( -1.327 2.987 -10.481) 10.979 2.002 ( 10.342 5.724 8.361) 14.478 2.130 ( 8.949 13.138 4.148) 16.428 2.474 ( 8.997 5.347 -10.055) 14.513 3.108 ( -7.266 1.633 9.347) 11.951 3.245 ( 2.831 -5.601 5.144) 8.115 3.350 ( -3.286 1.731 -0.955) 3.835 3.390 ( -1.797 -0.283 -5.273) 5.578 3.434 ( 6.052 4.685 -1.352) 7.772 3.527 ( 2.117 -1.960 5.412) 6.132 3.972 ( 0.574 7.654 7.508) 10.737 4.110 ( 8.564 3.237 -3.887) 9.947 4.182 ( -1.801 2.463 0.455) 3.085 4.288 ( 10.784 11.015 1.013) 15.449 4.362 ( 14.659 14.390 -14.179) 24.960 4.493 ( -3.159 -4.635 2.008) 5.957 4.692 ( -3.772 -8.009 1.303) 8.948 4.862 ( -1.040 -5.179 0.219) 5.287 4.964 ( -11.653 5.433 -1.068) 12.902 5.154 ( 2.190 -5.613 0.995) 6.106 5.330 ( -3.039 -5.716 -0.027) 6.474 5.412 ( -2.880 -1.257 -4.814) 5.749 5.679 ( -2.352 -1.670 2.856) 4.059 6.020 ( 1.880 -2.126 2.539) 3.808 6.175 ( -0.585 4.895 -1.865) 5.271 6.321 ( -0.921 -1.781 0.060) 2.006 6.419 ( -2.484 -4.526 2.821) 5.883 6.912 ( 4.879 9.597 1.278) 10.842 7.475 ( -9.553 -12.173 -0.229) 15.475 7.936 ( 1.224 -1.521 -1.251) 2.319 8.033 ( 3.540 1.042 -5.557) 6.671 8.165 ( 1.418 4.665 7.288) 8.768 8.603 ( 3.663 -5.527 -0.880) 6.689 8.712 ( 1.879 6.327 6.829) 9.497 8.859 ( -1.519 -3.374 -0.531) 3.738 9.069 ( 2.928 -2.618 3.273) 5.113 9.327 ( 0.832 -3.331 -4.103) 5.350 9.531 ( -9.501 -2.360 -4.481) 10.767 9.695 ( -9.451 0.724 3.791) 10.208 9.959 ( 2.307 3.858 2.546) 5.166 10.171 ( -4.456 -4.422 -5.900) 8.615 10.265 ( 4.854 0.700 -0.875) 4.982 10.747 ( -4.874 -7.894 -2.615) 9.639 10.945 ( -4.539 1.795 0.189) 4.884 11.305 ( 2.930 0.674 2.839) 4.135 11.474 ( 6.290 6.205 -2.003) 9.060 11.772 ( 1.316 2.007 -0.804) 2.531 11.885 ( 6.648 4.317 1.707) 8.109 12.097 ( 2.372 1.330 0.333) 2.739 12.538 ( -4.081 -5.723 5.311) 8.810 13.141 ( -6.695 -6.448 1.735) 9.456 13.349 ( 4.339 4.460 -0.713) 6.263 13.561 ( -7.628 -0.673 -3.670) 8.492 13.859 ( -5.341 -4.071 1.478) 6.876 13.895 ( 1.200 -11.259 -1.658) 11.444 14.115 ( -2.586 -5.258 -1.050) 5.953 14.440 ( -4.133 -4.089 -0.557) 5.841 14.498 ( 2.586 7.701 2.125) 8.397 15.909 ( -6.166 -5.080 2.882) 8.493 16.347 ( -6.749 -7.741 1.860) 10.437 16.519 ( 0.945 -3.387 -3.551) 4.997 16.907 ( -1.120 -10.052 7.465) 12.571 16.969 ( -1.075 7.290 -7.716) 10.669 17.953 ( -5.570 15.877 -7.913) 18.594 18.301 ( 10.561 3.133 3.523) 11.565 18.765 ( 16.204 3.052 3.824) 16.927 18.932 ( 12.725 18.818 2.428) 22.846 19.330 ( 1.819 21.618 -1.204) 21.728 19.577 ( 19.800 1.096 2.817) 20.029 21.077 ( -11.714 -1.674 -8.475) 14.554 21.260 ( -6.479 -12.365 -0.666) 13.975 21.397 ( -7.984 -3.709 -2.598) 9.179 21.717 ( -3.329 -7.001 7.578) 10.841 21.859 ( 2.254 -1.519 -0.516) 2.766 22.796 ( -12.403 -14.597 -0.845) 19.173 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.458 ( -0.955 -3.389 24.543) 24.794 1.826 ( -0.436 11.311 -0.525) 11.331 2.022 ( -3.617 5.700 -15.131) 16.568 2.208 ( -7.268 7.309 -3.241) 10.806 3.177 ( -4.990 1.048 4.213) 6.614 3.219 ( 4.699 3.261 2.853) 6.392 3.324 ( -0.051 1.433 -0.166) 1.443 3.345 ( 3.013 0.193 6.821) 7.459 3.410 ( -6.469 4.632 4.486) 9.133 3.541 ( 0.995 2.943 0.403) 3.132 3.734 ( -10.977 5.615 15.771) 20.019 3.884 ( -4.793 6.403 1.036) 8.066 3.969 ( -1.091 8.163 -6.291) 10.363 4.144 ( -6.611 14.193 -28.658) 32.656 4.259 ( -0.175 -3.044 -0.105) 3.051 4.626 ( 2.417 -5.293 -1.170) 5.936 4.843 ( 3.473 -7.541 5.235) 9.815 4.956 ( 6.200 -4.899 -4.996) 9.348 5.072 ( 1.856 2.067 5.857) 6.482 5.137 ( -1.987 -4.785 -2.586) 5.791 5.372 ( 4.141 -3.523 9.539) 10.980 5.528 ( 1.528 -3.700 -8.106) 9.041 5.745 ( 0.040 -2.983 -0.321) 3.001 5.993 ( 1.030 4.652 -2.487) 5.375 6.105 ( -5.522 2.973 2.114) 6.618 6.238 ( -2.664 6.851 -1.822) 7.574 6.600 ( 5.608 -9.413 2.186) 11.172 6.739 ( -3.480 6.230 -0.858) 7.187 7.802 ( 4.594 -10.226 0.971) 11.252 7.890 ( 8.816 -2.293 3.546) 9.775 7.962 ( -4.701 0.449 -0.142) 4.725 8.192 ( -3.438 -0.681 -7.409) 8.196 8.590 ( 0.141 3.396 0.401) 3.422 8.678 ( -1.394 1.026 -3.899) 4.266 8.981 ( 1.446 -8.816 -1.309) 9.030 9.051 ( 5.707 2.926 -2.292) 6.810 9.297 ( -3.316 1.258 1.906) 4.026 9.553 ( -3.191 2.571 4.213) 5.877 9.894 ( -1.369 4.371 -2.777) 5.356 9.921 ( 2.325 -7.585 4.135) 8.946 10.144 ( 3.574 0.718 -1.067) 3.798 10.267 ( 2.309 -5.987 4.811) 8.020 10.923 ( 4.049 -8.443 -2.736) 9.755 11.026 ( 0.224 -2.736 -3.876) 4.750 11.231 ( -2.643 5.507 -0.705) 6.149 11.316 ( -4.447 7.140 -2.174) 8.688 11.670 ( -1.236 2.590 2.348) 3.708 11.836 ( 1.473 -0.413 -0.665) 1.668 12.042 ( -2.757 3.898 0.351) 4.787 12.698 ( 1.856 -4.114 1.195) 4.669 13.190 ( -2.621 4.541 -2.257) 5.709 13.286 ( 1.329 -1.279 2.036) 2.747 13.561 ( -0.877 -0.668 1.203) 1.631 13.861 ( 1.652 0.809 2.408) 3.030 14.221 ( 7.903 -15.447 -1.352) 17.403 14.223 ( 5.447 -6.042 2.047) 8.388 14.416 ( -4.676 1.745 -6.210) 7.967 14.568 ( 2.574 -4.029 -1.330) 4.963 15.954 ( -3.741 8.048 -2.141) 9.130 16.565 ( 7.002 -12.228 2.508) 14.312 16.580 ( 8.433 -13.366 6.531) 17.101 16.952 ( 15.267 -6.842 1.293) 16.780 17.186 ( -8.608 -13.807 -3.040) 16.552 17.757 ( 2.380 11.271 4.174) 12.253 18.049 ( -11.330 11.213 1.898) 16.053 18.506 ( -5.696 18.866 -5.262) 20.397 18.582 ( -9.640 9.614 -1.746) 13.726 18.945 ( -12.137 23.128 -0.270) 26.120 19.259 ( -12.236 19.517 -3.735) 23.336 21.247 ( 7.747 -14.722 9.387) 19.102 21.436 ( 5.084 -10.928 9.211) 15.169 21.551 ( 3.475 -4.535 -4.712) 7.405 21.798 ( 5.044 -3.484 4.272) 7.473 21.956 ( -1.027 -1.855 -8.697) 8.952 23.176 ( 10.093 -17.550 -1.064) 20.273 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.554 ( 5.960 -2.447 9.072) 11.127 1.855 ( -9.133 6.976 -11.261) 16.090 2.000 ( 3.984 14.694 0.364) 15.229 2.296 ( -0.320 11.928 2.867) 12.272 3.121 ( -0.398 -3.611 -1.440) 3.907 3.289 ( -2.831 2.704 1.216) 4.100 3.324 ( 0.573 -2.482 -1.582) 2.998 3.351 ( -0.390 4.965 0.928) 5.066 3.450 ( 4.111 -2.612 0.706) 4.921 3.562 ( -1.221 3.385 -2.566) 4.419 3.853 ( 0.525 14.277 12.479) 18.969 3.910 ( 1.357 11.243 15.983) 19.588 4.054 ( -0.416 10.556 -7.138) 12.749 4.109 ( -1.760 13.751 -18.965) 23.492 4.260 ( 1.139 1.402 0.617) 1.909 4.587 ( 0.049 -6.335 0.783) 6.383 4.808 ( -1.612 -9.975 7.027) 12.307 4.900 ( -3.170 -7.955 -4.747) 9.791 5.004 ( 3.841 -4.774 -4.939) 7.870 5.213 ( 1.327 4.471 2.010) 5.079 5.406 ( -3.045 -6.449 2.435) 7.536 5.442 ( 2.113 -5.027 -3.776) 6.632 5.723 ( 0.543 -2.950 0.604) 3.060 6.003 ( -2.895 4.277 -0.254) 5.171 6.132 ( 3.453 2.218 1.211) 4.279 6.275 ( -1.009 7.384 -1.664) 7.636 6.542 ( -0.387 -11.082 0.871) 11.123 6.780 ( 0.224 8.631 -1.341) 8.737 7.697 ( -0.081 -18.673 0.583) 18.682 7.904 ( -1.976 1.610 -3.805) 4.580 8.028 ( 2.536 4.547 2.286) 5.686 8.157 ( 1.740 2.365 0.746) 3.030 8.596 ( -2.934 1.661 0.396) 3.394 8.678 ( 1.343 3.056 -0.891) 3.455 8.909 ( 0.137 -5.095 0.277) 5.104 9.089 ( -6.621 -3.258 1.256) 7.485 9.305 ( 2.808 3.357 0.006) 4.376 9.515 ( 0.455 -3.559 3.794) 5.222 9.846 ( 3.018 -10.910 -1.718) 11.450 9.937 ( 1.157 4.573 -3.537) 5.896 10.153 ( -4.960 -1.969 4.167) 6.771 10.288 ( 3.043 -0.547 -3.634) 4.771 10.854 ( -1.052 -9.660 2.591) 10.056 10.973 ( 0.883 -4.620 -1.375) 4.901 11.294 ( 0.536 6.232 -0.248) 6.260 11.362 ( 0.631 10.272 -0.543) 10.306 11.694 ( 0.219 3.859 0.341) 3.881 11.803 ( -2.629 -0.482 0.361) 2.697 12.088 ( 0.585 4.655 -0.092) 4.692 12.678 ( 1.180 -5.188 -0.479) 5.342 13.203 ( -0.282 1.605 -0.780) 1.806 13.284 ( -0.282 -0.138 -0.234) 0.392 13.530 ( -0.152 -1.909 3.358) 3.866 13.891 ( -2.157 -1.817 -1.192) 3.061 14.117 ( 0.956 -15.664 1.996) 15.820 14.215 ( -0.899 -7.759 -1.711) 7.996 14.395 ( 2.058 6.200 2.089) 6.858 14.526 ( -0.187 -6.327 -0.715) 6.370 15.966 ( 0.208 1.822 -3.487) 3.940 16.513 ( 1.245 -13.137 1.927) 13.335 16.556 ( -1.676 -6.048 0.889) 6.339 16.835 ( -6.741 -13.455 -0.826) 15.072 17.295 ( 18.523 -2.414 -2.306) 18.822 17.607 ( -12.262 2.721 0.584) 12.574 18.269 ( 4.971 18.240 5.999) 19.835 18.551 ( -5.155 15.343 -8.565) 18.313 18.711 ( -0.021 14.676 1.342) 14.737 18.932 ( -0.256 22.602 2.889) 22.787 19.461 ( 0.584 25.734 -1.178) 25.768 21.170 ( 1.221 -17.888 3.253) 18.223 21.441 ( 2.854 -7.611 4.386) 9.236 21.488 ( -1.544 -10.824 -5.619) 12.293 21.835 ( -4.544 -1.768 -5.455) 7.317 21.865 ( 2.984 -3.822 5.413) 7.267 23.060 ( -0.012 -20.685 -0.351) 20.688 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.584 ( -1.483 5.275 -16.628) 17.508 1.903 ( 6.297 6.438 9.311) 12.953 2.229 ( 4.057 14.803 1.390) 15.412 2.407 ( 0.335 8.802 0.718) 8.838 3.082 ( 4.796 -9.600 0.652) 10.751 3.259 ( -3.252 1.826 -0.575) 3.773 3.336 ( 2.677 1.746 -4.240) 5.310 3.432 ( 0.656 6.793 -0.932) 6.888 3.453 ( -0.861 -1.018 2.223) 2.592 3.561 ( -3.150 2.486 6.261) 7.437 3.981 ( 6.095 1.025 -5.013) 7.958 4.089 ( -1.613 6.900 -0.137) 7.087 4.212 ( 7.823 18.401 -18.589) 27.301 4.287 ( -4.243 6.657 -3.002) 8.445 4.318 ( 7.139 13.541 21.679) 26.538 4.510 ( -1.347 -4.312 4.217) 6.180 4.663 ( -2.396 -9.265 5.143) 10.864 4.800 ( 0.545 -6.689 -2.091) 7.029 5.026 ( 5.320 -3.936 -2.229) 6.984 5.181 ( -9.524 1.113 -5.416) 11.012 5.285 ( 0.239 -4.216 -3.224) 5.313 5.395 ( -1.121 -8.110 1.762) 8.375 5.705 ( -0.334 -1.431 1.920) 2.418 6.020 ( -0.951 2.426 2.475) 3.594 6.208 ( 2.567 1.358 0.687) 2.984 6.316 ( -0.684 0.250 -0.796) 1.079 6.409 ( -2.297 -6.350 -0.151) 6.754 6.918 ( 5.756 9.808 -2.058) 11.557 7.468 ( -5.823 -15.368 0.627) 16.446 7.875 ( -0.463 0.416 -4.613) 4.655 8.080 ( -1.175 6.090 -1.217) 6.321 8.265 ( -0.390 7.137 7.374) 10.270 8.552 ( -2.278 -2.941 3.187) 4.899 8.765 ( 2.283 6.593 1.963) 7.248 8.843 ( -2.352 -5.246 0.841) 5.810 8.996 ( 1.594 -2.504 5.412) 6.172 9.284 ( -3.038 -7.362 0.596) 7.987 9.506 ( 1.998 -7.298 -2.715) 8.039 9.868 ( 4.632 -3.677 5.947) 8.387 9.936 ( -2.557 5.714 -6.848) 9.278 10.145 ( 3.983 2.896 -1.453) 5.135 10.209 ( -5.634 -4.536 -7.372) 10.328 10.719 ( -3.536 -10.296 1.838) 11.040 10.970 ( 2.515 -2.379 0.280) 3.473 11.344 ( -1.460 5.303 3.045) 6.287 11.519 ( 1.374 13.645 0.791) 13.737 11.751 ( 0.939 -1.592 3.401) 3.871 11.791 ( 4.010 3.514 -4.530) 6.996 12.123 ( -0.927 2.781 0.291) 2.946 12.599 ( -4.301 -4.482 2.742) 6.790 13.126 ( -1.685 -9.792 -0.947) 9.981 13.345 ( 2.130 6.219 1.133) 6.670 13.613 ( 8.982 1.608 -0.918) 9.170 13.694 ( -8.381 -13.369 -1.419) 15.843 13.986 ( -7.463 -6.281 3.224) 10.273 14.097 ( -2.535 -4.990 -1.376) 5.763 14.440 ( -1.620 -4.584 -2.122) 5.304 14.557 ( 3.859 7.134 7.699) 11.183 15.921 ( -1.349 -8.961 0.416) 9.071 16.345 ( -3.108 -12.478 -12.377) 17.848 16.413 ( -4.878 -6.042 -1.232) 7.862 16.779 ( 6.744 2.083 8.229) 10.841 17.263 ( -15.344 6.528 -2.441) 16.852 17.793 ( 23.038 1.237 -5.494) 23.716 18.450 ( -11.071 18.726 -7.109) 22.886 18.615 ( 10.260 0.585 13.004) 16.574 18.952 ( 6.982 21.389 -1.069) 22.525 19.326 ( 13.769 13.588 3.227) 19.612 19.643 ( -6.794 20.409 2.645) 21.672 21.041 ( 3.243 -11.786 -5.282) 13.317 21.230 ( -7.434 -13.363 -10.443) 18.517 21.399 ( -0.419 -7.128 -1.310) 7.259 21.736 ( -2.908 -0.975 -3.387) 4.569 21.871 ( -2.291 -3.955 11.778) 12.634 22.797 ( -6.473 -18.077 0.802) 19.217 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.552 ( -0.000 0.000 19.803) 19.803 1.552 ( -0.000 0.000 19.803) 19.803 2.039 ( 0.000 -0.000 -16.847) 16.847 2.039 ( 0.000 -0.000 -16.847) 16.847 2.896 ( -0.000 0.000 43.431) 43.431 3.190 ( -0.000 0.000 1.109) 1.109 3.190 ( -0.000 0.000 1.109) 1.109 3.260 ( 0.000 -0.000 -3.492) 3.492 3.552 ( 0.000 -0.000 -0.858) 0.858 3.552 ( 0.000 -0.000 -0.858) 0.858 3.608 ( 0.000 -0.000 -1.501) 1.501 3.757 ( 0.000 -0.000 -0.890) 0.890 3.757 ( 0.000 -0.000 -0.890) 0.890 3.779 ( 0.000 -0.000 -35.297) 35.297 4.341 ( -0.000 0.000 1.063) 1.063 4.743 ( -0.000 0.000 0.859) 0.859 5.027 ( -0.000 0.000 9.196) 9.196 5.027 ( -0.000 0.000 9.196) 9.196 5.155 ( 0.000 -0.000 -8.325) 8.325 5.155 ( 0.000 -0.000 -8.325) 8.325 5.546 ( -0.000 0.000 3.738) 3.738 5.546 ( -0.000 0.000 3.738) 3.738 5.841 ( 0.000 -0.000 -2.939) 2.939 5.841 ( 0.000 -0.000 -2.939) 2.939 5.990 ( 0.000 -0.000 -0.278) 0.278 6.033 ( 0.000 -0.000 -1.743) 1.743 6.641 ( 0.000 -0.000 -0.293) 0.293 6.858 ( -0.000 0.000 2.146) 2.146 7.836 ( 0.000 -0.000 -2.281) 2.281 7.836 ( 0.000 -0.000 -2.281) 2.281 8.053 ( -0.000 0.000 3.860) 3.860 8.542 ( -0.000 0.000 1.056) 1.056 8.542 ( -0.000 0.000 1.056) 1.056 8.670 ( 0.000 -0.000 -1.405) 1.405 9.057 ( -0.000 0.000 0.234) 0.234 9.057 ( -0.000 0.000 0.234) 0.234 9.390 ( -0.000 0.000 2.356) 2.356 9.390 ( -0.000 0.000 2.356) 2.356 9.542 ( -0.000 0.000 1.540) 1.540 10.129 ( -0.000 0.000 2.254) 2.254 10.129 ( -0.000 0.000 2.254) 2.254 10.529 ( 0.000 -0.000 -5.705) 5.705 11.001 ( 0.000 -0.000 -3.112) 3.112 11.001 ( 0.000 -0.000 -3.112) 3.112 11.180 ( 0.000 -0.000 -1.360) 1.360 11.180 ( 0.000 -0.000 -1.360) 1.360 11.699 ( 0.000 -0.000 -0.824) 0.824 11.877 ( -0.000 0.000 0.571) 0.571 11.877 ( -0.000 0.000 0.571) 0.571 12.733 ( -0.000 0.000 11.869) 11.869 13.071 ( 0.000 -0.000 -5.054) 5.054 13.414 ( 0.000 -0.000 -1.660) 1.660 13.620 ( -0.000 0.000 0.795) 0.795 13.620 ( -0.000 0.000 0.795) 0.795 14.272 ( -0.000 0.000 0.317) 0.317 14.488 ( 0.000 -0.000 -1.619) 1.619 14.700 ( -0.000 0.000 0.322) 0.322 14.700 ( -0.000 0.000 0.322) 0.322 15.605 ( 0.000 -0.000 -0.265) 0.265 17.142 ( -0.000 0.000 2.353) 2.353 17.142 ( -0.000 0.000 2.353) 2.353 17.324 ( 0.000 -0.000 -3.392) 3.392 17.324 ( 0.000 -0.000 -3.392) 3.392 17.551 ( -0.000 0.000 0.539) 0.539 17.713 ( -0.000 0.000 0.127) 0.127 18.154 ( 0.000 -0.000 -0.150) 0.150 18.154 ( 0.000 -0.000 -0.150) 0.150 18.423 ( -0.000 0.000 0.275) 0.275 18.423 ( -0.000 0.000 0.275) 0.275 21.597 ( -0.000 0.000 0.738) 0.738 21.597 ( -0.000 0.000 0.738) 0.738 21.798 ( 0.000 -0.000 -0.268) 0.268 21.934 ( 0.000 -0.000 -0.474) 0.474 21.934 ( 0.000 -0.000 -0.474) 0.474 23.624 ( -0.000 0.000 0.257) 0.257 ======================= 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 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.645 ( 0.767 0.928 15.038) 15.086 1.677 ( 3.002 5.258 0.919) 6.124 1.864 ( -1.357 -7.419 -4.500) 8.783 2.091 ( 6.809 6.875 -9.862) 13.816 3.159 ( 0.152 -0.055 -0.304) 0.345 3.225 ( 3.598 1.489 -0.091) 3.895 3.247 ( 6.272 5.042 16.677) 18.517 3.305 ( 7.941 3.833 1.903) 9.021 3.424 ( -6.612 -2.180 8.751) 11.183 3.523 ( -0.830 -3.822 -3.970) 5.573 3.700 ( 3.849 4.171 -19.136) 19.960 3.737 ( 9.326 5.679 -1.397) 11.008 3.801 ( 4.558 1.478 1.825) 5.127 3.890 ( 7.515 4.838 -3.399) 9.562 4.309 ( -2.524 -1.402 -0.468) 2.925 4.701 ( -3.580 -2.202 0.010) 4.203 4.995 ( -4.324 -3.043 5.703) 7.777 5.024 ( -5.551 -1.560 -6.760) 8.885 5.067 ( -2.775 -2.317 7.629) 8.443 5.155 ( 2.096 0.869 -5.492) 5.942 5.494 ( -4.211 -1.407 9.676) 10.646 5.531 ( -2.038 -1.921 -7.740) 8.231 5.799 ( -2.621 -1.792 -3.482) 4.713 5.895 ( 4.484 2.674 2.630) 5.845 6.045 ( 4.478 2.152 0.137) 4.970 6.119 ( 6.096 3.886 -1.049) 7.305 6.665 ( 2.324 1.374 -0.084) 2.701 6.761 ( -7.842 -4.583 0.719) 9.111 7.843 ( 1.138 1.573 3.766) 4.237 7.872 ( 2.534 0.593 -4.607) 5.292 8.040 ( -2.681 -1.427 1.845) 3.553 8.306 ( -14.095 -8.919 -2.391) 16.850 8.559 ( 0.743 1.787 2.511) 3.171 8.648 ( 0.865 -0.698 -1.347) 1.746 9.014 ( -2.916 -3.453 0.450) 4.542 9.186 ( -2.515 8.816 -3.112) 9.681 9.211 ( 0.625 -8.443 3.144) 9.031 9.481 ( 5.089 3.515 -0.547) 6.210 9.765 ( 9.944 5.054 1.590) 11.268 10.049 ( -6.836 -4.612 2.555) 8.633 10.158 ( 1.198 1.709 -0.806) 2.237 10.385 ( -7.674 -3.919 -1.478) 8.743 11.001 ( -1.531 -1.581 -2.690) 3.476 11.056 ( -0.373 -0.153 -0.700) 0.808 11.155 ( 2.339 1.392 1.426) 3.073 11.202 ( 3.948 2.497 -1.282) 4.844 11.665 ( -1.029 -0.141 -0.310) 1.084 11.851 ( -1.952 -1.668 0.401) 2.599 11.969 ( 5.465 3.464 -0.171) 6.472 12.747 ( -1.622 -1.779 4.108) 4.761 13.103 ( 3.899 2.332 -1.725) 4.860 13.332 ( -3.115 -1.266 -0.237) 3.370 13.591 ( -2.396 -1.339 -1.119) 2.964 13.786 ( 8.473 5.025 1.084) 9.911 14.293 ( 1.360 1.251 0.596) 1.942 14.385 ( -7.266 -4.488 -0.692) 8.569 14.508 ( -13.592 -8.655 -0.890) 16.138 14.642 ( -4.334 -2.396 0.214) 4.957 15.768 ( 11.143 6.256 0.371) 12.785 16.819 ( -15.581 -9.133 3.488) 18.395 16.839 ( -15.585 -8.708 -3.047) 18.111 17.191 ( -19.169 -7.608 2.003) 20.721 17.428 ( -2.066 -13.328 -2.507) 13.718 17.521 ( 2.536 10.730 0.724) 11.050 17.842 ( 17.124 11.147 -1.067) 20.461 18.235 ( 8.560 6.375 2.166) 10.891 18.443 ( 22.958 0.047 -1.219) 22.991 18.535 ( 4.360 13.575 -0.750) 14.278 18.866 ( 27.410 14.729 0.255) 31.117 21.477 ( -9.958 -5.085 1.854) 11.334 21.577 ( -2.092 -1.932 -3.510) 4.520 21.687 ( -9.464 -4.103 2.243) 10.556 21.880 ( -4.339 -0.787 4.266) 6.136 21.927 ( 0.580 -2.230 -4.139) 4.737 23.450 ( -13.750 -7.948 0.001) 15.882 =================== 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 10.0 968.287 968.287 2169.342 0.000 -0.000 0.000 3/54675 20.0 196.761 196.761 289.780 0.000 -0.000 0.000 3/54675 30.0 76.115 76.115 108.872 0.000 -0.000 0.000 3/54675 40.0 41.500 41.500 59.683 0.000 -0.000 0.000 3/54675 50.0 27.033 27.033 39.078 0.000 -0.000 0.000 3/54675 60.0 19.486 19.486 28.263 0.000 -0.000 0.000 3/54675 70.0 14.973 14.973 21.767 0.000 -0.000 0.000 3/54675 80.0 12.027 12.027 17.507 0.000 -0.000 0.000 3/54675 90.0 9.983 9.983 14.539 0.000 -0.000 0.000 3/54675 100.0 8.498 8.498 12.376 0.000 -0.000 0.000 3/54675 110.0 7.381 7.381 10.743 0.000 -0.000 0.000 3/54675 120.0 6.517 6.517 9.474 0.000 -0.000 0.000 3/54675 130.0 5.832 5.832 8.466 0.000 -0.000 0.000 3/54675 140.0 5.278 5.278 7.649 0.000 -0.000 0.000 3/54675 150.0 4.822 4.822 6.974 0.000 -0.000 0.000 3/54675 160.0 4.442 4.442 6.410 0.000 -0.000 0.000 3/54675 170.0 4.120 4.120 5.931 0.000 -0.000 0.000 3/54675 180.0 3.844 3.844 5.520 0.000 -0.000 0.000 3/54675 190.0 3.605 3.605 5.164 0.000 -0.000 0.000 3/54675 200.0 3.396 3.396 4.853 0.000 -0.000 0.000 3/54675 210.0 3.212 3.212 4.578 0.000 -0.000 0.000 3/54675 220.0 3.048 3.048 4.334 0.000 -0.000 0.000 3/54675 230.0 2.902 2.902 4.116 0.000 -0.000 0.000 3/54675 240.0 2.770 2.770 3.920 0.000 -0.000 0.000 3/54675 250.0 2.651 2.651 3.742 0.000 -0.000 0.000 3/54675 260.0 2.542 2.542 3.581 0.000 -0.000 0.000 3/54675 270.0 2.443 2.443 3.433 0.000 -0.000 0.000 3/54675 280.0 2.351 2.351 3.298 0.000 -0.000 0.000 3/54675 290.0 2.267 2.267 3.174 0.000 -0.000 0.000 3/54675 300.0 2.189 2.189 3.059 0.000 -0.000 0.000 3/54675 310.0 2.116 2.116 2.952 0.000 -0.000 0.000 3/54675 320.0 2.049 2.049 2.853 0.000 -0.000 0.000 3/54675 330.0 1.985 1.985 2.760 0.000 -0.000 0.000 3/54675 340.0 1.926 1.926 2.674 0.000 -0.000 0.000 3/54675 350.0 1.870 1.870 2.593 0.000 -0.000 0.000 3/54675 360.0 1.818 1.818 2.517 0.000 -0.000 0.000 3/54675 370.0 1.769 1.769 2.445 0.000 -0.000 0.000 3/54675 380.0 1.722 1.722 2.378 0.000 -0.000 0.000 3/54675 390.0 1.678 1.678 2.314 0.000 -0.000 0.000 3/54675 400.0 1.636 1.636 2.253 0.000 -0.000 0.000 3/54675 410.0 1.596 1.596 2.196 0.000 -0.000 0.000 3/54675 420.0 1.558 1.558 2.142 0.000 -0.000 0.000 3/54675 430.0 1.522 1.522 2.090 0.000 -0.000 0.000 3/54675 440.0 1.488 1.488 2.041 0.000 -0.000 0.000 3/54675 450.0 1.455 1.455 1.994 0.000 -0.000 0.000 3/54675 460.0 1.423 1.423 1.950 0.000 -0.000 0.000 3/54675 470.0 1.393 1.393 1.907 0.000 -0.000 0.000 3/54675 480.0 1.365 1.365 1.866 0.000 -0.000 0.000 3/54675 490.0 1.337 1.337 1.827 0.000 -0.000 0.000 3/54675 500.0 1.311 1.311 1.790 0.000 -0.000 0.000 3/54675 510.0 1.285 1.285 1.754 0.000 -0.000 0.000 3/54675 520.0 1.261 1.261 1.719 0.000 -0.000 0.000 3/54675 530.0 1.237 1.237 1.686 0.000 -0.000 0.000 3/54675 540.0 1.214 1.214 1.654 0.000 -0.000 0.000 3/54675 550.0 1.193 1.193 1.624 0.000 -0.000 0.000 3/54675 560.0 1.171 1.171 1.594 0.000 -0.000 0.000 3/54675 570.0 1.151 1.151 1.566 0.000 -0.000 0.000 3/54675 580.0 1.131 1.131 1.538 0.000 -0.000 0.000 3/54675 590.0 1.112 1.112 1.512 0.000 -0.000 0.000 3/54675 600.0 1.094 1.094 1.486 0.000 -0.000 0.000 3/54675 610.0 1.076 1.076 1.462 0.000 -0.000 0.000 3/54675 620.0 1.059 1.059 1.438 0.000 -0.000 0.000 3/54675 630.0 1.043 1.043 1.415 0.000 -0.000 0.000 3/54675 640.0 1.026 1.026 1.392 0.000 -0.000 0.000 3/54675 650.0 1.011 1.011 1.370 0.000 -0.000 0.000 3/54675 660.0 0.996 0.996 1.349 0.000 -0.000 0.000 3/54675 670.0 0.981 0.981 1.329 0.000 -0.000 0.000 3/54675 680.0 0.967 0.967 1.309 0.000 -0.000 0.000 3/54675 690.0 0.953 0.953 1.290 0.000 -0.000 0.000 3/54675 700.0 0.939 0.939 1.271 0.000 -0.000 0.000 3/54675 710.0 0.926 0.926 1.253 0.000 -0.000 0.000 3/54675 720.0 0.913 0.913 1.236 0.000 -0.000 0.000 3/54675 730.0 0.901 0.901 1.219 0.000 -0.000 0.000 3/54675 740.0 0.889 0.889 1.202 0.000 -0.000 0.000 3/54675 750.0 0.877 0.877 1.186 0.000 -0.000 0.000 3/54675 760.0 0.866 0.866 1.170 0.000 -0.000 0.000 3/54675 770.0 0.855 0.855 1.155 0.000 -0.000 0.000 3/54675 780.0 0.844 0.844 1.140 0.000 -0.000 0.000 3/54675 790.0 0.833 0.833 1.125 0.000 -0.000 0.000 3/54675 800.0 0.823 0.823 1.111 0.000 -0.000 0.000 3/54675 810.0 0.813 0.813 1.097 0.000 -0.000 0.000 3/54675 820.0 0.803 0.803 1.084 0.000 -0.000 0.000 3/54675 830.0 0.793 0.793 1.071 0.000 -0.000 0.000 3/54675 840.0 0.784 0.784 1.058 0.000 -0.000 0.000 3/54675 850.0 0.775 0.775 1.045 0.000 -0.000 0.000 3/54675 860.0 0.766 0.766 1.033 0.000 -0.000 0.000 3/54675 870.0 0.757 0.757 1.021 0.000 -0.000 0.000 3/54675 880.0 0.749 0.749 1.010 0.000 -0.000 0.000 3/54675 890.0 0.740 0.740 0.998 0.000 -0.000 0.000 3/54675 900.0 0.732 0.732 0.987 0.000 -0.000 0.000 3/54675 910.0 0.724 0.724 0.976 0.000 -0.000 0.000 3/54675 920.0 0.716 0.716 0.965 0.000 -0.000 0.000 3/54675 930.0 0.709 0.709 0.955 0.000 -0.000 0.000 3/54675 940.0 0.701 0.701 0.945 0.000 -0.000 0.000 3/54675 950.0 0.694 0.694 0.935 0.000 -0.000 0.000 3/54675 960.0 0.687 0.687 0.925 0.000 -0.000 0.000 3/54675 970.0 0.680 0.680 0.915 0.000 -0.000 0.000 3/54675 980.0 0.673 0.673 0.906 0.000 -0.000 0.000 3/54675 990.0 0.666 0.666 0.897 0.000 -0.000 0.000 3/54675 1000.0 0.659 0.659 0.888 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 00:11:39]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|