----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-09 00:52:49]------------------------- 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 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.211833855000049 -3.340074534999999 0.000000000000000 b 7.211833855000049 3.340074534999999 0.000000000000000 c -5.516518205932991 0.000000000000000 8.740119996362409 Atomic positions (fractional): *1 Dy 0.76896576264757 0.51105655709735 0.33326741349933 162.500 *2 Dy 0.21980135947240 0.70821666026798 0.03703348698930 162.500 3 Dy 0.29178333973202 0.78019864052760 0.46296651301070 162.500 4 Dy 0.51105655709735 0.76896576264757 0.83326741349933 162.500 5 Dy 0.48894344290265 0.23103423735243 0.16673258650067 162.500 6 Dy 0.70821666026798 0.21980135947241 0.53703348698930 162.500 7 Dy 0.78019864052760 0.29178333973202 0.96296651301070 162.500 8 Dy 0.23103423735243 0.48894344290265 0.66673258650067 162.500 *9 Si 0.90955750638568 0.72681782354550 0.19052590521591 28.085 10 Si 0.72681782354550 0.90955750638568 0.69052590521591 28.085 11 Si 0.27318217645450 0.09044249361431 0.30947409478409 28.085 12 Si 0.09044249361432 0.27318217645450 0.80947409478409 28.085 *13 O 0.73413777997197 0.86452328284327 0.05657247788754 15.999 *14 O 0.90747190057975 0.91575202464039 0.35641235162703 15.999 *15 O 0.84899559589516 0.55597763279034 0.17324539038420 15.999 16 O 0.86452328284327 0.73413777997197 0.55657247788754 15.999 17 O 0.91575202464039 0.90747190057975 0.85641235162703 15.999 *18 O 0.40898051700035 0.82610958935380 0.31760964576221 15.999 19 O 0.55597763279034 0.84899559589516 0.67324539038420 15.999 *20 O 0.57797379981597 0.38489549789330 0.10105893745612 15.999 21 O 0.61510450210670 0.42202620018403 0.39894106254388 15.999 22 O 0.82610958935380 0.40898051700035 0.81760964576221 15.999 23 O 0.17389041064620 0.59101948299965 0.18239035423779 15.999 24 O 0.38489549789330 0.57797379981597 0.60105893745612 15.999 25 O 0.42202620018403 0.61510450210670 0.89894106254388 15.999 26 O 0.44402236720966 0.15100440410484 0.32675460961580 15.999 27 O 0.59101948299965 0.17389041064620 0.68239035423779 15.999 28 O 0.08424797535961 0.09252809942025 0.14358764837297 15.999 29 O 0.13547671715673 0.26586222002803 0.44342752211246 15.999 30 O 0.15100440410484 0.44402236720966 0.82675460961580 15.999 31 O 0.09252809942025 0.08424797535961 0.64358764837297 15.999 32 O 0.26586222002803 0.13547671715673 0.94342752211246 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 14.423667710000098 0.000000000000000 0.000000000000000 b 0.000000000000000 6.680149069999998 0.000000000000000 c -5.516518205932991 0.000000000000000 8.740119996362409 Atomic positions (fractional): *1 Dy 0.14001115987246 0.37104539722489 0.33326741349933 162.500 > 1 *2 Dy 0.96400900987019 0.74420765039779 0.03703348698930 162.500 > 2 3 Dy 0.03599099012981 0.74420765039779 0.46296651301070 162.500 > 3 4 Dy 0.14001115987246 0.62895460277511 0.83326741349933 162.500 > 4 5 Dy 0.85998884012754 0.37104539722489 0.16673258650067 162.500 > 5 6 Dy 0.96400900987019 0.25579234960221 0.53703348698930 162.500 > 6 7 Dy 0.03599099012981 0.25579234960221 0.96296651301070 162.500 > 7 8 Dy 0.85998884012754 0.62895460277511 0.66673258650067 162.500 > 8 9 Dy 0.64001115987246 0.87104539722489 0.33326741349933 162.500 > 1 10 Dy 0.46400900987019 0.24420765039779 0.03703348698930 162.500 > 2 11 Dy 0.53599099012981 0.24420765039779 0.46296651301070 162.500 > 3 12 Dy 0.64001115987246 0.12895460277511 0.83326741349933 162.500 > 4 13 Dy 0.35998884012754 0.87104539722489 0.16673258650067 162.500 > 5 14 Dy 0.46400900987019 0.75579234960221 0.53703348698930 162.500 > 6 15 Dy 0.53599099012981 0.75579234960221 0.96296651301070 162.500 > 7 16 Dy 0.35998884012754 0.12895460277511 0.66673258650067 162.500 > 8 *17 Si 0.81818766496559 0.90863015857991 0.19052590521591 28.085 > 9 18 Si 0.31818766496559 0.59136984142009 0.69052590521591 28.085 > 10 19 Si 0.68181233503441 0.40863015857991 0.30947409478409 28.085 > 11 20 Si 0.18181233503441 0.09136984142009 0.80947409478409 28.085 > 12 21 Si 0.31818766496559 0.40863015857991 0.19052590521591 28.085 > 9 22 Si 0.81818766496559 0.09136984142009 0.69052590521591 28.085 > 10 23 Si 0.18181233503441 0.90863015857991 0.30947409478409 28.085 > 11 24 Si 0.68181233503441 0.59136984142009 0.80947409478409 28.085 > 12 *25 O 0.79933053140762 0.06519275143565 0.05657247788754 15.999 > 13 *26 O 0.91161196261007 0.00414006203032 0.35641235162703 15.999 > 14 *27 O 0.70248661434275 0.85349101844759 0.17324539038420 15.999 > 15 28 O 0.79933053140762 0.93480724856435 0.55657247788754 15.999 > 16 29 O 0.41161196261007 0.49585993796968 0.85641235162703 15.999 > 17 *30 O 0.11754505317707 0.70856453617672 0.31760964576221 15.999 > 18 31 O 0.20248661434275 0.64650898155241 0.67324539038420 15.999 > 19 *32 O 0.98143464885463 0.40346084903866 0.10105893745612 15.999 > 20 33 O 0.01856535114537 0.40346084903866 0.39894106254388 15.999 > 21 34 O 0.11754505317707 0.29143546382328 0.81760964576221 15.999 > 22 35 O 0.88245494682293 0.70856453617672 0.18239035423779 15.999 > 23 36 O 0.98143464885463 0.59653915096134 0.60105893745612 15.999 > 24 37 O 0.01856535114537 0.59653915096134 0.89894106254388 15.999 > 25 38 O 0.79751338565725 0.35349101844759 0.32675460961580 15.999 > 26 39 O 0.88245494682293 0.29143546382328 0.68239035423779 15.999 > 27 40 O 0.58838803738993 0.50414006203032 0.14358764837297 15.999 > 28 41 O 0.20066946859238 0.06519275143565 0.44342752211246 15.999 > 29 42 O 0.29751338565725 0.14650898155241 0.82675460961580 15.999 > 30 43 O 0.08838803738993 0.99585993796968 0.64358764837297 15.999 > 31 44 O 0.20066946859238 0.93480724856435 0.94342752211246 15.999 > 32 45 O 0.29933053140762 0.56519275143565 0.05657247788754 15.999 > 13 46 O 0.41161196261007 0.50414006203032 0.35641235162703 15.999 > 14 47 O 0.20248661434275 0.35349101844759 0.17324539038420 15.999 > 15 48 O 0.29933053140762 0.43480724856435 0.55657247788754 15.999 > 16 49 O 0.91161196261007 0.99585993796968 0.85641235162703 15.999 > 17 50 O 0.61754505317707 0.20856453617672 0.31760964576221 15.999 > 18 51 O 0.70248661434275 0.14650898155241 0.67324539038420 15.999 > 19 52 O 0.48143464885463 0.90346084903866 0.10105893745612 15.999 > 20 53 O 0.51856535114537 0.90346084903866 0.39894106254388 15.999 > 21 54 O 0.61754505317707 0.79143546382328 0.81760964576221 15.999 > 22 55 O 0.38245494682293 0.20856453617672 0.18239035423779 15.999 > 23 56 O 0.48143464885463 0.09653915096134 0.60105893745612 15.999 > 24 57 O 0.51856535114537 0.09653915096134 0.89894106254388 15.999 > 25 58 O 0.29751338565725 0.85349101844759 0.32675460961580 15.999 > 26 59 O 0.38245494682293 0.79143546382328 0.68239035423779 15.999 > 27 60 O 0.08838803738993 0.00414006203032 0.14358764837297 15.999 > 28 61 O 0.70066946859238 0.56519275143565 0.44342752211246 15.999 > 29 62 O 0.79751338565725 0.64650898155241 0.82675460961580 15.999 > 30 63 O 0.58838803738993 0.49585993796968 0.64358764837297 15.999 > 31 64 O 0.70066946859238 0.43480724856435 0.94342752211246 15.999 > 32 -------------------------------- super cell -------------------------------- Lattice vectors: a 14.423667710000098 0.000000000000000 0.000000000000000 b 0.000000000000000 13.360298139999996 0.000000000000000 c -5.516518205932991 0.000000000000000 8.740119996362409 Atomic positions (fractional): *1 Dy 0.14001115987246 0.18552269861245 0.33326741349933 162.500 > 1 2 Dy 0.14001115987246 0.68552269861245 0.33326741349933 162.500 > 1 *3 Dy 0.96400900987019 0.37210382519889 0.03703348698930 162.500 > 2 4 Dy 0.96400900987019 0.87210382519889 0.03703348698930 162.500 > 2 5 Dy 0.03599099012981 0.37210382519889 0.46296651301070 162.500 > 3 6 Dy 0.03599099012981 0.87210382519889 0.46296651301070 162.500 > 3 7 Dy 0.14001115987246 0.31447730138755 0.83326741349933 162.500 > 4 8 Dy 0.14001115987246 0.81447730138755 0.83326741349933 162.500 > 4 9 Dy 0.85998884012754 0.18552269861245 0.16673258650067 162.500 > 5 10 Dy 0.85998884012754 0.68552269861245 0.16673258650067 162.500 > 5 11 Dy 0.96400900987019 0.12789617480111 0.53703348698930 162.500 > 6 12 Dy 0.96400900987019 0.62789617480111 0.53703348698930 162.500 > 6 13 Dy 0.03599099012981 0.12789617480111 0.96296651301070 162.500 > 7 14 Dy 0.03599099012981 0.62789617480111 0.96296651301070 162.500 > 7 15 Dy 0.85998884012754 0.31447730138755 0.66673258650067 162.500 > 8 16 Dy 0.85998884012754 0.81447730138755 0.66673258650067 162.500 > 8 17 Dy 0.64001115987246 0.43552269861245 0.33326741349933 162.500 > 1 18 Dy 0.64001115987246 0.93552269861245 0.33326741349933 162.500 > 1 19 Dy 0.46400900987019 0.12210382519889 0.03703348698930 162.500 > 2 20 Dy 0.46400900987019 0.62210382519889 0.03703348698930 162.500 > 2 21 Dy 0.53599099012981 0.12210382519889 0.46296651301070 162.500 > 3 22 Dy 0.53599099012981 0.62210382519889 0.46296651301070 162.500 > 3 23 Dy 0.64001115987246 0.06447730138755 0.83326741349933 162.500 > 4 24 Dy 0.64001115987246 0.56447730138755 0.83326741349933 162.500 > 4 25 Dy 0.35998884012754 0.43552269861245 0.16673258650067 162.500 > 5 26 Dy 0.35998884012754 0.93552269861245 0.16673258650067 162.500 > 5 27 Dy 0.46400900987019 0.37789617480111 0.53703348698930 162.500 > 6 28 Dy 0.46400900987019 0.87789617480111 0.53703348698930 162.500 > 6 29 Dy 0.53599099012981 0.37789617480111 0.96296651301070 162.500 > 7 30 Dy 0.53599099012981 0.87789617480111 0.96296651301070 162.500 > 7 31 Dy 0.35998884012754 0.06447730138755 0.66673258650067 162.500 > 8 32 Dy 0.35998884012754 0.56447730138755 0.66673258650067 162.500 > 8 *33 Si 0.81818766496559 0.45431507928995 0.19052590521591 28.085 > 9 34 Si 0.81818766496559 0.95431507928995 0.19052590521591 28.085 > 9 35 Si 0.31818766496559 0.29568492071005 0.69052590521591 28.085 > 10 36 Si 0.31818766496559 0.79568492071005 0.69052590521591 28.085 > 10 37 Si 0.68181233503441 0.20431507928995 0.30947409478409 28.085 > 11 38 Si 0.68181233503441 0.70431507928995 0.30947409478409 28.085 > 11 39 Si 0.18181233503441 0.04568492071005 0.80947409478409 28.085 > 12 40 Si 0.18181233503441 0.54568492071005 0.80947409478409 28.085 > 12 41 Si 0.31818766496559 0.20431507928995 0.19052590521591 28.085 > 9 42 Si 0.31818766496559 0.70431507928995 0.19052590521591 28.085 > 9 43 Si 0.81818766496559 0.04568492071005 0.69052590521591 28.085 > 10 44 Si 0.81818766496559 0.54568492071005 0.69052590521591 28.085 > 10 45 Si 0.18181233503441 0.45431507928995 0.30947409478409 28.085 > 11 46 Si 0.18181233503441 0.95431507928995 0.30947409478409 28.085 > 11 47 Si 0.68181233503441 0.29568492071005 0.80947409478409 28.085 > 12 48 Si 0.68181233503441 0.79568492071005 0.80947409478409 28.085 > 12 *49 O 0.79933053140762 0.03259637571783 0.05657247788754 15.999 > 13 50 O 0.79933053140762 0.53259637571783 0.05657247788754 15.999 > 13 *51 O 0.91161196261007 0.00207003101516 0.35641235162703 15.999 > 14 52 O 0.91161196261007 0.50207003101516 0.35641235162703 15.999 > 14 *53 O 0.70248661434275 0.42674550922380 0.17324539038420 15.999 > 15 54 O 0.70248661434275 0.92674550922380 0.17324539038420 15.999 > 15 55 O 0.79933053140762 0.46740362428217 0.55657247788754 15.999 > 16 56 O 0.79933053140762 0.96740362428217 0.55657247788754 15.999 > 16 57 O 0.41161196261007 0.24792996898484 0.85641235162703 15.999 > 17 58 O 0.41161196261007 0.74792996898484 0.85641235162703 15.999 > 17 *59 O 0.11754505317707 0.35428226808836 0.31760964576221 15.999 > 18 60 O 0.11754505317707 0.85428226808836 0.31760964576221 15.999 > 18 61 O 0.20248661434275 0.32325449077620 0.67324539038420 15.999 > 19 62 O 0.20248661434275 0.82325449077620 0.67324539038420 15.999 > 19 *63 O 0.98143464885463 0.20173042451933 0.10105893745612 15.999 > 20 64 O 0.98143464885463 0.70173042451933 0.10105893745612 15.999 > 20 65 O 0.01856535114537 0.20173042451933 0.39894106254388 15.999 > 21 66 O 0.01856535114537 0.70173042451933 0.39894106254388 15.999 > 21 67 O 0.11754505317707 0.14571773191164 0.81760964576221 15.999 > 22 68 O 0.11754505317707 0.64571773191164 0.81760964576221 15.999 > 22 69 O 0.88245494682293 0.35428226808836 0.18239035423779 15.999 > 23 70 O 0.88245494682293 0.85428226808836 0.18239035423779 15.999 > 23 71 O 0.98143464885463 0.29826957548067 0.60105893745612 15.999 > 24 72 O 0.98143464885463 0.79826957548067 0.60105893745612 15.999 > 24 73 O 0.01856535114537 0.29826957548067 0.89894106254388 15.999 > 25 74 O 0.01856535114537 0.79826957548067 0.89894106254388 15.999 > 25 75 O 0.79751338565725 0.17674550922380 0.32675460961580 15.999 > 26 76 O 0.79751338565725 0.67674550922380 0.32675460961580 15.999 > 26 77 O 0.88245494682293 0.14571773191164 0.68239035423779 15.999 > 27 78 O 0.88245494682293 0.64571773191164 0.68239035423779 15.999 > 27 79 O 0.58838803738993 0.25207003101516 0.14358764837297 15.999 > 28 80 O 0.58838803738993 0.75207003101516 0.14358764837297 15.999 > 28 81 O 0.20066946859238 0.03259637571783 0.44342752211246 15.999 > 29 82 O 0.20066946859238 0.53259637571783 0.44342752211246 15.999 > 29 83 O 0.29751338565725 0.07325449077620 0.82675460961580 15.999 > 30 84 O 0.29751338565725 0.57325449077620 0.82675460961580 15.999 > 30 85 O 0.08838803738993 0.49792996898484 0.64358764837297 15.999 > 31 86 O 0.08838803738993 0.99792996898484 0.64358764837297 15.999 > 31 87 O 0.20066946859238 0.46740362428217 0.94342752211246 15.999 > 32 88 O 0.20066946859238 0.96740362428217 0.94342752211246 15.999 > 32 89 O 0.29933053140762 0.28259637571783 0.05657247788754 15.999 > 13 90 O 0.29933053140762 0.78259637571783 0.05657247788754 15.999 > 13 91 O 0.41161196261007 0.25207003101516 0.35641235162703 15.999 > 14 92 O 0.41161196261007 0.75207003101516 0.35641235162703 15.999 > 14 93 O 0.20248661434275 0.17674550922380 0.17324539038420 15.999 > 15 94 O 0.20248661434275 0.67674550922380 0.17324539038420 15.999 > 15 95 O 0.29933053140762 0.21740362428217 0.55657247788754 15.999 > 16 96 O 0.29933053140762 0.71740362428217 0.55657247788754 15.999 > 16 97 O 0.91161196261007 0.49792996898484 0.85641235162703 15.999 > 17 98 O 0.91161196261007 0.99792996898484 0.85641235162703 15.999 > 17 99 O 0.61754505317707 0.10428226808836 0.31760964576221 15.999 > 18 100 O 0.61754505317707 0.60428226808836 0.31760964576221 15.999 > 18 101 O 0.70248661434275 0.07325449077620 0.67324539038420 15.999 > 19 102 O 0.70248661434275 0.57325449077620 0.67324539038420 15.999 > 19 103 O 0.48143464885463 0.45173042451933 0.10105893745612 15.999 > 20 104 O 0.48143464885463 0.95173042451933 0.10105893745612 15.999 > 20 105 O 0.51856535114537 0.45173042451933 0.39894106254388 15.999 > 21 106 O 0.51856535114537 0.95173042451933 0.39894106254388 15.999 > 21 107 O 0.61754505317707 0.39571773191164 0.81760964576221 15.999 > 22 108 O 0.61754505317707 0.89571773191164 0.81760964576221 15.999 > 22 109 O 0.38245494682293 0.10428226808836 0.18239035423779 15.999 > 23 110 O 0.38245494682293 0.60428226808836 0.18239035423779 15.999 > 23 111 O 0.48143464885463 0.04826957548067 0.60105893745612 15.999 > 24 112 O 0.48143464885463 0.54826957548067 0.60105893745612 15.999 > 24 113 O 0.51856535114537 0.04826957548067 0.89894106254388 15.999 > 25 114 O 0.51856535114537 0.54826957548067 0.89894106254388 15.999 > 25 115 O 0.29751338565725 0.42674550922380 0.32675460961580 15.999 > 26 116 O 0.29751338565725 0.92674550922380 0.32675460961580 15.999 > 26 117 O 0.38245494682293 0.39571773191164 0.68239035423779 15.999 > 27 118 O 0.38245494682293 0.89571773191164 0.68239035423779 15.999 > 27 119 O 0.08838803738993 0.00207003101516 0.14358764837297 15.999 > 28 120 O 0.08838803738993 0.50207003101516 0.14358764837297 15.999 > 28 121 O 0.70066946859238 0.28259637571783 0.44342752211246 15.999 > 29 122 O 0.70066946859238 0.78259637571783 0.44342752211246 15.999 > 29 123 O 0.79751338565725 0.32325449077620 0.82675460961580 15.999 > 30 124 O 0.79751338565725 0.82325449077620 0.82675460961580 15.999 > 30 125 O 0.58838803738993 0.24792996898484 0.64358764837297 15.999 > 31 126 O 0.58838803738993 0.74792996898484 0.64358764837297 15.999 > 31 127 O 0.70066946859238 0.21740362428217 0.94342752211246 15.999 > 32 128 O 0.70066946859238 0.71740362428217 0.94342752211246 15.999 > 32 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.5659208 0.0000000 -0.0398112 0.0000000 3.5571633 0.0000000 -0.0398119 0.0000000 3.6614936 -------------------------- Born effective charges -------------------------- 1 Dy 3.8682878 -0.4375395 -0.0379464 -0.4242018 3.6729416 -0.1132325 0.1189199 -0.1078397 3.8868991 2 Dy 3.3799105 0.0918774 -0.2451505 0.1154536 3.7984040 -0.0030969 -0.2901175 0.0061999 4.0335132 3 Dy 3.3799105 -0.0918774 -0.2451505 -0.1154536 3.7984040 0.0030969 -0.2901175 -0.0061999 4.0335132 4 Dy 3.8682878 0.4375395 -0.0379464 0.4242018 3.6729416 0.1132325 0.1189199 0.1078397 3.8868991 5 Dy 3.8682878 0.4375395 -0.0379464 0.4242018 3.6729416 0.1132325 0.1189199 0.1078397 3.8868991 6 Dy 3.3799105 -0.0918774 -0.2451505 -0.1154536 3.7984040 0.0030969 -0.2901175 -0.0061999 4.0335132 7 Dy 3.3799105 0.0918774 -0.2451505 0.1154536 3.7984040 -0.0030969 -0.2901175 0.0061999 4.0335132 8 Dy 3.8682878 -0.4375395 -0.0379464 -0.4242018 3.6729416 -0.1132325 0.1189199 -0.1078397 3.8868991 9 Si 3.4382627 -0.1064642 0.3139100 -0.0365160 3.1242671 -0.1217775 0.1698260 -0.0102855 3.0403753 10 Si 3.4382627 0.1064642 0.3139100 0.0365160 3.1242671 0.1217775 0.1698260 0.0102855 3.0403753 11 Si 3.4382627 0.1064642 0.3139100 0.0365160 3.1242671 0.1217775 0.1698260 0.0102855 3.0403753 12 Si 3.4382627 -0.1064642 0.3139100 -0.0365160 3.1242671 -0.1217775 0.1698260 -0.0102855 3.0403753 13 O -1.5093349 -0.1836566 -0.3144793 -0.1693663 -2.3112607 0.2460708 -0.2548443 0.2607700 -2.4219754 14 O -1.4166503 0.2613362 -0.3561873 0.2605616 -2.3641920 -0.3683306 -0.3550618 -0.2776328 -2.3854537 15 O -2.9681091 -0.2829910 0.0086225 -0.3142724 -1.3463063 -0.1765553 -0.0492024 -0.1776298 -1.9341626 16 O -1.5093349 0.1836566 -0.3144793 0.1693663 -2.3112607 -0.2460708 -0.2548443 -0.2607700 -2.4219754 17 O -1.4166503 -0.2613362 -0.3561873 -0.2605616 -2.3641920 0.3683306 -0.3550618 0.2776328 -2.3854537 18 O -2.0106725 -0.4056976 0.1671043 -0.4087540 -2.5251286 0.0976670 0.1986655 0.1267303 -1.8521405 19 O -2.9681091 0.2829910 0.0086225 0.3142724 -1.3463063 0.1765553 -0.0492024 0.1776298 -1.9341626 20 O -2.7816942 0.1788482 0.4641267 0.2556120 -2.0487251 0.0285951 0.4618146 0.1107877 -2.3670553 21 O -2.7816942 -0.1788482 0.4641267 -0.2556120 -2.0487251 -0.0285951 0.4618146 -0.1107877 -2.3670553 22 O -2.0106725 0.4056976 0.1671043 0.4087540 -2.5251286 -0.0976670 0.1986655 -0.1267303 -1.8521405 23 O -2.0106725 0.4056976 0.1671043 0.4087540 -2.5251286 -0.0976670 0.1986655 -0.1267303 -1.8521405 24 O -2.7816942 -0.1788482 0.4641267 -0.2556120 -2.0487251 -0.0285951 0.4618146 -0.1107877 -2.3670553 25 O -2.7816942 0.1788482 0.4641267 0.2556120 -2.0487251 0.0285951 0.4618146 0.1107877 -2.3670553 26 O -2.9681091 0.2829910 0.0086225 0.3142724 -1.3463063 0.1765553 -0.0492024 0.1776298 -1.9341626 27 O -2.0106725 -0.4056976 0.1671043 -0.4087540 -2.5251286 0.0976670 0.1986655 0.1267303 -1.8521405 28 O -1.4166503 -0.2613362 -0.3561873 -0.2605616 -2.3641920 0.3683306 -0.3550618 0.2776328 -2.3854537 29 O -1.5093349 0.1836566 -0.3144793 0.1693663 -2.3112607 -0.2460708 -0.2548443 -0.2607700 -2.4219754 30 O -2.9681091 -0.2829910 0.0086225 -0.3142724 -1.3463063 -0.1765553 -0.0492024 -0.1776298 -1.9341626 31 O -1.4166503 0.2613362 -0.3561873 0.2605616 -2.3641920 -0.3683306 -0.3550618 -0.2776328 -2.3854537 32 O -1.5093349 -0.1836566 -0.3144793 -0.1693663 -2.3112607 0.2460708 -0.2548443 0.2607700 -2.4219754 ---------------------------------------------------------------------------- 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: 384/384 Permutation basis: 22848/22848 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 4752 Number of blocks in projector: 4752 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 238 eigenvectors found. (2) Block: 524 / 524 (2) 258 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 508 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 16 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 238 eigenvectors found. (2) Block: 524 / 524 (2) 258 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 508 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 16 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 239 eigenvectors found. (2) Block: 524 / 524 (2) 265 eigenvectors found. (2) Complementary block size: 20 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 513 eigenvectors found. (1) Complementary block size: 26 (1) Compute compressed projector. (1) Use standard solver. (1) 11 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. Tree of FC basis block matrices: - (4752, 4681), data: False |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (1024, 1009), data: False |-- (1024, 11), data: (1024, 26) @ (26, 11) |-- (524, 513), data: False |-- (524, 9), data: (524, 20) @ (20, 9) |-- (274, 265), data: True |-- (250, 239), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (1024, 1008), data: False |-- (1024, 16), data: (1024, 32) @ (32, 16) |-- (524, 508), data: False |-- (524, 12), data: (524, 28) @ (28, 12) |-- (274, 258), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (1024, 1008), data: False |-- (1024, 16), data: (1024, 32) @ (32, 16) |-- (524, 508), data: False |-- (524, 12), data: (524, 28) @ (28, 12) |-- (274, 258), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True ----- Solver_atoms: 1 -- 128 / 128 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 960 - Time: 1.371 Solver_block: 200 / 960 - Time: 1.218 Solver_block: 300 / 960 - Time: 1.210 Solver_block: 400 / 960 - Time: 1.217 Solver_block: 500 / 960 - Time: 1.216 Solver_block: 600 / 960 - Time: 1.217 Solver_block: 700 / 960 - Time: 1.212 Solver_block: 800 / 960 - Time: 1.212 Solver_block: 900 / 960 - Time: 1.214 Solver_block: 960 / 960 - Time: 0.855 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 12.281 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 384/384 Permutation basis: 22848/22848 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 4752 Number of blocks in projector: 4752 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 238 eigenvectors found. (2) Block: 524 / 524 (2) 258 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 508 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 16 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 238 eigenvectors found. (2) Block: 524 / 524 (2) 258 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 508 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 16 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 239 eigenvectors found. (2) Block: 524 / 524 (2) 265 eigenvectors found. (2) Complementary block size: 20 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 513 eigenvectors found. (1) Complementary block size: 26 (1) Compute compressed projector. (1) Use standard solver. (1) 11 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. Tree of FC basis block matrices: - (4752, 4681), data: False |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (1024, 1009), data: False |-- (1024, 11), data: (1024, 26) @ (26, 11) |-- (524, 513), data: False |-- (524, 9), data: (524, 20) @ (20, 9) |-- (274, 265), data: True |-- (250, 239), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (1024, 1008), data: False |-- (1024, 16), data: (1024, 32) @ (32, 16) |-- (524, 508), data: False |-- (524, 12), data: (524, 28) @ (28, 12) |-- (274, 258), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (1024, 1008), data: False |-- (1024, 16), data: (1024, 32) @ (32, 16) |-- (524, 508), data: False |-- (524, 12), data: (524, 28) @ (28, 12) |-- (274, 258), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True Max drift after symmetrization by symfc projector: 0.00000000 (xx) 0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-09 00:53:48]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 00:53:49]------------------------- 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 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.211833855000049 -3.340074534999999 0.000000000000000 b 7.211833855000049 3.340074534999999 0.000000000000000 c -5.516518205932991 0.000000000000000 8.740119996362409 Atomic positions (fractional): 1 Dy 0.76896576264757 0.51105655709735 0.33326741349933 162.500 2 Dy 0.21980135947240 0.70821666026798 0.03703348698930 162.500 3 Dy 0.29178333973202 0.78019864052760 0.46296651301070 162.500 4 Dy 0.51105655709735 0.76896576264757 0.83326741349933 162.500 5 Dy 0.48894344290265 0.23103423735243 0.16673258650067 162.500 6 Dy 0.70821666026798 0.21980135947241 0.53703348698930 162.500 7 Dy 0.78019864052760 0.29178333973202 0.96296651301070 162.500 8 Dy 0.23103423735243 0.48894344290265 0.66673258650067 162.500 9 Si 0.90955750638568 0.72681782354550 0.19052590521591 28.085 10 Si 0.72681782354550 0.90955750638568 0.69052590521591 28.085 11 Si 0.27318217645450 0.09044249361431 0.30947409478409 28.085 12 Si 0.09044249361432 0.27318217645450 0.80947409478409 28.085 13 O 0.73413777997197 0.86452328284327 0.05657247788754 15.999 14 O 0.90747190057975 0.91575202464039 0.35641235162703 15.999 15 O 0.84899559589516 0.55597763279034 0.17324539038420 15.999 16 O 0.86452328284327 0.73413777997197 0.55657247788754 15.999 17 O 0.91575202464039 0.90747190057975 0.85641235162703 15.999 18 O 0.40898051700035 0.82610958935380 0.31760964576221 15.999 19 O 0.55597763279034 0.84899559589516 0.67324539038420 15.999 20 O 0.57797379981597 0.38489549789330 0.10105893745612 15.999 21 O 0.61510450210670 0.42202620018403 0.39894106254388 15.999 22 O 0.82610958935380 0.40898051700035 0.81760964576221 15.999 23 O 0.17389041064620 0.59101948299965 0.18239035423779 15.999 24 O 0.38489549789330 0.57797379981597 0.60105893745612 15.999 25 O 0.42202620018403 0.61510450210670 0.89894106254388 15.999 26 O 0.44402236720966 0.15100440410484 0.32675460961580 15.999 27 O 0.59101948299965 0.17389041064620 0.68239035423779 15.999 28 O 0.08424797535961 0.09252809942025 0.14358764837297 15.999 29 O 0.13547671715673 0.26586222002803 0.44342752211246 15.999 30 O 0.15100440410484 0.44402236720966 0.82675460961580 15.999 31 O 0.09252809942025 0.08424797535961 0.64358764837297 15.999 32 O 0.26586222002803 0.13547671715673 0.94342752211246 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.423667710000098 0.000000000000000 0.000000000000000 b 0.000000000000000 13.360298139999996 0.000000000000000 c -5.516518205932991 0.000000000000000 8.740119996362409 Atomic positions (fractional): 1 Dy 0.14001115987246 0.18552269861245 0.33326741349933 162.500 > 1 2 Dy 0.14001115987246 0.68552269861245 0.33326741349933 162.500 > 1 3 Dy 0.96400900987019 0.37210382519889 0.03703348698930 162.500 > 3 4 Dy 0.96400900987019 0.87210382519889 0.03703348698930 162.500 > 3 5 Dy 0.03599099012981 0.37210382519889 0.46296651301070 162.500 > 5 6 Dy 0.03599099012981 0.87210382519889 0.46296651301070 162.500 > 5 7 Dy 0.14001115987246 0.31447730138755 0.83326741349933 162.500 > 7 8 Dy 0.14001115987246 0.81447730138755 0.83326741349933 162.500 > 7 9 Dy 0.85998884012754 0.18552269861245 0.16673258650067 162.500 > 9 10 Dy 0.85998884012754 0.68552269861245 0.16673258650067 162.500 > 9 11 Dy 0.96400900987019 0.12789617480111 0.53703348698930 162.500 > 11 12 Dy 0.96400900987019 0.62789617480111 0.53703348698930 162.500 > 11 13 Dy 0.03599099012981 0.12789617480111 0.96296651301070 162.500 > 13 14 Dy 0.03599099012981 0.62789617480111 0.96296651301070 162.500 > 13 15 Dy 0.85998884012754 0.31447730138755 0.66673258650067 162.500 > 15 16 Dy 0.85998884012754 0.81447730138755 0.66673258650067 162.500 > 15 17 Dy 0.64001115987246 0.43552269861245 0.33326741349933 162.500 > 1 18 Dy 0.64001115987246 0.93552269861245 0.33326741349933 162.500 > 1 19 Dy 0.46400900987019 0.12210382519889 0.03703348698930 162.500 > 3 20 Dy 0.46400900987019 0.62210382519889 0.03703348698930 162.500 > 3 21 Dy 0.53599099012981 0.12210382519889 0.46296651301070 162.500 > 5 22 Dy 0.53599099012981 0.62210382519889 0.46296651301070 162.500 > 5 23 Dy 0.64001115987246 0.06447730138755 0.83326741349933 162.500 > 7 24 Dy 0.64001115987246 0.56447730138755 0.83326741349933 162.500 > 7 25 Dy 0.35998884012754 0.43552269861245 0.16673258650067 162.500 > 9 26 Dy 0.35998884012754 0.93552269861245 0.16673258650067 162.500 > 9 27 Dy 0.46400900987019 0.37789617480111 0.53703348698930 162.500 > 11 28 Dy 0.46400900987019 0.87789617480111 0.53703348698930 162.500 > 11 29 Dy 0.53599099012981 0.37789617480111 0.96296651301070 162.500 > 13 30 Dy 0.53599099012981 0.87789617480111 0.96296651301070 162.500 > 13 31 Dy 0.35998884012754 0.06447730138755 0.66673258650067 162.500 > 15 32 Dy 0.35998884012754 0.56447730138755 0.66673258650067 162.500 > 15 33 Si 0.81818766496559 0.45431507928995 0.19052590521591 28.085 > 33 34 Si 0.81818766496559 0.95431507928995 0.19052590521591 28.085 > 33 35 Si 0.31818766496559 0.29568492071005 0.69052590521591 28.085 > 35 36 Si 0.31818766496559 0.79568492071005 0.69052590521591 28.085 > 35 37 Si 0.68181233503441 0.20431507928995 0.30947409478409 28.085 > 37 38 Si 0.68181233503441 0.70431507928995 0.30947409478409 28.085 > 37 39 Si 0.18181233503441 0.04568492071005 0.80947409478409 28.085 > 39 40 Si 0.18181233503441 0.54568492071005 0.80947409478409 28.085 > 39 41 Si 0.31818766496559 0.20431507928995 0.19052590521591 28.085 > 33 42 Si 0.31818766496559 0.70431507928995 0.19052590521591 28.085 > 33 43 Si 0.81818766496559 0.04568492071005 0.69052590521591 28.085 > 35 44 Si 0.81818766496559 0.54568492071005 0.69052590521591 28.085 > 35 45 Si 0.18181233503441 0.45431507928995 0.30947409478409 28.085 > 37 46 Si 0.18181233503441 0.95431507928995 0.30947409478409 28.085 > 37 47 Si 0.68181233503441 0.29568492071005 0.80947409478409 28.085 > 39 48 Si 0.68181233503441 0.79568492071005 0.80947409478409 28.085 > 39 49 O 0.79933053140762 0.03259637571783 0.05657247788754 15.999 > 49 50 O 0.79933053140762 0.53259637571783 0.05657247788754 15.999 > 49 51 O 0.91161196261007 0.00207003101516 0.35641235162703 15.999 > 51 52 O 0.91161196261007 0.50207003101516 0.35641235162703 15.999 > 51 53 O 0.70248661434275 0.42674550922380 0.17324539038420 15.999 > 53 54 O 0.70248661434275 0.92674550922380 0.17324539038420 15.999 > 53 55 O 0.79933053140762 0.46740362428217 0.55657247788754 15.999 > 55 56 O 0.79933053140762 0.96740362428217 0.55657247788754 15.999 > 55 57 O 0.41161196261007 0.24792996898484 0.85641235162703 15.999 > 57 58 O 0.41161196261007 0.74792996898484 0.85641235162703 15.999 > 57 59 O 0.11754505317707 0.35428226808836 0.31760964576221 15.999 > 59 60 O 0.11754505317707 0.85428226808836 0.31760964576221 15.999 > 59 61 O 0.20248661434275 0.32325449077620 0.67324539038420 15.999 > 61 62 O 0.20248661434275 0.82325449077620 0.67324539038420 15.999 > 61 63 O 0.98143464885463 0.20173042451933 0.10105893745612 15.999 > 63 64 O 0.98143464885463 0.70173042451933 0.10105893745612 15.999 > 63 65 O 0.01856535114537 0.20173042451933 0.39894106254388 15.999 > 65 66 O 0.01856535114537 0.70173042451933 0.39894106254388 15.999 > 65 67 O 0.11754505317707 0.14571773191164 0.81760964576221 15.999 > 67 68 O 0.11754505317707 0.64571773191164 0.81760964576221 15.999 > 67 69 O 0.88245494682293 0.35428226808836 0.18239035423779 15.999 > 69 70 O 0.88245494682293 0.85428226808836 0.18239035423779 15.999 > 69 71 O 0.98143464885463 0.29826957548067 0.60105893745612 15.999 > 71 72 O 0.98143464885463 0.79826957548067 0.60105893745612 15.999 > 71 73 O 0.01856535114537 0.29826957548067 0.89894106254388 15.999 > 73 74 O 0.01856535114537 0.79826957548067 0.89894106254388 15.999 > 73 75 O 0.79751338565725 0.17674550922380 0.32675460961580 15.999 > 75 76 O 0.79751338565725 0.67674550922380 0.32675460961580 15.999 > 75 77 O 0.88245494682293 0.14571773191164 0.68239035423779 15.999 > 77 78 O 0.88245494682293 0.64571773191164 0.68239035423779 15.999 > 77 79 O 0.58838803738993 0.25207003101516 0.14358764837297 15.999 > 79 80 O 0.58838803738993 0.75207003101516 0.14358764837297 15.999 > 79 81 O 0.20066946859238 0.03259637571783 0.44342752211246 15.999 > 81 82 O 0.20066946859238 0.53259637571783 0.44342752211246 15.999 > 81 83 O 0.29751338565725 0.07325449077620 0.82675460961580 15.999 > 83 84 O 0.29751338565725 0.57325449077620 0.82675460961580 15.999 > 83 85 O 0.08838803738993 0.49792996898484 0.64358764837297 15.999 > 85 86 O 0.08838803738993 0.99792996898484 0.64358764837297 15.999 > 85 87 O 0.20066946859238 0.46740362428217 0.94342752211246 15.999 > 87 88 O 0.20066946859238 0.96740362428217 0.94342752211246 15.999 > 87 89 O 0.29933053140762 0.28259637571783 0.05657247788754 15.999 > 49 90 O 0.29933053140762 0.78259637571783 0.05657247788754 15.999 > 49 91 O 0.41161196261007 0.25207003101516 0.35641235162703 15.999 > 51 92 O 0.41161196261007 0.75207003101516 0.35641235162703 15.999 > 51 93 O 0.20248661434275 0.17674550922380 0.17324539038420 15.999 > 53 94 O 0.20248661434275 0.67674550922380 0.17324539038420 15.999 > 53 95 O 0.29933053140762 0.21740362428217 0.55657247788754 15.999 > 55 96 O 0.29933053140762 0.71740362428217 0.55657247788754 15.999 > 55 97 O 0.91161196261007 0.49792996898484 0.85641235162703 15.999 > 57 98 O 0.91161196261007 0.99792996898484 0.85641235162703 15.999 > 57 99 O 0.61754505317707 0.10428226808836 0.31760964576221 15.999 > 59 100 O 0.61754505317707 0.60428226808836 0.31760964576221 15.999 > 59 101 O 0.70248661434275 0.07325449077620 0.67324539038420 15.999 > 61 102 O 0.70248661434275 0.57325449077620 0.67324539038420 15.999 > 61 103 O 0.48143464885463 0.45173042451933 0.10105893745612 15.999 > 63 104 O 0.48143464885463 0.95173042451933 0.10105893745612 15.999 > 63 105 O 0.51856535114537 0.45173042451933 0.39894106254388 15.999 > 65 106 O 0.51856535114537 0.95173042451933 0.39894106254388 15.999 > 65 107 O 0.61754505317707 0.39571773191164 0.81760964576221 15.999 > 67 108 O 0.61754505317707 0.89571773191164 0.81760964576221 15.999 > 67 109 O 0.38245494682293 0.10428226808836 0.18239035423779 15.999 > 69 110 O 0.38245494682293 0.60428226808836 0.18239035423779 15.999 > 69 111 O 0.48143464885463 0.04826957548067 0.60105893745612 15.999 > 71 112 O 0.48143464885463 0.54826957548067 0.60105893745612 15.999 > 71 113 O 0.51856535114537 0.04826957548067 0.89894106254388 15.999 > 73 114 O 0.51856535114537 0.54826957548067 0.89894106254388 15.999 > 73 115 O 0.29751338565725 0.42674550922380 0.32675460961580 15.999 > 75 116 O 0.29751338565725 0.92674550922380 0.32675460961580 15.999 > 75 117 O 0.38245494682293 0.39571773191164 0.68239035423779 15.999 > 77 118 O 0.38245494682293 0.89571773191164 0.68239035423779 15.999 > 77 119 O 0.08838803738993 0.00207003101516 0.14358764837297 15.999 > 79 120 O 0.08838803738993 0.50207003101516 0.14358764837297 15.999 > 79 121 O 0.70066946859238 0.28259637571783 0.44342752211246 15.999 > 81 122 O 0.70066946859238 0.78259637571783 0.44342752211246 15.999 > 81 123 O 0.79751338565725 0.32325449077620 0.82675460961580 15.999 > 83 124 O 0.79751338565725 0.82325449077620 0.82675460961580 15.999 > 83 125 O 0.58838803738993 0.24792996898484 0.64358764837297 15.999 > 85 126 O 0.58838803738993 0.74792996898484 0.64358764837297 15.999 > 85 127 O 0.70066946859238 0.21740362428217 0.94342752211246 15.999 > 87 128 O 0.70066946859238 0.71740362428217 0.94342752211246 15.999 > 87 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.5659208 0.0000000 -0.0398112 0.0000000 3.5571633 0.0000000 -0.0398119 0.0000000 3.6614936 -------------------------- Born effective charges -------------------------- 1 Dy 3.8682878 -0.4375395 -0.0379464 -0.4242018 3.6729416 -0.1132325 0.1189199 -0.1078397 3.8868991 2 Dy 3.3799105 0.0918774 -0.2451505 0.1154536 3.7984040 -0.0030969 -0.2901175 0.0061999 4.0335132 3 Dy 3.3799105 -0.0918774 -0.2451505 -0.1154536 3.7984040 0.0030969 -0.2901175 -0.0061999 4.0335132 4 Dy 3.8682878 0.4375395 -0.0379464 0.4242018 3.6729416 0.1132325 0.1189199 0.1078397 3.8868991 5 Dy 3.8682878 0.4375395 -0.0379464 0.4242018 3.6729416 0.1132325 0.1189199 0.1078397 3.8868991 6 Dy 3.3799105 -0.0918774 -0.2451505 -0.1154536 3.7984040 0.0030969 -0.2901175 -0.0061999 4.0335132 7 Dy 3.3799105 0.0918774 -0.2451505 0.1154536 3.7984040 -0.0030969 -0.2901175 0.0061999 4.0335132 8 Dy 3.8682878 -0.4375395 -0.0379464 -0.4242018 3.6729416 -0.1132325 0.1189199 -0.1078397 3.8868991 9 Si 3.4382627 -0.1064642 0.3139100 -0.0365160 3.1242671 -0.1217775 0.1698260 -0.0102855 3.0403753 10 Si 3.4382627 0.1064642 0.3139100 0.0365160 3.1242671 0.1217775 0.1698260 0.0102855 3.0403753 11 Si 3.4382627 0.1064642 0.3139100 0.0365160 3.1242671 0.1217775 0.1698260 0.0102855 3.0403753 12 Si 3.4382627 -0.1064642 0.3139100 -0.0365160 3.1242671 -0.1217775 0.1698260 -0.0102855 3.0403753 13 O -1.5093349 -0.1836566 -0.3144793 -0.1693663 -2.3112607 0.2460708 -0.2548443 0.2607700 -2.4219754 14 O -1.4166503 0.2613362 -0.3561873 0.2605616 -2.3641920 -0.3683306 -0.3550618 -0.2776328 -2.3854537 15 O -2.9681091 -0.2829910 0.0086225 -0.3142724 -1.3463063 -0.1765553 -0.0492024 -0.1776298 -1.9341626 16 O -1.5093349 0.1836566 -0.3144793 0.1693663 -2.3112607 -0.2460708 -0.2548443 -0.2607700 -2.4219754 17 O -1.4166503 -0.2613362 -0.3561873 -0.2605616 -2.3641920 0.3683306 -0.3550618 0.2776328 -2.3854537 18 O -2.0106725 -0.4056976 0.1671043 -0.4087540 -2.5251286 0.0976670 0.1986655 0.1267303 -1.8521405 19 O -2.9681091 0.2829910 0.0086225 0.3142724 -1.3463063 0.1765553 -0.0492024 0.1776298 -1.9341626 20 O -2.7816942 0.1788482 0.4641267 0.2556120 -2.0487251 0.0285951 0.4618146 0.1107877 -2.3670553 21 O -2.7816942 -0.1788482 0.4641267 -0.2556120 -2.0487251 -0.0285951 0.4618146 -0.1107877 -2.3670553 22 O -2.0106725 0.4056976 0.1671043 0.4087540 -2.5251286 -0.0976670 0.1986655 -0.1267303 -1.8521405 23 O -2.0106725 0.4056976 0.1671043 0.4087540 -2.5251286 -0.0976670 0.1986655 -0.1267303 -1.8521405 24 O -2.7816942 -0.1788482 0.4641267 -0.2556120 -2.0487251 -0.0285951 0.4618146 -0.1107877 -2.3670553 25 O -2.7816942 0.1788482 0.4641267 0.2556120 -2.0487251 0.0285951 0.4618146 0.1107877 -2.3670553 26 O -2.9681091 0.2829910 0.0086225 0.3142724 -1.3463063 0.1765553 -0.0492024 0.1776298 -1.9341626 27 O -2.0106725 -0.4056976 0.1671043 -0.4087540 -2.5251286 0.0976670 0.1986655 0.1267303 -1.8521405 28 O -1.4166503 -0.2613362 -0.3561873 -0.2605616 -2.3641920 0.3683306 -0.3550618 0.2776328 -2.3854537 29 O -1.5093349 0.1836566 -0.3144793 0.1693663 -2.3112607 -0.2460708 -0.2548443 -0.2607700 -2.4219754 30 O -2.9681091 -0.2829910 0.0086225 -0.3142724 -1.3463063 -0.1765553 -0.0492024 -0.1776298 -1.9341626 31 O -1.4166503 0.2613362 -0.3561873 0.2605616 -2.3641920 -0.3683306 -0.3550618 -0.2776328 -2.3854537 32 O -1.5093349 -0.1836566 -0.3144793 -0.1693663 -2.3112607 0.2460708 -0.2548443 0.2607700 -2.4219754 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 3, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 51, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 53, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 59, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 63, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (xxx) -0.00000000 (xxx) -0.00000000 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (xy) 0.00000000 (xy) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 00:54:35]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 00:54:35]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.211833855000049 -3.340074534999999 0.000000000000000 b 7.211833855000049 3.340074534999999 0.000000000000000 c -5.516518205932991 0.000000000000000 8.740119996362409 Atomic positions (fractional): 1 Dy 0.76896576264757 0.51105655709735 0.33326741349933 162.500 2 Dy 0.21980135947240 0.70821666026798 0.03703348698930 162.500 3 Dy 0.29178333973202 0.78019864052760 0.46296651301070 162.500 4 Dy 0.51105655709735 0.76896576264757 0.83326741349933 162.500 5 Dy 0.48894344290265 0.23103423735243 0.16673258650067 162.500 6 Dy 0.70821666026798 0.21980135947241 0.53703348698930 162.500 7 Dy 0.78019864052760 0.29178333973202 0.96296651301070 162.500 8 Dy 0.23103423735243 0.48894344290265 0.66673258650067 162.500 9 Si 0.90955750638568 0.72681782354550 0.19052590521591 28.085 10 Si 0.72681782354550 0.90955750638568 0.69052590521591 28.085 11 Si 0.27318217645450 0.09044249361431 0.30947409478409 28.085 12 Si 0.09044249361432 0.27318217645450 0.80947409478409 28.085 13 O 0.73413777997197 0.86452328284327 0.05657247788754 15.999 14 O 0.90747190057975 0.91575202464039 0.35641235162703 15.999 15 O 0.84899559589516 0.55597763279034 0.17324539038420 15.999 16 O 0.86452328284327 0.73413777997197 0.55657247788754 15.999 17 O 0.91575202464039 0.90747190057975 0.85641235162703 15.999 18 O 0.40898051700035 0.82610958935380 0.31760964576221 15.999 19 O 0.55597763279034 0.84899559589516 0.67324539038420 15.999 20 O 0.57797379981597 0.38489549789330 0.10105893745612 15.999 21 O 0.61510450210670 0.42202620018403 0.39894106254388 15.999 22 O 0.82610958935380 0.40898051700035 0.81760964576221 15.999 23 O 0.17389041064620 0.59101948299965 0.18239035423779 15.999 24 O 0.38489549789330 0.57797379981597 0.60105893745612 15.999 25 O 0.42202620018403 0.61510450210670 0.89894106254388 15.999 26 O 0.44402236720966 0.15100440410484 0.32675460961580 15.999 27 O 0.59101948299965 0.17389041064620 0.68239035423779 15.999 28 O 0.08424797535961 0.09252809942025 0.14358764837297 15.999 29 O 0.13547671715673 0.26586222002803 0.44342752211246 15.999 30 O 0.15100440410484 0.44402236720966 0.82675460961580 15.999 31 O 0.09252809942025 0.08424797535961 0.64358764837297 15.999 32 O 0.26586222002803 0.13547671715673 0.94342752211246 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.423667710000098 0.000000000000000 0.000000000000000 b 0.000000000000000 13.360298139999996 0.000000000000000 c -5.516518205932991 0.000000000000000 8.740119996362409 Atomic positions (fractional): 1 Dy 0.14001115987246 0.18552269861245 0.33326741349933 162.500 > 1 2 Dy 0.14001115987246 0.68552269861245 0.33326741349933 162.500 > 1 3 Dy 0.96400900987019 0.37210382519889 0.03703348698930 162.500 > 3 4 Dy 0.96400900987019 0.87210382519889 0.03703348698930 162.500 > 3 5 Dy 0.03599099012981 0.37210382519889 0.46296651301070 162.500 > 5 6 Dy 0.03599099012981 0.87210382519889 0.46296651301070 162.500 > 5 7 Dy 0.14001115987246 0.31447730138755 0.83326741349933 162.500 > 7 8 Dy 0.14001115987246 0.81447730138755 0.83326741349933 162.500 > 7 9 Dy 0.85998884012754 0.18552269861245 0.16673258650067 162.500 > 9 10 Dy 0.85998884012754 0.68552269861245 0.16673258650067 162.500 > 9 11 Dy 0.96400900987019 0.12789617480111 0.53703348698930 162.500 > 11 12 Dy 0.96400900987019 0.62789617480111 0.53703348698930 162.500 > 11 13 Dy 0.03599099012981 0.12789617480111 0.96296651301070 162.500 > 13 14 Dy 0.03599099012981 0.62789617480111 0.96296651301070 162.500 > 13 15 Dy 0.85998884012754 0.31447730138755 0.66673258650067 162.500 > 15 16 Dy 0.85998884012754 0.81447730138755 0.66673258650067 162.500 > 15 17 Dy 0.64001115987246 0.43552269861245 0.33326741349933 162.500 > 1 18 Dy 0.64001115987246 0.93552269861245 0.33326741349933 162.500 > 1 19 Dy 0.46400900987019 0.12210382519889 0.03703348698930 162.500 > 3 20 Dy 0.46400900987019 0.62210382519889 0.03703348698930 162.500 > 3 21 Dy 0.53599099012981 0.12210382519889 0.46296651301070 162.500 > 5 22 Dy 0.53599099012981 0.62210382519889 0.46296651301070 162.500 > 5 23 Dy 0.64001115987246 0.06447730138755 0.83326741349933 162.500 > 7 24 Dy 0.64001115987246 0.56447730138755 0.83326741349933 162.500 > 7 25 Dy 0.35998884012754 0.43552269861245 0.16673258650067 162.500 > 9 26 Dy 0.35998884012754 0.93552269861245 0.16673258650067 162.500 > 9 27 Dy 0.46400900987019 0.37789617480111 0.53703348698930 162.500 > 11 28 Dy 0.46400900987019 0.87789617480111 0.53703348698930 162.500 > 11 29 Dy 0.53599099012981 0.37789617480111 0.96296651301070 162.500 > 13 30 Dy 0.53599099012981 0.87789617480111 0.96296651301070 162.500 > 13 31 Dy 0.35998884012754 0.06447730138755 0.66673258650067 162.500 > 15 32 Dy 0.35998884012754 0.56447730138755 0.66673258650067 162.500 > 15 33 Si 0.81818766496559 0.45431507928995 0.19052590521591 28.085 > 33 34 Si 0.81818766496559 0.95431507928995 0.19052590521591 28.085 > 33 35 Si 0.31818766496559 0.29568492071005 0.69052590521591 28.085 > 35 36 Si 0.31818766496559 0.79568492071005 0.69052590521591 28.085 > 35 37 Si 0.68181233503441 0.20431507928995 0.30947409478409 28.085 > 37 38 Si 0.68181233503441 0.70431507928995 0.30947409478409 28.085 > 37 39 Si 0.18181233503441 0.04568492071005 0.80947409478409 28.085 > 39 40 Si 0.18181233503441 0.54568492071005 0.80947409478409 28.085 > 39 41 Si 0.31818766496559 0.20431507928995 0.19052590521591 28.085 > 33 42 Si 0.31818766496559 0.70431507928995 0.19052590521591 28.085 > 33 43 Si 0.81818766496559 0.04568492071005 0.69052590521591 28.085 > 35 44 Si 0.81818766496559 0.54568492071005 0.69052590521591 28.085 > 35 45 Si 0.18181233503441 0.45431507928995 0.30947409478409 28.085 > 37 46 Si 0.18181233503441 0.95431507928995 0.30947409478409 28.085 > 37 47 Si 0.68181233503441 0.29568492071005 0.80947409478409 28.085 > 39 48 Si 0.68181233503441 0.79568492071005 0.80947409478409 28.085 > 39 49 O 0.79933053140762 0.03259637571783 0.05657247788754 15.999 > 49 50 O 0.79933053140762 0.53259637571783 0.05657247788754 15.999 > 49 51 O 0.91161196261007 0.00207003101516 0.35641235162703 15.999 > 51 52 O 0.91161196261007 0.50207003101516 0.35641235162703 15.999 > 51 53 O 0.70248661434275 0.42674550922380 0.17324539038420 15.999 > 53 54 O 0.70248661434275 0.92674550922380 0.17324539038420 15.999 > 53 55 O 0.79933053140762 0.46740362428217 0.55657247788754 15.999 > 55 56 O 0.79933053140762 0.96740362428217 0.55657247788754 15.999 > 55 57 O 0.41161196261007 0.24792996898484 0.85641235162703 15.999 > 57 58 O 0.41161196261007 0.74792996898484 0.85641235162703 15.999 > 57 59 O 0.11754505317707 0.35428226808836 0.31760964576221 15.999 > 59 60 O 0.11754505317707 0.85428226808836 0.31760964576221 15.999 > 59 61 O 0.20248661434275 0.32325449077620 0.67324539038420 15.999 > 61 62 O 0.20248661434275 0.82325449077620 0.67324539038420 15.999 > 61 63 O 0.98143464885463 0.20173042451933 0.10105893745612 15.999 > 63 64 O 0.98143464885463 0.70173042451933 0.10105893745612 15.999 > 63 65 O 0.01856535114537 0.20173042451933 0.39894106254388 15.999 > 65 66 O 0.01856535114537 0.70173042451933 0.39894106254388 15.999 > 65 67 O 0.11754505317707 0.14571773191164 0.81760964576221 15.999 > 67 68 O 0.11754505317707 0.64571773191164 0.81760964576221 15.999 > 67 69 O 0.88245494682293 0.35428226808836 0.18239035423779 15.999 > 69 70 O 0.88245494682293 0.85428226808836 0.18239035423779 15.999 > 69 71 O 0.98143464885463 0.29826957548067 0.60105893745612 15.999 > 71 72 O 0.98143464885463 0.79826957548067 0.60105893745612 15.999 > 71 73 O 0.01856535114537 0.29826957548067 0.89894106254388 15.999 > 73 74 O 0.01856535114537 0.79826957548067 0.89894106254388 15.999 > 73 75 O 0.79751338565725 0.17674550922380 0.32675460961580 15.999 > 75 76 O 0.79751338565725 0.67674550922380 0.32675460961580 15.999 > 75 77 O 0.88245494682293 0.14571773191164 0.68239035423779 15.999 > 77 78 O 0.88245494682293 0.64571773191164 0.68239035423779 15.999 > 77 79 O 0.58838803738993 0.25207003101516 0.14358764837297 15.999 > 79 80 O 0.58838803738993 0.75207003101516 0.14358764837297 15.999 > 79 81 O 0.20066946859238 0.03259637571783 0.44342752211246 15.999 > 81 82 O 0.20066946859238 0.53259637571783 0.44342752211246 15.999 > 81 83 O 0.29751338565725 0.07325449077620 0.82675460961580 15.999 > 83 84 O 0.29751338565725 0.57325449077620 0.82675460961580 15.999 > 83 85 O 0.08838803738993 0.49792996898484 0.64358764837297 15.999 > 85 86 O 0.08838803738993 0.99792996898484 0.64358764837297 15.999 > 85 87 O 0.20066946859238 0.46740362428217 0.94342752211246 15.999 > 87 88 O 0.20066946859238 0.96740362428217 0.94342752211246 15.999 > 87 89 O 0.29933053140762 0.28259637571783 0.05657247788754 15.999 > 49 90 O 0.29933053140762 0.78259637571783 0.05657247788754 15.999 > 49 91 O 0.41161196261007 0.25207003101516 0.35641235162703 15.999 > 51 92 O 0.41161196261007 0.75207003101516 0.35641235162703 15.999 > 51 93 O 0.20248661434275 0.17674550922380 0.17324539038420 15.999 > 53 94 O 0.20248661434275 0.67674550922380 0.17324539038420 15.999 > 53 95 O 0.29933053140762 0.21740362428217 0.55657247788754 15.999 > 55 96 O 0.29933053140762 0.71740362428217 0.55657247788754 15.999 > 55 97 O 0.91161196261007 0.49792996898484 0.85641235162703 15.999 > 57 98 O 0.91161196261007 0.99792996898484 0.85641235162703 15.999 > 57 99 O 0.61754505317707 0.10428226808836 0.31760964576221 15.999 > 59 100 O 0.61754505317707 0.60428226808836 0.31760964576221 15.999 > 59 101 O 0.70248661434275 0.07325449077620 0.67324539038420 15.999 > 61 102 O 0.70248661434275 0.57325449077620 0.67324539038420 15.999 > 61 103 O 0.48143464885463 0.45173042451933 0.10105893745612 15.999 > 63 104 O 0.48143464885463 0.95173042451933 0.10105893745612 15.999 > 63 105 O 0.51856535114537 0.45173042451933 0.39894106254388 15.999 > 65 106 O 0.51856535114537 0.95173042451933 0.39894106254388 15.999 > 65 107 O 0.61754505317707 0.39571773191164 0.81760964576221 15.999 > 67 108 O 0.61754505317707 0.89571773191164 0.81760964576221 15.999 > 67 109 O 0.38245494682293 0.10428226808836 0.18239035423779 15.999 > 69 110 O 0.38245494682293 0.60428226808836 0.18239035423779 15.999 > 69 111 O 0.48143464885463 0.04826957548067 0.60105893745612 15.999 > 71 112 O 0.48143464885463 0.54826957548067 0.60105893745612 15.999 > 71 113 O 0.51856535114537 0.04826957548067 0.89894106254388 15.999 > 73 114 O 0.51856535114537 0.54826957548067 0.89894106254388 15.999 > 73 115 O 0.29751338565725 0.42674550922380 0.32675460961580 15.999 > 75 116 O 0.29751338565725 0.92674550922380 0.32675460961580 15.999 > 75 117 O 0.38245494682293 0.39571773191164 0.68239035423779 15.999 > 77 118 O 0.38245494682293 0.89571773191164 0.68239035423779 15.999 > 77 119 O 0.08838803738993 0.00207003101516 0.14358764837297 15.999 > 79 120 O 0.08838803738993 0.50207003101516 0.14358764837297 15.999 > 79 121 O 0.70066946859238 0.28259637571783 0.44342752211246 15.999 > 81 122 O 0.70066946859238 0.78259637571783 0.44342752211246 15.999 > 81 123 O 0.79751338565725 0.32325449077620 0.82675460961580 15.999 > 83 124 O 0.79751338565725 0.82325449077620 0.82675460961580 15.999 > 83 125 O 0.58838803738993 0.24792996898484 0.64358764837297 15.999 > 85 126 O 0.58838803738993 0.74792996898484 0.64358764837297 15.999 > 85 127 O 0.70066946859238 0.21740362428217 0.94342752211246 15.999 > 87 128 O 0.70066946859238 0.71740362428217 0.94342752211246 15.999 > 87 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.5659208 0.0000000 -0.0398112 0.0000000 3.5571633 0.0000000 -0.0398119 0.0000000 3.6614936 -------------------------- Born effective charges -------------------------- 1 Dy 3.8682878 -0.4375395 -0.0379464 -0.4242018 3.6729416 -0.1132325 0.1189199 -0.1078397 3.8868991 2 Dy 3.3799105 0.0918774 -0.2451505 0.1154536 3.7984040 -0.0030969 -0.2901175 0.0061999 4.0335132 3 Dy 3.3799105 -0.0918774 -0.2451505 -0.1154536 3.7984040 0.0030969 -0.2901175 -0.0061999 4.0335132 4 Dy 3.8682878 0.4375395 -0.0379464 0.4242018 3.6729416 0.1132325 0.1189199 0.1078397 3.8868991 5 Dy 3.8682878 0.4375395 -0.0379464 0.4242018 3.6729416 0.1132325 0.1189199 0.1078397 3.8868991 6 Dy 3.3799105 -0.0918774 -0.2451505 -0.1154536 3.7984040 0.0030969 -0.2901175 -0.0061999 4.0335132 7 Dy 3.3799105 0.0918774 -0.2451505 0.1154536 3.7984040 -0.0030969 -0.2901175 0.0061999 4.0335132 8 Dy 3.8682878 -0.4375395 -0.0379464 -0.4242018 3.6729416 -0.1132325 0.1189199 -0.1078397 3.8868991 9 Si 3.4382627 -0.1064642 0.3139100 -0.0365160 3.1242671 -0.1217775 0.1698260 -0.0102855 3.0403753 10 Si 3.4382627 0.1064642 0.3139100 0.0365160 3.1242671 0.1217775 0.1698260 0.0102855 3.0403753 11 Si 3.4382627 0.1064642 0.3139100 0.0365160 3.1242671 0.1217775 0.1698260 0.0102855 3.0403753 12 Si 3.4382627 -0.1064642 0.3139100 -0.0365160 3.1242671 -0.1217775 0.1698260 -0.0102855 3.0403753 13 O -1.5093349 -0.1836566 -0.3144793 -0.1693663 -2.3112607 0.2460708 -0.2548443 0.2607700 -2.4219754 14 O -1.4166503 0.2613362 -0.3561873 0.2605616 -2.3641920 -0.3683306 -0.3550618 -0.2776328 -2.3854537 15 O -2.9681091 -0.2829910 0.0086225 -0.3142724 -1.3463063 -0.1765553 -0.0492024 -0.1776298 -1.9341626 16 O -1.5093349 0.1836566 -0.3144793 0.1693663 -2.3112607 -0.2460708 -0.2548443 -0.2607700 -2.4219754 17 O -1.4166503 -0.2613362 -0.3561873 -0.2605616 -2.3641920 0.3683306 -0.3550618 0.2776328 -2.3854537 18 O -2.0106725 -0.4056976 0.1671043 -0.4087540 -2.5251286 0.0976670 0.1986655 0.1267303 -1.8521405 19 O -2.9681091 0.2829910 0.0086225 0.3142724 -1.3463063 0.1765553 -0.0492024 0.1776298 -1.9341626 20 O -2.7816942 0.1788482 0.4641267 0.2556120 -2.0487251 0.0285951 0.4618146 0.1107877 -2.3670553 21 O -2.7816942 -0.1788482 0.4641267 -0.2556120 -2.0487251 -0.0285951 0.4618146 -0.1107877 -2.3670553 22 O -2.0106725 0.4056976 0.1671043 0.4087540 -2.5251286 -0.0976670 0.1986655 -0.1267303 -1.8521405 23 O -2.0106725 0.4056976 0.1671043 0.4087540 -2.5251286 -0.0976670 0.1986655 -0.1267303 -1.8521405 24 O -2.7816942 -0.1788482 0.4641267 -0.2556120 -2.0487251 -0.0285951 0.4618146 -0.1107877 -2.3670553 25 O -2.7816942 0.1788482 0.4641267 0.2556120 -2.0487251 0.0285951 0.4618146 0.1107877 -2.3670553 26 O -2.9681091 0.2829910 0.0086225 0.3142724 -1.3463063 0.1765553 -0.0492024 0.1776298 -1.9341626 27 O -2.0106725 -0.4056976 0.1671043 -0.4087540 -2.5251286 0.0976670 0.1986655 0.1267303 -1.8521405 28 O -1.4166503 -0.2613362 -0.3561873 -0.2605616 -2.3641920 0.3683306 -0.3550618 0.2776328 -2.3854537 29 O -1.5093349 0.1836566 -0.3144793 0.1693663 -2.3112607 -0.2460708 -0.2548443 -0.2607700 -2.4219754 30 O -2.9681091 -0.2829910 0.0086225 -0.3142724 -1.3463063 -0.1765553 -0.0492024 -0.1776298 -1.9341626 31 O -1.4166503 0.2613362 -0.3561873 0.2605616 -2.3641920 -0.3683306 -0.3550618 -0.2776328 -2.3854537 32 O -1.5093349 -0.1836566 -0.3144793 -0.1693663 -2.3112607 0.2460708 -0.2548443 0.2607700 -2.4219754 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (xxx) -0.00000000 (xxx) -0.00000000 (xxx) Max drift of fc2: 0.00000000 (xx) 0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 9 9 6 ] 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: 0.55, Number of G-points: 309, Lambda: 0.11 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/140) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 1.209 ( 0.000 0.000 0.000) 0.000 2.046 ( 0.000 0.000 0.000) 0.000 2.222 ( 0.000 0.000 0.000) 0.000 2.516 ( 0.000 0.000 0.000) 0.000 2.518 ( 0.000 0.000 0.000) 0.000 2.569 ( 0.000 0.000 0.000) 0.000 2.634 ( 0.000 0.000 0.000) 0.000 2.960 ( 0.000 0.000 0.000) 0.000 3.482 ( 0.000 0.000 0.000) 0.000 3.587 ( 0.000 0.000 0.000) 0.000 3.634 ( 0.000 0.000 0.000) 0.000 3.686 ( 0.000 0.000 0.000) 0.000 3.767 ( 0.000 0.000 0.000) 0.000 4.229 ( 0.000 0.000 0.000) 0.000 4.254 ( 0.000 0.000 0.000) 0.000 4.283 ( 0.000 0.000 0.000) 0.000 4.490 ( 0.000 0.000 0.000) 0.000 4.600 ( 0.000 0.000 0.000) 0.000 4.635 ( 0.000 0.000 0.000) 0.000 4.720 ( 0.000 0.000 0.000) 0.000 5.276 ( 0.000 0.000 0.000) 0.000 5.286 ( 0.000 0.000 0.000) 0.000 5.288 ( 0.000 0.000 0.000) 0.000 5.695 ( 0.000 0.000 0.000) 0.000 5.840 ( 0.000 0.000 0.000) 0.000 6.028 ( 0.000 0.000 0.000) 0.000 6.086 ( 0.000 0.000 0.000) 0.000 6.248 ( 0.000 0.000 0.000) 0.000 6.262 ( 0.000 0.000 0.000) 0.000 6.484 ( 0.000 0.000 0.000) 0.000 6.495 ( 0.000 0.000 0.000) 0.000 6.711 ( 0.000 0.000 0.000) 0.000 6.905 ( 0.000 0.000 0.000) 0.000 7.210 ( 0.000 0.000 0.000) 0.000 7.246 ( 0.000 0.000 0.000) 0.000 7.644 ( 0.000 0.000 0.000) 0.000 7.785 ( 0.000 0.000 0.000) 0.000 8.281 ( 0.000 0.000 0.000) 0.000 8.654 ( 0.000 0.000 0.000) 0.000 8.781 ( 0.000 0.000 0.000) 0.000 8.835 ( 0.000 0.000 0.000) 0.000 9.152 ( 0.000 0.000 0.000) 0.000 9.213 ( 0.000 0.000 0.000) 0.000 9.248 ( 0.000 0.000 0.000) 0.000 9.635 ( 0.000 0.000 0.000) 0.000 9.835 ( 0.000 0.000 0.000) 0.000 10.308 ( 0.000 0.000 0.000) 0.000 10.400 ( 0.000 0.000 0.000) 0.000 10.838 ( 0.000 0.000 0.000) 0.000 10.983 ( 0.000 0.000 0.000) 0.000 11.088 ( 0.000 0.000 0.000) 0.000 11.115 ( 0.000 0.000 0.000) 0.000 11.673 ( 0.000 0.000 0.000) 0.000 11.717 ( 0.000 0.000 0.000) 0.000 11.876 ( 0.000 0.000 0.000) 0.000 12.032 ( 0.000 0.000 0.000) 0.000 12.393 ( 0.000 0.000 0.000) 0.000 12.479 ( 0.000 0.000 0.000) 0.000 12.638 ( 0.000 0.000 0.000) 0.000 12.666 ( 0.000 0.000 0.000) 0.000 13.363 ( 0.000 0.000 0.000) 0.000 14.775 ( 0.000 0.000 0.000) 0.000 14.827 ( 0.000 0.000 0.000) 0.000 14.837 ( 0.000 0.000 0.000) 0.000 14.879 ( 0.000 0.000 0.000) 0.000 15.012 ( 0.000 0.000 0.000) 0.000 15.296 ( 0.000 0.000 0.000) 0.000 15.538 ( 0.000 0.000 0.000) 0.000 15.569 ( 0.000 0.000 0.000) 0.000 15.725 ( 0.000 0.000 0.000) 0.000 16.080 ( 0.000 0.000 0.000) 0.000 16.213 ( 0.000 0.000 0.000) 0.000 16.377 ( 0.000 0.000 0.000) 0.000 16.526 ( 0.000 0.000 0.000) 0.000 16.726 ( 0.000 0.000 0.000) 0.000 17.341 ( 0.000 0.000 0.000) 0.000 17.578 ( 0.000 0.000 0.000) 0.000 25.480 ( 0.000 0.000 0.000) 0.000 25.607 ( 0.000 0.000 0.000) 0.000 25.615 ( 0.000 0.000 0.000) 0.000 25.749 ( 0.000 0.000 0.000) 0.000 25.871 ( 0.000 0.000 0.000) 0.000 26.078 ( 0.000 0.000 0.000) 0.000 26.380 ( 0.000 0.000 0.000) 0.000 26.432 ( 0.000 0.000 0.000) 0.000 26.633 ( 0.000 0.000 0.000) 0.000 26.967 ( 0.000 0.000 0.000) 0.000 27.579 ( 0.000 0.000 0.000) 0.000 28.272 ( 0.000 0.000 0.000) 0.000 28.304 ( 0.000 0.000 0.000) 0.000 28.412 ( 0.000 0.000 0.000) 0.000 28.684 ( 0.000 0.000 0.000) 0.000 29.334 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/140) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.463 ( 22.715 -17.579 -2.514) 28.833 0.627 ( 11.008 -26.476 17.648) 33.669 0.877 ( 21.535 -33.650 16.701) 43.302 1.414 ( 0.983 -20.698 3.181) 20.964 2.171 ( -4.292 -13.027 -3.255) 14.097 2.298 ( -4.894 -10.008 0.453) 11.150 2.494 ( 2.788 -1.822 -1.362) 3.599 2.558 ( -9.277 -10.220 1.859) 13.927 2.676 ( -3.403 -5.462 2.296) 6.832 2.699 ( 10.562 -7.456 -5.239) 13.950 2.984 ( 1.346 -1.496 0.980) 2.238 3.419 ( 1.530 11.029 -6.399) 12.843 3.486 ( -2.378 2.485 3.493) 4.902 3.611 ( 1.148 -1.101 1.903) 2.480 3.718 ( -0.556 0.642 -1.412) 1.648 3.899 ( -1.007 -10.653 -2.048) 10.895 4.175 ( -6.839 6.405 2.813) 9.783 4.187 ( -1.343 4.057 -4.782) 6.414 4.347 ( 2.699 -4.497 4.721) 7.056 4.460 ( 3.975 4.405 1.361) 6.087 4.535 ( -5.947 2.365 -2.592) 6.905 4.585 ( -0.075 3.265 0.500) 3.304 4.920 ( -1.510 -5.235 -7.160) 8.998 5.179 ( -1.447 4.156 0.634) 4.446 5.384 ( 4.198 -2.935 0.507) 5.148 5.410 ( -0.830 -8.265 -0.335) 8.314 5.715 ( -2.484 2.430 -2.988) 4.583 5.875 ( -5.520 -3.428 -2.306) 6.894 6.010 ( -0.152 7.692 3.241) 8.349 6.040 ( 4.166 0.686 -2.870) 5.105 6.270 ( -0.253 -1.997 0.930) 2.217 6.385 ( 11.643 5.324 2.908) 13.129 6.406 ( 2.388 1.206 1.124) 2.902 6.588 ( -1.140 -2.803 4.609) 5.514 6.813 ( -0.449 6.996 -2.057) 7.306 7.183 ( -5.586 -1.257 2.214) 6.139 7.263 ( 4.101 -2.338 -1.672) 5.007 7.596 ( -7.563 5.411 0.019) 9.300 7.642 ( -16.612 -4.706 -6.341) 18.393 7.698 ( -0.826 6.009 3.222) 6.868 8.395 ( 4.599 -9.463 -1.544) 10.634 8.750 ( 5.576 -1.580 4.334) 7.237 8.847 ( -2.648 -4.264 -4.038) 6.442 9.086 ( -7.283 3.947 5.292) 9.829 9.148 ( 2.292 -4.249 -12.070) 12.999 9.222 ( 12.851 2.292 6.413) 14.544 9.349 ( -3.234 -4.123 10.428) 11.671 9.583 ( -2.748 4.132 -0.683) 5.009 10.018 ( -4.884 -4.179 -1.024) 6.509 10.421 ( 3.684 0.318 4.609) 5.909 10.770 ( -2.481 1.953 -3.281) 4.553 10.918 ( -0.576 -3.588 -8.358) 9.114 11.087 ( -0.638 -12.605 -8.173) 15.036 11.175 ( 1.601 -5.653 1.557) 6.078 11.536 ( -7.083 7.518 21.741) 24.070 11.684 ( -0.480 0.546 1.838) 1.976 11.739 ( -6.020 -2.028 9.322) 11.281 11.862 ( 4.237 2.555 -0.875) 5.025 12.016 ( 3.516 4.965 -0.650) 6.118 12.368 ( -4.101 0.356 -4.447) 6.060 12.451 ( -3.540 0.577 -6.397) 7.333 12.679 ( 3.446 -0.376 8.070) 8.783 13.247 ( -24.302 -11.948 -25.394) 37.124 13.341 ( -28.838 -2.472 27.457) 39.896 14.635 ( -1.263 8.397 -1.093) 8.561 14.816 ( 1.814 4.376 -0.864) 4.816 14.893 ( 7.146 4.961 -0.945) 8.751 15.024 ( 1.299 -5.871 0.447) 6.029 15.202 ( 17.310 4.501 -3.863) 18.298 15.231 ( 0.250 5.033 -1.164) 5.171 15.545 ( 2.729 8.289 6.404) 10.825 15.589 ( 1.054 -3.456 -0.919) 3.728 15.755 ( 1.451 -2.119 -1.369) 2.911 16.056 ( -7.573 1.397 6.679) 10.194 16.283 ( -7.038 -0.089 2.406) 7.439 16.470 ( 2.336 -6.873 -7.265) 10.270 16.651 ( 13.902 12.436 1.299) 18.698 16.839 ( 21.356 3.036 -4.329) 22.001 17.594 ( 2.025 -0.766 0.166) 2.172 17.976 ( 5.645 1.961 -17.644) 18.629 25.501 ( 0.740 -1.916 0.611) 2.143 25.587 ( -0.150 1.231 1.356) 1.838 25.650 ( -0.312 -1.873 2.037) 2.784 25.754 ( -0.364 -0.500 0.480) 0.783 25.881 ( -0.351 -1.063 -0.167) 1.131 26.304 ( -2.844 -1.862 -11.157) 11.663 26.434 ( -1.239 -1.413 -1.555) 2.439 26.439 ( -2.187 -1.789 9.295) 9.715 26.680 ( -0.196 -1.247 3.289) 3.523 27.411 ( -24.218 0.369 -7.862) 25.465 27.898 ( -35.865 -23.112 -2.122) 42.719 28.273 ( 0.312 0.154 0.937) 0.999 28.382 ( -7.899 -12.842 -0.585) 15.089 28.471 ( -4.329 -6.404 -0.583) 7.751 29.290 ( 0.281 3.986 -4.084) 5.714 29.760 ( 82.534 46.463 15.059) 95.903 ======================= Grid point 2 (3/140) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.903 ( 20.386 -15.788 -0.168) 25.786 1.204 ( 9.007 -23.545 14.236) 28.951 1.552 ( 11.276 -22.686 11.704) 27.906 1.834 ( -1.292 -23.563 4.768) 24.075 2.239 ( -6.248 -8.593 -3.893) 11.315 2.498 ( -0.952 -8.295 -4.509) 9.489 2.554 ( -0.752 -7.265 3.190) 7.970 2.757 ( -0.458 -12.733 -0.646) 12.758 2.820 ( -4.356 -14.731 5.109) 16.189 2.937 ( 5.201 -14.405 -4.590) 15.988 3.026 ( 1.780 -1.268 1.577) 2.695 3.245 ( 4.235 6.903 -0.047) 8.099 3.445 ( -2.650 1.825 -2.203) 3.900 3.592 ( -2.531 3.272 -3.224) 5.245 3.728 ( 2.209 -0.244 3.064) 3.785 3.970 ( -4.136 -2.931 -6.998) 8.641 4.039 ( -4.588 7.228 -7.381) 11.304 4.056 ( -5.472 0.435 4.772) 7.273 4.369 ( 5.091 8.080 -3.893) 10.313 4.442 ( -1.175 0.503 7.154) 7.268 4.520 ( -4.719 -3.410 0.154) 5.824 4.611 ( 6.292 -4.529 9.131) 11.978 4.902 ( -1.788 1.832 -4.293) 4.998 5.125 ( -1.613 1.574 0.208) 2.264 5.475 ( 3.987 -2.718 1.385) 5.020 5.529 ( -0.247 -6.841 -5.605) 8.847 5.669 ( 0.616 -0.076 -0.820) 1.028 5.827 ( -3.953 2.920 -1.735) 5.212 5.891 ( 2.723 8.263 3.141) 9.250 6.054 ( 3.150 -0.105 -2.594) 4.082 6.259 ( -1.844 2.748 -2.082) 3.910 6.353 ( 0.931 1.141 4.837) 5.056 6.524 ( 8.412 -3.168 1.481) 9.110 6.614 ( -4.160 -0.640 2.038) 4.676 6.722 ( 3.093 1.643 -5.659) 6.655 7.174 ( 0.108 0.030 -1.128) 1.134 7.269 ( -1.497 4.246 -2.866) 5.337 7.389 ( -6.608 6.366 -3.144) 9.700 7.518 ( -12.853 2.603 -1.407) 13.189 7.647 ( -1.697 2.374 1.498) 3.280 8.599 ( 3.797 -9.269 0.647) 10.037 8.837 ( 0.633 -3.102 2.856) 4.264 8.904 ( -0.079 -5.791 -2.526) 6.319 9.021 ( -7.801 -2.480 -1.909) 8.406 9.198 ( -3.314 -8.533 -8.359) 12.397 9.304 ( 5.778 3.887 12.157) 14.010 9.424 ( -6.176 -2.739 -0.583) 6.782 9.519 ( 4.051 -1.288 1.843) 4.633 10.038 ( -4.080 -2.547 -1.102) 4.935 10.489 ( 5.085 -0.385 6.901) 8.580 10.730 ( 1.659 0.852 -0.413) 1.911 10.946 ( 4.088 -0.764 -0.826) 4.240 11.223 ( -0.294 -5.528 -2.566) 6.101 11.307 ( 2.398 -6.525 1.344) 7.081 11.508 ( 4.405 0.863 4.087) 6.071 11.665 ( -1.969 0.137 -0.529) 2.043 11.755 ( -3.672 0.532 6.964) 7.890 11.882 ( 4.278 -0.187 2.078) 4.759 11.917 ( 2.654 8.363 -0.979) 8.828 12.312 ( -3.322 0.734 -4.299) 5.482 12.361 ( -4.543 0.145 -10.339) 11.294 12.749 ( 2.293 0.253 8.300) 8.615 13.066 ( -9.350 7.064 -10.754) 15.905 13.271 ( -20.955 1.468 18.126) 27.746 14.524 ( -0.219 2.874 -1.635) 3.314 14.709 ( 4.374 7.928 0.340) 9.061 14.894 ( 1.105 -0.897 -1.812) 2.304 15.101 ( -0.846 -0.552 -5.850) 5.936 15.170 ( -3.628 -3.348 3.515) 6.061 15.258 ( 6.161 -0.063 0.684) 6.199 15.438 ( 1.843 7.859 0.512) 8.088 15.636 ( -1.530 -1.356 1.608) 2.602 15.779 ( 6.307 0.627 -6.273) 8.918 15.997 ( -8.398 2.017 8.386) 12.038 16.229 ( 2.563 6.631 -0.692) 7.143 16.541 ( -5.176 -4.882 -1.483) 7.268 16.595 ( 10.103 2.869 -3.327) 11.017 16.937 ( 10.316 -1.417 -1.513) 10.523 17.624 ( 2.994 -0.013 0.028) 2.995 17.877 ( 0.464 4.906 -7.188) 8.715 25.555 ( 1.241 -2.946 0.616) 3.255 25.584 ( 0.601 -0.013 1.457) 1.576 25.687 ( 0.293 -1.617 0.759) 1.810 25.764 ( -0.735 -0.711 1.083) 1.490 25.887 ( -0.739 -0.110 -0.388) 0.842 26.279 ( 0.225 -1.167 -5.367) 5.497 26.439 ( -1.604 -1.606 -2.385) 3.292 26.485 ( -1.899 0.796 12.695) 12.861 26.716 ( -0.257 -3.604 -6.582) 7.508 27.201 ( -13.040 3.388 -2.816) 13.764 27.948 ( -9.110 -4.785 0.085) 10.290 28.288 ( -0.002 -0.463 3.165) 3.199 28.538 ( -6.886 -10.266 2.727) 12.658 28.605 ( -4.155 -14.938 -1.789) 15.608 29.181 ( 1.329 6.192 -6.373) 8.985 29.665 ( 37.124 26.523 5.741) 45.985 ======================= Grid point 3 (4/140) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.279 ( 15.946 -11.327 1.555) 19.622 1.648 ( 1.989 -17.767 4.764) 18.502 1.914 ( 2.582 -9.885 12.619) 16.236 2.140 ( -3.951 -15.412 -3.182) 16.226 2.430 ( 4.434 -12.165 3.648) 13.452 2.532 ( -1.800 -2.280 -3.955) 4.907 2.675 ( -3.642 -6.984 1.363) 7.994 2.914 ( 5.327 -1.698 -3.976) 6.860 3.008 ( -3.001 -4.144 1.829) 5.434 3.069 ( 0.627 -1.329 5.448) 5.643 3.103 ( -1.534 -13.538 5.008) 14.516 3.306 ( 1.464 1.480 -6.322) 6.656 3.409 ( 2.999 -4.137 0.598) 5.145 3.498 ( -3.589 1.416 -4.994) 6.311 3.717 ( -2.739 1.603 1.749) 3.624 3.817 ( -3.014 9.467 -5.404) 11.309 4.045 ( -0.136 -1.107 -1.046) 1.529 4.068 ( 1.569 -10.086 -1.609) 10.333 4.263 ( 3.684 5.619 -3.011) 7.363 4.429 ( -6.528 0.212 8.348) 10.599 4.582 ( -0.352 -3.725 3.222) 4.937 4.794 ( 6.322 -1.892 4.568) 8.025 4.821 ( -1.742 1.076 0.806) 2.201 5.086 ( -2.251 1.436 -1.278) 2.960 5.512 ( 1.674 -0.058 -5.167) 5.432 5.569 ( -3.430 -4.447 -5.086) 7.576 5.708 ( -1.421 -0.411 -2.536) 2.936 5.769 ( 2.702 0.313 4.594) 5.339 5.823 ( 4.173 4.599 3.712) 7.235 6.070 ( 4.877 -0.096 -2.714) 5.582 6.189 ( -0.727 2.093 -3.415) 4.071 6.342 ( -3.561 2.371 3.623) 5.606 6.547 ( -6.569 0.611 -0.413) 6.611 6.664 ( 7.546 -1.887 2.356) 8.127 6.733 ( 3.572 -2.123 -6.380) 7.614 7.068 ( -4.212 8.644 -2.114) 9.845 7.196 ( 1.547 -0.799 -2.964) 3.437 7.301 ( -2.114 1.236 -4.047) 4.730 7.370 ( -9.626 3.997 1.387) 10.515 7.598 ( -2.444 2.463 2.158) 4.086 8.696 ( 2.833 1.125 2.139) 3.724 8.885 ( -6.257 -3.725 -5.049) 8.861 9.005 ( -0.663 -6.144 5.622) 8.354 9.045 ( -1.728 -6.502 -2.551) 7.195 9.259 ( -3.314 -3.134 -2.487) 5.196 9.311 ( 5.676 4.953 5.013) 9.048 9.420 ( -4.738 -7.075 -2.114) 8.774 9.659 ( 3.265 -6.811 1.608) 7.722 10.021 ( -2.286 1.241 0.188) 2.608 10.545 ( 3.310 1.762 6.115) 7.173 10.788 ( 4.064 -5.214 -0.583) 6.636 10.986 ( 3.557 0.116 1.572) 3.890 11.242 ( -3.763 -0.977 1.912) 4.333 11.438 ( 2.227 -6.699 -1.559) 7.230 11.533 ( 5.726 4.379 -1.412) 7.345 11.682 ( -0.174 2.701 1.872) 3.291 11.732 ( 2.986 1.846 2.575) 4.354 11.798 ( -2.717 0.440 2.447) 3.683 11.961 ( 4.940 -2.548 -2.017) 5.914 12.239 ( -2.454 0.584 -7.723) 8.125 12.315 ( -0.993 -0.862 -4.447) 4.637 12.747 ( -0.769 6.513 -7.599) 10.038 12.831 ( -6.692 5.698 8.449) 12.192 13.144 ( -13.813 6.219 12.720) 19.781 14.522 ( 1.500 -2.609 -1.275) 3.268 14.667 ( 1.609 0.699 1.863) 2.559 14.884 ( -2.886 0.401 -1.207) 3.154 15.089 ( 2.245 -1.282 -3.850) 4.638 15.171 ( -1.789 3.582 -0.725) 4.069 15.304 ( 3.384 0.465 0.310) 3.430 15.382 ( -0.682 -2.186 2.101) 3.108 15.616 ( -3.164 2.386 2.269) 4.566 15.778 ( 6.669 1.618 -6.823) 9.677 15.950 ( -5.353 2.198 7.529) 9.496 16.097 ( 2.244 8.797 -2.945) 9.545 16.562 ( -3.630 -2.341 2.343) 4.914 16.655 ( 5.128 -3.589 -5.424) 8.282 17.017 ( 5.966 -0.930 -0.240) 6.043 17.627 ( 2.917 2.752 -0.455) 4.036 17.776 ( -1.666 2.846 -2.896) 4.389 25.595 ( 1.057 -0.813 0.618) 1.470 25.631 ( 1.304 -3.192 1.256) 3.670 25.712 ( 0.419 -0.876 -0.437) 1.065 25.776 ( -0.916 -0.682 1.677) 2.029 25.865 ( -0.992 1.585 -0.545) 1.948 26.289 ( 1.485 -1.083 -1.795) 2.569 26.432 ( -2.174 -0.695 -2.628) 3.481 26.511 ( -1.784 1.264 11.162) 11.374 26.715 ( -1.860 -2.422 -10.489) 10.924 27.091 ( -3.864 1.929 2.109) 4.806 27.939 ( -3.748 -0.881 -1.103) 4.005 28.307 ( -0.984 -0.275 2.895) 3.070 28.674 ( -3.764 -8.720 5.059) 10.761 28.826 ( -6.929 -17.115 -3.071) 18.718 29.063 ( 3.330 6.195 -4.902) 8.573 29.509 ( 20.862 21.107 1.686) 29.725 ======================= Grid point 4 (5/140) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.504 ( 5.995 -3.826 1.016) 7.184 1.896 ( -0.599 -13.037 -1.936) 13.193 2.049 ( 0.164 4.378 7.423) 8.619 2.303 ( 0.531 -8.688 0.530) 8.720 2.496 ( -2.212 2.220 -3.108) 4.414 2.634 ( 1.994 -5.288 1.600) 5.874 2.766 ( -0.875 -5.505 1.065) 5.675 2.879 ( 1.354 3.716 -1.817) 4.352 3.105 ( -1.491 -3.102 3.437) 4.864 3.129 ( 3.608 -0.245 -0.669) 3.678 3.200 ( -1.643 -4.459 1.857) 5.102 3.358 ( -0.704 -2.565 5.795) 6.376 3.377 ( -0.410 0.792 -5.407) 5.480 3.480 ( 0.599 0.520 -1.876) 2.037 3.543 ( -6.181 6.812 -4.941) 10.441 3.812 ( 3.638 -1.803 1.124) 4.213 4.028 ( -0.740 0.655 -1.479) 1.779 4.146 ( 0.911 1.772 -1.059) 2.256 4.331 ( 7.766 -6.560 -1.314) 10.251 4.419 ( -7.065 -0.224 5.679) 9.067 4.649 ( -0.772 -3.094 2.278) 3.919 4.730 ( -1.111 2.999 -0.453) 3.230 4.922 ( 3.748 -1.199 2.630) 4.733 5.033 ( -2.399 1.290 -1.351) 3.040 5.499 ( 1.462 -0.382 -5.092) 5.312 5.568 ( -2.105 -0.376 -1.127) 2.417 5.671 ( -2.710 0.063 0.181) 2.717 5.824 ( 2.844 0.787 4.445) 5.336 5.835 ( 1.818 -0.765 -0.095) 1.975 6.130 ( 8.194 -2.249 -1.013) 8.557 6.152 ( 0.877 0.096 -3.550) 3.658 6.254 ( -8.905 3.812 2.595) 10.028 6.482 ( -2.882 1.193 -1.261) 3.364 6.737 ( 1.924 -1.810 -2.140) 3.399 6.760 ( 2.415 0.386 1.150) 2.703 6.944 ( -1.533 2.221 -1.196) 2.951 7.192 ( 0.670 0.545 -2.969) 3.092 7.261 ( 0.016 2.948 2.365) 3.780 7.287 ( -3.873 -1.647 -1.924) 4.628 7.557 ( -1.349 1.401 1.514) 2.464 8.690 ( 1.517 1.451 1.099) 2.369 8.841 ( -4.430 -0.187 -2.045) 4.883 9.105 ( -1.294 -4.360 -0.500) 4.575 9.147 ( 1.599 -3.567 2.704) 4.753 9.240 ( -2.302 1.171 1.583) 3.029 9.291 ( 3.176 2.361 -1.269) 4.156 9.522 ( -1.629 -6.415 -1.710) 6.836 9.753 ( 1.435 -1.377 -0.159) 1.995 9.985 ( -0.960 1.140 1.313) 1.986 10.555 ( 1.212 1.112 2.121) 2.684 10.907 ( 2.415 -4.351 -0.567) 5.009 11.004 ( 1.510 0.908 1.410) 2.256 11.267 ( -2.479 -4.190 1.891) 5.223 11.429 ( 0.822 8.257 0.159) 8.299 11.534 ( -0.822 -4.977 -6.842) 8.501 11.591 ( 1.942 5.240 4.696) 7.299 11.790 ( 2.578 -1.396 2.420) 3.802 11.842 ( -0.255 -2.348 1.528) 2.813 11.997 ( 1.365 -0.608 -4.127) 4.390 12.206 ( 0.328 -0.368 -3.313) 3.349 12.315 ( 0.849 -0.510 -0.213) 1.013 12.545 ( -4.466 5.652 -3.220) 7.890 12.831 ( 1.372 -0.480 2.154) 2.598 13.007 ( -7.111 4.657 6.246) 10.548 14.598 ( 2.928 -3.879 -0.389) 4.876 14.678 ( -1.979 0.533 0.353) 2.080 14.878 ( -1.628 -3.527 2.154) 4.442 15.007 ( 0.561 8.474 -2.476) 8.846 15.169 ( 0.454 -3.288 -2.432) 4.114 15.312 ( 1.531 0.841 0.635) 1.859 15.459 ( -0.023 -4.593 1.486) 4.827 15.548 ( -1.944 3.802 0.621) 4.315 15.764 ( 1.704 1.063 -1.964) 2.809 15.900 ( -0.564 3.193 2.084) 3.854 16.003 ( 0.027 1.783 -1.195) 2.147 16.581 ( -1.052 -0.950 0.849) 1.652 16.712 ( 1.585 -1.844 -2.046) 3.177 17.056 ( 1.965 -0.216 0.070) 1.978 17.586 ( 0.907 2.366 -0.409) 2.567 17.738 ( -0.705 0.226 -0.588) 0.945 25.616 ( 0.588 -0.470 0.440) 0.872 25.694 ( 0.821 -2.405 0.317) 2.561 25.718 ( 0.171 0.148 -0.308) 0.382 25.788 ( -0.526 -0.474 1.010) 1.233 25.824 ( -0.656 1.756 -0.511) 1.943 26.311 ( 1.066 -0.444 0.106) 1.160 26.411 ( -1.262 -0.020 -1.513) 1.970 26.522 ( -0.959 0.782 4.686) 4.847 26.690 ( -0.979 -1.008 -5.117) 5.306 27.072 ( -0.294 0.460 1.581) 1.673 27.921 ( -1.172 -0.104 -0.696) 1.367 28.311 ( -0.698 0.009 0.923) 1.157 28.799 ( -2.631 -5.297 5.521) 8.091 28.937 ( 0.072 0.017 -8.594) 8.595 29.083 ( -5.066 -12.776 3.408) 14.159 29.308 ( 12.010 18.049 -0.763) 21.693 ======================= Grid point 10 (6/140) ======================= q-point: ( 0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.543 ( 22.154 0.000 19.169) 29.296 0.612 ( 36.138 0.000 4.710) 36.443 1.022 ( 38.262 0.000 35.412) 52.134 1.254 ( 2.936 0.000 3.996) 4.958 2.009 ( -3.298 -0.000 -3.318) 4.678 2.145 ( -9.537 -0.000 1.317) 9.628 2.370 ( -11.344 -0.000 3.117) 11.765 2.507 ( 1.312 0.000 -6.647) 6.775 2.592 ( -5.096 -0.000 0.473) 5.117 2.714 ( 11.462 0.000 -2.168) 11.665 2.996 ( 2.276 0.000 2.442) 3.338 3.409 ( -1.606 -0.000 -11.179) 11.293 3.594 ( -1.676 -0.000 -2.772) 3.239 3.652 ( 3.936 0.000 1.612) 4.253 3.686 ( -2.535 -0.000 -1.627) 3.013 3.766 ( -1.608 -0.000 6.065) 6.275 4.201 ( -3.739 -0.000 -0.011) 3.739 4.211 ( -2.192 -0.000 -3.263) 3.931 4.330 ( -0.299 -0.000 7.928) 7.933 4.409 ( -14.900 -0.000 -2.676) 15.138 4.549 ( 6.367 0.000 -0.932) 6.435 4.676 ( 1.974 0.000 4.101) 4.552 4.762 ( 6.747 0.000 -8.425) 10.793 5.236 ( -4.413 -0.000 -0.580) 4.451 5.290 ( -0.351 -0.000 1.013) 1.073 5.401 ( 9.058 0.000 2.422) 9.376 5.687 ( 1.034 0.000 -0.409) 1.112 5.800 ( -3.105 -0.000 -3.324) 4.549 6.052 ( 1.770 0.000 1.509) 2.326 6.122 ( 4.935 0.000 -1.603) 5.189 6.275 ( 1.825 0.000 1.492) 2.357 6.445 ( -3.718 -0.000 -0.639) 3.773 6.466 ( 9.037 0.000 -2.422) 9.356 6.717 ( 1.012 0.000 -0.665) 1.211 6.857 ( -4.943 -0.000 -0.665) 4.987 7.082 ( -17.559 -0.000 17.217) 24.591 7.229 ( 0.663 0.000 -4.644) 4.691 7.482 ( 4.866 0.000 1.397) 5.062 7.606 ( -6.951 -0.000 4.363) 8.206 7.725 ( -8.038 -0.000 0.623) 8.062 8.335 ( 4.111 0.000 0.698) 4.170 8.750 ( -1.983 -0.000 -4.669) 5.073 8.796 ( -3.444 -0.000 -1.859) 3.914 8.953 ( -2.110 -0.000 -19.059) 19.176 9.206 ( 1.115 0.000 -2.100) 2.378 9.289 ( -12.393 -0.000 8.697) 15.140 9.534 ( 6.303 0.000 -3.074) 7.012 9.816 ( -2.820 -0.000 1.712) 3.299 9.827 ( -5.089 -0.000 22.511) 23.079 10.310 ( -0.677 -0.000 4.504) 4.555 10.483 ( 4.344 0.000 6.101) 7.489 10.850 ( 1.976 0.000 -0.767) 2.119 11.023 ( 2.756 0.000 3.867) 4.748 11.174 ( 6.149 0.000 1.714) 6.384 11.609 ( -13.524 -0.000 12.535) 18.440 11.695 ( -0.921 -0.000 -2.020) 2.220 11.750 ( -18.451 -0.000 35.134) 39.684 11.854 ( -2.762 -0.000 -0.231) 2.771 12.127 ( 2.686 0.000 -0.569) 2.745 12.305 ( -2.434 -0.000 -7.336) 7.730 12.423 ( -3.091 -0.000 -6.360) 7.072 12.633 ( -7.657 -0.000 11.626) 13.921 12.792 ( 12.541 0.000 -2.194) 12.732 13.326 ( -6.741 -0.000 4.257) 7.972 14.737 ( -4.736 -0.000 1.287) 4.907 14.794 ( -2.955 -0.000 -0.294) 2.969 14.870 ( 3.396 0.000 -0.151) 3.399 15.103 ( 3.788 0.000 3.691) 5.289 15.176 ( -3.995 -0.000 -4.720) 6.183 15.534 ( 0.688 0.000 -1.526) 1.674 15.539 ( 19.025 0.000 -17.988) 26.182 15.708 ( -1.197 -0.000 -1.164) 1.670 15.731 ( -6.451 -0.000 11.281) 12.995 16.088 ( -1.020 -0.000 2.942) 3.114 16.128 ( -11.705 -0.000 5.047) 12.746 16.389 ( 2.630 0.000 -6.379) 6.900 16.752 ( 2.834 0.000 2.784) 3.973 17.379 ( 4.931 0.000 -1.446) 5.139 17.575 ( -0.198 -0.000 -0.130) 0.237 17.856 ( 35.867 0.000 -60.996) 70.759 25.498 ( 1.395 0.000 1.242) 1.868 25.613 ( 0.569 0.000 0.271) 0.630 25.643 ( -5.446 -0.000 9.645) 11.076 25.749 ( -0.546 -0.000 0.747) 0.925 25.872 ( -0.979 -0.000 1.822) 2.069 26.114 ( 2.460 0.000 3.445) 4.233 26.355 ( -1.741 -0.000 -1.953) 2.616 26.427 ( -0.539 -0.000 -0.048) 0.541 26.799 ( -14.992 -0.000 24.992) 29.144 27.000 ( 2.351 0.000 2.885) 3.721 27.561 ( 0.093 0.000 -4.002) 4.003 28.282 ( -0.520 -0.000 2.010) 2.076 28.286 ( -1.313 -0.000 -1.435) 1.945 28.402 ( -1.433 -0.000 0.083) 1.435 29.294 ( -0.078 -0.000 -7.274) 7.274 30.882 ( 18.168 0.000 -27.518) 32.974 ======================= Grid point 11 (7/140) ======================= q-point: ( 0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.873 ( 24.189 -9.942 5.009) 26.628 1.041 ( 22.034 -14.074 12.097) 28.808 1.424 ( 5.688 -17.138 11.198) 21.247 1.592 ( 17.615 -9.873 22.140) 29.966 2.031 ( -3.510 -8.664 -3.273) 9.904 2.240 ( -3.633 -15.871 1.281) 16.332 2.421 ( -10.414 -10.186 3.634) 15.014 2.505 ( 1.016 -6.078 -1.644) 6.378 2.623 ( -3.029 -7.863 -0.528) 8.442 2.832 ( 11.007 -5.149 -2.710) 12.450 3.034 ( 1.923 -0.951 2.950) 3.648 3.323 ( -1.222 1.830 -13.721) 13.896 3.487 ( -2.007 5.660 2.069) 6.352 3.614 ( -3.258 2.663 -3.405) 5.413 3.727 ( 2.318 -2.047 4.048) 5.094 3.828 ( -3.167 -3.492 -3.162) 5.677 4.084 ( -4.941 7.370 -2.469) 9.210 4.105 ( -6.658 5.042 1.176) 8.434 4.338 ( -9.648 -4.510 -4.298) 11.485 4.451 ( 2.166 -5.407 7.913) 9.826 4.569 ( 6.527 4.436 1.895) 8.116 4.662 ( 3.866 1.381 5.403) 6.786 4.841 ( 0.899 -4.195 -6.991) 8.202 5.150 ( -3.311 2.965 -0.220) 4.450 5.364 ( -2.081 -6.093 -1.684) 6.655 5.490 ( 3.961 -1.616 -0.574) 4.316 5.691 ( 3.185 1.474 -2.175) 4.129 5.786 ( -2.273 -2.552 -1.169) 3.612 6.048 ( 1.452 3.992 1.583) 4.533 6.101 ( 7.404 4.196 -3.733) 9.293 6.277 ( -0.597 1.693 0.698) 1.926 6.407 ( -2.381 1.165 1.750) 3.176 6.567 ( 9.596 -2.773 -0.627) 10.009 6.622 ( -2.065 6.254 5.423) 8.532 6.770 ( -0.282 4.281 -3.897) 5.796 7.100 ( -7.961 -5.711 2.619) 10.142 7.255 ( -2.563 -3.717 -4.971) 6.715 7.424 ( -5.143 9.293 -8.188) 13.411 7.511 ( -3.146 5.592 7.459) 9.839 7.671 ( -6.418 0.067 2.671) 6.952 8.460 ( 3.092 -8.907 3.157) 9.943 8.736 ( -4.587 -3.351 -6.160) 8.379 8.781 ( -2.183 -5.834 -4.091) 7.452 8.935 ( -5.431 -7.322 -10.160) 13.650 9.086 ( -3.991 6.911 2.755) 8.443 9.283 ( -8.194 -4.229 -0.349) 9.227 9.526 ( 11.644 5.532 7.015) 14.676 9.619 ( 1.906 8.295 7.097) 11.082 9.962 ( -2.921 -3.863 4.518) 6.624 10.550 ( 4.733 -0.561 6.048) 7.700 10.656 ( -4.578 -15.536 -1.731) 16.288 10.897 ( 2.940 -5.221 -1.492) 6.174 11.113 ( 3.645 -5.490 4.227) 7.829 11.263 ( 6.879 -3.331 1.087) 7.720 11.533 ( -6.408 2.110 3.809) 7.747 11.669 ( 0.054 0.967 -3.041) 3.192 11.776 ( -4.758 -0.052 13.188) 14.020 11.884 ( -5.755 -3.920 6.555) 9.563 12.078 ( 1.974 7.050 1.194) 7.418 12.262 ( -1.221 -0.425 -5.996) 6.134 12.303 ( -3.584 3.657 -8.703) 10.098 12.748 ( -13.320 -7.928 12.333) 19.809 12.900 ( 3.609 -4.497 -6.059) 8.364 13.258 ( -8.931 4.129 7.070) 12.116 14.599 ( -2.556 7.379 1.514) 7.954 14.807 ( -1.081 -0.003 -1.876) 2.165 14.941 ( 1.168 -1.557 -1.910) 2.727 15.061 ( -3.590 -0.449 1.517) 3.923 15.148 ( 4.477 5.837 -0.746) 7.394 15.405 ( 9.773 9.651 -4.063) 14.324 15.580 ( -1.591 2.060 1.180) 2.858 15.619 ( 1.619 4.348 -0.384) 4.655 15.786 ( 7.971 -2.518 -6.491) 10.584 16.009 ( -8.369 2.373 7.987) 11.809 16.194 ( -6.914 -5.551 1.725) 9.033 16.408 ( -2.332 -4.484 -5.257) 7.293 16.781 ( 7.385 3.931 1.329) 8.471 17.147 ( 17.933 16.517 -5.812) 25.063 17.632 ( 1.097 -1.969 1.556) 2.739 17.868 ( 5.983 -0.905 -21.647) 22.477 25.532 ( 1.860 -1.674 1.292) 2.816 25.607 ( 0.396 0.894 2.221) 2.427 25.667 ( -0.806 -1.613 2.583) 3.150 25.752 ( -0.901 -0.526 1.008) 1.451 25.875 ( -0.705 -0.325 1.222) 1.448 26.227 ( 1.248 -4.079 -0.867) 4.353 26.365 ( -3.814 -3.384 -2.684) 5.762 26.455 ( -2.264 -4.117 2.083) 5.139 26.733 ( -1.452 5.078 8.983) 10.420 27.110 ( -6.527 -3.365 2.562) 7.778 27.691 ( -4.451 -15.335 -2.409) 16.148 28.268 ( -2.854 -1.248 -0.433) 3.145 28.330 ( -2.389 -5.706 0.853) 6.244 28.432 ( -1.846 -5.120 -0.339) 5.454 29.230 ( 1.243 2.997 -9.116) 9.676 30.521 ( 24.231 35.488 -3.751) 43.135 ======================= Grid point 12 (8/140) ======================= q-point: ( 0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.263 ( 21.964 -11.816 2.783) 25.096 1.422 ( 4.800 -11.636 6.172) 14.018 1.811 ( -1.100 -19.460 1.110) 19.523 1.870 ( 7.426 -9.529 16.853) 20.736 2.279 ( 5.998 -14.402 6.181) 16.781 2.409 ( -1.691 -6.296 -5.517) 8.540 2.506 ( -8.586 -9.156 5.233) 13.599 2.751 ( -4.008 -16.608 5.364) 17.907 2.812 ( 1.893 -14.104 -2.151) 14.393 3.005 ( 6.156 -4.393 -1.642) 7.739 3.086 ( 1.408 -1.628 5.295) 5.716 3.240 ( 0.026 -2.409 -10.853) 11.117 3.426 ( 0.270 1.887 1.791) 2.616 3.501 ( -2.272 5.714 -3.952) 7.310 3.714 ( -6.333 -0.690 -2.167) 6.729 3.869 ( -4.290 7.039 -8.881) 12.117 3.919 ( 1.460 -6.203 1.333) 6.511 4.047 ( -0.455 -0.492 3.921) 3.978 4.303 ( -4.582 0.185 -4.058) 6.123 4.526 ( 4.494 6.858 6.400) 10.402 4.573 ( 1.743 -2.516 7.512) 8.111 4.780 ( 1.970 -5.457 8.579) 10.357 4.840 ( 0.741 0.459 -4.318) 4.405 5.089 ( -2.041 1.495 -1.912) 3.171 5.399 ( -4.904 -3.479 -8.644) 10.530 5.502 ( -0.002 -1.127 -1.672) 2.017 5.678 ( -3.187 -0.203 -1.557) 3.553 5.836 ( 7.763 -0.401 2.154) 8.066 5.971 ( 2.407 6.696 2.141) 7.431 6.098 ( 8.007 0.590 -5.808) 9.909 6.218 ( -2.117 3.741 -0.147) 4.301 6.368 ( -3.996 2.218 0.848) 4.648 6.533 ( -2.034 3.223 0.233) 3.819 6.694 ( 5.870 -3.247 1.953) 6.987 6.713 ( 2.828 1.596 -2.895) 4.350 7.127 ( -9.208 2.720 -4.460) 10.586 7.188 ( -1.148 2.348 -1.464) 2.996 7.225 ( -6.301 -0.167 -4.906) 7.987 7.427 ( -0.108 6.027 3.681) 7.063 7.636 ( -3.737 1.374 3.533) 5.323 8.643 ( -0.780 -7.808 1.414) 7.973 8.745 ( -4.128 -4.819 -5.610) 8.469 8.855 ( -6.053 -8.284 -3.944) 10.991 8.975 ( -2.862 -4.768 0.560) 5.589 9.065 ( 0.160 -7.069 -4.556) 8.411 9.290 ( -6.090 -4.283 -1.877) 7.678 9.508 ( 4.036 8.877 7.224) 12.137 9.634 ( 6.374 -2.283 5.250) 8.567 10.014 ( -1.155 -1.242 3.921) 4.272 10.622 ( 3.630 0.043 5.110) 6.268 10.750 ( 1.827 -3.021 -0.024) 3.530 10.997 ( 2.031 -3.122 1.401) 3.980 11.220 ( 1.224 -1.722 0.398) 2.150 11.373 ( 2.935 -2.336 1.211) 3.942 11.569 ( 3.410 -9.098 -2.816) 10.116 11.639 ( 1.333 1.868 -1.504) 2.744 11.798 ( -0.285 0.599 6.005) 6.042 11.896 ( -4.802 5.554 2.606) 7.791 11.981 ( 0.455 1.922 4.351) 4.779 12.199 ( -1.096 0.700 -7.671) 7.781 12.248 ( 0.113 -1.061 -4.531) 4.655 12.795 ( -8.905 -2.044 8.635) 12.571 12.861 ( -4.213 5.098 -7.020) 9.644 13.148 ( -12.176 3.861 10.572) 16.581 14.515 ( -0.495 1.977 2.118) 2.939 14.743 ( -0.895 4.449 -1.790) 4.878 14.911 ( 2.194 2.879 -1.467) 3.906 15.043 ( 0.969 1.749 -4.161) 4.617 15.158 ( -1.371 -4.617 2.876) 5.610 15.366 ( 5.891 3.536 1.294) 6.992 15.463 ( 2.889 7.680 -1.473) 8.336 15.622 ( -2.573 -0.382 1.954) 3.254 15.825 ( 8.534 1.174 -8.419) 12.045 15.957 ( -7.179 1.065 6.939) 10.041 16.170 ( -7.140 2.346 -1.571) 7.678 16.458 ( -3.233 -5.912 -0.588) 6.763 16.751 ( 12.422 6.592 -1.910) 14.192 17.096 ( 11.108 3.817 -1.811) 11.884 17.667 ( 2.133 0.109 0.052) 2.136 17.780 ( -2.934 2.641 -8.797) 9.642 25.585 ( 1.867 -2.048 0.381) 2.797 25.622 ( 1.020 -0.514 3.453) 3.637 25.697 ( 0.271 -1.295 0.138) 1.330 25.761 ( -1.291 -0.888 1.394) 2.097 25.873 ( -0.911 0.561 0.570) 1.212 26.282 ( 3.121 -1.477 0.502) 3.489 26.367 ( -3.788 -2.434 -3.093) 5.462 26.501 ( -4.244 -2.831 0.097) 5.102 26.699 ( 0.619 2.770 5.340) 6.048 27.104 ( -0.844 0.681 2.856) 3.055 27.837 ( -4.568 -7.348 -2.746) 9.078 28.263 ( -6.047 -2.497 -1.345) 6.679 28.461 ( -4.886 -12.954 -0.751) 13.865 28.535 ( -2.888 -8.932 0.221) 9.390 29.145 ( 3.674 3.974 -7.538) 9.279 30.146 ( 20.371 30.654 2.609) 36.897 ======================= Grid point 13 (9/140) ======================= q-point: ( 0.44 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.521 ( 6.773 -1.673 2.877) 7.546 1.668 ( 5.681 -15.296 1.821) 16.418 2.067 ( -1.116 -9.925 -2.917) 10.405 2.170 ( 8.080 -8.011 14.289) 18.266 2.452 ( -4.279 -4.749 -0.358) 6.403 2.556 ( 4.830 -8.302 5.308) 10.974 2.629 ( -4.025 -9.682 2.988) 10.902 2.927 ( -4.134 -0.765 -5.450) 6.884 2.958 ( 0.827 -8.120 -1.355) 8.273 3.087 ( -4.988 -7.503 2.770) 9.426 3.154 ( 1.071 -1.842 6.729) 7.059 3.248 ( -0.111 -4.955 -4.598) 6.761 3.364 ( -4.321 1.642 -8.360) 9.553 3.467 ( -0.150 0.041 0.609) 0.628 3.586 ( -2.712 7.039 -6.856) 10.193 3.828 ( 0.639 -4.714 -0.817) 4.827 3.963 ( -3.012 -1.006 0.203) 3.182 4.196 ( 5.213 -0.864 -0.677) 5.327 4.286 ( 7.893 -6.988 3.342) 11.059 4.482 ( 1.419 6.076 8.919) 10.885 4.640 ( -0.475 -1.101 7.085) 7.186 4.775 ( -1.057 2.852 -0.725) 3.126 4.898 ( -1.200 -1.830 -1.174) 2.484 5.057 ( 2.215 1.276 0.119) 2.559 5.380 ( -2.582 -5.009 -10.870) 12.243 5.511 ( -5.828 -2.686 1.152) 6.520 5.664 ( -2.066 -0.961 3.706) 4.350 5.875 ( 5.515 3.198 -6.712) 9.257 5.913 ( 3.362 3.638 3.359) 5.985 6.139 ( -0.519 -0.039 -0.302) 0.602 6.167 ( 9.303 -0.385 -2.890) 9.749 6.266 ( -7.504 4.413 -0.828) 8.745 6.481 ( -0.611 1.683 -0.684) 1.916 6.715 ( 2.486 -0.804 -3.257) 4.175 6.780 ( 2.100 -1.029 3.523) 4.229 6.939 ( -8.171 3.355 -3.661) 9.562 7.133 ( -3.447 0.843 -8.099) 8.842 7.241 ( -2.289 -2.876 2.421) 4.402 7.371 ( 4.263 4.031 4.683) 7.506 7.600 ( -1.728 2.566 3.622) 4.763 8.665 ( -7.389 -1.368 -2.371) 7.880 8.778 ( -0.648 -3.644 -2.321) 4.369 8.965 ( -1.685 -8.920 -1.426) 9.190 9.059 ( -3.197 -7.232 -1.842) 8.119 9.184 ( 0.784 -5.575 -1.779) 5.904 9.338 ( -3.164 -8.354 -2.676) 9.325 9.425 ( 3.032 7.231 3.566) 8.614 9.757 ( 5.028 -3.083 5.040) 7.758 10.013 ( -1.308 2.059 2.812) 3.722 10.631 ( 2.334 3.261 2.478) 4.715 10.850 ( 3.416 -4.996 1.625) 6.267 11.041 ( 0.762 0.320 2.626) 2.753 11.230 ( 0.507 0.122 0.800) 0.955 11.409 ( -1.084 -3.283 -4.546) 5.711 11.590 ( 2.284 7.129 -1.131) 7.571 11.669 ( -1.954 3.048 -1.726) 4.011 11.811 ( 0.664 -0.526 5.288) 5.355 11.850 ( 7.644 -4.661 0.490) 8.966 11.993 ( -0.426 0.912 2.111) 2.339 12.191 ( 3.961 -0.477 -1.780) 4.368 12.263 ( -1.089 -3.561 -4.154) 5.579 12.636 ( -2.657 10.660 -4.471) 11.861 12.808 ( -8.492 -2.122 5.227) 10.195 13.028 ( -12.239 4.242 6.778) 14.619 14.544 ( 0.900 -3.428 2.478) 4.324 14.678 ( -1.236 1.367 -1.568) 2.420 14.871 ( 1.296 2.093 0.612) 2.536 15.066 ( 0.318 -5.082 -3.586) 6.228 15.146 ( -0.677 6.346 -0.713) 6.422 15.373 ( 3.758 1.197 1.536) 4.233 15.421 ( 3.709 0.080 1.716) 4.087 15.591 ( -2.462 2.381 1.222) 3.636 15.803 ( 3.384 2.829 -4.065) 5.998 15.921 ( -5.404 1.272 2.127) 5.945 16.039 ( -3.904 4.348 -2.783) 6.472 16.528 ( -1.738 -4.273 0.760) 4.675 16.763 ( 11.357 2.771 -0.861) 11.722 17.108 ( 5.656 2.702 -0.216) 6.272 17.617 ( -2.733 3.723 -5.051) 6.844 17.723 ( -1.544 -0.804 0.033) 1.742 25.623 ( 1.243 -0.583 1.321) 1.905 25.668 ( 1.038 -1.866 2.103) 2.997 25.716 ( 1.061 -0.769 -0.767) 1.518 25.773 ( -1.538 -0.917 1.174) 2.141 25.847 ( -0.917 1.853 0.095) 2.070 26.325 ( 1.147 0.031 2.365) 2.629 26.369 ( -1.136 -2.431 -2.296) 3.531 26.487 ( -2.994 -1.129 -5.680) 6.520 26.711 ( 1.509 0.787 8.751) 8.915 27.101 ( 1.417 1.822 1.707) 2.871 27.875 ( -2.260 -3.161 -2.539) 4.642 28.251 ( -5.873 -3.401 -3.835) 7.795 28.642 ( -5.283 -12.331 1.287) 13.477 28.661 ( -6.876 -10.981 -3.783) 13.498 29.099 ( 5.532 2.601 -2.081) 6.457 29.820 ( 14.880 26.868 3.319) 30.892 ======================= Grid point 14 (10/140) ======================= q-point: ( 0.56 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.536 ( -2.509 3.273 1.685) 4.456 1.938 ( 6.383 -8.490 -1.004) 10.669 2.077 ( 0.100 4.714 0.166) 4.718 2.329 ( -0.569 -1.931 0.396) 2.052 2.518 ( 3.711 -2.150 8.176) 9.233 2.657 ( -1.127 -0.882 0.421) 1.492 2.789 ( 0.273 -5.680 5.221) 7.720 2.849 ( -1.933 2.213 -2.997) 4.196 3.070 ( -4.440 -5.321 -0.535) 6.951 3.082 ( -2.678 -0.726 -5.275) 5.960 3.205 ( -5.036 -2.797 -0.893) 5.830 3.289 ( 0.580 -0.291 -6.223) 6.257 3.377 ( 0.641 -2.451 -2.778) 3.760 3.407 ( -4.770 -5.105 3.558) 7.840 3.558 ( 6.296 -1.006 -0.024) 6.376 3.864 ( 2.767 1.431 -2.853) 4.224 3.943 ( -7.347 -1.565 0.649) 7.540 4.189 ( 3.270 2.004 3.608) 5.266 4.414 ( -1.755 6.687 6.147) 9.251 4.489 ( 10.791 0.116 -0.144) 10.793 4.701 ( 0.799 -2.588 0.352) 2.731 4.732 ( 2.312 3.094 5.044) 6.353 4.851 ( -6.112 -0.721 -6.161) 8.708 5.065 ( 4.563 1.273 0.210) 4.742 5.412 ( -3.192 -5.665 -4.544) 7.933 5.551 ( -4.341 -4.457 6.413) 8.935 5.702 ( 1.878 -0.985 3.692) 4.258 5.798 ( -2.610 2.423 -6.728) 7.613 5.874 ( 4.168 4.009 -4.880) 7.567 6.126 ( -6.570 4.068 -0.987) 7.790 6.151 ( -2.085 -1.198 5.639) 6.130 6.267 ( 10.689 -1.562 -4.139) 11.568 6.483 ( 2.716 -1.891 1.328) 3.566 6.726 ( -2.058 -0.219 -1.379) 2.487 6.758 ( -2.850 2.234 -0.278) 3.632 6.898 ( -3.470 -2.919 1.600) 4.808 7.102 ( 0.790 -3.918 -7.650) 8.631 7.248 ( -3.339 -0.230 2.622) 4.252 7.401 ( 6.217 2.698 6.950) 9.708 7.571 ( 1.592 1.358 1.368) 2.500 8.616 ( -6.743 -1.597 -2.995) 7.550 8.845 ( 3.452 -4.174 0.049) 5.417 9.065 ( -1.023 -5.008 -3.171) 6.015 9.119 ( -3.577 -4.208 -3.721) 6.660 9.228 ( -0.027 -1.405 0.438) 1.472 9.332 ( 0.795 6.425 1.779) 6.714 9.491 ( 0.150 -9.411 -2.037) 9.630 9.825 ( 2.927 2.931 6.304) 7.543 9.976 ( -0.576 0.891 -0.781) 1.318 10.587 ( 1.908 4.520 -0.106) 4.907 10.928 ( -0.724 -0.785 2.377) 2.606 11.018 ( -1.532 3.391 0.913) 3.831 11.272 ( 1.916 -4.247 -0.015) 4.659 11.433 ( 1.310 6.435 -3.036) 7.235 11.445 ( -0.961 -3.043 -5.037) 5.963 11.608 ( -3.716 1.208 0.278) 3.917 11.832 ( 0.769 3.200 3.750) 4.990 11.945 ( 4.577 5.940 2.731) 7.980 12.008 ( 3.781 -3.195 3.565) 6.100 12.220 ( 2.384 0.156 0.246) 2.402 12.282 ( -2.359 -1.783 -2.493) 3.868 12.527 ( 3.281 -1.137 0.376) 3.493 12.792 ( -8.059 -0.677 1.511) 8.227 12.933 ( -4.721 -1.851 -2.389) 5.605 14.609 ( -2.965 0.039 0.845) 3.083 14.666 ( 2.048 -2.614 0.023) 3.320 14.897 ( 0.466 -3.500 1.561) 3.860 15.001 ( 2.172 8.054 -2.057) 8.592 15.146 ( -1.440 -4.486 -0.062) 4.712 15.359 ( 2.982 4.036 0.722) 5.070 15.494 ( 2.486 -2.895 1.360) 4.051 15.533 ( -0.671 2.812 0.375) 2.915 15.764 ( 0.076 1.254 -1.039) 1.630 15.838 ( -6.703 1.069 -1.621) 6.979 15.991 ( 0.037 -0.167 -1.023) 1.037 16.574 ( -0.160 -1.782 0.011) 1.789 16.796 ( 8.098 3.471 2.104) 9.058 17.085 ( 1.567 3.242 0.121) 3.602 17.530 ( -4.988 -0.565 -3.850) 6.326 17.735 ( -0.064 -0.755 0.812) 1.110 25.630 ( -0.133 1.090 1.369) 1.755 25.705 ( 0.687 -0.952 -0.097) 1.178 25.730 ( 0.927 0.794 0.636) 1.376 25.781 ( -1.134 -1.024 0.538) 1.620 25.813 ( -0.094 0.694 -0.656) 0.959 26.320 ( -1.369 0.774 1.679) 2.301 26.408 ( 1.800 -1.757 0.218) 2.525 26.458 ( -1.204 -1.590 -7.860) 8.109 26.774 ( 3.120 0.417 12.298) 12.694 27.075 ( 1.020 1.786 -2.414) 3.172 27.905 ( 0.084 -2.636 -0.876) 2.779 28.251 ( -4.040 -3.816 -5.284) 7.668 28.722 ( -7.407 -6.275 -6.747) 11.822 28.802 ( -5.101 -10.753 0.855) 11.933 29.125 ( 2.746 -0.735 3.562) 4.558 29.512 ( 10.289 23.386 3.052) 25.731 ======================= Grid point 15 (11/140) ======================= q-point: (-0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.378 ( -7.357 11.148 -0.229) 13.359 1.869 ( -3.324 13.576 -6.792) 15.540 2.035 ( 5.617 5.727 0.098) 8.023 2.346 ( 3.017 2.019 3.185) 4.829 2.560 ( -4.261 8.494 -3.932) 10.284 2.583 ( 1.702 2.612 6.615) 7.313 2.787 ( 1.490 3.991 1.138) 4.410 2.860 ( -1.573 -3.249 0.909) 3.723 3.047 ( -1.462 0.260 -3.184) 3.514 3.071 ( -3.479 2.269 -0.999) 4.272 3.200 ( -4.125 -5.725 0.438) 7.070 3.282 ( 2.012 4.101 -9.612) 10.642 3.409 ( 1.139 -4.134 1.044) 4.414 3.487 ( -1.888 -2.974 2.695) 4.435 3.711 ( 7.026 -9.291 5.135) 12.730 3.776 ( 1.178 7.654 -1.777) 7.945 3.972 ( -5.959 -7.283 -1.260) 9.494 4.211 ( 3.919 1.967 6.107) 7.518 4.271 ( -3.171 10.466 2.417) 11.199 4.490 ( 5.712 4.055 -3.380) 7.778 4.639 ( -3.188 3.787 -5.372) 7.305 4.766 ( 3.321 0.207 1.477) 3.640 4.815 ( -2.190 0.538 -0.453) 2.300 5.092 ( 3.331 -0.538 -0.326) 3.390 5.464 ( -3.909 -3.878 1.106) 5.616 5.620 ( -0.984 -2.656 3.593) 4.575 5.715 ( -3.536 0.619 -3.757) 5.196 5.756 ( 3.567 -1.157 2.396) 4.450 5.797 ( 0.430 4.889 -3.420) 5.982 6.055 ( -2.087 0.421 0.846) 2.291 6.181 ( -1.539 -1.126 4.568) 4.950 6.325 ( 5.367 -0.979 -4.084) 6.815 6.580 ( 6.843 -2.733 0.126) 7.370 6.632 ( -8.020 2.856 -1.170) 8.593 6.751 ( -2.960 -0.041 3.414) 4.519 6.960 ( -0.120 -6.417 0.378) 6.429 7.189 ( 3.154 -5.849 -1.410) 6.793 7.251 ( -1.217 -1.996 0.799) 2.470 7.411 ( 2.331 2.148 3.340) 4.605 7.610 ( 5.859 -0.866 2.756) 6.532 8.594 ( -5.502 -3.467 -3.996) 7.633 8.963 ( 6.010 -3.734 2.472) 7.495 9.057 ( -2.418 1.894 -4.194) 5.199 9.131 ( 0.873 0.164 -0.118) 0.896 9.216 ( 1.065 3.642 -5.471) 6.658 9.274 ( -3.207 -1.689 2.590) 4.455 9.573 ( 2.537 1.658 1.374) 3.327 9.763 ( -1.191 7.648 3.342) 8.431 9.996 ( 2.105 -3.188 -0.472) 3.849 10.515 ( -0.193 3.785 -3.181) 4.948 10.869 ( -3.399 6.744 1.668) 7.734 10.949 ( -3.765 0.870 -1.213) 4.051 11.307 ( 4.338 3.488 -1.269) 5.709 11.404 ( 0.152 -3.741 -2.917) 4.746 11.526 ( -1.612 -8.671 -0.285) 8.824 11.559 ( -3.430 2.400 1.168) 4.346 11.732 ( -1.013 6.255 -2.054) 6.661 11.891 ( 3.976 5.558 0.956) 6.901 12.018 ( -2.542 5.476 5.323) 8.049 12.263 ( 0.063 -1.423 4.263) 4.495 12.309 ( 1.797 -4.320 2.263) 5.197 12.692 ( 7.697 -9.666 5.640) 13.583 12.733 ( -6.009 -0.711 -3.700) 7.092 13.002 ( 2.480 -9.775 -11.004) 14.927 14.550 ( -3.631 2.703 0.842) 4.604 14.703 ( 2.255 2.337 -0.386) 3.270 14.918 ( 4.291 0.861 -0.834) 4.455 15.010 ( -1.589 -5.753 1.295) 6.107 15.179 ( -1.867 -0.882 3.737) 4.270 15.304 ( 0.761 3.811 -0.643) 3.940 15.464 ( 2.056 4.666 -1.186) 5.235 15.582 ( 3.919 -3.364 -1.581) 5.402 15.747 ( -4.442 0.436 3.615) 5.743 15.832 ( -3.632 -7.660 -4.253) 9.484 16.005 ( -0.617 -1.723 0.513) 1.901 16.587 ( 0.866 0.247 -0.751) 1.173 16.775 ( 4.263 6.397 3.444) 8.424 17.028 ( -1.473 3.621 0.012) 3.909 17.532 ( -3.972 -4.906 -1.654) 6.525 17.756 ( 0.321 -1.408 0.913) 1.709 25.606 ( -0.642 1.560 0.362) 1.726 25.677 ( -0.796 3.420 -0.148) 3.515 25.727 ( 0.453 0.703 0.741) 1.117 25.780 ( 0.023 0.077 -1.276) 1.278 25.839 ( 0.601 -2.515 0.281) 2.601 26.310 ( -0.750 0.738 3.319) 3.482 26.433 ( 1.066 -1.543 -9.350) 9.536 26.456 ( 0.186 -1.098 1.272) 1.690 26.838 ( 2.373 2.845 12.414) 12.955 27.071 ( 3.786 -2.471 -3.431) 5.675 27.953 ( 2.299 -2.120 0.014) 3.127 28.257 ( -2.955 -3.057 -5.592) 7.025 28.700 ( -5.102 -1.884 -8.013) 9.684 28.941 ( -2.545 -8.578 2.904) 9.407 29.114 ( -1.957 8.809 1.168) 9.099 29.289 ( 3.446 8.162 4.886) 10.117 ======================= Grid point 16 (12/140) ======================= q-point: (-0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.078 ( -7.302 17.044 -0.373) 18.546 1.490 ( -4.154 22.856 -7.435) 24.391 1.865 ( 0.266 19.499 -0.283) 19.503 2.196 ( 0.921 19.008 -1.424) 19.083 2.419 ( 4.640 4.843 1.584) 6.891 2.545 ( -3.743 2.409 0.710) 4.507 2.700 ( 0.487 7.794 0.103) 7.810 2.906 ( -1.304 5.176 5.003) 7.316 3.006 ( -0.355 -3.513 -0.206) 3.537 3.036 ( 0.240 -0.524 -3.828) 3.871 3.069 ( 1.662 13.443 -4.506) 14.276 3.261 ( -4.357 6.660 0.400) 7.969 3.436 ( 1.744 -0.497 2.484) 3.075 3.569 ( 1.538 -5.520 1.078) 5.830 3.677 ( -1.407 0.534 -1.554) 2.163 3.931 ( 1.043 -4.699 0.392) 4.829 4.038 ( 5.637 -4.544 -0.011) 7.241 4.133 ( -3.050 2.163 4.396) 5.771 4.251 ( 1.276 -1.655 4.632) 5.082 4.448 ( 3.090 2.695 -4.112) 5.807 4.519 ( -6.131 2.122 -5.968) 8.816 4.699 ( 1.442 8.118 -0.063) 8.246 4.862 ( 1.184 -4.636 1.003) 4.888 5.119 ( 1.383 -0.702 -0.346) 1.589 5.461 ( -4.195 0.728 -0.512) 4.288 5.661 ( 1.164 0.037 3.679) 3.859 5.686 ( 1.807 4.643 -2.380) 5.521 5.723 ( -4.662 -4.213 0.354) 6.293 5.820 ( 2.785 -2.477 0.543) 3.766 6.055 ( -0.001 -0.036 0.844) 0.845 6.221 ( -0.926 -2.813 2.743) 4.037 6.348 ( 3.386 0.175 -3.505) 4.876 6.510 ( -7.616 3.352 -0.861) 8.365 6.654 ( 7.885 0.231 -3.112) 8.480 6.723 ( -6.008 1.399 5.626) 8.349 7.099 ( -0.256 -7.933 0.567) 7.957 7.262 ( 1.976 -1.130 3.144) 3.882 7.346 ( 4.304 -5.702 1.558) 7.312 7.441 ( -0.800 -6.418 -4.138) 7.678 7.691 ( 5.755 -0.603 4.408) 7.274 8.598 ( -4.178 -2.864 -3.194) 5.988 8.920 ( -0.510 9.489 -2.706) 9.880 9.029 ( 2.954 4.112 4.900) 7.046 9.130 ( 1.731 1.930 -0.432) 2.629 9.168 ( -2.473 -2.167 -3.342) 4.688 9.309 ( 1.990 -2.024 -1.247) 3.101 9.520 ( 3.025 6.223 3.369) 7.696 9.599 ( -2.483 9.992 -1.516) 10.407 10.084 ( 2.974 -2.861 2.524) 4.837 10.436 ( -2.434 1.963 -4.857) 5.776 10.742 ( -1.914 4.840 0.319) 5.215 10.910 ( -3.747 -0.330 -0.528) 3.798 11.295 ( 3.298 1.483 0.162) 3.620 11.392 ( -1.653 3.163 -2.398) 4.300 11.461 ( -4.106 4.848 1.319) 6.488 11.663 ( 0.074 -2.019 -1.309) 2.408 11.705 ( 0.103 -8.771 -0.776) 8.806 11.837 ( 5.215 3.569 -2.674) 6.862 11.900 ( -6.561 5.594 3.895) 9.461 12.311 ( 0.577 -2.608 1.776) 3.208 12.424 ( 3.263 -2.519 7.919) 8.928 12.684 ( -3.409 -0.367 -5.964) 6.880 12.982 ( 6.388 -12.770 8.935) 16.844 13.160 ( 4.532 -13.029 -13.834) 19.537 14.498 ( -2.772 0.618 1.326) 3.134 14.669 ( 2.855 1.882 -0.518) 3.458 14.933 ( 1.124 2.037 0.161) 2.332 15.077 ( -2.112 -4.631 2.518) 5.678 15.212 ( 1.690 1.918 1.291) 2.864 15.266 ( -1.313 -1.823 -0.635) 2.334 15.384 ( 1.417 4.857 -1.624) 5.313 15.644 ( 3.491 -1.221 -2.864) 4.678 15.737 ( -5.647 -1.833 5.154) 7.862 15.953 ( 4.832 -8.700 -7.796) 12.642 16.042 ( -6.942 -4.735 4.692) 9.624 16.574 ( 0.781 1.609 -0.807) 1.962 16.694 ( 1.623 7.316 2.666) 7.954 16.946 ( -2.794 4.151 0.085) 5.004 17.580 ( -2.177 -3.284 -0.162) 3.943 17.809 ( 0.125 -4.403 1.218) 4.570 25.580 ( -0.422 1.054 -0.058) 1.137 25.608 ( -0.564 3.807 -0.376) 3.867 25.710 ( -0.183 1.547 0.108) 1.561 25.774 ( 0.352 0.338 -0.759) 0.903 25.881 ( 0.412 -1.654 0.279) 1.727 26.321 ( 0.041 0.395 6.514) 6.526 26.409 ( 0.044 -1.116 -10.600) 10.659 26.474 ( 0.582 0.364 1.312) 1.481 26.822 ( -0.019 4.591 4.945) 6.747 27.203 ( 7.367 -7.368 2.380) 10.688 28.011 ( 4.397 -1.926 -0.116) 4.801 28.252 ( -2.224 -1.748 -3.688) 4.648 28.652 ( 0.110 0.656 -5.238) 5.280 28.876 ( -0.677 14.776 -1.182) 14.839 29.082 ( -0.962 -7.567 4.277) 8.745 29.250 ( -9.119 -0.057 1.404) 9.227 ======================= Grid point 17 (13/140) ======================= q-point: (-0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.726 ( -0.000 20.586 -0.000) 20.586 1.017 ( -0.000 28.349 -0.000) 28.349 1.398 ( -0.000 34.243 -0.000) 34.243 1.811 ( -0.000 25.606 -0.000) 25.606 2.424 ( -0.000 3.459 -0.000) 3.459 2.444 ( -0.000 7.129 -0.000) 7.129 2.523 ( -0.000 10.495 -0.000) 10.495 2.783 ( -0.000 8.348 -0.000) 8.348 2.820 ( -0.000 12.459 -0.000) 12.459 2.929 ( -0.000 22.469 -0.000) 22.469 3.006 ( -0.000 1.990 -0.000) 1.990 3.201 ( 0.000 -12.649 0.000) 12.649 3.481 ( 0.000 -1.070 0.000) 1.070 3.638 ( -0.000 2.402 -0.000) 2.402 3.678 ( 0.000 -4.395 0.000) 4.395 4.034 ( 0.000 -10.153 0.000) 10.153 4.075 ( -0.000 7.242 -0.000) 7.242 4.161 ( 0.000 -3.560 0.000) 3.560 4.334 ( 0.000 -5.095 0.000) 5.095 4.399 ( -0.000 2.278 -0.000) 2.278 4.478 ( 0.000 -2.561 0.000) 2.561 4.601 ( -0.000 3.090 -0.000) 3.090 4.945 ( 0.000 -3.247 0.000) 3.247 5.139 ( 0.000 -1.418 0.000) 1.418 5.403 ( -0.000 2.786 -0.000) 2.786 5.557 ( -0.000 8.370 -0.000) 8.370 5.696 ( 0.000 -0.835 0.000) 0.835 5.836 ( 0.000 -10.062 0.000) 10.062 5.886 ( 0.000 -3.558 0.000) 3.558 6.050 ( -0.000 1.057 -0.000) 1.057 6.281 ( 0.000 -3.807 0.000) 3.807 6.330 ( -0.000 3.071 -0.000) 3.071 6.407 ( -0.000 3.865 -0.000) 3.865 6.652 ( -0.000 3.392 -0.000) 3.392 6.720 ( 0.000 -3.697 0.000) 3.697 7.180 ( 0.000 -2.382 0.000) 2.382 7.287 ( -0.000 0.562 -0.000) 0.562 7.509 ( 0.000 -10.044 0.000) 10.044 7.554 ( 0.000 -7.551 0.000) 7.551 7.739 ( 0.000 -0.523 0.000) 0.523 8.544 ( -0.000 7.779 -0.000) 7.779 8.772 ( -0.000 4.969 -0.000) 4.969 8.960 ( -0.000 6.232 -0.000) 6.232 9.116 ( -0.000 1.236 -0.000) 1.236 9.142 ( -0.000 1.646 -0.000) 1.646 9.285 ( -0.000 6.247 -0.000) 6.247 9.428 ( -0.000 7.474 -0.000) 7.474 9.527 ( 0.000 -3.968 0.000) 3.968 10.110 ( -0.000 2.878 -0.000) 2.878 10.387 ( -0.000 0.248 -0.000) 0.248 10.716 ( 0.000 -2.319 0.000) 2.319 10.909 ( 0.000 -1.513 0.000) 1.513 11.243 ( -0.000 6.798 -0.000) 6.798 11.302 ( -0.000 6.648 -0.000) 6.648 11.413 ( 0.000 -2.746 0.000) 2.746 11.680 ( 0.000 -0.559 0.000) 0.559 11.788 ( -0.000 3.420 -0.000) 3.420 11.803 ( 0.000 -1.602 0.000) 1.602 11.902 ( 0.000 -7.661 0.000) 7.661 12.364 ( 0.000 -2.537 0.000) 2.537 12.489 ( 0.000 -0.334 0.000) 0.334 12.645 ( -0.000 0.478 -0.000) 0.478 13.220 ( 0.000 -8.965 0.000) 8.965 13.380 ( 0.000 -13.470 0.000) 13.470 14.519 ( 0.000 -4.572 0.000) 4.572 14.699 ( 0.000 -4.052 0.000) 4.052 14.883 ( -0.000 3.161 -0.000) 3.161 15.140 ( -0.000 0.930 -0.000) 0.930 15.188 ( 0.000 -2.648 0.000) 2.648 15.195 ( -0.000 9.172 -0.000) 9.172 15.408 ( 0.000 -5.965 0.000) 5.965 15.639 ( -0.000 2.190 -0.000) 2.190 15.760 ( 0.000 -1.115 0.000) 1.115 16.052 ( 0.000 -1.601 0.000) 1.601 16.149 ( 0.000 -11.386 0.000) 11.386 16.537 ( -0.000 2.628 -0.000) 2.628 16.597 ( -0.000 5.662 -0.000) 5.662 16.857 ( -0.000 4.820 -0.000) 4.820 17.595 ( -0.000 0.053 -0.000) 0.053 17.908 ( 0.000 -6.295 0.000) 6.295 25.541 ( -0.000 3.258 -0.000) 3.258 25.573 ( 0.000 -0.067 0.000) 0.067 25.680 ( -0.000 1.898 -0.000) 1.898 25.765 ( -0.000 0.648 -0.000) 0.648 25.896 ( -0.000 0.192 -0.000) 0.192 26.354 ( 0.000 -0.296 0.000) 0.296 26.383 ( 0.000 -1.151 0.000) 1.151 26.465 ( -0.000 1.261 -0.000) 1.261 26.752 ( -0.000 4.977 -0.000) 4.977 27.394 ( 0.000 -9.111 0.000) 9.111 28.084 ( 0.000 -3.594 0.000) 3.594 28.256 ( 0.000 -1.001 0.000) 1.001 28.634 ( -0.000 12.748 -0.000) 12.748 28.661 ( 0.000 -1.305 0.000) 1.305 29.131 ( -0.000 5.167 -0.000) 5.167 29.216 ( 0.000 -6.588 0.000) 6.588 ======================= Grid point 20 (14/140) ======================= q-point: ( 0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.033 ( 17.168 0.000 17.433) 24.467 1.193 ( 32.415 0.000 4.091) 32.672 1.300 ( 1.888 0.000 8.734) 8.936 1.765 ( 1.861 0.000 11.324) 11.476 1.880 ( -5.188 -0.000 -6.810) 8.561 2.154 ( 17.254 0.000 17.862) 24.835 2.272 ( -8.923 -0.000 7.723) 11.801 2.482 ( 4.508 0.000 -3.979) 6.013 2.512 ( -5.792 -0.000 1.925) 6.103 2.865 ( 10.688 0.000 -1.526) 10.796 3.051 ( 0.386 0.000 3.933) 3.952 3.232 ( -3.039 -0.000 -17.189) 17.455 3.501 ( -3.337 -0.000 -6.252) 7.087 3.559 ( -7.861 -0.000 -6.728) 10.347 3.771 ( 5.602 0.000 6.005) 8.213 3.819 ( -2.381 -0.000 8.741) 9.060 4.122 ( -2.540 -0.000 -6.437) 6.920 4.137 ( -14.485 -0.000 -1.325) 14.545 4.147 ( -1.854 -0.000 -2.491) 3.105 4.434 ( -0.577 -0.000 8.634) 8.654 4.651 ( 5.047 0.000 2.986) 5.864 4.736 ( -0.563 -0.000 4.108) 4.147 4.785 ( 7.923 0.000 -7.683) 11.036 5.128 ( -6.795 -0.000 -2.533) 7.252 5.318 ( 1.437 0.000 3.640) 3.913 5.503 ( 2.484 0.000 -0.535) 2.541 5.687 ( -4.063 -0.000 -7.611) 8.627 5.780 ( 9.388 0.000 1.323) 9.480 6.087 ( 2.303 0.000 -2.592) 3.467 6.193 ( 5.715 0.000 -0.251) 5.720 6.287 ( -2.639 -0.000 -0.695) 2.729 6.398 ( -1.086 -0.000 0.836) 1.370 6.601 ( 6.328 0.000 1.968) 6.627 6.731 ( 1.941 0.000 -0.421) 1.986 6.769 ( -5.534 -0.000 1.457) 5.723 6.976 ( -7.116 -0.000 3.592) 7.971 7.176 ( -0.548 -0.000 -6.438) 6.461 7.486 ( -3.528 -0.000 -4.256) 5.528 7.557 ( -14.079 -0.000 0.153) 14.080 7.620 ( 2.120 0.000 7.148) 7.456 8.435 ( 3.607 0.000 6.699) 7.609 8.633 ( -4.808 -0.000 -6.990) 8.484 8.684 ( -7.430 -0.000 -4.136) 8.504 8.760 ( -2.533 -0.000 -12.379) 12.636 9.105 ( -13.457 -0.000 1.855) 13.584 9.228 ( 3.923 0.000 -1.106) 4.076 9.656 ( 7.146 0.000 -1.051) 7.223 9.804 ( -0.959 -0.000 2.102) 2.311 9.933 ( -3.973 -0.000 14.947) 15.466 10.389 ( 0.411 0.000 11.728) 11.736 10.608 ( 4.286 0.000 4.938) 6.538 10.882 ( 3.430 0.000 -1.351) 3.687 11.143 ( 6.000 0.000 6.415) 8.783 11.296 ( 6.897 0.000 -1.270) 7.013 11.513 ( -8.314 -0.000 2.598) 8.710 11.663 ( -0.026 -0.000 -2.585) 2.585 11.810 ( -5.111 -0.000 14.185) 15.077 11.812 ( -1.437 -0.000 2.025) 2.483 12.140 ( -0.573 -0.000 -1.444) 1.553 12.241 ( -0.249 -0.000 -1.352) 1.375 12.274 ( -6.957 -0.000 -7.026) 9.887 12.607 ( -7.710 -0.000 6.616) 10.160 12.931 ( 7.012 0.000 -2.500) 7.445 13.275 ( -4.507 -0.000 4.745) 6.544 14.693 ( -2.962 -0.000 1.950) 3.547 14.742 ( -1.948 -0.000 -1.881) 2.708 14.930 ( 3.202 0.000 1.306) 3.458 14.981 ( -8.347 -0.000 -4.141) 9.318 15.289 ( 7.452 0.000 3.929) 8.424 15.536 ( 0.476 0.000 -0.165) 0.504 15.588 ( 2.855 0.000 -5.660) 6.340 15.678 ( 0.518 0.000 -2.886) 2.933 15.797 ( 11.115 0.000 -6.068) 12.664 15.984 ( -12.882 -0.000 4.968) 13.806 16.102 ( -1.931 -0.000 4.604) 4.992 16.325 ( -2.165 -0.000 -5.389) 5.807 16.869 ( 8.971 0.000 0.944) 9.020 17.433 ( 2.878 0.000 -1.225) 3.128 17.571 ( 0.287 0.000 -0.777) 0.828 17.801 ( 11.051 0.000 -24.464) 26.844 25.541 ( 2.277 0.000 1.462) 2.706 25.630 ( 1.177 0.000 0.450) 1.260 25.652 ( -1.948 -0.000 3.761) 4.235 25.745 ( -1.036 -0.000 0.892) 1.367 25.882 ( -1.131 -0.000 3.996) 4.153 26.210 ( 3.049 0.000 6.383) 7.074 26.302 ( -1.110 -0.000 -3.386) 3.563 26.416 ( -0.730 -0.000 -0.267) 0.777 26.816 ( -6.008 -0.000 11.589) 13.053 27.093 ( 4.003 0.000 5.972) 7.190 27.506 ( -0.068 -0.000 -7.140) 7.140 28.243 ( -1.944 -0.000 -1.795) 2.646 28.258 ( -6.024 -0.000 0.624) 6.056 28.379 ( -0.796 -0.000 -0.173) 0.815 29.219 ( 2.569 0.000 -10.456) 10.767 30.898 ( 7.314 0.000 -9.701) 12.150 ======================= Grid point 21 (15/140) ======================= q-point: ( 0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.216 ( 8.021 -5.706 11.306) 14.991 1.466 ( 13.338 -3.842 1.399) 13.950 1.554 ( 13.639 -12.865 6.253) 19.765 1.820 ( 2.828 -9.755 8.509) 13.250 1.998 ( -6.732 -18.369 -2.505) 19.724 2.313 ( -8.833 -6.493 4.749) 11.947 2.389 ( 8.806 -2.586 6.195) 11.073 2.527 ( -2.110 -7.663 6.421) 10.218 2.654 ( 8.771 -8.423 5.922) 13.526 2.982 ( 9.467 -4.447 -0.375) 10.466 3.086 ( -0.733 -1.803 4.731) 5.115 3.138 ( -1.339 -1.257 -14.811) 14.924 3.421 ( -5.918 2.222 -6.260) 8.897 3.498 ( -3.310 -4.759 -3.384) 6.712 3.726 ( -3.866 10.382 2.193) 11.294 3.882 ( 4.379 -3.684 6.579) 8.720 3.950 ( -3.755 9.309 -9.243) 13.645 4.038 ( -4.659 -0.216 4.044) 6.173 4.201 ( -2.367 -5.390 -5.764) 8.239 4.533 ( -2.457 -6.652 6.528) 9.638 4.685 ( 4.387 3.251 3.247) 6.353 4.751 ( -1.807 -2.227 5.921) 6.579 4.828 ( 6.618 -0.876 -4.231) 7.904 5.068 ( -4.558 -0.010 -1.387) 4.764 5.337 ( -1.458 1.557 1.811) 2.798 5.496 ( 1.297 1.140 -3.916) 4.279 5.628 ( -3.209 -1.064 -5.290) 6.278 5.880 ( 9.241 -2.123 -0.742) 9.510 6.049 ( -0.256 3.360 -4.134) 5.334 6.198 ( 7.671 4.412 0.639) 8.873 6.237 ( -5.386 0.995 -2.269) 5.928 6.383 ( 0.100 2.642 0.954) 2.811 6.613 ( -0.517 4.578 -1.573) 4.868 6.701 ( 2.915 -1.133 6.147) 6.896 6.767 ( 2.899 1.985 -0.297) 3.526 7.006 ( -5.946 -4.452 1.421) 7.562 7.150 ( -1.978 -0.983 -6.766) 7.117 7.261 ( -9.524 9.689 -2.431) 13.802 7.563 ( -8.031 -1.958 2.678) 8.689 7.602 ( 4.030 4.300 2.232) 6.302 8.536 ( -0.168 -4.577 4.130) 6.167 8.608 ( -4.019 -4.795 -5.076) 8.057 8.659 ( -5.813 -6.783 -3.213) 9.493 8.758 ( -4.134 -7.522 -9.236) 12.609 9.037 ( -5.620 -1.592 1.080) 5.940 9.218 ( 1.796 1.990 -1.666) 3.156 9.688 ( 4.433 0.485 1.838) 4.823 9.716 ( 2.113 7.873 5.399) 9.778 10.007 ( -0.874 -2.358 8.902) 9.250 10.621 ( -2.459 -10.257 7.575) 12.986 10.676 ( 4.026 -3.702 3.871) 6.701 10.935 ( 3.150 -4.308 -0.881) 5.409 11.225 ( 5.407 -0.393 -1.019) 5.516 11.356 ( 4.080 -4.427 1.111) 6.122 11.469 ( -4.377 -0.908 1.037) 4.589 11.646 ( 0.422 0.224 -3.329) 3.363 11.831 ( 0.373 0.169 6.394) 6.407 11.870 ( -2.498 -2.397 7.032) 7.838 12.089 ( -2.582 6.890 2.212) 7.683 12.131 ( -3.209 -0.693 -8.118) 8.757 12.267 ( 0.619 -0.006 -0.096) 0.627 12.627 ( -11.750 -6.184 5.539) 14.387 12.921 ( 2.055 4.039 -5.493) 7.121 13.224 ( -3.504 5.589 6.010) 8.924 14.592 ( -0.782 5.822 2.195) 6.271 14.763 ( -2.415 0.513 -1.330) 2.804 14.874 ( -3.622 -0.768 -5.075) 6.282 15.035 ( -0.239 -5.737 1.832) 6.027 15.255 ( 5.320 10.784 0.914) 12.060 15.492 ( 4.815 5.656 -0.902) 7.483 15.563 ( -2.233 -0.519 1.864) 2.955 15.626 ( 2.448 4.770 -2.244) 5.812 15.863 ( 10.399 -0.293 -8.633) 13.518 15.931 ( -9.915 -0.867 5.194) 11.227 16.116 ( -4.622 -0.470 1.095) 4.773 16.334 ( -1.740 -5.451 -2.249) 6.148 16.925 ( 10.273 3.050 -0.084) 10.716 17.298 ( 7.768 10.623 -2.337) 13.366 17.646 ( -1.850 -4.325 1.260) 4.870 17.747 ( 1.601 2.186 -14.162) 14.419 25.576 ( 2.286 -1.154 0.772) 2.675 25.640 ( 0.745 -0.129 2.566) 2.675 25.673 ( -0.428 -1.639 0.702) 1.833 25.745 ( -1.270 -0.501 0.853) 1.610 25.888 ( -0.607 0.807 3.598) 3.737 26.276 ( -3.230 -2.654 1.776) 4.542 26.303 ( 4.456 -0.841 -0.290) 4.544 26.429 ( -1.394 -2.096 -1.161) 2.772 26.791 ( -2.320 3.421 8.756) 9.683 27.145 ( 3.791 1.019 5.502) 6.759 27.600 ( -2.493 -12.785 -5.619) 14.186 28.161 ( -8.117 0.745 -4.438) 9.281 28.287 ( -3.240 -5.664 -0.615) 6.554 28.414 ( -0.912 -4.556 0.640) 4.690 29.182 ( 4.362 1.639 -8.679) 9.851 30.718 ( 8.877 20.999 -2.739) 22.962 ======================= Grid point 22 (16/140) ======================= q-point: ( 0.44 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.432 ( -1.710 -10.419 3.603) 11.156 1.627 ( 13.484 -6.123 3.991) 15.337 1.871 ( 8.785 -10.408 0.576) 13.632 2.134 ( 7.343 -12.502 8.197) 16.656 2.268 ( -4.205 -15.273 3.987) 16.335 2.397 ( -7.490 -10.949 4.266) 13.935 2.528 ( 4.965 -6.344 6.508) 10.356 2.719 ( -4.733 -11.219 0.529) 12.188 2.817 ( 0.468 -7.855 -2.811) 8.356 3.020 ( -0.446 -0.010 -4.040) 4.065 3.122 ( 0.440 -5.449 -9.728) 11.159 3.183 ( -0.696 -0.937 11.930) 11.987 3.297 ( -7.360 1.409 -7.651) 10.709 3.539 ( -3.561 7.463 2.109) 8.534 3.649 ( 5.611 -4.171 -3.076) 7.638 3.710 ( -2.774 4.721 -7.044) 8.922 3.955 ( -2.226 -0.764 4.422) 5.009 4.183 ( 11.772 -9.240 3.239) 15.312 4.228 ( -1.080 -4.208 -0.898) 4.436 4.626 ( -2.485 -2.930 4.612) 6.003 4.657 ( 2.121 4.946 4.430) 6.970 4.785 ( 0.755 0.057 -0.903) 1.179 4.864 ( -1.158 -0.544 -0.234) 1.301 5.083 ( 2.469 -2.266 4.512) 5.621 5.272 ( -2.439 0.788 -3.777) 4.565 5.453 ( -3.108 1.658 -3.368) 4.874 5.627 ( -2.629 -3.065 0.553) 4.076 5.907 ( 1.809 2.991 -12.540) 13.018 5.994 ( 2.745 1.500 0.955) 3.271 6.158 ( -4.999 1.823 1.714) 5.590 6.210 ( 7.278 1.281 -1.835) 7.615 6.316 ( 1.949 5.750 -0.758) 6.119 6.535 ( 0.893 4.256 0.450) 4.372 6.739 ( 3.603 1.883 -0.580) 4.106 6.796 ( 0.573 -1.893 6.340) 6.642 6.910 ( -9.812 4.970 -4.043) 11.718 7.094 ( -3.446 1.666 -7.582) 8.493 7.174 ( -3.004 -3.564 2.227) 5.166 7.501 ( 3.204 4.994 3.337) 6.807 7.615 ( -2.010 -0.995 2.490) 3.351 8.560 ( -6.273 -2.301 -2.105) 7.005 8.666 ( -2.192 -6.660 -3.514) 7.843 8.789 ( -1.885 -10.594 0.893) 10.798 8.837 ( -4.625 -10.150 -6.537) 12.929 9.102 ( 1.208 -7.388 0.383) 7.495 9.204 ( -1.608 -1.251 -1.792) 2.714 9.604 ( 2.472 8.864 3.522) 9.853 9.771 ( 4.539 -2.687 3.381) 6.265 10.053 ( -0.716 0.799 5.733) 5.833 10.689 ( 0.859 0.290 3.611) 3.723 10.814 ( 3.247 -4.382 4.436) 7.030 11.033 ( 1.103 -3.426 0.690) 3.665 11.235 ( 3.424 -1.414 -6.749) 7.699 11.393 ( -1.925 2.621 2.021) 3.829 11.597 ( 0.933 -6.589 1.173) 6.757 11.644 ( 2.534 -6.618 -5.251) 8.821 11.801 ( -7.489 5.568 1.111) 9.398 11.873 ( 4.233 1.082 3.092) 5.352 12.037 ( 1.642 0.980 6.027) 6.323 12.148 ( 1.084 -4.480 -3.288) 5.662 12.263 ( 1.815 1.647 1.940) 3.126 12.665 ( -12.506 -6.502 4.079) 14.673 12.771 ( -1.946 9.421 -6.551) 11.638 13.095 ( -5.563 9.123 5.570) 12.050 14.546 ( 0.611 1.139 3.343) 3.584 14.686 ( -2.474 2.666 -2.576) 4.457 14.892 ( -0.779 -3.382 -2.683) 4.387 15.049 ( 2.104 5.595 -1.099) 6.078 15.179 ( 0.307 -0.254 1.439) 1.493 15.447 ( 2.328 4.182 2.499) 5.399 15.527 ( 6.426 4.827 -1.330) 8.146 15.595 ( -2.329 0.335 0.886) 2.514 15.852 ( -2.500 2.336 0.019) 3.421 15.905 ( 0.576 0.700 -3.669) 3.779 16.049 ( -4.896 2.856 -1.124) 5.779 16.430 ( -0.567 -6.564 0.111) 6.590 16.935 ( 12.349 5.261 0.634) 13.438 17.224 ( 6.936 5.446 -0.905) 8.865 17.612 ( -6.509 3.763 -9.032) 11.752 17.694 ( -0.365 -1.603 1.436) 2.183 25.618 ( 2.050 -1.627 0.212) 2.626 25.670 ( -0.071 -0.737 3.594) 3.669 25.701 ( 1.180 -1.569 -0.850) 2.139 25.749 ( -1.676 -0.839 0.688) 1.997 25.877 ( -0.419 1.867 2.325) 3.011 26.284 ( -3.543 -2.470 -1.328) 4.518 26.368 ( 4.183 -0.844 3.289) 5.388 26.427 ( -0.985 -0.635 -5.008) 5.144 26.780 ( -0.388 1.318 9.003) 9.107 27.176 ( 4.399 2.688 4.432) 6.798 27.741 ( -3.355 -8.829 -4.286) 10.372 28.085 ( -9.523 -4.201 -7.784) 12.998 28.391 ( -3.029 -9.951 -1.056) 10.455 28.501 ( -2.634 -6.522 0.914) 7.093 29.159 ( 5.227 1.499 -4.392) 6.990 30.385 ( 9.323 26.196 1.352) 27.838 ======================= Grid point 23 (17/140) ======================= q-point: ( 0.56 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.556 ( -0.042 -2.628 2.795) 3.837 1.880 ( 10.697 -8.119 4.233) 14.080 2.014 ( -1.317 -5.637 -2.937) 6.492 2.314 ( -0.515 -3.485 1.477) 3.820 2.488 ( 3.586 -9.090 6.575) 11.778 2.585 ( -2.557 -9.311 5.840) 11.285 2.721 ( 3.737 -5.913 8.646) 11.122 2.765 ( -5.427 -6.336 -6.251) 10.425 2.930 ( -0.034 -7.001 -7.326) 10.133 3.023 ( -5.538 -0.257 1.290) 5.692 3.135 ( -2.561 -1.185 -7.573) 8.082 3.218 ( -2.858 -3.758 -2.313) 5.258 3.285 ( -1.010 -5.705 7.491) 9.470 3.407 ( -2.471 6.910 -3.539) 8.147 3.562 ( 2.911 -1.738 -3.447) 4.835 3.787 ( -1.694 -3.332 -3.716) 5.271 3.959 ( -0.405 1.142 2.190) 2.503 4.250 ( 3.770 -0.671 3.248) 5.021 4.518 ( 6.408 -9.472 2.509) 11.707 4.581 ( 3.999 6.535 1.916) 7.898 4.643 ( -2.297 0.291 2.809) 3.640 4.774 ( 0.649 1.013 0.649) 1.367 4.837 ( -0.643 2.083 0.606) 2.263 5.138 ( 5.395 0.836 -0.069) 5.460 5.286 ( -0.967 -2.623 -3.019) 4.115 5.430 ( -6.990 -6.775 5.571) 11.216 5.680 ( -2.566 -4.378 1.301) 5.238 5.787 ( -0.379 3.726 -9.558) 10.265 5.939 ( 0.452 3.941 -7.879) 8.821 6.145 ( -3.617 0.457 6.536) 7.484 6.165 ( -0.362 4.493 -1.641) 4.797 6.322 ( 11.888 -0.256 -3.055) 12.277 6.492 ( 0.277 1.306 1.707) 2.168 6.719 ( -3.148 2.199 -0.628) 3.891 6.769 ( -1.917 2.604 -2.653) 4.182 6.847 ( -3.096 -1.487 6.414) 7.276 7.032 ( 0.659 -0.956 -8.619) 8.697 7.210 ( -3.307 -2.514 2.187) 4.694 7.508 ( 4.542 1.520 4.850) 6.817 7.613 ( 0.251 1.043 1.781) 2.079 8.528 ( -5.521 -1.116 -2.550) 6.183 8.762 ( 0.986 -7.102 -1.381) 7.302 8.917 ( -5.289 -9.096 -5.046) 11.669 8.964 ( -0.283 -8.689 -0.000) 8.694 9.200 ( -1.136 -1.119 0.413) 1.647 9.287 ( 0.526 -12.338 -1.700) 12.465 9.484 ( 1.788 8.990 1.125) 9.235 9.870 ( 3.428 -3.138 3.044) 5.555 10.023 ( -1.064 4.189 2.707) 5.100 10.682 ( 2.017 3.553 1.941) 4.523 10.918 ( 1.187 -2.714 4.572) 5.448 11.050 ( -0.363 1.007 -1.477) 1.824 11.267 ( 4.600 0.108 -1.853) 4.960 11.354 ( -1.890 -1.631 -1.021) 2.697 11.566 ( -1.880 3.173 -4.063) 5.487 11.597 ( -3.519 7.129 -1.947) 8.185 11.885 ( -0.406 -5.627 4.705) 7.346 11.936 ( 7.095 -4.306 -0.973) 8.356 12.070 ( 2.284 0.128 6.183) 6.593 12.207 ( -0.407 -2.390 -3.164) 3.986 12.286 ( 5.787 0.965 4.063) 7.136 12.575 ( -0.689 5.955 -5.513) 8.144 12.693 ( -8.954 -4.216 2.933) 10.322 12.905 ( -8.752 7.630 1.323) 11.687 14.580 ( -0.555 -1.855 2.457) 3.128 14.645 ( 0.308 -0.612 -1.317) 1.485 14.893 ( 0.739 1.497 -0.076) 1.671 15.044 ( 0.255 -4.851 -1.737) 5.159 15.140 ( 0.320 6.045 0.027) 6.054 15.436 ( 1.891 1.287 2.080) 3.091 15.514 ( 5.970 2.151 0.594) 6.373 15.562 ( -2.144 1.547 0.355) 2.667 15.767 ( -7.575 2.749 0.186) 8.060 15.850 ( 0.820 4.110 -3.516) 5.471 15.987 ( -0.792 0.800 -1.117) 1.586 16.522 ( -0.013 -4.393 0.217) 4.399 16.961 ( 12.430 4.840 3.063) 13.686 17.177 ( 3.326 5.095 -0.157) 6.087 17.458 ( -8.975 1.714 -6.650) 11.301 17.721 ( -0.349 -1.226 0.917) 1.571 25.652 ( 0.655 0.097 1.309) 1.467 25.692 ( 0.875 -1.275 0.101) 1.550 25.739 ( 1.137 -1.204 0.970) 1.919 25.752 ( -1.583 -1.122 0.200) 1.951 25.842 ( -0.409 2.824 0.741) 2.949 26.297 ( -2.733 -2.293 0.431) 3.593 26.397 ( -0.905 -0.592 -5.643) 5.745 26.419 ( 3.565 0.187 1.566) 3.898 26.837 ( 1.622 -1.912 10.127) 10.433 27.142 ( 2.359 5.770 -0.316) 6.241 27.822 ( -1.496 -5.974 -1.921) 6.451 28.082 ( -6.723 -6.944 -7.602) 12.296 28.523 ( -4.399 -8.480 -2.422) 9.855 28.605 ( -2.764 -9.111 1.013) 9.575 29.170 ( 4.195 0.474 -0.157) 4.224 30.016 ( 7.022 26.471 2.141) 27.470 ======================= Grid point 24 (18/140) ======================= q-point: (-0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.511 ( -1.646 8.017 1.053) 8.252 1.991 ( 1.833 4.848 -1.546) 5.408 2.083 ( 0.597 -4.787 -0.851) 4.899 2.360 ( 2.421 -2.532 4.437) 5.654 2.584 ( -3.903 0.126 -3.864) 5.494 2.700 ( 4.552 1.071 9.634) 10.709 2.795 ( -1.446 -2.906 -0.714) 3.324 2.845 ( 0.347 0.740 2.819) 2.935 2.963 ( -3.907 -7.252 -6.587) 10.548 3.019 ( -0.961 -4.194 -1.733) 4.639 3.087 ( -2.746 1.343 -2.738) 4.104 3.267 ( -0.494 -4.420 -0.432) 4.468 3.341 ( -0.632 -2.173 -2.229) 3.177 3.419 ( -0.312 -5.693 2.923) 6.408 3.664 ( 6.512 -5.463 0.800) 8.538 3.787 ( -5.343 -4.868 -4.285) 8.403 3.910 ( -0.429 5.840 1.448) 6.032 4.313 ( 5.483 1.440 6.829) 8.875 4.431 ( -2.134 7.514 -0.256) 7.816 4.585 ( -0.914 4.987 -1.788) 5.376 4.626 ( -0.363 3.040 -2.946) 4.249 4.772 ( -0.085 -0.639 -0.750) 0.988 4.854 ( 3.125 -0.522 3.995) 5.099 5.133 ( 3.282 3.086 -0.373) 4.520 5.356 ( -1.256 -6.955 0.470) 7.083 5.547 ( -2.593 -6.300 3.362) 7.598 5.681 ( -2.449 -0.057 -5.146) 5.699 5.765 ( 2.169 -1.197 3.027) 3.912 5.843 ( -0.975 2.480 -5.651) 6.248 6.072 ( -0.333 2.854 0.010) 2.873 6.171 ( -1.343 -0.706 3.009) 3.370 6.364 ( 5.967 2.029 -2.339) 6.722 6.548 ( 0.558 -4.479 1.157) 4.660 6.626 ( -3.719 2.036 -0.424) 4.261 6.744 ( -0.246 0.737 -0.342) 0.849 6.876 ( -1.872 -2.867 1.756) 3.848 7.069 ( 1.456 -6.227 -4.005) 7.546 7.237 ( -0.850 -1.438 1.742) 2.413 7.497 ( 0.337 4.451 2.553) 5.142 7.643 ( 3.625 -1.633 1.971) 4.438 8.498 ( -3.524 -1.366 -2.401) 4.478 8.900 ( 3.293 -7.264 0.729) 8.009 8.981 ( -4.097 -5.693 -3.590) 7.879 9.086 ( 1.070 -5.352 -0.149) 5.459 9.213 ( -1.479 -1.895 -0.397) 2.436 9.345 ( 0.019 8.865 0.238) 8.869 9.490 ( 0.847 -10.789 -0.506) 10.834 9.912 ( -0.235 6.581 4.868) 8.189 9.963 ( 1.320 -1.424 -2.270) 2.987 10.614 ( 1.334 6.775 -0.021) 6.905 10.935 ( -1.384 2.263 2.553) 3.682 10.983 ( -1.518 5.378 -1.335) 5.745 11.317 ( 2.959 -4.498 -0.071) 5.385 11.414 ( 0.755 -4.635 0.871) 4.776 11.434 ( 1.915 6.832 -3.061) 7.727 11.513 ( -5.670 -0.002 -2.376) 6.148 11.877 ( 0.516 7.585 1.950) 7.849 11.992 ( 2.959 2.812 -0.465) 4.108 12.115 ( -2.219 0.790 4.928) 5.462 12.247 ( 2.100 -4.532 0.924) 5.080 12.290 ( 3.619 4.328 1.452) 5.825 12.583 ( 3.798 -6.634 -6.913) 10.307 12.695 ( -6.311 -1.494 10.963) 12.738 12.808 ( -4.107 -5.170 -8.483) 10.750 14.571 ( -1.509 1.726 -0.043) 2.293 14.704 ( 1.262 -3.459 0.846) 3.778 14.907 ( 0.018 -2.799 -0.022) 2.799 15.030 ( 2.413 6.308 -0.784) 6.800 15.129 ( -1.426 -4.485 1.138) 4.842 15.398 ( 1.179 5.185 0.252) 5.323 15.524 ( -0.230 1.920 0.442) 1.983 15.561 ( 4.001 -2.114 0.400) 4.543 15.690 ( -6.278 -1.768 -1.864) 6.784 15.773 ( -0.309 3.723 -0.007) 3.736 15.983 ( 0.080 -0.849 -0.620) 1.055 16.575 ( 0.241 -1.914 -0.080) 1.931 16.950 ( 6.400 7.841 2.550) 10.438 17.104 ( 0.565 5.378 0.207) 5.411 17.399 ( -5.179 -4.885 -3.256) 7.828 17.741 ( -0.076 -1.051 0.441) 1.142 25.636 ( -0.250 1.923 0.627) 2.038 25.714 ( 0.421 0.934 -0.057) 1.026 25.747 ( 0.306 -0.749 0.272) 0.853 25.776 ( -0.300 1.016 1.306) 1.682 25.803 ( -0.076 -1.053 -1.160) 1.569 26.320 ( -1.435 -1.283 3.209) 3.742 26.376 ( 0.817 -0.565 -6.751) 6.823 26.447 ( 0.730 -0.881 1.392) 1.802 26.946 ( 1.725 -1.188 12.745) 12.916 27.049 ( 1.401 2.792 -7.476) 8.103 27.904 ( 0.377 -4.838 -0.390) 4.868 28.122 ( -3.602 -6.066 -4.798) 8.532 28.575 ( -3.741 -4.060 -2.427) 6.031 28.768 ( -1.404 -10.818 0.843) 10.942 29.186 ( 1.451 1.525 1.258) 2.452 29.645 ( 3.604 23.427 1.479) 23.748 ======================= Grid point 25 (19/140) ======================= q-point: (-0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.315 ( -0.000 13.946 -0.000) 13.946 1.794 ( -0.000 16.634 -0.000) 16.634 2.097 ( -0.000 5.909 -0.000) 5.909 2.437 ( 0.000 -1.890 0.000) 1.890 2.445 ( -0.000 10.874 -0.000) 10.874 2.635 ( -0.000 7.676 -0.000) 7.676 2.803 ( -0.000 4.365 -0.000) 4.365 2.879 ( 0.000 -6.461 0.000) 6.461 3.010 ( -0.000 3.952 -0.000) 3.952 3.025 ( 0.000 -0.938 0.000) 0.938 3.149 ( 0.000 -11.467 0.000) 11.467 3.252 ( -0.000 7.573 -0.000) 7.573 3.436 ( 0.000 -8.882 0.000) 8.882 3.477 ( 0.000 -0.471 0.000) 0.471 3.769 ( -0.000 8.397 -0.000) 8.397 3.857 ( 0.000 -6.635 0.000) 6.635 3.863 ( 0.000 -12.194 0.000) 12.194 4.255 ( -0.000 10.858 -0.000) 10.858 4.330 ( -0.000 4.156 -0.000) 4.156 4.484 ( -0.000 2.800 -0.000) 2.800 4.542 ( -0.000 4.845 -0.000) 4.845 4.803 ( 0.000 -2.985 0.000) 2.985 4.834 ( -0.000 5.887 -0.000) 5.887 5.116 ( -0.000 0.075 -0.000) 0.075 5.431 ( 0.000 -2.529 0.000) 2.529 5.630 ( 0.000 -4.034 0.000) 4.034 5.655 ( 0.000 -0.195 0.000) 0.195 5.783 ( -0.000 3.807 -0.000) 3.807 5.808 ( 0.000 -1.292 0.000) 1.292 6.054 ( 0.000 -0.112 0.000) 0.112 6.188 ( 0.000 -1.420 0.000) 1.420 6.357 ( -0.000 0.484 -0.000) 0.484 6.527 ( -0.000 2.644 -0.000) 2.644 6.674 ( 0.000 -3.063 0.000) 3.063 6.722 ( -0.000 1.196 -0.000) 1.196 6.960 ( 0.000 -7.610 0.000) 7.610 7.209 ( 0.000 -10.307 0.000) 10.307 7.258 ( 0.000 -0.988 0.000) 0.988 7.426 ( -0.000 3.849 -0.000) 3.849 7.701 ( 0.000 -2.051 0.000) 2.051 8.513 ( 0.000 -3.150 0.000) 3.150 9.004 ( -0.000 0.368 -0.000) 0.368 9.037 ( 0.000 -5.862 0.000) 5.862 9.150 ( 0.000 -0.821 0.000) 0.821 9.197 ( -0.000 7.667 -0.000) 7.667 9.246 ( 0.000 -3.356 0.000) 3.356 9.603 ( 0.000 -1.044 0.000) 1.044 9.766 ( -0.000 10.575 -0.000) 10.575 10.020 ( 0.000 -4.798 0.000) 4.798 10.497 ( -0.000 6.792 -0.000) 6.792 10.851 ( -0.000 8.013 -0.000) 8.013 10.900 ( -0.000 1.324 -0.000) 1.324 11.347 ( -0.000 3.651 -0.000) 3.651 11.396 ( 0.000 -0.631 0.000) 0.631 11.502 ( 0.000 -2.182 0.000) 2.182 11.528 ( 0.000 -8.738 0.000) 8.738 11.717 ( -0.000 9.213 -0.000) 9.213 11.937 ( -0.000 4.701 -0.000) 4.701 12.017 ( -0.000 9.458 -0.000) 9.458 12.273 ( 0.000 -1.939 0.000) 1.939 12.378 ( 0.000 -6.570 0.000) 6.570 12.638 ( 0.000 -1.914 0.000) 1.914 12.860 ( 0.000 -9.870 0.000) 9.870 12.888 ( 0.000 -12.484 0.000) 12.484 14.523 ( -0.000 2.805 -0.000) 2.805 14.725 ( -0.000 2.184 -0.000) 2.184 14.953 ( 0.000 -1.413 0.000) 1.413 15.001 ( 0.000 -2.184 0.000) 2.184 15.184 ( 0.000 -3.499 0.000) 3.499 15.308 ( -0.000 5.666 -0.000) 5.666 15.480 ( -0.000 4.271 -0.000) 4.271 15.624 ( 0.000 -2.404 0.000) 2.404 15.698 ( 0.000 -1.245 0.000) 1.245 15.781 ( 0.000 -7.173 0.000) 7.173 16.002 ( 0.000 -1.313 0.000) 1.313 16.591 ( -0.000 0.099 -0.000) 0.099 16.839 ( -0.000 8.235 -0.000) 8.235 17.016 ( -0.000 5.138 -0.000) 5.138 17.481 ( 0.000 -6.752 0.000) 6.752 17.763 ( 0.000 -1.715 0.000) 1.715 25.603 ( -0.000 1.871 -0.000) 1.871 25.670 ( -0.000 3.717 -0.000) 3.717 25.737 ( -0.000 1.838 -0.000) 1.838 25.771 ( 0.000 -0.648 0.000) 0.648 25.845 ( 0.000 -2.782 0.000) 2.782 26.349 ( 0.000 -0.822 0.000) 0.822 26.359 ( 0.000 -0.065 0.000) 0.065 26.472 ( 0.000 -1.113 0.000) 1.113 26.916 ( -0.000 5.437 -0.000) 5.437 27.109 ( 0.000 -7.156 0.000) 7.156 27.977 ( 0.000 -3.616 0.000) 3.616 28.180 ( 0.000 -4.071 0.000) 4.071 28.603 ( 0.000 -2.338 0.000) 2.338 28.937 ( 0.000 -9.795 0.000) 9.795 29.105 ( -0.000 10.740 -0.000) 10.740 29.350 ( -0.000 12.464 -0.000) 12.464 ======================= Grid point 30 (20/140) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.355 ( 4.917 0.000 10.706) 11.781 1.389 ( 2.431 0.000 5.824) 6.311 1.648 ( -11.490 -0.000 0.628) 11.507 1.729 ( 28.311 0.000 4.927) 28.736 1.806 ( 2.886 0.000 -1.211) 3.130 2.215 ( -7.826 -0.000 7.003) 10.502 2.429 ( 5.211 0.000 -1.691) 5.478 2.478 ( -2.892 -0.000 5.068) 5.835 2.745 ( 6.656 0.000 11.058) 12.906 2.984 ( -0.227 -0.000 -12.291) 12.293 3.038 ( 7.627 0.000 -6.590) 10.080 3.140 ( 4.405 0.000 14.790) 15.432 3.338 ( -10.860 -0.000 -6.739) 12.782 3.422 ( 2.190 0.000 -3.004) 3.717 3.833 ( -3.962 -0.000 1.373) 4.193 3.913 ( 3.153 0.000 5.465) 6.309 3.961 ( -7.651 -0.000 2.544) 8.063 3.999 ( -0.689 -0.000 -12.683) 12.702 4.125 ( 2.674 0.000 -0.769) 2.782 4.429 ( -6.609 -0.000 1.636) 6.809 4.734 ( -1.932 -0.000 1.079) 2.213 4.746 ( 0.941 0.000 5.492) 5.572 4.870 ( 7.288 0.000 -2.595) 7.737 5.039 ( -2.575 -0.000 3.897) 4.671 5.385 ( -0.686 -0.000 6.239) 6.277 5.498 ( 0.417 0.000 -4.846) 4.864 5.555 ( -0.488 -0.000 -10.058) 10.070 5.916 ( 7.889 0.000 -4.347) 9.007 6.066 ( -1.486 -0.000 0.456) 1.554 6.162 ( -8.580 -0.000 -4.987) 9.924 6.315 ( 8.279 0.000 3.338) 8.927 6.443 ( 5.416 0.000 0.408) 5.431 6.591 ( -5.119 -0.000 -2.075) 5.524 6.777 ( 3.900 0.000 0.693) 3.961 6.792 ( 1.024 0.000 6.162) 6.246 6.974 ( 2.241 0.000 2.456) 3.324 7.090 ( -2.769 -0.000 -5.660) 6.301 7.300 ( -17.898 -0.000 -1.677) 17.976 7.387 ( -4.529 -0.000 -1.690) 4.834 7.719 ( 3.959 0.000 2.463) 4.662 8.497 ( -2.958 -0.000 -7.897) 8.433 8.514 ( -9.380 -0.000 -1.620) 9.519 8.534 ( 0.096 0.000 3.613) 3.614 8.656 ( -0.359 -0.000 -1.974) 2.007 8.965 ( -4.129 -0.000 -1.569) 4.417 9.291 ( 4.458 0.000 -0.265) 4.466 9.688 ( 0.145 0.000 -2.815) 2.819 9.821 ( 0.567 0.000 1.471) 1.577 10.021 ( -1.705 -0.000 12.104) 12.224 10.539 ( 1.296 0.000 15.474) 15.528 10.700 ( 3.062 0.000 2.217) 3.781 10.923 ( 3.526 0.000 -1.932) 4.020 11.235 ( 2.162 0.000 -11.873) 12.068 11.372 ( 5.543 0.000 8.276) 9.961 11.414 ( -5.654 -0.000 -0.073) 5.654 11.652 ( 1.691 0.000 -1.971) 2.597 11.857 ( -1.741 -0.000 5.336) 5.613 11.915 ( 6.970 0.000 8.506) 10.997 12.053 ( -4.882 -0.000 -8.108) 9.465 12.129 ( -6.120 -0.000 1.195) 6.236 12.252 ( -0.957 -0.000 3.724) 3.845 12.529 ( -7.121 -0.000 2.681) 7.609 12.938 ( -0.251 -0.000 -6.750) 6.754 13.288 ( -0.171 -0.000 4.398) 4.401 14.679 ( -1.754 -0.000 2.349) 2.931 14.707 ( -0.082 -0.000 -2.105) 2.107 14.826 ( -6.048 -0.000 -4.143) 7.331 14.991 ( 3.256 0.000 1.401) 3.545 15.405 ( 4.180 0.000 0.537) 4.214 15.511 ( -6.140 -0.000 2.768) 6.735 15.573 ( 0.371 0.000 -0.638) 0.738 15.694 ( 6.237 0.000 -4.842) 7.896 15.847 ( -9.534 -0.000 3.872) 10.290 15.907 ( 11.396 0.000 -8.364) 14.136 16.116 ( -2.399 -0.000 5.147) 5.679 16.250 ( -1.501 -0.000 -3.539) 3.844 17.027 ( 10.998 0.000 -0.615) 11.015 17.427 ( -2.891 -0.000 -0.296) 2.906 17.571 ( 1.420 0.000 -1.887) 2.362 17.730 ( 1.757 0.000 -9.821) 9.977 25.588 ( 2.375 0.000 0.561) 2.440 25.652 ( -1.411 -0.000 1.599) 2.132 25.655 ( 1.459 0.000 0.274) 1.485 25.735 ( -1.201 -0.000 0.743) 1.413 25.915 ( -0.442 -0.000 4.894) 4.914 26.233 ( -2.639 -0.000 -0.105) 2.641 26.347 ( 5.122 0.000 3.241) 6.061 26.402 ( -0.531 -0.000 -0.494) 0.726 26.837 ( -2.763 -0.000 6.585) 7.141 27.241 ( 5.656 0.000 9.430) 10.996 27.428 ( -0.327 -0.000 -7.607) 7.614 28.091 ( -11.188 -0.000 -6.364) 12.871 28.199 ( -1.617 -0.000 -1.188) 2.007 28.375 ( -0.155 -0.000 0.414) 0.442 29.190 ( 4.780 0.000 -7.378) 8.791 30.915 ( 3.238 0.000 -3.520) 4.783 ======================= Grid point 31 (21/140) ======================= q-point: ( 0.44 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.326 ( -2.405 -0.858 5.875) 6.405 1.531 ( 3.709 -9.915 -0.533) 10.599 1.865 ( -4.683 -20.428 -1.569) 21.016 1.947 ( 16.537 -7.033 8.299) 19.794 2.004 ( 8.628 -11.864 5.827) 15.785 2.241 ( -4.891 -5.066 4.821) 8.535 2.478 ( 3.044 -3.296 -0.325) 4.499 2.545 ( -1.219 -6.770 3.473) 7.706 2.761 ( -6.170 0.007 1.529) 6.357 2.925 ( -1.085 -4.058 -14.538) 15.133 3.086 ( 6.218 1.360 1.159) 6.470 3.211 ( -6.454 0.942 -0.224) 6.526 3.250 ( -1.923 0.487 4.599) 5.009 3.527 ( 4.628 -3.820 2.950) 6.687 3.700 ( 0.487 5.721 -3.414) 6.680 3.826 ( -1.816 10.180 -3.897) 11.051 3.944 ( -2.605 -0.772 4.900) 5.603 4.067 ( -0.235 -10.522 -1.117) 10.584 4.172 ( 6.650 -2.927 -0.756) 7.305 4.496 ( -3.329 -9.572 -0.497) 10.147 4.712 ( -1.591 1.161 0.642) 2.071 4.789 ( -0.810 -2.006 4.895) 5.352 4.875 ( 1.987 2.200 -3.169) 4.340 5.089 ( 2.577 -2.024 9.225) 9.789 5.326 ( -2.371 6.067 1.484) 6.681 5.476 ( 1.411 2.277 -3.381) 4.313 5.528 ( -2.352 -2.980 -8.341) 9.164 5.918 ( 1.798 2.478 -7.584) 8.178 6.018 ( -2.292 2.182 -2.476) 4.018 6.118 ( -3.184 -1.979 1.824) 4.170 6.336 ( 6.618 5.439 1.598) 8.714 6.444 ( 6.304 5.018 0.261) 8.062 6.577 ( -2.617 -0.760 0.090) 2.727 6.778 ( 0.524 1.207 4.944) 5.116 6.826 ( 3.981 1.676 0.018) 4.320 6.947 ( -3.459 5.898 -0.127) 6.839 7.054 ( -6.662 2.340 -6.242) 9.424 7.107 ( -4.423 -2.134 0.708) 4.962 7.460 ( -5.393 -8.053 0.386) 9.699 7.691 ( 3.688 6.229 1.355) 7.364 8.474 ( -5.489 -3.008 -1.450) 6.425 8.514 ( -1.308 -6.439 -4.200) 7.798 8.582 ( -3.839 -7.005 -2.810) 8.468 8.699 ( -0.296 -4.485 3.175) 5.503 8.981 ( -0.328 -4.864 -1.720) 5.169 9.247 ( 1.851 5.365 -0.230) 5.680 9.736 ( 1.631 -4.309 -0.762) 4.670 9.773 ( 0.972 5.645 1.986) 6.062 10.077 ( -0.865 -0.828 7.134) 7.234 10.694 ( 0.000 -3.379 8.419) 9.072 10.775 ( 3.193 -6.797 6.872) 10.179 10.968 ( 2.270 -4.096 -1.282) 4.856 11.162 ( -0.718 -0.405 -14.775) 14.798 11.397 ( -3.547 -1.386 0.613) 3.857 11.506 ( 5.955 -5.422 6.581) 10.400 11.626 ( 0.939 3.321 -1.827) 3.905 11.837 ( -4.639 3.096 1.030) 5.672 11.934 ( 1.235 2.033 -0.575) 2.447 12.084 ( 5.996 -4.519 2.667) 7.968 12.088 ( -2.210 0.525 1.817) 2.909 12.275 ( -3.393 -1.560 4.654) 5.967 12.517 ( -5.590 -2.761 2.090) 6.576 12.840 ( -3.417 5.611 -7.961) 10.322 13.249 ( -0.129 7.235 3.604) 8.084 14.610 ( 0.059 4.063 1.924) 4.496 14.707 ( -2.633 3.194 -1.526) 4.411 14.791 ( -1.324 -4.555 -3.160) 5.700 15.072 ( 2.934 -4.120 0.947) 5.146 15.292 ( -0.966 10.891 -0.015) 10.934 15.522 ( -1.892 -1.094 0.375) 2.217 15.549 ( -0.439 1.815 2.553) 3.164 15.675 ( 6.368 4.496 -3.668) 8.615 15.819 ( -7.255 -0.725 3.260) 7.986 15.939 ( 7.670 1.139 -6.826) 10.331 16.072 ( -3.048 3.756 1.833) 5.173 16.309 ( -0.249 -7.225 -0.484) 7.246 17.091 ( 11.248 2.170 0.029) 11.456 17.349 ( -0.284 4.489 0.134) 4.500 17.569 ( -3.299 1.711 -5.862) 6.941 17.686 ( -0.283 0.439 -1.509) 1.597 25.614 ( 2.130 -0.814 0.004) 2.280 25.659 ( -1.383 -1.160 1.371) 2.267 25.681 ( 1.378 -1.511 0.113) 2.048 25.732 ( -1.154 -0.263 0.557) 1.308 25.921 ( -0.059 1.562 3.647) 3.968 26.224 ( -2.013 -1.269 -0.778) 2.503 26.387 ( -0.103 0.246 0.028) 0.269 26.415 ( 3.471 -1.091 1.253) 3.848 26.832 ( -1.369 1.430 5.334) 5.689 27.291 ( 5.875 2.638 6.532) 9.173 27.522 ( -1.066 -11.025 -2.569) 11.371 27.942 ( -10.316 1.098 -9.292) 13.928 28.240 ( -1.677 -5.877 -0.785) 6.162 28.407 ( -0.724 -3.564 0.486) 3.669 29.190 ( 4.139 0.551 -4.271) 5.973 30.789 ( 3.299 15.358 -0.934) 15.736 ======================= Grid point 32 (22/140) ======================= q-point: ( 0.56 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.450 ( 0.868 -10.510 1.112) 10.604 1.746 ( 0.109 -12.245 1.956) 12.401 2.037 ( 6.579 0.580 0.145) 6.606 2.195 ( 3.811 -10.505 2.919) 11.550 2.329 ( -4.845 -10.839 -0.807) 11.900 2.398 ( 3.037 -17.911 10.529) 20.997 2.586 ( -0.555 -7.573 -2.546) 8.009 2.660 ( -0.446 -6.684 -2.158) 7.038 2.759 ( -3.869 -6.886 0.242) 7.902 2.982 ( 0.926 -6.615 -3.425) 7.507 3.065 ( -0.359 3.099 -2.420) 3.948 3.149 ( -3.375 -0.585 -2.943) 4.516 3.274 ( -0.713 -0.783 7.412) 7.487 3.498 ( -2.785 3.327 4.265) 6.084 3.563 ( -0.116 8.413 -11.090) 13.921 3.759 ( 2.653 0.461 0.620) 2.763 3.964 ( -0.538 -0.844 1.855) 2.108 4.227 ( 2.296 -7.784 0.703) 8.146 4.343 ( -0.250 -10.422 0.342) 10.431 4.626 ( 4.914 -4.649 0.128) 6.765 4.688 ( -0.340 1.048 0.853) 1.393 4.827 ( 3.171 1.459 -0.715) 3.563 4.848 ( -2.364 -1.334 3.562) 4.478 5.135 ( -1.890 1.454 -0.396) 2.418 5.308 ( 4.481 -2.709 9.163) 10.553 5.378 ( -2.626 6.299 -0.715) 6.862 5.532 ( -4.646 -5.525 -9.922) 12.271 5.838 ( 1.296 4.036 -0.506) 4.269 5.935 ( -3.307 2.397 -7.351) 8.409 6.160 ( 0.146 -0.835 4.308) 4.390 6.262 ( 1.403 7.025 -1.419) 7.303 6.420 ( 9.368 3.511 -0.754) 10.033 6.531 ( -4.314 2.991 1.533) 5.468 6.738 ( -4.111 4.092 1.050) 5.895 6.813 ( 3.884 3.243 -2.414) 5.606 6.858 ( -2.489 1.218 5.569) 6.221 6.977 ( -1.634 -1.301 -6.159) 6.504 7.150 ( -1.548 -2.938 0.849) 3.428 7.540 ( -0.684 -3.487 1.538) 3.872 7.638 ( 1.620 2.584 0.791) 3.150 8.474 ( -2.624 -1.046 -0.577) 2.883 8.629 ( 1.646 -8.643 -2.012) 9.026 8.684 ( -4.923 -10.284 -2.810) 11.743 8.821 ( -0.238 -8.583 1.763) 8.766 9.093 ( 0.049 -9.010 -1.629) 9.156 9.200 ( 0.306 0.919 0.363) 1.035 9.655 ( 1.124 9.011 0.980) 9.134 9.834 ( 1.571 -4.446 0.509) 4.742 10.084 ( -0.753 2.058 2.670) 3.454 10.737 ( 0.877 0.100 2.252) 2.419 10.922 ( 2.166 -1.595 8.848) 9.248 11.026 ( 0.002 -1.274 -5.277) 5.429 11.196 ( 1.239 -10.294 -6.372) 12.170 11.376 ( -1.664 2.727 1.139) 3.392 11.557 ( -1.531 2.733 -1.999) 3.716 11.685 ( 1.210 -2.945 -0.581) 3.236 11.726 ( -1.933 -1.376 1.990) 3.097 11.959 ( 4.129 -2.123 0.193) 4.646 12.081 ( -2.527 -0.029 2.091) 3.280 12.193 ( 5.265 -0.641 -0.695) 5.349 12.323 ( -0.553 -4.234 6.901) 8.115 12.553 ( -2.469 -3.613 0.937) 4.475 12.648 ( -5.188 7.367 -6.604) 11.171 13.077 ( -1.599 13.842 1.835) 14.054 14.581 ( -0.104 0.901 2.046) 2.238 14.640 ( -0.384 1.289 -1.764) 2.219 14.862 ( -0.408 -5.181 -1.041) 5.300 15.077 ( 2.107 8.029 -0.599) 8.323 15.180 ( -1.274 -0.752 0.836) 1.699 15.493 ( 1.104 3.494 1.420) 3.930 15.543 ( -1.896 -0.920 0.191) 2.116 15.633 ( 5.745 4.583 -1.527) 7.506 15.760 ( -6.715 2.842 1.509) 7.446 15.916 ( 2.842 3.497 -3.112) 5.476 16.002 ( -1.343 2.503 0.192) 2.847 16.430 ( 0.122 -6.768 0.043) 6.769 17.145 ( 12.115 2.752 3.300) 12.854 17.284 ( 0.633 4.096 -0.129) 4.146 17.407 ( -8.736 6.470 -6.291) 12.561 17.699 ( -0.257 -1.420 0.561) 1.548 25.650 ( 1.810 -1.603 0.157) 2.423 25.674 ( -1.147 -1.124 0.310) 1.635 25.722 ( 0.815 -2.013 0.502) 2.229 25.730 ( -0.948 -0.270 0.149) 0.997 25.897 ( 0.026 2.913 1.585) 3.316 26.238 ( -1.224 -2.334 -0.365) 2.661 26.368 ( -0.762 0.258 -1.931) 2.092 26.459 ( 2.575 0.180 1.237) 2.862 26.845 ( -0.033 -1.370 4.174) 4.393 27.284 ( 3.188 6.693 2.764) 7.912 27.675 ( -1.210 -8.797 -0.440) 8.891 27.877 ( -5.675 -6.685 -6.918) 11.169 28.350 ( -1.127 -8.677 -0.459) 8.762 28.476 ( -1.111 -5.302 0.274) 5.424 29.196 ( 2.372 0.148 -1.191) 2.658 30.483 ( 2.701 23.325 0.485) 23.486 ======================= Grid point 33 (23/140) ======================= q-point: ( 0.67 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.581 ( 0.000 -1.437 0.000) 1.437 1.937 ( 0.000 -10.489 0.000) 10.489 2.045 ( -0.000 0.917 -0.000) 0.917 2.309 ( 0.000 -4.591 0.000) 4.591 2.491 ( 0.000 -8.728 0.000) 8.728 2.677 ( 0.000 -6.076 0.000) 6.076 2.726 ( 0.000 -13.680 0.000) 13.680 2.747 ( 0.000 -5.102 0.000) 5.102 2.900 ( 0.000 -9.072 0.000) 9.072 2.953 ( -0.000 7.457 -0.000) 7.457 3.072 ( 0.000 -2.544 0.000) 2.544 3.176 ( 0.000 -4.939 0.000) 4.939 3.337 ( 0.000 -4.545 0.000) 4.545 3.359 ( -0.000 6.695 -0.000) 6.695 3.571 ( 0.000 -6.991 0.000) 6.991 3.744 ( -0.000 1.588 -0.000) 1.588 3.969 ( -0.000 1.086 -0.000) 1.086 4.369 ( 0.000 -4.469 0.000) 4.469 4.409 ( 0.000 -1.480 0.000) 1.480 4.666 ( -0.000 3.404 -0.000) 3.404 4.687 ( -0.000 0.940 -0.000) 0.940 4.801 ( -0.000 5.006 -0.000) 5.006 4.844 ( 0.000 -1.440 0.000) 1.440 5.203 ( 0.000 -9.894 0.000) 9.894 5.236 ( -0.000 7.009 -0.000) 7.009 5.445 ( 0.000 -5.344 0.000) 5.344 5.584 ( 0.000 -7.189 0.000) 7.189 5.808 ( -0.000 2.234 -0.000) 2.234 5.843 ( -0.000 2.645 -0.000) 2.645 6.146 ( -0.000 6.044 -0.000) 6.044 6.172 ( -0.000 0.302 -0.000) 0.302 6.442 ( -0.000 3.900 -0.000) 3.900 6.475 ( 0.000 -3.191 0.000) 3.191 6.655 ( -0.000 3.627 -0.000) 3.627 6.772 ( -0.000 2.424 -0.000) 2.424 6.852 ( 0.000 -0.114 0.000) 0.114 6.993 ( 0.000 -2.580 0.000) 2.580 7.196 ( 0.000 -3.162 0.000) 3.162 7.562 ( -0.000 1.681 -0.000) 1.681 7.634 ( 0.000 -0.980 0.000) 0.980 8.470 ( 0.000 -0.235 0.000) 0.235 8.799 ( 0.000 -8.446 0.000) 8.446 8.803 ( 0.000 -9.655 0.000) 9.655 8.973 ( 0.000 -8.497 0.000) 8.497 9.180 ( 0.000 -1.531 0.000) 1.531 9.293 ( 0.000 -11.623 0.000) 11.623 9.503 ( -0.000 9.697 -0.000) 9.697 9.911 ( 0.000 -3.731 0.000) 3.731 10.029 ( -0.000 4.947 -0.000) 4.947 10.715 ( -0.000 3.999 -0.000) 3.999 10.959 ( -0.000 0.016 -0.000) 0.016 11.026 ( -0.000 0.346 -0.000) 0.346 11.309 ( -0.000 2.827 -0.000) 2.827 11.333 ( 0.000 -6.286 0.000) 6.286 11.505 ( -0.000 2.043 -0.000) 2.043 11.562 ( -0.000 8.222 -0.000) 8.222 11.898 ( 0.000 -7.239 0.000) 7.239 12.051 ( -0.000 2.090 -0.000) 2.090 12.054 ( 0.000 -5.098 0.000) 5.098 12.208 ( 0.000 -0.837 0.000) 0.837 12.437 ( -0.000 8.161 -0.000) 8.161 12.457 ( 0.000 -7.003 0.000) 7.003 12.648 ( 0.000 -5.322 0.000) 5.322 12.828 ( -0.000 12.938 -0.000) 12.938 14.579 ( -0.000 0.103 -0.000) 0.103 14.652 ( 0.000 -2.831 0.000) 2.831 14.897 ( -0.000 1.021 -0.000) 1.021 15.039 ( 0.000 -4.286 0.000) 4.286 15.146 ( -0.000 5.286 -0.000) 5.286 15.463 ( -0.000 1.750 -0.000) 1.750 15.542 ( -0.000 0.444 -0.000) 0.444 15.590 ( -0.000 3.001 -0.000) 3.001 15.671 ( -0.000 3.129 -0.000) 3.129 15.848 ( -0.000 4.733 -0.000) 4.733 15.976 ( -0.000 0.304 -0.000) 0.304 16.524 ( 0.000 -4.391 0.000) 4.391 17.146 ( -0.000 9.828 -0.000) 9.828 17.202 ( -0.000 5.991 -0.000) 5.991 17.281 ( 0.000 -3.832 0.000) 3.832 17.723 ( 0.000 -1.253 0.000) 1.253 25.664 ( -0.000 0.988 -0.000) 0.988 25.705 ( 0.000 -2.837 0.000) 2.837 25.727 ( -0.000 0.141 -0.000) 0.141 25.761 ( 0.000 -2.083 0.000) 2.083 25.843 ( -0.000 3.828 -0.000) 3.828 26.278 ( 0.000 -2.973 0.000) 2.973 26.360 ( 0.000 -0.236 0.000) 0.236 26.458 ( -0.000 1.023 -0.000) 1.023 26.911 ( 0.000 -4.623 0.000) 4.623 27.158 ( -0.000 9.021 -0.000) 9.021 27.801 ( 0.000 -7.198 0.000) 7.198 27.976 ( 0.000 -8.146 0.000) 8.146 28.477 ( 0.000 -6.304 0.000) 6.304 28.589 ( 0.000 -9.350 0.000) 9.350 29.204 ( 0.000 -0.056 0.000) 0.056 30.080 ( -0.000 25.893 -0.000) 25.893 ======================= Grid point 41 (24/140) ======================= q-point: ( 0.44 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.432 ( -0.081 -0.000 2.268) 2.269 1.457 ( 1.910 0.000 0.707) 2.037 1.519 ( -5.483 -0.000 1.269) 5.628 1.881 ( 1.680 0.000 2.911) 3.361 2.137 ( 16.985 0.000 2.810) 17.216 2.192 ( -1.285 -0.000 2.795) 3.076 2.485 ( 2.770 0.000 0.298) 2.786 2.501 ( -1.265 -0.000 4.668) 4.837 2.694 ( -9.796 -0.000 -0.689) 9.820 2.809 ( -0.638 -0.000 -11.140) 11.158 3.150 ( -5.298 -0.000 -2.769) 5.978 3.171 ( 5.732 0.000 1.027) 5.823 3.278 ( -0.858 -0.000 4.395) 4.478 3.605 ( 9.221 0.000 9.777) 13.439 3.735 ( -4.155 -0.000 -2.754) 4.985 3.859 ( -0.270 -0.000 -10.572) 10.575 3.926 ( -3.445 -0.000 -0.413) 3.470 3.942 ( -1.334 -0.000 3.410) 3.661 4.254 ( 8.194 0.000 2.825) 8.667 4.324 ( -4.335 -0.000 -1.483) 4.582 4.712 ( -1.259 -0.000 0.547) 1.373 4.775 ( -1.889 -0.000 1.882) 2.666 4.895 ( 0.804 0.000 -1.831) 2.000 5.146 ( 3.079 0.000 9.602) 10.083 5.377 ( -2.720 -0.000 0.307) 2.737 5.419 ( -1.264 -0.000 -8.128) 8.225 5.513 ( 1.726 0.000 -2.581) 3.105 5.924 ( 1.296 0.000 -4.095) 4.295 6.004 ( -4.443 -0.000 -3.037) 5.382 6.095 ( 0.468 0.000 3.403) 3.435 6.448 ( 3.196 0.000 1.263) 3.436 6.504 ( -3.124 -0.000 -0.592) 3.180 6.583 ( 10.999 0.000 2.108) 11.199 6.844 ( 0.527 0.000 1.772) 1.849 6.856 ( 4.847 0.000 0.507) 4.873 6.989 ( -6.117 -0.000 -2.612) 6.652 7.006 ( -13.241 -0.000 -2.725) 13.518 7.036 ( 1.612 0.000 1.752) 2.381 7.327 ( -1.480 -0.000 -0.783) 1.675 7.779 ( 1.688 0.000 0.624) 1.800 8.382 ( -3.019 -0.000 -2.612) 3.992 8.421 ( -2.076 -0.000 -1.004) 2.306 8.515 ( -0.828 -0.000 -1.371) 1.602 8.679 ( -0.442 -0.000 3.129) 3.160 8.938 ( 0.821 0.000 -0.871) 1.197 9.342 ( 1.890 0.000 -0.034) 1.890 9.649 ( -0.952 -0.000 -1.744) 1.987 9.840 ( 0.402 0.000 0.513) 0.652 10.094 ( -0.370 -0.000 5.060) 5.073 10.700 ( 0.553 0.000 11.082) 11.095 10.750 ( 2.055 0.000 0.597) 2.140 10.945 ( 1.416 0.000 -1.347) 1.954 11.094 ( -1.635 -0.000 -10.909) 11.031 11.353 ( -1.923 -0.000 -0.056) 1.924 11.543 ( 4.744 0.000 4.941) 6.850 11.676 ( 2.572 0.000 -0.631) 2.649 11.835 ( -4.162 -0.000 0.350) 4.177 11.936 ( -1.365 -0.000 -2.865) 3.173 12.082 ( -1.856 -0.000 0.951) 2.085 12.088 ( 4.721 0.000 3.493) 5.873 12.247 ( -3.636 -0.000 2.900) 4.651 12.498 ( 0.109 0.000 3.035) 3.037 12.826 ( -3.248 -0.000 -6.608) 7.363 13.329 ( 0.668 0.000 1.842) 1.960 14.679 ( -1.052 -0.000 2.007) 2.266 14.694 ( 0.209 0.000 -0.964) 0.986 14.729 ( -1.845 -0.000 -2.755) 3.316 15.055 ( 2.932 0.000 0.585) 2.990 15.426 ( -5.520 -0.000 1.296) 5.670 15.434 ( 0.940 0.000 -1.129) 1.469 15.588 ( 0.440 0.000 1.034) 1.124 15.728 ( 2.003 0.000 -2.716) 3.374 15.793 ( -1.509 -0.000 2.217) 2.682 15.973 ( 4.703 0.000 -3.947) 6.140 16.127 ( -1.279 -0.000 2.671) 2.961 16.212 ( -0.391 -0.000 -1.221) 1.282 17.189 ( 10.628 0.000 -0.966) 10.672 17.341 ( -7.952 -0.000 0.527) 7.969 17.577 ( 1.388 0.000 -1.548) 2.079 17.676 ( -0.888 -0.000 -1.972) 2.163 25.622 ( 1.977 0.000 -0.500) 2.039 25.642 ( -1.590 -0.000 1.012) 1.885 25.675 ( 0.810 0.000 -0.031) 0.811 25.725 ( -0.666 -0.000 0.399) 0.776 25.950 ( -0.013 -0.000 2.312) 2.312 26.201 ( -0.918 -0.000 -0.322) 0.973 26.392 ( -0.174 -0.000 -0.292) 0.340 26.432 ( 2.091 0.000 1.622) 2.646 26.854 ( -0.840 -0.000 2.413) 2.555 27.365 ( -0.213 -0.000 -3.489) 3.495 27.439 ( 6.269 0.000 9.578) 11.447 27.838 ( -9.042 -0.000 -8.990) 12.751 28.174 ( -0.611 -0.000 -0.376) 0.717 28.377 ( -0.086 -0.000 0.212) 0.229 29.203 ( 2.328 0.000 -2.368) 3.321 30.927 ( 0.929 0.000 -0.848) 1.258 ======================= Grid point 42 (25/140) ======================= q-point: ( 0.56 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.330 ( 0.000 -1.149 0.000) 1.149 1.561 ( 0.000 -9.930 0.000) 9.930 1.820 ( 0.000 -22.200 0.000) 22.200 2.055 ( 0.000 -16.930 0.000) 16.930 2.219 ( -0.000 0.108 -0.000) 0.108 2.229 ( 0.000 -4.116 0.000) 4.116 2.499 ( 0.000 -2.038 0.000) 2.038 2.556 ( 0.000 -4.558 0.000) 4.558 2.656 ( 0.000 -2.389 0.000) 2.389 2.842 ( 0.000 -6.918 0.000) 6.918 3.113 ( -0.000 1.249 -0.000) 1.249 3.162 ( -0.000 3.613 -0.000) 3.613 3.282 ( -0.000 0.107 -0.000) 0.107 3.575 ( -0.000 7.577 -0.000) 7.577 3.656 ( -0.000 3.456 -0.000) 3.456 3.842 ( -0.000 6.633 -0.000) 6.633 3.951 ( 0.000 -1.119 0.000) 1.119 4.026 ( 0.000 -14.420 0.000) 14.420 4.234 ( 0.000 -2.670 0.000) 2.670 4.500 ( 0.000 -12.088 0.000) 12.088 4.701 ( -0.000 0.794 -0.000) 0.794 4.790 ( 0.000 -2.619 0.000) 2.619 4.871 ( -0.000 2.336 -0.000) 2.336 5.181 ( -0.000 1.888 -0.000) 1.888 5.348 ( -0.000 0.865 -0.000) 0.865 5.402 ( 0.000 -1.875 0.000) 1.875 5.476 ( -0.000 4.568 -0.000) 4.568 5.899 ( -0.000 2.164 -0.000) 2.164 5.944 ( -0.000 3.154 -0.000) 3.154 6.140 ( 0.000 -2.845 0.000) 2.845 6.384 ( -0.000 6.602 -0.000) 6.602 6.518 ( 0.000 -0.551 0.000) 0.551 6.574 ( -0.000 7.114 -0.000) 7.114 6.812 ( -0.000 4.892 -0.000) 4.892 6.881 ( -0.000 1.930 -0.000) 1.930 6.887 ( -0.000 1.381 -0.000) 1.381 6.925 ( -0.000 1.239 -0.000) 1.239 7.094 ( 0.000 -3.630 0.000) 3.630 7.420 ( 0.000 -8.878 0.000) 8.878 7.728 ( -0.000 5.772 -0.000) 5.772 8.419 ( 0.000 -4.681 0.000) 4.681 8.486 ( 0.000 -8.112 0.000) 8.112 8.531 ( 0.000 -3.549 0.000) 3.549 8.717 ( 0.000 -4.031 0.000) 4.031 8.977 ( 0.000 -4.497 0.000) 4.497 9.260 ( -0.000 6.173 -0.000) 6.173 9.742 ( 0.000 -7.546 0.000) 7.546 9.790 ( -0.000 5.906 -0.000) 5.906 10.106 ( -0.000 0.211 -0.000) 0.211 10.735 ( 0.000 -0.773 0.000) 0.773 10.891 ( 0.000 -11.951 0.000) 11.951 10.981 ( 0.000 -5.517 0.000) 5.517 11.023 ( -0.000 3.452 -0.000) 3.452 11.369 ( 0.000 -1.994 0.000) 1.994 11.602 ( 0.000 -3.500 0.000) 3.500 11.629 ( -0.000 5.592 -0.000) 5.592 11.786 ( -0.000 3.604 -0.000) 3.604 11.937 ( 0.000 -1.536 0.000) 1.536 12.073 ( 0.000 -0.078 0.000) 0.078 12.201 ( 0.000 -8.132 0.000) 8.132 12.230 ( -0.000 0.913 -0.000) 0.913 12.519 ( 0.000 -1.185 0.000) 1.185 12.735 ( -0.000 6.584 -0.000) 6.584 13.269 ( -0.000 8.076 -0.000) 8.076 14.621 ( -0.000 3.195 -0.000) 3.195 14.676 ( -0.000 3.491 -0.000) 3.491 14.767 ( 0.000 -5.188 0.000) 5.188 15.114 ( 0.000 -4.417 0.000) 4.417 15.266 ( -0.000 11.112 -0.000) 11.112 15.500 ( 0.000 -3.082 0.000) 3.082 15.565 ( -0.000 3.189 -0.000) 3.189 15.710 ( -0.000 2.213 -0.000) 2.213 15.781 ( -0.000 1.809 -0.000) 1.809 15.966 ( -0.000 1.836 -0.000) 1.836 16.057 ( -0.000 4.735 -0.000) 4.735 16.306 ( 0.000 -7.762 0.000) 7.762 17.242 ( -0.000 0.469 -0.000) 0.469 17.285 ( -0.000 0.879 -0.000) 0.879 17.511 ( -0.000 7.702 -0.000) 7.702 17.677 ( 0.000 -1.120 0.000) 1.120 25.638 ( 0.000 -0.790 0.000) 0.790 25.645 ( 0.000 -1.257 0.000) 1.257 25.694 ( 0.000 -1.665 0.000) 1.665 25.725 ( 0.000 -0.106 0.000) 0.106 25.942 ( -0.000 1.721 -0.000) 1.721 26.205 ( 0.000 -1.030 0.000) 1.030 26.375 ( -0.000 1.243 -0.000) 1.243 26.462 ( 0.000 -1.377 0.000) 1.377 26.848 ( -0.000 0.611 -0.000) 0.611 27.370 ( -0.000 0.024 -0.000) 0.024 27.550 ( 0.000 -5.864 0.000) 5.864 27.757 ( 0.000 -0.483 0.000) 0.483 28.223 ( 0.000 -5.688 0.000) 5.688 28.404 ( 0.000 -3.061 0.000) 3.061 29.204 ( -0.000 0.169 -0.000) 0.169 30.809 ( -0.000 13.847 -0.000) 13.847 ======================= Grid point 85 (26/140) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.524 ( 7.964 0.000 26.961) 28.113 0.614 ( -20.023 -0.000 31.409) 37.248 1.009 ( 17.588 0.000 50.703) 53.667 1.289 ( 0.762 0.000 6.618) 6.662 2.019 ( -1.742 -0.000 -2.813) 3.309 2.301 ( -2.183 -0.000 7.403) 7.718 2.424 ( -4.663 -0.000 -11.201) 12.133 2.431 ( 12.581 0.000 -10.494) 16.383 2.569 ( -7.347 -0.000 2.232) 7.679 2.696 ( -2.656 -0.000 5.668) 6.260 3.007 ( -0.108 -0.000 4.730) 4.731 3.305 ( -1.555 -0.000 -11.821) 11.923 3.548 ( 0.226 0.000 -8.461) 8.464 3.667 ( -0.425 -0.000 -6.247) 6.261 3.677 ( 0.213 0.000 8.542) 8.545 3.892 ( -2.510 -0.000 9.751) 10.069 4.143 ( -0.342 -0.000 -8.470) 8.477 4.304 ( 0.979 0.000 4.688) 4.789 4.311 ( 6.878 0.000 2.678) 7.381 4.520 ( 7.232 0.000 -9.103) 11.626 4.566 ( -4.713 -0.000 0.812) 4.782 4.665 ( -11.940 -0.000 -3.130) 12.343 4.678 ( 0.862 0.000 4.885) 4.960 5.304 ( 1.981 0.000 1.685) 2.601 5.307 ( -0.219 -0.000 2.406) 2.416 5.338 ( -3.769 -0.000 1.493) 4.054 5.559 ( 4.779 0.000 -13.129) 13.971 5.780 ( 0.435 0.000 -6.107) 6.122 5.999 ( 2.535 0.000 -0.434) 2.571 6.168 ( -4.610 -0.000 5.961) 7.536 6.205 ( 5.171 0.000 -3.179) 6.070 6.316 ( 3.595 0.000 2.203) 4.216 6.565 ( -5.587 -0.000 6.823) 8.818 6.733 ( -2.448 -0.000 2.531) 3.521 6.875 ( -1.864 -0.000 -2.695) 3.276 7.092 ( 17.936 0.000 -0.450) 17.942 7.202 ( -2.385 -0.000 -3.888) 4.562 7.462 ( -6.363 -0.000 -10.068) 11.910 7.793 ( 5.753 0.000 6.770) 8.884 7.818 ( -1.370 -0.000 3.030) 3.325 8.367 ( -8.479 -0.000 2.670) 8.889 8.706 ( 11.404 0.000 -5.335) 12.590 8.732 ( -0.922 -0.000 -4.433) 4.528 8.822 ( -2.802 -0.000 -2.186) 3.554 9.189 ( -1.280 -0.000 -1.711) 2.136 9.198 ( 5.920 0.000 3.298) 6.777 9.652 ( -2.504 -0.000 1.909) 3.149 9.825 ( 3.005 0.000 -1.000) 3.167 10.282 ( -20.978 -0.000 1.842) 21.059 10.306 ( 3.358 0.000 1.210) 3.569 10.475 ( 4.306 0.000 5.647) 7.102 10.817 ( -0.652 -0.000 -2.184) 2.279 11.035 ( 0.642 0.000 5.096) 5.136 11.184 ( -1.610 -0.000 6.994) 7.176 11.565 ( 18.701 0.000 -10.088) 21.248 11.691 ( -3.045 -0.000 -0.837) 3.158 11.876 ( 0.059 0.000 0.070) 0.091 11.942 ( 12.627 0.000 3.343) 13.062 12.218 ( 0.126 0.000 -12.497) 12.497 12.370 ( -0.627 -0.000 -0.317) 0.703 12.417 ( 1.608 0.000 -2.303) 2.809 12.579 ( 9.987 0.000 0.386) 9.994 12.957 ( -10.946 -0.000 18.152) 21.197 13.996 ( -12.474 -0.000 -5.468) 13.620 14.809 ( 2.315 0.000 -1.406) 2.709 14.835 ( 10.181 0.000 -3.182) 10.667 14.852 ( -2.708 -0.000 1.092) 2.920 14.918 ( -12.884 -0.000 -0.827) 12.911 15.055 ( 5.192 0.000 3.638) 6.340 15.359 ( -7.737 -0.000 5.989) 9.784 15.467 ( 2.050 0.000 -6.355) 6.677 15.732 ( -1.113 -0.000 0.254) 1.141 15.995 ( -5.302 -0.000 -7.202) 8.943 16.094 ( 10.135 0.000 -9.199) 13.687 16.449 ( -10.361 -0.000 4.393) 11.254 16.450 ( 40.555 0.000 1.281) 40.576 16.634 ( -61.120 -0.000 5.996) 61.414 16.753 ( 4.158 0.000 2.472) 4.838 17.348 ( -3.047 -0.000 0.773) 3.143 17.555 ( 3.930 0.000 -2.339) 4.574 25.499 ( 0.387 0.000 1.888) 1.927 25.606 ( 0.335 0.000 -0.125) 0.358 25.764 ( -0.092 -0.000 1.353) 1.356 25.844 ( -3.596 -0.000 -2.142) 4.185 26.015 ( -9.646 -0.000 2.691) 10.014 26.078 ( 3.902 0.000 0.206) 3.907 26.381 ( -2.275 -0.000 -0.003) 2.275 26.423 ( -0.220 -0.000 -0.870) 0.897 26.976 ( 3.070 0.000 1.125) 3.269 27.496 ( -8.399 -0.000 -7.756) 11.433 28.044 ( -83.771 -0.000 4.066) 83.870 28.255 ( 4.030 0.000 -1.690) 4.370 28.293 ( -1.317 -0.000 -0.756) 1.519 28.405 ( 1.099 0.000 -0.742) 1.326 29.226 ( 119.265 0.000 3.305) 119.311 29.344 ( -10.555 -0.000 0.835) 10.588 ======================= Grid point 86 (27/140) ======================= q-point: ( 0.11 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.725 ( -2.144 -10.869 22.865) 25.408 0.984 ( 7.856 -21.502 19.180) 29.865 1.447 ( 10.276 -13.228 23.348) 28.735 1.600 ( 12.624 -18.024 25.253) 33.496 2.082 ( -6.990 -9.826 -5.841) 13.398 2.298 ( -4.145 -3.101 -6.396) 8.228 2.442 ( 2.889 -9.031 1.130) 9.548 2.552 ( 10.978 -9.979 -7.838) 16.779 2.643 ( -8.101 -10.925 6.453) 15.055 2.731 ( -2.717 -4.756 3.610) 6.560 3.043 ( 1.083 -0.660 5.056) 5.212 3.214 ( -2.379 1.295 -12.354) 12.648 3.483 ( 0.579 2.374 -5.722) 6.222 3.604 ( -1.828 2.333 -6.772) 7.392 3.746 ( 1.359 -1.981 8.087) 8.436 3.904 ( -5.792 0.714 1.725) 6.086 4.044 ( -1.575 4.894 -8.260) 9.729 4.275 ( -5.351 4.257 3.839) 7.842 4.393 ( 2.720 0.449 -0.614) 2.825 4.494 ( 3.961 1.757 -1.264) 4.513 4.527 ( -5.777 -0.355 2.774) 6.419 4.607 ( 5.998 -3.179 1.679) 6.993 4.768 ( 1.336 -2.928 -1.220) 3.442 5.228 ( -5.676 3.018 2.100) 6.763 5.389 ( -3.102 -4.987 -1.983) 6.199 5.400 ( 6.044 -2.842 0.375) 6.690 5.537 ( 5.987 -0.063 -13.084) 14.389 5.783 ( -2.479 -4.341 -7.404) 8.934 5.980 ( 4.254 4.535 -1.202) 6.333 6.111 ( -3.244 5.295 5.322) 8.178 6.247 ( 5.466 -0.452 -1.967) 5.827 6.385 ( 7.602 -0.957 0.524) 7.680 6.517 ( -3.955 3.584 7.340) 9.075 6.674 ( -0.477 3.162 3.319) 4.609 6.792 ( -3.328 5.156 -0.350) 6.146 7.152 ( 1.216 1.220 -2.846) 3.326 7.213 ( 3.979 -1.919 -3.578) 5.685 7.386 ( -6.814 -0.585 -11.921) 13.743 7.705 ( -6.934 7.554 4.480) 11.190 7.800 ( -3.878 4.120 5.462) 7.865 8.437 ( 1.907 -8.436 4.198) 9.614 8.730 ( 0.701 -4.059 -5.573) 6.930 8.750 ( -2.389 -5.338 -4.761) 7.541 8.915 ( -2.346 -11.228 -7.970) 13.967 9.123 ( -1.063 4.408 1.131) 4.674 9.314 ( 7.998 -3.546 2.597) 9.126 9.603 ( -7.265 1.750 3.595) 8.292 9.697 ( -2.984 10.685 9.803) 14.805 10.076 ( -6.665 1.263 7.371) 10.017 10.538 ( 4.570 -0.458 6.278) 7.778 10.635 ( 1.630 -15.603 -7.161) 17.245 10.802 ( 2.722 -0.360 -3.096) 4.138 11.090 ( 2.350 -2.522 3.276) 4.756 11.247 ( 0.083 -3.594 6.583) 7.500 11.558 ( 7.662 5.424 -6.598) 11.474 11.667 ( -3.333 -0.786 -0.898) 3.541 11.837 ( -0.254 3.074 -0.358) 3.105 11.992 ( 7.771 4.891 1.090) 9.246 12.097 ( 0.120 7.413 4.010) 8.429 12.282 ( -5.052 4.312 -8.658) 10.912 12.289 ( -6.932 1.564 0.059) 7.107 12.738 ( 8.570 -2.480 -5.391) 10.424 13.039 ( -8.225 -5.794 9.219) 13.646 13.733 ( -29.468 2.797 7.740) 30.596 14.689 ( -6.055 6.930 4.648) 10.310 14.803 ( -2.305 1.672 -0.422) 2.879 14.884 ( 8.327 7.257 0.222) 11.047 14.981 ( 4.754 -4.762 -3.896) 7.775 15.143 ( 7.030 -3.064 -1.511) 7.816 15.261 ( -3.235 4.642 2.472) 6.174 15.502 ( 2.193 -3.498 -5.306) 6.723 15.612 ( -0.763 12.885 0.044) 12.907 15.791 ( -4.807 0.656 0.847) 4.925 16.183 ( 3.597 0.165 0.075) 3.601 16.323 ( -19.705 -1.838 3.015) 20.019 16.399 ( 2.344 0.337 3.352) 4.105 16.661 ( 15.530 9.527 0.006) 18.219 16.840 ( 4.838 -3.653 3.557) 7.029 17.507 ( 6.932 -5.791 -10.127) 13.570 17.644 ( 2.477 -8.447 -6.769) 11.105 25.527 ( 0.833 -1.533 1.990) 2.647 25.618 ( 0.216 -0.818 0.182) 0.865 25.759 ( -3.148 2.384 3.519) 5.289 25.786 ( -2.912 -0.063 2.321) 3.725 25.905 ( -0.061 2.859 4.482) 5.316 26.171 ( 2.355 -2.683 -3.375) 4.913 26.390 ( -2.724 -1.926 -2.502) 4.170 26.471 ( -0.698 -5.863 -2.415) 6.379 26.857 ( 1.950 10.814 10.494) 15.195 27.322 ( -16.371 2.759 -4.610) 17.230 27.925 ( -27.485 -16.110 3.589) 32.060 28.276 ( 0.744 -3.574 -1.282) 3.869 28.365 ( -0.976 -8.508 0.034) 8.564 28.454 ( -3.155 -6.062 -1.280) 6.953 29.223 ( -8.246 4.049 -3.158) 9.714 29.704 ( 65.705 21.138 -7.647) 69.443 ======================= Grid point 87 (28/140) ======================= q-point: ( 0.22 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.064 ( 7.745 -14.186 14.705) 21.851 1.455 ( 3.708 -18.688 12.430) 22.749 1.838 ( 2.296 -16.126 4.703) 16.954 1.972 ( -1.780 -9.497 12.952) 16.159 2.247 ( 7.343 -13.094 7.452) 16.761 2.384 ( -1.509 -9.841 -3.974) 10.719 2.607 ( 7.350 -6.110 -3.723) 10.258 2.735 ( -3.211 -6.140 2.845) 7.490 2.903 ( -4.761 -14.994 3.446) 16.104 2.907 ( 4.230 -17.648 3.385) 18.461 3.100 ( 2.639 -3.315 4.751) 6.366 3.136 ( -1.790 -1.256 -9.117) 9.376 3.430 ( 1.001 2.406 -1.788) 3.160 3.491 ( -3.392 3.977 -7.358) 9.026 3.774 ( -3.831 1.914 -0.242) 4.289 3.882 ( -6.002 5.450 -4.315) 9.184 3.911 ( 0.176 -6.131 1.561) 6.329 4.129 ( -3.358 8.391 -0.105) 9.038 4.329 ( -3.500 2.859 -0.430) 4.540 4.526 ( 2.093 -1.098 -0.324) 2.386 4.599 ( 5.002 -2.447 7.372) 9.238 4.720 ( 5.546 -1.473 -5.257) 7.782 4.818 ( 3.011 -2.334 7.423) 8.343 5.142 ( -6.566 2.112 -0.165) 6.900 5.344 ( -1.287 1.583 -13.418) 13.572 5.501 ( -1.241 -6.838 0.342) 6.958 5.586 ( 9.906 -1.615 -4.424) 10.969 5.775 ( -3.121 -0.816 -4.144) 5.252 5.941 ( 6.006 2.860 -2.138) 6.987 6.023 ( -2.398 4.508 2.467) 5.671 6.240 ( 0.157 3.492 0.706) 3.566 6.398 ( 1.841 2.387 -0.287) 3.028 6.571 ( 5.368 -4.193 2.999) 7.443 6.640 ( -3.156 1.869 2.236) 4.296 6.697 ( -1.618 3.190 2.297) 4.251 7.133 ( 3.325 2.152 -2.353) 4.607 7.173 ( -2.459 5.195 -6.946) 9.015 7.269 ( -6.410 0.173 -6.471) 9.110 7.556 ( -8.614 5.221 3.956) 10.821 7.718 ( -2.246 4.660 3.903) 6.480 8.637 ( 3.116 -8.955 2.909) 9.918 8.763 ( -4.408 -5.624 -4.786) 8.601 8.869 ( -0.797 -10.149 -4.123) 10.984 9.028 ( -4.089 -10.221 -8.212) 13.734 9.073 ( -2.556 0.558 5.884) 6.439 9.389 ( -1.646 -0.378 -1.756) 2.436 9.561 ( -4.565 4.145 10.708) 12.356 9.618 ( 1.635 -0.446 6.148) 6.378 10.069 ( -2.306 0.320 4.674) 5.222 10.623 ( 3.570 -1.737 6.429) 7.556 10.727 ( 0.127 -0.773 0.004) 0.783 10.898 ( 9.096 -5.219 -4.950) 11.597 11.160 ( 1.555 -3.437 -3.368) 5.057 11.356 ( 2.430 -4.414 4.024) 6.448 11.501 ( 4.002 2.713 -3.029) 5.705 11.666 ( -3.948 -2.660 1.522) 4.998 11.801 ( 2.258 1.377 -1.401) 2.993 11.905 ( 3.409 10.941 0.131) 11.461 12.046 ( 2.456 4.538 8.847) 10.241 12.146 ( -2.921 1.775 -10.486) 11.029 12.237 ( -4.256 -0.957 -2.233) 4.901 12.725 ( 4.630 5.650 -8.901) 11.515 13.060 ( -8.668 0.357 8.697) 12.285 13.531 ( -18.802 5.102 7.211) 20.774 14.578 ( -4.921 4.094 6.854) 9.378 14.730 ( 2.722 5.503 1.592) 6.342 14.873 ( 1.928 -0.169 -0.404) 1.977 14.997 ( -1.453 -0.618 -4.311) 4.591 15.211 ( -1.436 -2.884 -1.649) 3.619 15.259 ( 6.623 0.307 0.207) 6.633 15.439 ( 0.116 6.914 0.524) 6.935 15.545 ( 6.341 -1.577 -7.570) 10.000 15.762 ( -5.146 0.702 1.669) 5.456 16.131 ( -5.440 3.500 5.157) 8.273 16.248 ( -3.762 4.620 0.188) 5.961 16.475 ( 5.285 -4.114 0.278) 6.703 16.601 ( 0.723 3.178 0.680) 3.330 16.958 ( 6.165 -2.822 3.171) 7.485 17.559 ( 6.294 -0.352 -7.334) 9.670 17.710 ( 1.881 -1.924 -6.644) 7.168 25.575 ( 0.756 -2.261 1.421) 2.776 25.639 ( 0.633 -1.140 1.542) 2.019 25.726 ( -2.001 1.242 4.130) 4.754 25.798 ( -1.416 -1.098 1.877) 2.595 25.891 ( -0.087 1.433 1.558) 2.119 26.212 ( 3.938 -1.435 -2.246) 4.755 26.387 ( -2.517 -1.713 -2.727) 4.087 26.510 ( -2.468 -2.985 -7.603) 8.532 26.803 ( 1.357 5.356 14.105) 15.148 27.169 ( -7.416 2.243 -2.433) 8.121 27.950 ( -10.811 -4.048 0.705) 11.565 28.333 ( -2.586 -2.498 0.026) 3.596 28.537 ( -5.275 -14.942 -3.201) 16.166 28.567 ( -3.667 -11.112 0.357) 11.707 29.081 ( -3.575 4.176 -4.577) 7.153 29.682 ( 37.934 23.782 -1.892) 44.812 ======================= Grid point 88 (29/140) ======================= q-point: ( 0.33 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.410 ( 10.018 -10.489 10.546) 17.933 1.738 ( -5.015 -11.089 6.286) 13.698 2.032 ( -0.322 -9.858 -5.645) 11.364 2.217 ( 2.385 -9.052 11.964) 15.191 2.485 ( 1.647 -6.318 0.071) 6.529 2.553 ( 4.302 -7.969 8.231) 12.238 2.711 ( 0.753 -4.077 -0.114) 4.147 2.801 ( 1.540 -1.962 -4.236) 4.916 3.026 ( -3.721 -6.360 1.287) 7.480 3.100 ( 0.712 -0.904 -6.946) 7.041 3.197 ( -0.478 -8.402 4.984) 9.781 3.238 ( -0.573 -6.459 1.448) 6.644 3.377 ( -5.972 0.526 -7.780) 9.822 3.448 ( 2.019 -1.698 2.661) 3.747 3.667 ( -9.387 5.058 -0.737) 10.688 3.780 ( 2.780 0.134 -1.773) 3.300 3.995 ( -1.727 1.037 -2.344) 3.091 4.091 ( 5.743 -6.066 2.309) 8.666 4.283 ( -1.297 0.150 4.762) 4.938 4.545 ( 1.630 1.264 0.437) 2.109 4.690 ( 4.360 0.993 7.306) 8.566 4.697 ( 2.303 2.076 -6.828) 7.499 4.914 ( 1.967 -1.058 3.395) 4.064 5.056 ( -6.578 1.132 -3.110) 7.364 5.283 ( 1.589 -3.248 -10.772) 11.363 5.592 ( -3.292 -5.217 -0.118) 6.170 5.639 ( 7.514 1.430 -2.031) 7.914 5.774 ( -0.831 -3.238 -0.240) 3.351 5.926 ( 0.892 5.905 1.649) 6.195 5.976 ( 4.384 -2.265 -6.014) 7.779 6.193 ( -0.721 1.883 4.176) 4.637 6.366 ( -1.285 1.505 -0.634) 2.079 6.541 ( -10.110 2.991 0.687) 10.566 6.667 ( 1.711 -2.659 -0.354) 3.182 6.741 ( 6.930 -1.583 4.217) 8.265 7.002 ( -3.092 5.015 -3.510) 6.858 7.118 ( -2.347 1.351 -5.228) 5.888 7.226 ( 1.964 -0.624 -1.427) 2.506 7.439 ( -5.726 4.318 3.718) 8.078 7.649 ( -0.774 4.514 2.466) 5.202 8.744 ( -1.350 -0.873 2.396) 2.885 8.794 ( -5.234 -4.712 -3.171) 7.723 8.986 ( -3.031 -8.399 -2.313) 9.224 9.125 ( -6.573 -7.690 -4.166) 10.941 9.139 ( 3.460 -4.838 2.678) 6.523 9.352 ( 0.294 0.388 -1.663) 1.733 9.500 ( -6.676 1.849 7.600) 10.284 9.722 ( 4.128 -3.352 4.116) 6.724 10.056 ( -1.220 2.370 3.650) 4.520 10.645 ( -1.055 2.800 3.457) 4.572 10.809 ( 4.436 -5.604 3.358) 7.897 10.993 ( 7.615 -0.161 -2.324) 7.963 11.196 ( -0.639 -3.686 -6.308) 7.334 11.418 ( -0.282 -1.452 -0.115) 1.483 11.510 ( 3.629 2.643 -0.750) 4.552 11.706 ( -2.576 0.382 1.356) 2.936 11.759 ( 3.929 1.299 -0.432) 4.161 11.807 ( 3.125 -0.126 -0.731) 3.212 12.027 ( 1.172 5.801 6.777) 8.997 12.104 ( 3.213 -1.840 -4.685) 5.971 12.229 ( -1.161 -2.490 -4.871) 5.593 12.571 ( 2.258 8.850 -9.218) 12.977 12.988 ( -8.575 4.704 6.881) 11.958 13.321 ( -13.194 8.697 4.830) 16.525 14.558 ( -0.419 -0.759 4.707) 4.786 14.699 ( -0.593 0.765 1.184) 1.529 14.877 ( -1.022 -0.953 0.282) 1.425 15.034 ( 0.400 -5.215 -1.110) 5.347 15.132 ( -0.508 7.854 -3.665) 8.682 15.300 ( 5.025 0.462 -0.140) 5.048 15.425 ( -0.220 -2.281 1.831) 2.933 15.575 ( 5.483 0.284 -6.388) 8.423 15.710 ( -2.842 1.076 0.674) 3.113 16.071 ( -1.589 4.183 1.489) 4.716 16.099 ( -7.332 6.626 5.015) 11.083 16.582 ( -2.024 -0.692 -0.311) 2.161 16.602 ( 6.076 -5.039 0.792) 7.933 17.046 ( 4.053 -1.010 2.830) 5.046 17.548 ( 3.109 1.523 -7.114) 7.911 17.711 ( 1.511 -0.256 -2.980) 3.351 25.624 ( 0.525 -2.249 1.399) 2.700 25.682 ( 1.600 -1.676 1.909) 3.002 25.714 ( -1.590 0.856 2.949) 3.458 25.809 ( -1.603 -0.544 1.308) 2.140 25.861 ( -0.576 2.460 0.503) 2.576 26.249 ( 5.200 0.084 -3.586) 6.317 26.384 ( -2.057 -1.667 -1.746) 3.171 26.485 ( -3.452 -1.746 -6.707) 7.743 26.809 ( 0.641 3.032 13.400) 13.754 27.098 ( -1.128 2.057 -1.755) 2.930 27.934 ( -6.230 -1.988 1.137) 6.638 28.320 ( -5.999 -1.284 -2.365) 6.575 28.690 ( -3.865 -8.907 -6.652) 11.769 28.745 ( -6.847 -13.785 0.236) 15.394 29.031 ( 2.155 -1.467 0.286) 2.622 29.525 ( 24.591 22.843 0.374) 33.566 ======================= Grid point 89 (30/140) ======================= q-point: ( 0.44 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.618 ( 1.551 -1.875 9.520) 9.826 1.877 ( -1.894 -7.304 0.482) 7.561 2.074 ( 0.314 2.919 -0.963) 3.089 2.347 ( -1.598 -1.229 0.411) 2.058 2.563 ( 2.936 -1.225 7.931) 8.545 2.704 ( -1.638 -0.422 3.303) 3.710 2.763 ( 4.727 0.156 -4.557) 6.568 2.807 ( 1.594 -3.516 0.692) 3.922 3.056 ( 0.122 0.928 -4.253) 4.355 3.126 ( -3.788 -5.897 -1.757) 7.226 3.211 ( -3.199 0.773 -8.965) 9.550 3.267 ( -1.350 -0.276 -0.129) 1.384 3.409 ( -3.920 -4.735 1.420) 6.310 3.461 ( 0.854 1.213 -0.948) 1.760 3.564 ( -4.531 -2.019 6.102) 7.864 3.809 ( 1.817 0.144 0.852) 2.012 4.020 ( 0.225 -3.477 -0.153) 3.488 4.163 ( 4.119 1.372 2.561) 5.041 4.364 ( 3.849 -1.383 4.644) 6.188 4.519 ( -1.518 2.587 1.850) 3.524 4.634 ( 2.230 2.863 -8.330) 9.086 4.692 ( 4.100 5.724 4.310) 8.255 4.909 ( -6.140 -1.404 -5.282) 8.220 5.007 ( 2.023 -0.030 -1.563) 2.557 5.373 ( 2.804 -7.867 -2.138) 8.621 5.599 ( 0.970 0.448 -6.800) 6.883 5.680 ( 3.478 0.252 6.365) 7.258 5.819 ( -2.002 1.708 -3.085) 4.055 5.830 ( -4.485 -1.850 -0.178) 4.855 6.069 ( 9.276 -3.945 -2.662) 10.426 6.192 ( -2.964 0.495 2.385) 3.837 6.319 ( -7.873 1.341 5.722) 9.825 6.447 ( -0.134 0.955 -1.604) 1.872 6.728 ( 0.919 -3.250 0.993) 3.520 6.787 ( 0.535 0.897 -0.143) 1.054 6.967 ( -2.019 -0.552 4.435) 4.904 7.048 ( -2.693 -3.010 -7.900) 8.872 7.277 ( 4.083 -0.285 0.158) 4.096 7.377 ( 1.651 2.874 6.229) 7.056 7.570 ( -0.489 4.940 -0.071) 4.965 8.719 ( -5.683 0.378 1.618) 5.921 8.817 ( -0.846 -2.609 -0.041) 2.743 9.077 ( -2.999 -5.385 -1.219) 6.284 9.131 ( -0.532 0.462 -7.231) 7.265 9.198 ( -1.173 -0.846 0.853) 1.679 9.389 ( 0.020 0.144 5.873) 5.875 9.504 ( -4.424 -6.032 0.176) 7.482 9.810 ( 5.260 -0.377 4.944) 7.228 9.997 ( -2.397 4.333 0.726) 5.005 10.594 ( -1.959 3.072 1.943) 4.129 10.940 ( 2.243 -3.305 3.533) 5.332 11.004 ( 5.191 3.170 -2.179) 6.461 11.236 ( -0.485 -6.327 -5.765) 8.573 11.368 ( -1.560 10.116 -4.194) 11.061 11.452 ( -1.768 -4.454 -1.004) 4.896 11.673 ( -1.924 0.850 2.700) 3.422 11.845 ( 4.267 -0.022 1.854) 4.653 11.919 ( 8.488 -7.571 2.678) 11.685 11.928 ( -1.336 8.217 2.235) 8.620 12.173 ( 3.199 -3.880 -0.766) 5.087 12.246 ( 0.990 -2.986 -7.324) 7.971 12.452 ( 4.569 2.483 -5.049) 7.248 12.855 ( -5.645 5.930 0.846) 8.231 13.105 ( -9.645 8.368 3.149) 13.152 14.624 ( 2.381 -3.094 2.354) 4.559 14.678 ( -2.796 0.896 0.277) 2.949 14.916 ( -0.101 -0.111 0.434) 0.459 14.956 ( -0.022 4.078 -1.854) 4.480 15.160 ( 0.240 -6.301 1.698) 6.530 15.314 ( 2.867 1.607 -0.311) 3.302 15.461 ( 1.455 -0.761 -1.543) 2.254 15.533 ( 0.332 3.716 -1.737) 4.116 15.723 ( 0.883 -2.187 -1.480) 2.784 15.928 ( -3.591 5.084 0.901) 6.290 16.067 ( -5.257 -0.963 6.578) 8.475 16.571 ( -0.212 0.563 -1.846) 1.942 16.726 ( 3.549 -3.574 3.317) 6.031 17.082 ( 0.717 0.163 2.259) 2.376 17.514 ( 0.354 -0.564 -6.187) 6.223 17.718 ( 1.971 -0.110 -1.552) 2.511 25.665 ( -0.628 -0.542 3.101) 3.209 25.702 ( -0.849 -0.470 0.032) 0.971 25.725 ( 1.096 -0.096 2.363) 2.606 25.805 ( -1.143 0.717 0.789) 1.563 25.812 ( -0.732 1.496 -0.735) 1.820 26.252 ( 5.677 1.180 -6.032) 8.367 26.397 ( -2.013 -1.983 -0.988) 2.993 26.462 ( -2.130 -0.844 -1.464) 2.719 26.849 ( 2.678 1.265 12.971) 13.305 27.041 ( -0.589 2.399 -4.301) 4.960 27.936 ( -3.622 -1.769 2.140) 4.564 28.282 ( -5.298 -1.641 -4.053) 6.869 28.705 ( -1.606 -1.367 -9.321) 9.556 28.902 ( -6.695 -11.202 0.066) 13.050 29.146 ( -0.012 -7.512 2.844) 8.032 29.327 ( 16.204 19.392 2.668) 25.411 ======================= Grid point 90 (31/140) ======================= q-point: (-0.44 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.587 ( -11.352 5.546 8.835) 15.417 1.866 ( -4.038 8.350 -6.105) 11.104 1.984 ( 4.077 8.054 6.533) 11.144 2.317 ( 2.303 4.731 0.701) 5.308 2.574 ( -2.533 9.209 -7.393) 12.078 2.612 ( 1.673 2.037 5.003) 5.655 2.770 ( 0.354 5.360 0.345) 5.383 2.844 ( 1.346 -2.730 -1.394) 3.348 3.034 ( 0.788 1.295 -2.001) 2.510 3.126 ( -2.934 4.749 -1.323) 5.737 3.167 ( 0.613 0.216 -8.582) 8.607 3.238 ( -0.871 -4.563 0.752) 4.706 3.429 ( -1.107 -0.909 0.618) 1.560 3.537 ( 0.634 -5.781 2.915) 6.505 3.654 ( 1.392 -5.717 4.785) 7.584 3.775 ( -2.462 3.405 -0.461) 4.227 4.092 ( -0.939 -4.873 3.734) 6.210 4.202 ( 4.777 0.579 5.230) 7.107 4.333 ( -0.058 11.397 -0.561) 11.410 4.401 ( -3.480 4.623 2.294) 6.224 4.619 ( 1.583 3.099 -0.297) 3.493 4.652 ( 6.782 -1.713 -6.967) 9.873 4.825 ( -4.062 3.930 -7.190) 9.145 5.057 ( 3.188 -2.669 0.837) 4.241 5.497 ( -0.675 -3.946 -0.955) 4.115 5.576 ( 1.344 -2.357 -8.106) 8.548 5.705 ( 4.626 2.531 2.802) 5.971 5.773 ( -0.962 0.561 3.749) 3.911 5.829 ( -4.893 -0.503 -0.122) 4.920 6.133 ( -6.647 0.625 -0.710) 6.714 6.184 ( 6.215 -3.440 -3.049) 7.730 6.282 ( -5.062 0.843 6.872) 8.576 6.487 ( 5.083 -1.808 -0.361) 5.407 6.737 ( -3.561 1.486 0.086) 3.860 6.825 ( -1.464 -4.234 4.244) 6.171 6.944 ( -1.601 -2.414 -3.087) 4.233 7.158 ( 1.454 -8.755 1.395) 8.983 7.270 ( 0.260 1.298 0.014) 1.324 7.408 ( 4.138 4.225 7.036) 9.191 7.518 ( 5.542 0.358 -1.910) 5.873 8.683 ( -7.472 -1.942 0.574) 7.741 8.887 ( 6.178 -2.365 2.744) 7.162 9.046 ( 1.150 5.401 -4.508) 7.128 9.107 ( -2.441 -1.677 -4.286) 5.209 9.183 ( -1.763 0.892 -0.341) 2.006 9.374 ( -4.232 1.736 4.233) 6.232 9.552 ( 1.236 1.534 1.314) 2.368 9.832 ( -1.662 7.478 6.946) 10.341 9.943 ( 3.398 -3.084 -2.030) 5.018 10.532 ( -3.570 2.567 0.335) 4.410 10.942 ( -0.742 6.178 0.986) 6.300 10.977 ( -1.636 -0.770 -0.327) 1.838 11.197 ( 2.794 6.327 -5.799) 9.026 11.343 ( 1.323 -7.531 -5.226) 9.262 11.542 ( -0.986 -7.832 -0.390) 7.904 11.653 ( -4.972 0.287 3.087) 5.860 11.763 ( -2.935 8.319 -0.564) 8.839 11.851 ( 2.391 4.601 1.952) 5.540 12.057 ( 3.457 0.214 2.438) 4.235 12.266 ( 1.437 -1.819 -3.353) 4.077 12.301 ( 2.638 -7.621 3.503) 8.793 12.529 ( 8.220 -7.847 -4.862) 12.361 12.743 ( 1.334 3.463 -5.475) 6.614 12.962 ( -3.514 2.794 2.366) 5.075 14.632 ( -1.803 3.168 2.432) 4.382 14.660 ( 0.674 1.810 -1.224) 2.286 14.857 ( 2.159 -0.584 0.014) 2.237 15.040 ( -0.300 -6.646 0.773) 6.698 15.242 ( -0.126 0.060 4.948) 4.950 15.289 ( -0.715 0.506 -1.578) 1.805 15.417 ( 0.854 5.079 -2.458) 5.707 15.513 ( 2.244 -1.318 -2.765) 3.797 15.742 ( 1.102 -1.438 -3.650) 4.074 15.909 ( -3.927 -3.691 2.766) 6.058 16.100 ( -4.417 -3.553 7.890) 9.715 16.539 ( 1.728 2.331 -3.409) 4.477 16.789 ( -0.664 0.095 5.231) 5.274 17.081 ( -3.270 -0.053 2.332) 4.017 17.530 ( -0.206 -4.614 -5.546) 7.218 17.731 ( 2.468 -0.470 -1.544) 2.949 25.651 ( -2.836 1.268 2.942) 4.279 25.693 ( -1.206 3.094 0.167) 3.325 25.728 ( 0.366 -0.324 0.957) 1.075 25.769 ( 0.072 1.454 -0.763) 1.644 25.832 ( 0.639 -2.154 0.425) 2.287 26.257 ( 6.092 0.161 -5.670) 8.324 26.390 ( -2.496 -0.266 -1.431) 2.889 26.472 ( 0.140 -0.487 2.265) 2.322 26.914 ( 2.554 3.586 11.477) 12.293 26.991 ( 1.808 -1.662 -4.310) 4.961 27.948 ( -1.576 -0.793 1.121) 2.090 28.257 ( -2.735 -1.366 -3.954) 4.998 28.646 ( 0.623 2.465 -8.319) 8.699 28.984 ( 0.440 1.977 -3.800) 4.306 29.120 ( 1.410 4.950 6.126) 8.001 29.341 ( -3.838 -9.223 2.301) 10.251 ======================= Grid point 91 (32/140) ======================= q-point: (-0.33 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.381 ( -19.465 9.876 11.849) 24.836 1.534 ( -7.289 20.834 -2.243) 22.186 1.885 ( 1.110 14.722 6.504) 16.133 2.144 ( 3.022 18.930 -1.805) 19.254 2.373 ( 0.020 7.847 -3.257) 8.496 2.593 ( -2.052 1.704 0.319) 2.686 2.633 ( 3.277 8.674 -4.079) 10.130 2.908 ( 5.578 5.899 -6.217) 10.225 2.966 ( -0.629 3.529 -5.548) 6.606 2.988 ( 0.952 5.977 5.024) 7.866 3.098 ( -2.215 2.366 2.792) 4.277 3.347 ( -3.969 -2.523 -0.698) 4.754 3.451 ( -0.026 1.282 3.502) 3.729 3.590 ( -0.416 -1.740 3.780) 4.182 3.632 ( 0.907 2.130 -3.562) 4.248 3.889 ( 3.919 -9.371 -0.185) 10.160 4.064 ( -5.697 6.985 3.423) 9.642 4.198 ( 5.118 4.104 8.799) 10.975 4.285 ( 4.921 -4.194 -0.224) 6.469 4.376 ( -3.700 -2.403 3.188) 5.443 4.555 ( -1.401 3.251 -0.378) 3.560 4.638 ( -1.311 9.024 -8.975) 12.795 4.742 ( 6.782 -4.276 -8.240) 11.497 5.126 ( 1.317 -2.460 2.136) 3.514 5.499 ( -0.976 0.510 -2.270) 2.523 5.572 ( -0.169 -1.764 -8.972) 9.145 5.735 ( -0.324 4.435 4.662) 6.442 5.776 ( 4.400 -0.137 4.352) 6.190 5.804 ( -4.008 -3.026 -1.317) 5.192 6.092 ( -4.395 -0.953 0.025) 4.497 6.243 ( 2.589 -1.821 -5.379) 6.241 6.275 ( -1.751 -0.272 4.337) 4.685 6.539 ( 4.196 -0.561 -0.820) 4.312 6.653 ( -9.559 2.526 0.659) 9.909 6.843 ( -3.352 0.444 2.294) 4.086 7.076 ( 2.926 -9.843 0.186) 10.271 7.252 ( 2.604 1.151 2.493) 3.784 7.318 ( 0.878 -5.060 1.299) 5.297 7.401 ( 3.272 -2.444 0.631) 4.132 7.595 ( 9.284 -0.354 1.445) 9.402 8.672 ( -6.812 -2.361 0.264) 7.214 8.905 ( 1.387 9.239 -1.116) 9.409 8.985 ( 6.510 1.316 1.277) 6.763 9.077 ( 1.262 2.745 -1.191) 3.247 9.161 ( -0.837 -0.871 -3.173) 3.395 9.330 ( -3.015 0.363 1.505) 3.389 9.492 ( 3.081 8.076 3.400) 9.288 9.687 ( -5.324 7.037 4.017) 9.696 10.047 ( 5.529 -2.045 3.504) 6.858 10.464 ( -4.696 1.254 -1.131) 4.990 10.817 ( -4.922 5.472 2.485) 7.768 10.967 ( -3.685 -1.176 -0.748) 3.940 11.146 ( 8.499 2.144 -8.803) 12.423 11.384 ( -1.364 1.775 -4.332) 4.876 11.567 ( -7.119 3.722 0.560) 8.053 11.669 ( -1.898 -0.005 -0.873) 2.089 11.694 ( 0.202 -7.827 0.439) 7.842 11.773 ( 1.870 4.266 0.134) 4.660 12.035 ( -3.470 3.110 4.610) 6.554 12.295 ( 1.530 -2.109 -1.737) 3.131 12.433 ( 3.422 -2.352 4.477) 6.106 12.602 ( 1.467 0.044 -12.359) 12.445 12.861 ( 14.033 -10.881 0.020) 17.757 13.000 ( 4.622 -5.002 3.593) 7.701 14.578 ( 3.507 4.378 3.267) 6.491 14.643 ( -5.333 -3.909 -0.234) 6.616 14.918 ( 1.378 -2.024 1.992) 3.157 15.132 ( 1.154 -3.335 -0.088) 3.531 15.196 ( -0.139 4.657 1.698) 4.958 15.278 ( -3.279 0.194 -1.845) 3.767 15.370 ( -0.337 -1.099 1.602) 1.971 15.544 ( 2.947 -1.592 -4.500) 5.610 15.774 ( 4.830 -2.631 -6.739) 8.698 15.945 ( -7.673 -2.471 6.134) 10.129 16.198 ( -2.980 -6.289 6.865) 9.775 16.497 ( 3.300 2.195 -4.166) 5.750 16.769 ( -4.944 2.352 5.635) 7.857 17.059 ( -8.137 -0.755 3.866) 9.040 17.581 ( -0.808 -3.785 -4.990) 6.316 17.771 ( 3.074 -3.802 -3.597) 6.070 25.619 ( -1.717 3.219 0.391) 3.669 25.631 ( -2.893 0.868 3.148) 4.363 25.711 ( -0.352 1.883 -0.749) 2.057 25.766 ( 0.789 0.111 1.030) 1.302 25.874 ( 0.914 -1.486 0.228) 1.759 26.276 ( 5.164 -0.364 -7.239) 8.899 26.376 ( -0.286 0.462 3.423) 3.466 26.484 ( 0.181 0.711 1.935) 2.070 26.853 ( -1.947 3.949 -1.909) 4.799 27.120 ( 9.997 -4.222 9.624) 14.505 27.945 ( 1.417 1.014 -1.454) 2.269 28.245 ( -0.203 -0.429 -2.358) 2.406 28.559 ( 2.896 5.116 -6.426) 8.710 28.807 ( 5.198 14.676 -3.268) 15.909 29.200 ( -6.353 -8.044 7.476) 12.686 29.447 ( -14.017 -11.578 -4.701) 18.779 ======================= Grid point 92 (33/140) ======================= q-point: (-0.22 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.096 ( -15.077 19.007 9.949) 26.222 1.107 ( -14.251 18.465 17.315) 29.049 1.485 ( -11.113 29.501 1.943) 31.584 1.783 ( 3.317 25.278 0.542) 25.501 2.322 ( 9.005 4.179 2.163) 10.160 2.470 ( 2.519 12.411 -3.655) 13.181 2.528 ( -6.270 1.268 -3.776) 7.428 2.684 ( 5.833 16.112 -5.884) 18.117 2.807 ( 0.408 10.710 2.971) 11.122 3.015 ( 1.287 3.778 1.112) 4.144 3.031 ( -4.606 10.174 2.896) 11.538 3.234 ( -5.224 -4.270 1.433) 6.897 3.473 ( 0.417 -0.886 -0.514) 1.106 3.644 ( 0.365 -0.619 -1.407) 1.580 3.660 ( 2.494 -2.823 0.169) 3.771 3.973 ( 1.658 -4.350 -0.011) 4.655 4.091 ( 0.964 -4.612 -2.237) 5.216 4.182 ( 2.523 6.458 9.391) 11.673 4.363 ( 1.711 1.298 -0.421) 2.188 4.429 ( -2.636 -0.732 -0.212) 2.744 4.452 ( -0.307 -2.097 -4.467) 4.944 4.556 ( 2.251 -1.491 3.558) 4.467 4.816 ( 5.134 -3.733 -10.132) 11.956 5.189 ( 0.930 -2.720 3.857) 4.810 5.438 ( -5.165 2.272 -2.799) 6.298 5.551 ( 1.755 3.490 -4.317) 5.822 5.639 ( 0.925 4.937 -0.262) 5.029 5.843 ( 0.488 -3.001 -1.059) 3.219 5.856 ( 2.938 -4.071 -1.111) 5.142 6.089 ( -4.658 -2.218 1.725) 5.439 6.237 ( 0.091 -0.172 -6.074) 6.077 6.311 ( 1.520 -1.902 2.755) 3.676 6.508 ( -7.769 3.744 -0.053) 8.624 6.601 ( -0.082 -2.070 1.437) 2.521 6.818 ( -4.186 -0.334 2.444) 4.859 7.151 ( 0.830 1.247 -2.500) 2.914 7.290 ( -0.529 -1.124 -0.926) 1.549 7.451 ( 8.656 -8.624 3.388) 12.680 7.531 ( 3.255 -6.055 1.091) 6.960 7.652 ( 7.529 1.641 -1.130) 7.788 8.605 ( -4.816 6.327 0.853) 7.997 8.779 ( 0.296 5.439 0.744) 5.498 8.947 ( 0.893 5.062 -3.326) 6.123 9.024 ( 5.831 7.066 0.592) 9.181 9.143 ( -1.861 -0.853 -4.394) 4.847 9.334 ( -1.465 5.120 6.428) 8.348 9.424 ( 3.376 -0.676 -0.589) 3.493 9.618 ( -4.115 -0.567 9.190) 10.085 10.101 ( 4.183 2.641 5.846) 7.657 10.414 ( -3.323 0.443 0.321) 3.368 10.757 ( -3.248 -0.956 2.825) 4.410 10.956 ( -6.154 -2.345 -0.744) 6.627 11.119 ( 13.221 6.745 -14.429) 20.700 11.274 ( 0.623 4.647 -1.893) 5.056 11.402 ( -7.991 7.636 -1.423) 11.144 11.698 ( 1.083 -1.321 4.760) 5.057 11.738 ( 1.023 0.442 1.350) 1.751 11.833 ( 0.886 -5.381 -2.609) 6.046 11.998 ( -5.202 -1.415 6.200) 8.216 12.334 ( 1.848 -2.031 -3.242) 4.249 12.473 ( -0.800 -0.752 -3.981) 4.129 12.571 ( 8.781 2.067 -5.283) 10.454 13.035 ( 4.887 -2.359 -1.223) 5.563 13.288 ( 18.446 -11.499 9.990) 23.922 14.597 ( 4.427 -0.781 4.319) 6.234 14.721 ( -6.504 -10.271 1.431) 12.241 14.929 ( -2.521 0.867 1.351) 2.989 15.096 ( 4.363 7.335 -2.589) 8.919 15.213 ( -2.322 -4.646 2.444) 5.740 15.244 ( -5.995 -1.352 -0.196) 6.149 15.423 ( -1.574 -4.758 0.700) 5.061 15.559 ( 2.350 -0.244 -4.453) 5.041 15.832 ( 7.899 -2.123 -7.790) 11.295 15.936 ( -7.677 -0.357 8.079) 11.150 16.263 ( 1.288 0.942 0.819) 1.794 16.521 ( 0.960 -4.925 -0.285) 5.026 16.703 ( -8.456 2.323 5.095) 10.142 17.018 ( -15.223 -2.291 6.434) 16.685 17.579 ( -0.732 -0.021 -4.753) 4.809 17.853 ( 0.776 -6.497 -9.665) 11.671 25.552 ( -1.037 3.221 0.450) 3.414 25.634 ( -3.287 -0.979 4.254) 5.464 25.680 ( -0.046 0.577 1.172) 1.307 25.771 ( 0.274 0.546 1.838) 1.937 25.891 ( 0.604 0.221 -0.196) 0.672 26.263 ( 2.442 0.329 -9.167) 9.492 26.422 ( 3.714 -0.448 8.722) 9.490 26.469 ( -0.393 1.572 0.705) 1.768 26.759 ( -2.658 3.206 -3.098) 5.190 27.355 ( 12.451 -6.607 12.087) 18.569 27.934 ( 11.882 4.639 -0.610) 12.770 28.245 ( 2.071 0.329 -1.162) 2.397 28.469 ( 7.862 7.393 -3.708) 11.412 28.596 ( 3.179 12.277 -2.069) 12.849 29.311 ( -8.701 -7.584 5.326) 12.712 29.431 ( -29.392 -11.043 -15.553) 35.039 ======================= Grid point 93 (34/140) ======================= q-point: (-0.11 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.745 ( -10.025 19.229 22.645) 31.354 0.786 ( -7.734 26.506 16.936) 32.392 0.926 ( -14.896 20.371 30.036) 39.231 1.426 ( 2.745 19.352 4.307) 20.015 2.184 ( 0.123 14.909 -2.237) 15.077 2.358 ( 5.104 6.106 3.474) 8.684 2.453 ( 4.382 4.981 -10.505) 12.425 2.461 ( -1.304 4.140 -2.590) 5.054 2.697 ( -2.428 5.097 6.023) 8.255 2.761 ( -5.535 10.872 0.459) 12.208 3.005 ( -1.171 1.173 2.993) 3.421 3.323 ( -0.170 -5.332 -7.285) 9.029 3.510 ( 0.586 -4.563 -1.848) 4.957 3.638 ( -0.810 0.270 3.502) 3.604 3.701 ( 0.991 -0.409 -2.161) 2.413 3.949 ( -2.886 6.896 3.130) 8.104 4.142 ( -0.567 -3.827 -7.875) 8.774 4.222 ( 5.632 -3.088 6.266) 8.973 4.301 ( 4.812 4.119 -0.777) 6.381 4.463 ( 3.684 -2.137 -0.023) 4.259 4.534 ( -0.090 -5.879 -1.481) 6.063 4.625 ( -3.812 -3.192 2.889) 5.750 4.819 ( -0.118 1.445 -9.084) 9.199 5.263 ( -1.600 -3.335 3.873) 5.355 5.339 ( -1.052 4.301 -2.001) 4.859 5.438 ( -2.273 6.650 1.185) 7.127 5.606 ( 4.961 0.480 -11.821) 12.829 5.835 ( 4.337 4.574 -4.913) 7.992 5.950 ( 0.876 -5.029 -1.882) 5.441 6.123 ( -5.358 -4.639 5.215) 8.799 6.210 ( 0.421 0.182 -4.510) 4.534 6.332 ( -2.542 2.578 0.989) 3.753 6.481 ( -2.068 -7.546 7.919) 11.132 6.634 ( -0.197 -0.560 5.630) 5.661 6.843 ( -2.824 -5.054 -0.034) 5.790 7.095 ( 7.453 7.087 -3.714) 10.934 7.257 ( -3.364 1.590 -2.336) 4.393 7.574 ( -1.215 0.418 -10.475) 10.554 7.675 ( 13.213 -0.246 7.007) 14.958 7.708 ( 2.966 -7.456 2.783) 8.493 8.461 ( -6.798 4.647 1.966) 8.466 8.696 ( 3.015 5.845 -0.223) 6.580 8.838 ( -1.009 4.957 -6.172) 7.980 8.925 ( 5.304 9.516 -1.758) 11.035 9.150 ( -2.738 -3.094 -0.848) 4.218 9.231 ( -2.104 4.368 1.805) 5.173 9.548 ( 3.249 -8.422 6.131) 10.912 9.696 ( -3.140 -5.198 8.855) 10.737 10.110 ( -2.802 -0.762 8.494) 8.976 10.417 ( 2.005 -0.209 4.163) 4.625 10.794 ( -3.712 -0.762 -3.721) 5.311 10.820 ( -1.818 11.874 -17.438) 21.175 11.023 ( 3.550 3.282 2.675) 5.526 11.230 ( -4.329 5.937 3.113) 7.980 11.341 ( 23.538 -2.135 0.669) 23.644 11.716 ( -2.726 0.181 1.363) 3.053 11.783 ( 3.674 -1.909 6.984) 8.119 11.882 ( 2.168 -0.524 1.168) 2.518 12.084 ( -2.967 -8.809 6.137) 11.138 12.342 ( 2.011 0.175 -6.864) 7.155 12.440 ( -3.771 -1.668 -6.680) 7.850 12.594 ( 14.085 4.932 -1.964) 15.052 13.037 ( -0.864 5.409 5.331) 7.644 13.705 ( 28.233 -11.542 10.502) 32.259 14.704 ( 5.040 -4.866 3.370) 7.774 14.822 ( -3.106 -2.104 -0.694) 3.815 14.905 ( -3.656 -0.607 0.232) 3.713 15.009 ( 1.280 2.101 0.580) 2.527 15.143 ( -21.940 -0.612 -6.460) 22.879 15.308 ( -1.939 -5.164 3.496) 6.530 15.515 ( 1.739 0.883 -0.838) 2.122 15.591 ( 0.813 -12.401 1.871) 12.568 15.848 ( -2.725 -2.004 0.203) 3.389 15.992 ( 10.771 -1.911 4.270) 11.743 16.241 ( 8.111 3.814 -2.537) 9.315 16.588 ( -1.368 6.087 4.768) 7.852 16.644 ( -11.422 -9.302 1.101) 14.771 16.960 ( -32.762 -8.227 6.401) 34.380 17.542 ( 0.283 0.905 -5.890) 5.966 17.791 ( -7.947 7.299 -23.174) 25.563 25.507 ( -0.379 1.851 1.187) 2.232 25.619 ( -0.399 1.275 -0.125) 1.341 25.749 ( -1.083 -3.514 4.236) 5.609 25.792 ( -3.131 -6.284 8.105) 10.723 25.879 ( 0.389 0.922 -0.166) 1.015 26.217 ( 1.111 2.324 -9.103) 9.461 26.439 ( -1.045 1.154 -0.941) 1.820 26.468 ( 2.411 4.900 2.727) 6.104 26.757 ( -0.467 -8.456 6.673) 10.782 27.554 ( -4.400 -5.147 -0.005) 6.771 28.090 ( 39.655 0.006 13.577) 41.915 28.250 ( 4.839 1.167 -1.540) 5.211 28.384 ( 10.554 11.182 -0.442) 15.382 28.511 ( 28.955 7.832 6.714) 30.738 29.057 ( -64.727 2.133 -35.073) 73.650 29.378 ( -9.451 -3.703 4.733) 11.200 ======================= Grid point 95 (35/140) ======================= q-point: ( 0.11 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.859 ( 14.894 0.000 20.184) 25.084 0.966 ( 14.874 0.000 23.141) 27.509 1.366 ( 0.502 0.000 8.395) 8.410 1.819 ( 19.759 0.000 36.556) 41.554 1.909 ( -6.131 -0.000 -6.229) 8.740 2.190 ( -7.712 -0.000 -4.145) 8.755 2.394 ( 5.037 0.000 5.851) 7.720 2.436 ( -1.049 -0.000 -2.768) 2.960 2.594 ( 2.554 0.000 3.018) 3.953 2.702 ( 0.873 0.000 3.255) 3.370 3.078 ( 1.744 0.000 6.379) 6.613 3.113 ( -4.435 -0.000 -17.825) 18.368 3.459 ( -0.626 -0.000 -9.179) 9.200 3.565 ( -3.177 -0.000 -8.819) 9.373 3.785 ( 1.985 0.000 9.541) 9.745 3.930 ( -2.715 -0.000 5.214) 5.879 4.035 ( -1.315 -0.000 -10.713) 10.794 4.256 ( -8.129 -0.000 1.226) 8.221 4.345 ( -10.191 -0.000 -2.657) 10.532 4.512 ( -1.123 -0.000 -1.347) 1.754 4.569 ( 9.868 0.000 1.238) 9.945 4.618 ( 4.393 0.000 5.783) 7.263 4.766 ( 2.132 0.000 5.060) 5.491 5.204 ( -8.293 -0.000 -3.978) 9.198 5.329 ( 0.508 0.000 2.613) 2.662 5.419 ( 5.231 0.000 -3.315) 6.193 5.557 ( 12.166 0.000 -8.391) 14.779 5.676 ( -3.891 -0.000 -8.948) 9.758 6.051 ( 3.938 0.000 0.041) 3.938 6.169 ( -2.146 -0.000 5.033) 5.471 6.270 ( 3.775 0.000 -2.386) 4.466 6.451 ( 11.077 0.000 0.263) 11.080 6.523 ( -7.716 -0.000 6.921) 10.365 6.728 ( -0.876 -0.000 1.814) 2.014 6.812 ( -2.476 -0.000 -2.113) 3.255 7.140 ( -0.936 -0.000 -3.557) 3.679 7.171 ( -8.780 -0.000 -0.670) 8.805 7.342 ( 8.640 0.000 -8.844) 12.363 7.757 ( -9.921 -0.000 2.238) 10.170 7.788 ( -9.670 -0.000 6.872) 11.863 8.414 ( 5.212 0.000 6.080) 8.008 8.646 ( -4.173 -0.000 -5.786) 7.134 8.689 ( -0.443 -0.000 -8.067) 8.079 8.730 ( -4.061 -0.000 -4.948) 6.401 9.173 ( 1.420 0.000 -0.858) 1.659 9.317 ( -2.825 -0.000 -0.600) 2.888 9.574 ( -2.840 -0.000 2.677) 3.903 9.831 ( -0.690 -0.000 0.086) 0.696 10.132 ( -6.828 -0.000 9.385) 11.606 10.423 ( 6.211 0.000 6.653) 9.101 10.596 ( 3.923 0.000 5.264) 6.565 10.802 ( 2.480 0.000 -3.981) 4.690 11.109 ( 2.827 0.000 2.468) 3.753 11.266 ( 1.689 0.000 8.671) 8.834 11.605 ( 1.805 0.000 -6.632) 6.873 11.629 ( -2.854 -0.000 -2.457) 3.766 11.851 ( -2.105 -0.000 0.670) 2.209 12.065 ( 2.802 0.000 -1.653) 3.253 12.166 ( 4.803 0.000 -5.668) 7.429 12.208 ( -10.802 -0.000 -2.077) 11.000 12.318 ( -11.558 -0.000 2.349) 11.794 12.701 ( 4.693 0.000 -0.152) 4.695 12.965 ( -9.437 -0.000 14.265) 17.104 13.544 ( -25.561 -0.000 10.654) 27.692 14.768 ( -4.279 -0.000 1.544) 4.549 14.780 ( -3.400 -0.000 -1.110) 3.577 14.883 ( 3.926 0.000 1.377) 4.161 15.070 ( 3.864 0.000 -5.487) 6.711 15.176 ( 7.239 0.000 0.901) 7.295 15.345 ( 6.861 0.000 -0.847) 6.913 15.442 ( 3.884 0.000 -6.763) 7.799 15.704 ( -2.847 -0.000 0.579) 2.906 15.792 ( -8.812 -0.000 -1.690) 8.973 16.102 ( 1.403 0.000 -7.801) 7.926 16.245 ( -10.931 -0.000 10.586) 15.217 16.336 ( -6.997 -0.000 0.848) 7.048 16.845 ( 1.509 0.000 6.673) 6.841 17.103 ( 36.942 0.000 -18.667) 41.390 17.355 ( 4.057 0.000 -1.023) 4.184 17.599 ( 3.659 0.000 -0.689) 3.724 25.534 ( 1.171 0.000 2.280) 2.563 25.614 ( 0.885 0.000 -0.213) 0.910 25.749 ( -5.419 -0.000 0.757) 5.472 25.771 ( -0.761 -0.000 1.330) 1.532 25.968 ( -3.681 -0.000 5.718) 6.800 26.166 ( 5.818 0.000 1.484) 6.004 26.332 ( -3.366 -0.000 -0.025) 3.366 26.414 ( 0.058 0.000 -1.039) 1.040 27.069 ( 5.281 0.000 4.602) 7.005 27.170 ( -21.120 -0.000 5.007) 21.706 27.556 ( -14.232 -0.000 8.144) 16.397 28.261 ( -1.914 -0.000 -0.799) 2.074 28.305 ( 2.216 0.000 0.415) 2.255 28.397 ( -2.186 -0.000 -0.305) 2.207 29.163 ( -7.273 -0.000 -6.756) 9.927 30.297 ( 48.823 0.000 -22.381) 53.708 ======================= Grid point 96 (36/140) ======================= q-point: ( 0.22 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.075 ( 18.472 -4.271 15.536) 24.511 1.321 ( 10.884 -11.882 16.603) 23.137 1.565 ( -2.693 -15.012 1.201) 15.299 1.877 ( -3.169 -6.739 2.123) 7.744 2.124 ( -4.299 -14.451 10.209) 18.208 2.243 ( 10.581 -4.447 0.874) 11.511 2.498 ( -0.619 -8.327 -0.947) 8.404 2.619 ( 3.317 -10.062 12.557) 16.430 2.645 ( -3.147 -5.605 8.596) 10.733 2.806 ( 10.691 -6.767 2.785) 12.956 3.008 ( -3.915 -2.616 -18.309) 18.905 3.132 ( 2.891 -0.698 7.861) 8.405 3.411 ( -1.375 0.070 -8.226) 8.341 3.487 ( -2.830 0.104 -8.448) 8.910 3.800 ( -4.882 8.179 -1.527) 9.647 3.880 ( 2.922 -3.032 7.674) 8.754 3.941 ( -3.741 6.934 -3.985) 8.829 4.194 ( -7.083 2.301 1.235) 7.549 4.240 ( -10.109 -2.045 -5.071) 11.493 4.541 ( 6.053 -3.160 -6.559) 9.469 4.658 ( 5.097 0.331 10.877) 12.016 4.707 ( 4.703 -1.727 0.855) 5.083 4.821 ( 0.578 -2.811 7.131) 7.687 5.104 ( -6.471 1.284 -5.919) 8.863 5.349 ( 1.355 2.946 -2.245) 3.944 5.414 ( 1.949 -1.643 -5.336) 5.913 5.615 ( 2.613 -2.365 -3.187) 4.751 5.666 ( 5.690 -3.468 -9.303) 11.444 6.033 ( 3.026 4.653 -0.893) 5.622 6.135 ( 1.197 5.159 4.106) 6.701 6.275 ( -0.824 0.371 -0.777) 1.191 6.456 ( -2.625 3.541 1.698) 4.723 6.559 ( 4.031 -1.597 0.740) 4.399 6.697 ( 0.687 3.427 2.578) 4.343 6.765 ( -0.038 2.617 3.305) 4.216 7.108 ( -3.492 -1.902 -1.170) 4.145 7.157 ( -7.035 -2.553 -4.409) 8.686 7.285 ( 4.302 8.167 -5.665) 10.831 7.628 ( -6.627 6.648 4.153) 10.264 7.731 ( -9.365 0.292 2.743) 9.762 8.540 ( 3.595 -5.718 3.613) 7.659 8.638 ( -4.339 -5.192 -2.666) 7.272 8.675 ( -1.306 -6.053 -4.900) 7.897 8.772 ( -5.513 -9.085 -6.287) 12.347 9.140 ( 0.457 4.043 2.573) 4.814 9.271 ( -12.223 -3.452 -0.528) 12.712 9.617 ( 4.793 -2.142 2.183) 5.686 9.746 ( -0.222 8.282 3.559) 9.017 10.102 ( -1.239 1.774 8.612) 8.880 10.654 ( 2.920 -1.673 4.514) 5.630 10.663 ( 3.906 -9.586 2.776) 10.717 10.830 ( 6.108 -4.312 -5.235) 9.127 11.129 ( 1.696 -0.217 -4.713) 5.013 11.347 ( 2.940 -2.633 8.664) 9.521 11.545 ( -1.152 3.138 -3.501) 4.841 11.611 ( -1.957 -1.647 -1.850) 3.157 11.844 ( 1.536 1.202 2.455) 3.136 12.051 ( -1.404 2.966 0.443) 3.311 12.100 ( -3.826 1.951 -8.877) 9.862 12.174 ( -4.364 0.515 0.960) 4.498 12.196 ( 0.774 5.008 5.465) 7.453 12.765 ( 2.675 -1.519 -6.499) 7.191 12.969 ( -13.327 -2.943 9.967) 16.900 13.437 ( -17.042 0.269 8.673) 19.124 14.656 ( -4.237 5.909 3.978) 8.288 14.781 ( -0.658 0.099 -0.804) 1.044 14.914 ( -3.211 0.217 -0.086) 3.220 15.068 ( 2.010 0.693 -2.053) 2.956 15.142 ( 4.819 5.862 0.066) 7.589 15.346 ( 8.961 3.131 -2.129) 9.728 15.512 ( 6.440 -3.366 -6.550) 9.783 15.599 ( 0.556 8.631 -0.236) 8.652 15.732 ( -3.074 -0.692 0.047) 3.151 16.135 ( -9.348 -4.020 -0.339) 10.182 16.176 ( -2.604 1.772 0.204) 3.156 16.372 ( -4.800 -6.663 2.559) 8.601 16.840 ( 4.803 8.416 4.043) 10.499 17.065 ( 17.919 8.141 -1.821) 19.766 17.530 ( 7.875 -5.778 -11.280) 14.921 17.648 ( 2.192 -3.167 -0.864) 3.947 25.562 ( 1.120 -1.063 1.747) 2.331 25.630 ( 1.264 -1.084 -0.109) 1.669 25.726 ( -3.527 -0.580 2.192) 4.193 25.777 ( -1.227 -0.744 1.340) 1.963 25.943 ( -1.236 2.692 4.984) 5.798 26.222 ( 5.246 -0.871 -0.706) 5.365 26.326 ( -2.591 -1.462 -0.217) 2.983 26.429 ( -0.995 -1.844 -2.819) 3.513 26.971 ( -5.176 7.049 11.357) 14.334 27.139 ( -0.368 0.230 0.510) 0.670 27.681 ( -11.791 -15.658 2.766) 19.795 28.229 ( -4.379 -1.096 -2.644) 5.231 28.361 ( -5.314 -4.000 1.468) 6.811 28.417 ( 0.110 -6.089 -1.047) 6.179 29.077 ( -1.170 1.526 -6.944) 7.206 30.322 ( 32.471 19.733 -12.512) 40.004 ======================= Grid point 97 (37/140) ======================= q-point: ( 0.33 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.407 ( 17.743 -9.135 11.207) 22.888 1.566 ( -5.566 -8.549 7.509) 12.667 1.793 ( 2.652 -14.766 -0.906) 15.029 2.109 ( 3.051 -13.332 4.026) 14.257 2.354 ( 0.839 -11.053 3.547) 11.638 2.477 ( 3.386 -12.333 10.551) 16.580 2.603 ( -5.362 -6.868 -2.004) 8.941 2.713 ( 0.999 -5.487 -3.438) 6.551 2.844 ( -4.924 -8.068 4.173) 10.332 2.979 ( 0.264 -8.278 -7.723) 11.324 3.043 ( 0.838 -6.437 -0.148) 6.493 3.245 ( 5.253 -2.170 8.090) 9.886 3.318 ( -5.127 2.104 -9.015) 10.583 3.509 ( 7.336 -0.188 1.339) 7.460 3.661 ( -5.738 -2.212 -1.942) 6.449 3.729 ( -7.553 8.826 -1.928) 11.776 4.033 ( 2.123 -2.705 7.764) 8.491 4.075 ( 0.904 1.405 -1.083) 1.991 4.245 ( -2.897 -4.641 -1.620) 5.706 4.612 ( 8.105 -0.539 -2.420) 8.476 4.707 ( 0.750 1.497 -4.386) 4.695 4.726 ( -1.228 -1.326 5.911) 6.181 4.896 ( -3.259 -0.405 0.803) 3.381 5.052 ( 3.038 0.076 -0.106) 3.041 5.251 ( 0.969 3.802 -4.411) 5.904 5.473 ( -1.418 -5.055 -0.410) 5.266 5.656 ( -3.703 -6.043 -4.242) 8.260 5.717 ( 8.670 0.980 -7.022) 11.200 5.966 ( 0.942 3.473 -3.113) 4.758 6.081 ( 6.175 5.716 1.052) 8.480 6.239 ( -2.452 2.253 3.274) 4.670 6.378 ( -4.219 2.785 0.112) 5.057 6.537 ( -2.918 3.243 0.521) 4.393 6.681 ( 3.235 1.467 1.313) 3.788 6.804 ( 5.491 -0.006 6.046) 8.168 7.020 ( -7.886 4.830 -5.328) 10.672 7.091 ( -4.301 1.569 -4.303) 6.283 7.236 ( 1.410 -1.304 2.012) 2.781 7.495 ( -2.460 6.047 2.751) 7.084 7.690 ( -4.518 0.322 1.855) 4.894 8.622 ( -3.888 -4.729 -2.272) 6.530 8.715 ( -5.189 -6.395 0.167) 8.238 8.800 ( 1.250 -9.140 -0.029) 9.225 8.872 ( -6.159 -11.501 -5.230) 14.056 9.124 ( 0.175 -1.154 4.836) 4.974 9.260 ( -8.479 -4.795 -1.292) 9.826 9.617 ( 0.328 8.918 3.705) 9.663 9.716 ( 4.396 -3.643 2.040) 6.063 10.109 ( -0.189 1.776 5.506) 5.788 10.693 ( 0.961 1.146 1.873) 2.397 10.788 ( 5.020 -3.598 4.354) 7.557 10.980 ( 5.416 -5.356 -3.490) 8.379 11.118 ( 1.780 -2.891 -8.995) 9.614 11.438 ( 0.946 2.216 1.837) 3.030 11.516 ( 4.285 -4.302 -1.107) 6.172 11.631 ( -3.074 -3.186 0.301) 4.437 11.843 ( 0.594 4.456 0.669) 4.545 11.892 ( 0.027 6.458 -1.195) 6.568 12.085 ( 2.854 -1.185 -2.942) 4.267 12.137 ( -6.996 -0.746 4.714) 8.469 12.194 ( 7.135 3.294 1.750) 8.051 12.686 ( 2.026 7.485 -9.479) 12.247 12.948 ( -15.246 -2.693 5.766) 16.521 13.319 ( -15.300 4.035 6.286) 17.026 14.584 ( -1.948 2.083 4.730) 5.523 14.726 ( -3.711 3.262 -0.024) 4.940 14.917 ( -1.981 -2.533 2.208) 3.901 14.972 ( 5.530 6.198 -3.316) 8.944 15.174 ( -0.372 -1.235 -1.525) 1.997 15.366 ( 7.700 1.450 -1.402) 7.960 15.467 ( 1.522 5.333 2.689) 6.163 15.589 ( 6.972 -0.574 -6.190) 9.341 15.711 ( -0.807 0.922 -1.709) 2.103 16.081 ( -8.402 1.262 5.669) 10.214 16.127 ( -6.618 1.916 -3.447) 7.704 16.467 ( -3.323 -6.523 1.993) 7.587 16.761 ( 12.176 8.113 2.640) 14.868 17.108 ( 8.253 1.593 3.014) 8.929 17.547 ( 2.206 0.807 -9.748) 10.027 17.696 ( 1.246 -1.530 -1.413) 2.426 25.601 ( 1.046 -1.809 1.066) 2.346 25.667 ( 1.733 -1.844 -0.428) 2.567 25.726 ( -2.334 -0.255 3.521) 4.232 25.786 ( -1.805 -0.943 1.095) 2.312 25.910 ( -0.728 2.922 2.867) 4.158 26.268 ( 3.543 -1.480 -3.494) 5.191 26.337 ( 0.014 -0.508 0.713) 0.876 26.419 ( -1.696 -0.955 -3.193) 3.740 26.903 ( -4.069 2.684 8.150) 9.497 27.150 ( 4.238 2.673 4.307) 6.607 27.806 ( -8.118 -7.876 0.260) 11.314 28.182 ( -11.284 -3.473 -6.607) 13.529 28.440 ( -4.637 -10.376 -0.743) 11.389 28.537 ( -2.251 -8.411 -0.813) 8.745 29.052 ( 4.844 0.261 -2.007) 5.250 30.114 ( 23.113 24.605 -4.826) 34.101 ======================= Grid point 98 (38/140) ======================= q-point: ( 0.44 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.659 ( 0.260 -2.177 10.284) 10.515 1.744 ( 7.066 -11.066 5.730) 14.325 1.998 ( 0.266 -8.580 -2.832) 9.039 2.306 ( 1.882 -5.923 0.574) 6.241 2.551 ( 0.161 -7.561 5.591) 9.404 2.656 ( -3.591 -5.920 -0.812) 6.972 2.703 ( 4.156 -6.205 3.863) 8.408 2.761 ( -1.094 -3.156 -4.512) 5.614 2.933 ( -4.510 -8.645 -1.622) 9.885 3.050 ( -0.491 0.342 -4.422) 4.463 3.125 ( -4.227 -3.624 -5.798) 8.038 3.257 ( -3.836 -6.785 0.454) 7.808 3.287 ( 1.439 0.921 -1.531) 2.294 3.506 ( 1.992 2.505 2.323) 3.955 3.542 ( -9.173 3.020 5.322) 11.026 3.783 ( -0.319 -5.334 -1.146) 5.465 3.983 ( 0.100 0.617 1.007) 1.185 4.209 ( 5.144 -2.104 2.550) 6.115 4.386 ( 9.633 -7.135 5.346) 13.126 4.597 ( 2.099 5.251 -2.140) 6.046 4.665 ( 0.085 3.103 -0.637) 3.169 4.761 ( -5.377 -5.504 -6.486) 10.064 4.835 ( 1.145 4.566 1.456) 4.927 5.049 ( 4.673 2.707 -2.167) 5.819 5.270 ( 2.012 -4.106 1.606) 4.847 5.535 ( -2.916 -4.178 -2.837) 5.832 5.703 ( 0.067 -1.952 -5.339) 5.685 5.731 ( -0.591 -4.050 2.305) 4.698 5.872 ( -0.413 5.548 -4.658) 7.255 6.099 ( 10.618 -0.487 -2.292) 10.873 6.194 ( -3.681 2.684 0.491) 4.582 6.312 ( -6.552 1.239 6.469) 9.290 6.476 ( 1.342 2.598 0.454) 2.959 6.706 ( 2.211 -0.932 1.389) 2.772 6.814 ( -0.680 3.024 -2.010) 3.694 6.949 ( -1.556 -2.361 3.981) 4.883 6.982 ( -5.847 3.192 -4.258) 7.907 7.282 ( -1.717 -1.540 1.380) 2.688 7.457 ( 5.290 1.080 3.885) 6.652 7.642 ( -2.202 3.504 0.709) 4.199 8.629 ( -8.008 -2.356 -0.556) 8.366 8.770 ( -2.218 -4.722 1.047) 5.321 8.949 ( 0.478 -7.086 0.053) 7.103 8.979 ( -6.089 -9.274 -3.968) 11.782 9.205 ( 1.506 -1.707 1.163) 2.556 9.302 ( -3.689 -9.364 -0.619) 10.083 9.495 ( -1.102 7.073 3.399) 7.924 9.822 ( 4.274 -3.904 0.976) 5.870 10.074 ( -1.633 4.494 3.677) 6.032 10.665 ( 1.406 3.760 1.147) 4.175 10.921 ( 3.537 -3.660 4.493) 6.789 11.018 ( 0.669 -2.584 -5.840) 6.421 11.172 ( 5.442 -1.369 -3.153) 6.437 11.392 ( -1.901 0.629 -0.500) 2.064 11.522 ( 0.724 7.914 -3.510) 8.688 11.655 ( -4.832 0.681 -0.089) 4.881 11.800 ( 5.648 -7.513 -3.598) 10.064 11.917 ( 3.843 -0.552 5.932) 7.089 12.095 ( 0.758 3.856 5.274) 6.577 12.149 ( 2.248 -3.957 -6.074) 7.590 12.206 ( 7.106 2.885 1.695) 7.855 12.523 ( 0.864 6.547 -6.656) 9.376 12.866 ( -11.632 1.949 1.183) 11.853 13.134 ( -15.029 5.962 3.543) 16.552 14.603 ( 1.066 -2.188 2.829) 3.732 14.660 ( -4.259 0.832 0.288) 4.349 14.904 ( 1.122 1.388 2.251) 2.873 15.011 ( -0.671 -3.758 -2.643) 4.643 15.120 ( 2.146 3.940 -0.578) 4.524 15.380 ( 5.056 2.312 -0.924) 5.635 15.468 ( 2.815 -0.164 2.626) 3.853 15.580 ( 0.601 2.378 -2.770) 3.699 15.702 ( 3.817 -0.330 -3.898) 5.465 15.968 ( -11.183 5.244 0.282) 12.354 16.053 ( -4.034 0.638 4.801) 6.303 16.537 ( -1.583 -3.239 0.197) 3.610 16.797 ( 12.619 2.204 4.092) 13.448 17.136 ( 3.561 2.505 3.047) 5.314 17.475 ( -2.521 1.356 -8.272) 8.753 17.716 ( 1.170 -0.717 -1.125) 1.774 25.650 ( 1.141 -2.239 1.078) 2.735 25.693 ( -0.338 -0.338 -0.885) 1.006 25.742 ( 0.101 -0.761 4.018) 4.091 25.786 ( -2.118 -0.492 0.384) 2.208 25.858 ( -0.876 3.578 0.634) 3.738 26.283 ( 3.410 -0.087 -6.910) 7.706 26.343 ( -0.725 -0.783 1.102) 1.534 26.433 ( -0.328 -1.567 1.666) 2.311 26.903 ( -0.723 -1.200 4.395) 4.613 27.122 ( 2.622 6.548 4.453) 8.341 27.858 ( -4.632 -4.764 0.506) 6.663 28.138 ( -9.138 -5.268 -6.851) 12.578 28.560 ( -4.414 -7.565 -4.576) 9.882 28.659 ( -4.269 -10.968 -0.815) 11.798 29.115 ( 5.068 -2.092 3.176) 6.336 29.837 ( 16.105 24.609 -1.590) 29.454 ======================= Grid point 99 (39/140) ======================= q-point: (-0.44 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.652 ( -7.880 5.123 9.114) 13.092 1.922 ( 5.146 0.184 0.472) 5.171 2.089 ( 0.306 -3.031 2.675) 4.054 2.358 ( 2.428 -0.428 2.679) 3.641 2.605 ( -5.251 0.392 -8.125) 9.682 2.700 ( 3.887 2.570 2.543) 5.309 2.782 ( -0.092 -3.722 1.680) 4.085 2.846 ( 0.789 0.962 -0.791) 1.474 2.916 ( -2.910 -7.060 -11.805) 14.060 3.070 ( -1.769 -2.527 1.726) 3.535 3.100 ( -3.058 -1.212 -2.879) 4.371 3.272 ( 0.489 -0.347 1.059) 1.217 3.375 ( -3.420 -5.632 2.355) 6.998 3.475 ( -1.223 -0.800 1.615) 2.178 3.587 ( 2.889 -5.353 2.602) 6.616 3.799 ( -1.859 -0.040 -0.980) 2.102 4.002 ( -4.765 -1.972 4.254) 6.685 4.289 ( 6.196 0.249 6.766) 9.178 4.491 ( -1.109 5.665 1.012) 5.861 4.524 ( 4.949 4.934 1.380) 7.123 4.577 ( 0.231 2.007 -8.997) 9.221 4.724 ( 0.133 2.462 -3.916) 4.627 4.825 ( 1.953 0.325 -0.217) 1.992 5.066 ( 5.258 -0.362 -0.371) 5.283 5.380 ( -0.831 -6.417 0.969) 6.543 5.522 ( -0.255 -1.185 -9.679) 9.754 5.730 ( -3.656 -2.224 1.091) 4.416 5.779 ( 1.572 2.025 0.964) 2.740 5.817 ( 0.391 -2.438 3.037) 3.914 6.106 ( -4.689 2.097 -0.986) 5.230 6.181 ( 6.816 -1.264 -3.498) 7.765 6.294 ( -3.694 0.722 6.831) 7.800 6.498 ( 5.173 -1.619 0.607) 5.454 6.733 ( -6.038 2.395 0.365) 6.506 6.760 ( -0.178 -3.258 1.448) 3.570 6.887 ( -2.319 0.169 -5.709) 6.164 7.051 ( 0.984 -6.293 5.647) 8.513 7.276 ( -2.279 -0.016 0.053) 2.280 7.523 ( 1.254 3.237 4.403) 5.606 7.570 ( 5.289 0.919 -0.990) 5.458 8.589 ( -8.505 -1.296 0.845) 8.645 8.868 ( 3.081 -5.752 2.287) 6.915 9.020 ( -2.894 -3.274 -1.065) 4.497 9.054 ( -0.404 -4.095 -3.228) 5.230 9.199 ( 1.179 1.407 -2.296) 2.940 9.399 ( -4.764 2.765 2.980) 6.263 9.482 ( 1.356 -8.956 1.872) 9.250 9.910 ( 2.718 -2.585 -2.191) 4.344 9.975 ( -2.157 6.887 5.433) 9.034 10.605 ( 0.837 5.406 1.812) 5.763 10.941 ( -1.848 -0.014 -4.630) 4.985 11.033 ( -1.535 3.729 2.961) 5.003 11.238 ( 6.198 -4.517 -3.339) 8.365 11.333 ( 2.839 7.639 -3.360) 8.815 11.440 ( -0.147 -3.322 2.393) 4.097 11.600 ( -6.699 0.003 -0.432) 6.713 11.892 ( -2.052 6.942 -2.947) 7.816 11.930 ( 4.113 -0.742 1.650) 4.493 12.152 ( 8.222 0.195 7.464) 11.106 12.197 ( 2.227 -4.812 -3.591) 6.404 12.222 ( 4.177 -0.405 -1.815) 4.573 12.464 ( 2.268 -1.926 -6.046) 6.739 12.750 ( -4.456 1.696 -3.699) 6.034 12.971 ( -11.209 2.529 4.551) 12.359 14.617 ( -3.230 0.581 -0.563) 3.330 14.685 ( 1.063 -3.420 2.438) 4.332 14.921 ( 0.890 3.028 -0.231) 3.165 14.954 ( 1.300 -0.399 -1.772) 2.234 15.187 ( -0.342 -5.106 4.063) 6.534 15.358 ( 2.829 3.518 -0.929) 4.609 15.493 ( 4.472 1.903 -1.353) 5.045 15.523 ( -0.005 2.574 -1.285) 2.877 15.713 ( 0.473 -0.300 -3.513) 3.558 15.837 ( -7.876 0.036 1.650) 8.047 16.057 ( -4.340 -1.528 6.810) 8.219 16.557 ( 0.924 -0.144 -1.694) 1.935 16.867 ( 7.974 2.878 4.691) 9.688 17.111 ( 0.046 3.510 2.153) 4.119 17.422 ( -3.329 -2.939 -6.278) 7.690 17.729 ( 1.100 -0.537 -1.452) 1.899 25.666 ( -1.980 1.297 1.376) 2.738 25.702 ( 0.847 -1.234 -0.028) 1.497 25.757 ( -0.245 1.584 1.786) 2.399 25.792 ( -0.869 2.669 -0.966) 2.969 25.798 ( -0.198 -2.312 0.824) 2.463 26.274 ( 3.700 0.153 -6.445) 7.433 26.367 ( -0.423 -1.115 3.321) 3.529 26.462 ( -0.481 -1.245 1.710) 2.170 26.946 ( 0.824 -1.726 -6.584) 6.856 27.057 ( 1.641 4.685 11.755) 12.760 27.900 ( -1.798 -3.374 -1.013) 3.955 28.152 ( -4.504 -5.276 -2.846) 7.498 28.585 ( -2.867 -2.937 -6.380) 7.586 28.816 ( -4.187 -11.287 -0.152) 12.040 29.191 ( 1.000 -0.978 3.047) 3.353 29.547 ( 9.741 20.862 0.263) 23.026 ======================= Grid point 100 (40/140) ======================= q-point: (-0.33 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.484 ( -12.643 10.293 10.448) 19.363 1.808 ( -0.204 14.273 2.656) 14.519 2.119 ( 1.621 5.422 7.415) 9.328 2.391 ( 5.392 7.188 1.065) 9.049 2.438 ( -3.089 4.248 -7.983) 9.556 2.616 ( -1.633 5.236 -5.795) 7.979 2.750 ( 1.824 5.469 -4.524) 7.328 2.882 ( 0.986 -4.776 2.808) 5.628 3.002 ( -0.988 4.662 -6.739) 8.254 3.049 ( -0.224 -5.908 0.128) 5.914 3.123 ( -0.560 -3.526 -0.844) 3.669 3.288 ( 0.913 4.047 6.290) 7.535 3.431 ( 0.507 -5.869 0.478) 5.911 3.534 ( -3.982 -3.887 2.550) 6.122 3.700 ( 1.792 2.577 -1.197) 3.360 3.792 ( 4.020 -5.429 0.465) 6.771 4.045 ( -8.688 -6.642 7.431) 13.222 4.276 ( -2.729 9.710 -0.966) 10.133 4.369 ( -0.063 4.667 5.604) 7.293 4.438 ( 4.732 4.594 0.386) 6.606 4.541 ( -1.883 1.639 -3.713) 4.475 4.707 ( 6.232 -0.380 -5.435) 8.278 4.781 ( 3.044 5.909 -4.758) 8.174 5.114 ( 2.309 -1.300 1.887) 3.253 5.435 ( -2.988 -2.752 -3.683) 5.484 5.524 ( 3.727 -2.443 -7.044) 8.335 5.718 ( -3.328 -0.452 0.207) 3.365 5.805 ( 2.338 -0.529 2.588) 3.528 5.841 ( -1.790 1.918 5.618) 6.200 6.064 ( -1.703 0.020 -0.168) 1.712 6.197 ( -1.145 -0.664 -3.905) 4.123 6.308 ( 3.283 0.118 3.660) 4.918 6.558 ( 3.311 -0.372 -1.375) 3.604 6.635 ( -7.018 2.731 0.478) 7.545 6.812 ( -3.123 -1.899 1.613) 3.995 6.929 ( 1.627 -8.299 -2.183) 8.735 7.217 ( 1.248 -8.537 3.443) 9.289 7.266 ( -0.290 -1.036 1.202) 1.613 7.430 ( -1.078 4.650 -1.117) 4.902 7.651 ( 5.884 -1.456 -0.004) 6.061 8.573 ( -5.810 -2.879 2.728) 7.035 9.014 ( 0.564 -3.440 1.607) 3.838 9.017 ( 2.445 -1.181 -0.650) 2.792 9.067 ( 5.386 2.661 -3.436) 6.921 9.176 ( -0.534 0.516 -0.674) 1.003 9.339 ( -4.057 1.723 4.680) 6.429 9.591 ( 1.592 -0.283 0.588) 1.720 9.797 ( -3.821 8.258 -0.851) 9.139 10.021 ( 1.625 -4.336 4.237) 6.277 10.522 ( -0.301 5.940 3.846) 7.082 10.884 ( -4.378 2.833 -3.531) 6.298 10.920 ( -4.045 4.583 1.313) 6.253 11.227 ( 8.897 4.038 -7.979) 12.614 11.381 ( 3.354 -2.436 2.923) 5.072 11.532 ( -1.551 -4.048 -1.309) 4.529 11.567 ( -4.822 -4.115 1.908) 6.620 11.718 ( -0.983 8.260 -0.725) 8.349 11.905 ( 1.573 6.811 0.554) 7.012 12.091 ( -3.451 5.545 2.167) 6.881 12.243 ( 1.192 -2.646 -4.170) 5.080 12.376 ( 0.514 -6.550 -0.201) 6.573 12.513 ( 4.517 -5.149 -12.205) 13.995 12.796 ( 6.392 -7.967 0.671) 10.237 12.958 ( -1.517 -4.298 7.787) 9.023 14.576 ( -4.348 0.607 1.081) 4.521 14.705 ( 2.182 3.683 1.045) 4.407 14.901 ( 3.576 -1.465 -0.882) 3.964 15.031 ( -1.677 -6.065 0.331) 6.301 15.234 ( -4.008 -0.884 0.845) 4.191 15.301 ( 0.865 5.150 1.290) 5.379 15.443 ( 4.368 4.801 -0.311) 6.498 15.523 ( 3.385 -0.857 -3.915) 5.246 15.721 ( 1.989 -3.398 -4.692) 6.125 15.846 ( -7.874 -4.563 4.698) 10.242 16.102 ( -5.304 -3.990 8.088) 10.463 16.543 ( 2.995 2.050 -3.449) 5.007 16.851 ( 1.362 5.481 3.799) 6.807 17.051 ( -3.255 3.097 1.796) 4.839 17.463 ( -0.536 -6.010 -4.733) 7.669 17.739 ( 1.289 -0.928 -2.521) 2.979 25.633 ( -2.321 1.254 1.921) 3.264 25.676 ( -0.794 3.460 -0.065) 3.551 25.735 ( -0.039 1.744 -0.434) 1.797 25.773 ( 0.334 -0.487 1.146) 1.290 25.845 ( 0.301 -2.511 0.385) 2.558 26.268 ( 2.625 0.022 -6.289) 6.815 26.408 ( 1.601 -0.528 6.748) 6.956 26.482 ( -1.028 -1.074 0.332) 1.523 26.875 ( -0.928 3.179 -8.537) 9.156 27.145 ( 2.618 -4.131 10.229) 11.338 27.938 ( 2.325 -2.210 -1.752) 3.655 28.203 ( -1.086 -3.437 1.501) 3.905 28.570 ( 0.194 -0.574 -5.778) 5.809 28.946 ( -1.476 -5.571 -1.857) 6.055 29.131 ( -2.453 7.560 0.570) 7.969 29.355 ( -0.087 6.741 1.700) 6.952 ======================= Grid point 101 (41/140) ======================= q-point: (-0.22 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.236 ( -15.215 13.590 14.575) 25.073 1.545 ( 1.340 20.986 13.229) 24.844 1.901 ( -2.806 21.477 2.553) 21.809 2.187 ( 3.499 18.205 1.466) 18.596 2.436 ( 7.785 0.485 -0.304) 7.806 2.481 ( -5.775 3.509 -7.206) 9.879 2.635 ( 2.161 8.489 -5.085) 10.128 2.864 ( 0.060 6.380 -5.883) 8.679 2.966 ( 2.573 -0.747 -1.499) 3.070 3.063 ( 1.106 6.169 5.027) 8.035 3.127 ( 1.014 2.451 4.983) 5.645 3.273 ( -3.978 2.819 0.033) 4.875 3.462 ( -2.586 3.152 1.578) 4.372 3.591 ( -1.012 -2.597 -1.297) 3.075 3.642 ( 1.825 -2.725 1.431) 3.578 3.915 ( 1.676 -3.887 -2.038) 4.698 4.075 ( 0.734 5.230 -0.031) 5.281 4.190 ( -8.495 -9.281 5.273) 13.642 4.294 ( -8.580 0.914 -3.590) 9.345 4.464 ( 6.448 4.151 6.698) 10.182 4.483 ( 4.279 1.244 2.229) 4.983 4.662 ( 3.622 6.873 -4.026) 8.750 4.756 ( 5.762 -2.660 -8.307) 10.454 5.163 ( 0.071 -2.105 2.586) 3.335 5.420 ( -1.108 -0.039 -3.078) 3.272 5.561 ( 4.024 -1.013 -7.203) 8.313 5.709 ( -1.233 -0.055 0.590) 1.368 5.755 ( -3.982 3.675 -0.020) 5.419 5.867 ( 0.240 -1.990 4.166) 4.623 6.057 ( -0.716 0.000 -0.678) 0.986 6.183 ( -0.808 -1.949 -4.526) 4.994 6.358 ( 5.468 0.702 2.678) 6.129 6.509 ( -7.204 2.968 0.456) 7.805 6.594 ( 4.299 0.514 -1.912) 4.733 6.800 ( -5.314 0.256 2.314) 5.802 7.077 ( -0.274 -7.493 -2.394) 7.871 7.252 ( -1.151 -1.621 -3.759) 4.252 7.385 ( -1.220 -2.400 -1.875) 3.280 7.447 ( 4.736 -9.374 7.477) 12.892 7.681 ( 0.948 -0.388 -4.695) 4.806 8.612 ( -1.630 -1.605 4.228) 4.807 8.939 ( 1.716 8.216 3.230) 8.993 9.002 ( 0.311 4.091 -5.151) 6.586 9.113 ( 2.778 0.937 -1.077) 3.124 9.153 ( 0.536 0.650 -0.249) 0.878 9.380 ( 1.725 -2.986 8.483) 9.157 9.499 ( -1.208 8.123 -4.062) 9.162 9.663 ( -3.750 5.229 5.707) 8.600 10.112 ( -2.087 -3.637 1.694) 4.523 10.467 ( 1.712 3.845 7.173) 8.317 10.766 ( -4.135 3.932 2.237) 6.129 10.874 ( -1.964 -0.721 -3.726) 4.273 11.218 ( 9.625 2.270 -7.344) 12.318 11.360 ( 1.264 4.816 -0.714) 5.030 11.465 ( -4.612 5.977 -0.671) 7.580 11.668 ( 0.748 -6.803 0.275) 6.850 11.719 ( 0.779 -4.555 3.485) 5.788 11.799 ( 1.988 5.383 -0.747) 5.787 11.985 ( -7.737 2.631 4.099) 9.142 12.278 ( 0.535 -3.229 -5.329) 6.254 12.388 ( -2.937 -1.637 -10.417) 10.946 12.604 ( 7.393 -4.150 -5.266) 9.980 12.977 ( 0.692 -7.080 3.396) 7.883 13.212 ( 10.772 -15.166 9.275) 20.786 14.560 ( -5.958 -2.548 3.797) 7.510 14.672 ( 3.085 2.162 1.088) 3.921 14.940 ( 0.632 0.964 0.666) 1.331 15.088 ( -5.985 -4.291 -1.591) 7.535 15.218 ( -1.339 0.080 -2.197) 2.574 15.232 ( 3.205 3.057 -0.736) 4.490 15.406 ( 1.255 3.022 2.669) 4.223 15.543 ( 3.120 -0.940 -5.214) 6.149 15.811 ( 6.587 -4.466 -4.992) 9.394 15.881 ( -6.697 -3.964 7.353) 10.706 16.183 ( -7.881 -6.530 8.256) 13.150 16.505 ( 3.536 3.050 -4.854) 6.736 16.766 ( -3.165 5.429 3.448) 7.168 16.978 ( -5.532 2.921 2.623) 6.784 17.527 ( 1.296 -3.345 -5.089) 6.226 17.760 ( 1.756 -2.364 -5.429) 6.176 25.605 ( -0.960 2.897 1.006) 3.213 25.623 ( -1.853 0.758 3.139) 3.724 25.704 ( 0.234 1.534 -0.399) 1.602 25.788 ( 0.171 0.100 1.936) 1.946 25.881 ( 0.080 -1.485 -0.290) 1.515 26.248 ( 1.561 0.686 -6.261) 6.489 26.473 ( 0.907 -0.303 2.616) 2.786 26.486 ( 0.955 -0.606 6.392) 6.491 26.770 ( -1.609 3.341 -8.214) 9.012 27.287 ( -2.505 -7.762 3.600) 8.915 28.009 ( 6.158 -2.660 1.026) 6.786 28.258 ( 1.874 -1.121 3.846) 4.423 28.581 ( 9.120 -0.437 -1.945) 9.335 28.827 ( 2.709 13.907 -3.420) 14.575 29.107 ( -8.872 -4.941 -2.468) 10.451 29.252 ( -7.732 2.480 -0.098) 8.121 ======================= Grid point 102 (42/140) ======================= q-point: (-0.11 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.951 ( -14.748 15.910 18.614) 28.585 1.277 ( 1.531 23.497 17.964) 29.617 1.530 ( 8.611 25.475 17.185) 31.913 1.872 ( 3.469 23.689 6.582) 24.830 2.320 ( -9.326 5.234 -7.662) 13.156 2.447 ( 0.465 9.369 -5.987) 11.129 2.491 ( 10.554 3.564 -1.888) 11.299 2.719 ( 2.780 11.329 -0.419) 11.673 2.842 ( 0.589 12.704 1.822) 12.848 2.976 ( -5.813 15.523 2.081) 16.706 3.044 ( 0.012 4.928 3.398) 5.986 3.197 ( -1.048 -4.889 -0.506) 5.026 3.453 ( -0.666 -2.491 -2.712) 3.742 3.595 ( -1.650 -3.044 -5.043) 6.117 3.727 ( 1.787 -0.065 5.488) 5.772 3.973 ( -2.178 -0.115 -2.262) 3.143 4.024 ( -2.874 -3.654 -7.790) 9.072 4.193 ( -5.478 -3.092 0.721) 6.332 4.321 ( -0.990 -5.465 2.836) 6.236 4.466 ( 3.154 1.721 4.084) 5.440 4.569 ( 8.583 1.642 6.959) 11.172 4.581 ( -1.409 1.842 -2.422) 3.353 4.792 ( 4.008 -1.295 -8.553) 9.534 5.204 ( -3.312 -2.750 2.435) 4.946 5.403 ( 3.252 1.932 -0.342) 3.798 5.512 ( -1.090 4.082 -5.806) 7.181 5.601 ( -0.550 4.668 -7.147) 8.554 5.816 ( 0.538 -6.781 -0.616) 6.830 5.909 ( 1.124 -0.593 -1.440) 1.921 6.049 ( -2.971 -1.750 1.506) 3.763 6.215 ( 4.382 -1.916 -3.834) 6.130 6.367 ( 0.536 1.720 1.317) 2.232 6.447 ( 1.517 1.139 4.638) 5.011 6.631 ( 1.317 -2.072 0.622) 2.532 6.764 ( -5.898 -0.901 2.340) 6.409 7.129 ( 1.294 -1.636 -4.205) 4.693 7.247 ( -1.127 -0.555 -3.955) 4.150 7.437 ( -4.460 -6.254 -6.659) 10.166 7.652 ( 0.664 -2.041 -0.516) 2.208 7.670 ( -1.077 -7.727 4.436) 8.975 8.570 ( 0.308 8.282 2.534) 8.666 8.843 ( 2.770 7.829 1.770) 8.492 8.882 ( -2.038 5.624 -5.266) 7.969 9.074 ( -1.395 -0.701 -1.670) 2.286 9.133 ( 3.394 8.269 -2.419) 9.260 9.325 ( -0.854 4.703 2.796) 5.537 9.510 ( 3.696 -2.462 6.060) 7.513 9.626 ( -8.826 -2.285 8.854) 12.709 10.109 ( -6.111 0.446 2.346) 6.561 10.486 ( 4.644 1.832 7.653) 9.137 10.739 ( -2.278 -1.232 1.996) 3.269 10.849 ( 2.389 2.151 -7.030) 7.730 11.152 ( 3.195 7.001 -3.574) 8.484 11.327 ( -2.516 6.795 1.877) 7.485 11.397 ( 12.538 -3.981 -2.417) 13.375 11.716 ( -3.062 1.720 1.343) 3.760 11.779 ( 2.957 -2.117 0.320) 3.651 11.837 ( 0.845 -6.577 1.870) 6.890 11.979 ( -3.610 -4.302 6.799) 8.818 12.301 ( -0.765 -2.713 -5.888) 6.528 12.327 ( -3.901 -1.043 -10.912) 11.635 12.692 ( 8.076 -1.672 -3.477) 8.950 13.075 ( -1.577 -2.341 3.680) 4.638 13.605 ( 4.696 -16.549 7.925) 18.940 14.615 ( -8.864 -6.917 8.034) 13.819 14.699 ( 0.010 -3.779 0.122) 3.781 14.878 ( -2.468 3.985 -0.041) 4.687 15.071 ( -2.717 1.031 -5.247) 5.998 15.168 ( 3.792 4.756 0.594) 6.112 15.237 ( -0.120 -0.434 -0.972) 1.071 15.434 ( -0.028 -6.091 1.655) 6.312 15.545 ( 2.391 0.479 -5.421) 5.945 15.827 ( -4.708 0.241 1.387) 4.914 16.034 ( 11.671 -6.461 3.832) 13.879 16.263 ( -5.659 -5.737 6.238) 10.191 16.451 ( -2.419 1.698 -4.091) 5.047 16.664 ( -6.185 4.337 3.542) 8.343 16.895 ( -3.733 4.159 3.171) 6.426 17.540 ( 3.295 0.333 -5.900) 6.766 17.764 ( 1.887 0.360 -10.724) 10.894 25.553 ( 0.156 2.942 1.229) 3.193 25.627 ( -1.614 0.003 2.591) 3.053 25.703 ( -0.545 -1.424 4.008) 4.288 25.791 ( -0.512 0.632 2.456) 2.587 25.889 ( -0.076 0.099 -0.535) 0.550 26.213 ( 1.327 1.287 -5.694) 5.986 26.444 ( -1.699 1.375 -1.942) 2.924 26.566 ( 2.538 2.062 4.788) 5.798 26.690 ( -0.990 -1.757 -0.262) 2.034 27.365 ( -10.853 -7.099 -3.252) 13.370 28.089 ( -4.168 -3.260 0.716) 5.339 28.294 ( 3.061 1.196 2.638) 4.214 28.583 ( 1.055 10.968 -3.625) 11.600 28.744 ( -5.949 5.259 4.365) 9.061 28.991 ( 24.601 -0.262 -6.946) 25.564 29.255 ( -3.670 -5.207 0.938) 6.439 ======================= Grid point 105 (43/140) ======================= q-point: ( 0.22 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.288 ( 14.819 0.000 3.837) 15.308 1.361 ( 9.080 0.000 14.413) 17.035 1.449 ( 9.041 0.000 5.636) 10.654 1.771 ( -1.956 -0.000 -3.534) 4.039 1.931 ( -13.866 -0.000 9.865) 17.017 2.296 ( 9.617 0.000 -1.164) 9.687 2.381 ( -5.381 -0.000 -0.835) 5.446 2.613 ( -5.391 -0.000 9.869) 11.246 2.748 ( 12.126 0.000 22.702) 25.738 2.834 ( 8.195 0.000 -7.839) 11.341 2.859 ( 1.082 0.000 -12.153) 12.201 3.202 ( 5.078 0.000 12.950) 13.910 3.364 ( 0.170 0.000 -7.002) 7.004 3.398 ( -6.812 -0.000 -9.236) 11.476 3.886 ( -4.431 -0.000 -3.375) 5.570 3.900 ( -1.247 -0.000 -10.224) 10.300 3.916 ( 2.899 0.000 7.250) 7.808 4.142 ( -5.758 -0.000 -1.205) 5.883 4.149 ( -11.631 -0.000 2.182) 11.834 4.482 ( 0.891 0.000 -6.116) 6.181 4.731 ( 2.596 0.000 2.788) 3.810 4.765 ( 4.703 0.000 6.190) 7.774 4.820 ( -0.760 -0.000 5.904) 5.953 5.056 ( -0.549 -0.000 -3.839) 3.878 5.396 ( 3.993 0.000 1.450) 4.248 5.401 ( 2.628 0.000 -9.625) 9.977 5.515 ( -5.243 -0.000 -7.052) 8.787 5.709 ( 11.978 0.000 -3.770) 12.557 6.105 ( 1.131 0.000 2.076) 2.364 6.224 ( 4.881 0.000 4.046) 6.340 6.228 ( -4.821 -0.000 -5.078) 7.002 6.483 ( -5.489 -0.000 6.361) 8.402 6.577 ( 4.616 0.000 -2.943) 5.474 6.751 ( 1.556 0.000 2.205) 2.699 6.794 ( 0.777 0.000 0.846) 1.149 7.042 ( -4.915 -0.000 2.598) 5.559 7.094 ( -2.204 -0.000 -1.437) 2.631 7.390 ( 3.401 0.000 -4.872) 5.942 7.560 ( -16.556 -0.000 -0.318) 16.559 7.716 ( -4.169 -0.000 2.715) 4.975 8.501 ( -6.150 -0.000 -6.611) 9.029 8.544 ( 2.111 0.000 1.988) 2.900 8.615 ( -5.395 -0.000 -2.630) 6.002 8.657 ( 3.028 0.000 3.913) 4.948 9.123 ( -15.310 -0.000 0.463) 15.317 9.216 ( 4.255 0.000 -0.058) 4.255 9.614 ( 3.284 0.000 -3.796) 5.019 9.825 ( -0.014 -0.000 0.097) 0.098 10.159 ( -2.630 -0.000 8.414) 8.816 10.603 ( 6.067 0.000 9.809) 11.533 10.689 ( 2.259 0.000 3.586) 4.238 10.815 ( 5.080 0.000 -5.461) 7.458 11.108 ( 0.423 0.000 -9.219) 9.229 11.397 ( 2.932 0.000 10.950) 11.336 11.519 ( -6.388 -0.000 -1.678) 6.605 11.585 ( 2.130 0.000 -5.291) 5.704 11.895 ( 4.170 0.000 5.754) 7.107 12.008 ( -6.958 -0.000 1.383) 7.094 12.050 ( -5.819 -0.000 -5.307) 7.875 12.219 ( -5.351 -0.000 2.318) 5.831 12.234 ( 6.152 0.000 1.320) 6.292 12.699 ( -6.104 -0.000 1.660) 6.326 12.916 ( -7.166 -0.000 1.229) 7.270 13.388 ( -8.298 -0.000 6.393) 10.475 14.719 ( -2.913 -0.000 -0.621) 2.979 14.736 ( -2.549 -0.000 2.428) 3.521 14.944 ( -10.742 -0.000 0.066) 10.742 14.956 ( 3.189 0.000 1.346) 3.462 15.320 ( 8.102 0.000 -1.204) 8.191 15.458 ( 10.409 0.000 -6.520) 12.282 15.479 ( 7.929 0.000 -4.438) 9.086 15.656 ( -4.089 -0.000 0.295) 4.100 15.727 ( 1.481 0.000 -0.492) 1.561 16.004 ( -5.717 -0.000 -3.595) 6.754 16.223 ( -4.470 -0.000 7.034) 8.334 16.253 ( -3.403 -0.000 -1.173) 3.600 16.938 ( 2.883 0.000 6.042) 6.695 17.341 ( 17.766 0.000 -14.096) 22.678 17.423 ( 3.837 0.000 0.375) 3.855 17.646 ( 2.772 0.000 -0.540) 2.824 25.571 ( 1.191 0.000 1.514) 1.927 25.628 ( 1.415 0.000 -0.808) 1.629 25.701 ( -2.724 -0.000 1.492) 3.106 25.768 ( -1.299 -0.000 1.528) 2.005 25.977 ( -1.859 -0.000 3.928) 4.346 26.233 ( 1.329 0.000 -3.141) 3.411 26.326 ( 1.762 0.000 4.882) 5.191 26.404 ( -0.250 -0.000 -0.514) 0.572 26.987 ( -9.127 -0.000 2.189) 9.386 27.225 ( 6.881 0.000 8.027) 10.572 27.461 ( -7.689 -0.000 5.818) 9.642 28.223 ( -2.211 -0.000 -0.135) 2.215 28.229 ( -12.905 -0.000 -4.147) 13.555 28.364 ( 0.890 0.000 -1.251) 1.536 29.065 ( 3.641 0.000 -5.163) 6.318 30.628 ( 22.607 0.000 -15.422) 27.367 ======================= Grid point 106 (44/140) ======================= q-point: ( 0.33 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.385 ( -6.322 -5.712 -6.234) 10.557 1.477 ( 12.595 -6.890 10.973) 18.070 1.692 ( 15.590 -6.658 8.616) 19.016 1.880 ( 0.660 -12.693 -2.792) 13.013 2.106 ( -5.064 -20.235 12.594) 24.366 2.365 ( -2.186 -4.624 -1.934) 5.468 2.403 ( 0.729 -6.702 -4.855) 8.308 2.638 ( -5.340 -2.612 5.758) 8.276 2.802 ( 0.223 -5.400 -11.278) 12.507 2.848 ( 2.832 0.930 9.483) 9.941 2.987 ( 5.634 -3.436 0.875) 6.657 3.271 ( -5.135 2.005 -7.906) 9.638 3.293 ( 0.559 -0.151 2.291) 2.363 3.479 ( 10.149 -7.753 10.788) 16.718 3.682 ( -4.513 8.539 -6.233) 11.495 3.854 ( -3.738 7.535 -0.550) 8.429 4.035 ( 4.647 -4.110 8.660) 10.653 4.069 ( -5.888 -2.479 -1.701) 6.611 4.102 ( -3.338 -2.369 -3.751) 5.552 4.524 ( -1.427 -7.043 -6.291) 9.550 4.723 ( -0.050 2.023 -2.317) 3.077 4.772 ( 1.302 2.537 -0.726) 2.942 4.875 ( -0.585 -2.211 4.652) 5.184 5.090 ( 6.284 -0.945 4.826) 7.980 5.324 ( 0.656 4.533 -5.322) 7.022 5.429 ( 1.762 -1.400 -2.110) 3.085 5.492 ( -3.356 -3.336 -5.085) 6.946 5.778 ( 8.995 0.279 -3.436) 9.633 6.039 ( -1.548 5.998 -1.380) 6.347 6.175 ( -2.061 0.790 -2.885) 3.633 6.268 ( 3.727 2.196 5.338) 6.871 6.426 ( -1.961 4.647 2.303) 5.545 6.583 ( 0.986 1.367 -0.880) 1.902 6.751 ( 3.356 2.505 0.917) 4.287 6.834 ( 0.069 -3.448 4.705) 5.833 7.022 ( -3.580 4.163 -0.157) 5.493 7.066 ( -3.369 0.835 -1.941) 3.977 7.239 ( -6.762 4.555 0.758) 8.188 7.576 ( -8.577 -8.303 -0.910) 11.972 7.631 ( 1.388 7.922 0.363) 8.051 8.503 ( -5.894 -8.533 -5.512) 11.745 8.552 ( -1.571 -1.183 0.888) 2.157 8.646 ( -5.103 -7.685 -1.358) 9.324 8.746 ( 3.030 -3.319 7.641) 8.865 9.054 ( -10.891 -4.076 0.799) 11.656 9.206 ( 2.532 2.893 0.131) 3.847 9.669 ( 2.950 -5.342 -3.951) 7.270 9.770 ( 0.809 6.450 0.825) 6.552 10.159 ( -1.483 1.498 5.477) 5.869 10.716 ( 1.210 -0.149 1.909) 2.265 10.785 ( 5.297 -5.980 5.510) 9.705 10.887 ( 6.147 -8.278 -2.277) 10.559 11.037 ( -0.796 1.158 -12.558) 12.636 11.475 ( -3.884 -0.061 -0.338) 3.899 11.494 ( 3.441 -2.423 7.404) 8.517 11.572 ( 1.159 0.064 -3.731) 3.908 11.915 ( -0.371 3.753 -1.169) 3.949 11.952 ( -5.040 2.669 1.166) 5.821 12.023 ( 1.698 -3.534 -0.839) 4.009 12.166 ( -3.129 1.994 5.940) 7.003 12.289 ( 5.531 1.067 2.762) 6.274 12.684 ( -8.010 -3.184 -1.941) 8.836 12.826 ( -9.065 2.471 -2.600) 9.749 13.334 ( -6.663 3.951 5.109) 9.280 14.640 ( -1.783 3.950 2.486) 4.996 14.753 ( -3.266 2.408 0.162) 4.061 14.833 ( -5.524 -1.637 0.712) 5.806 15.051 ( 0.126 -4.153 -0.328) 4.168 15.249 ( 5.732 10.486 -0.699) 11.971 15.454 ( 8.424 2.798 -3.716) 9.623 15.550 ( 4.211 -0.101 -2.887) 5.107 15.612 ( -1.556 1.922 0.424) 2.509 15.729 ( 6.558 1.273 -3.712) 7.643 15.990 ( -8.802 -3.417 0.204) 9.444 16.142 ( -2.878 3.999 2.087) 5.351 16.339 ( -2.745 -7.301 2.845) 8.303 16.964 ( 6.845 3.903 3.892) 8.788 17.274 ( 10.576 7.861 -0.310) 13.181 17.511 ( 1.620 -1.848 -7.616) 8.003 17.674 ( 1.252 -1.528 -0.183) 1.984 25.593 ( 1.177 -0.814 0.895) 1.688 25.647 ( 1.578 -1.415 -1.248) 2.460 25.703 ( -2.146 -1.373 1.866) 3.158 25.769 ( -1.628 -0.411 1.752) 2.427 25.961 ( -1.265 2.093 2.363) 3.401 26.228 ( -0.581 -1.144 -3.253) 3.497 26.375 ( 4.135 -0.151 4.116) 5.837 26.394 ( -0.862 0.443 -1.025) 1.411 26.919 ( -5.290 1.650 0.748) 5.591 27.279 ( 6.139 2.793 10.527) 12.502 27.574 ( -6.180 -11.827 3.665) 13.839 28.040 ( -13.289 2.363 -8.588) 15.998 28.275 ( -3.804 -6.218 -0.374) 7.299 28.409 ( -0.111 -4.895 -1.361) 5.082 29.090 ( 6.343 0.023 -0.434) 6.358 30.576 ( 17.192 15.187 -10.622) 25.279 ======================= Grid point 107 (45/140) ======================= q-point: ( 0.44 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.498 ( -4.825 -13.726 2.527) 14.767 1.755 ( 8.687 -8.620 8.459) 14.877 1.898 ( 8.796 -2.447 2.723) 9.527 2.131 ( 2.854 -16.083 -3.731) 16.755 2.387 ( -7.809 -6.762 -9.965) 14.353 2.471 ( 0.142 -16.902 6.868) 18.244 2.557 ( 0.779 -11.352 -2.225) 11.594 2.677 ( -2.902 -4.095 3.745) 6.262 2.837 ( -2.522 -2.920 0.032) 3.858 2.964 ( 1.480 -8.090 4.179) 9.225 3.037 ( 1.085 -0.157 -2.491) 2.721 3.174 ( -4.255 0.137 -3.699) 5.639 3.288 ( -0.497 0.261 -5.960) 5.987 3.523 ( -4.681 2.734 -1.994) 5.776 3.642 ( -5.959 7.634 9.736) 13.732 3.726 ( 5.737 -1.197 4.811) 7.582 4.004 ( -2.547 1.487 0.180) 2.955 4.183 ( 3.281 -6.822 -0.157) 7.572 4.299 ( 8.114 -12.648 3.741) 15.486 4.574 ( -5.040 -4.508 -8.053) 10.515 4.672 ( 3.033 1.625 -5.419) 6.419 4.739 ( 3.871 2.128 0.807) 4.490 4.893 ( -0.039 2.187 0.879) 2.357 5.126 ( 2.169 3.232 -2.619) 4.692 5.295 ( 3.945 0.401 4.826) 6.246 5.454 ( -2.901 -0.802 3.069) 4.299 5.510 ( -4.585 -8.155 -7.930) 12.264 5.793 ( 5.507 2.809 0.613) 6.212 5.922 ( -2.124 4.534 -4.390) 6.659 6.157 ( 4.136 0.182 -1.693) 4.473 6.236 ( -1.079 4.692 0.116) 4.816 6.357 ( 0.058 4.537 5.278) 6.960 6.550 ( 2.257 3.512 0.965) 4.284 6.742 ( 3.024 1.758 0.136) 3.500 6.854 ( -6.730 5.561 -1.968) 8.949 6.927 ( 1.270 -2.451 4.778) 5.518 6.981 ( -5.769 2.921 -0.283) 6.473 7.221 ( -5.156 -2.415 2.023) 6.043 7.543 ( 3.643 3.025 1.006) 4.841 7.628 ( -3.102 -2.508 -1.075) 4.132 8.550 ( -5.774 -2.242 0.650) 6.228 8.620 ( -1.650 -8.807 0.118) 8.961 8.750 ( -5.023 -9.966 -1.118) 11.216 8.864 ( -0.340 -5.623 4.728) 7.355 9.110 ( -4.121 -8.849 0.741) 9.789 9.194 ( 0.275 -0.240 0.253) 0.444 9.649 ( 0.943 8.899 1.081) 9.013 9.771 ( 3.731 -5.331 -2.755) 7.066 10.132 ( -2.271 2.409 1.800) 3.768 10.723 ( 1.537 0.989 -0.516) 1.899 10.926 ( 4.642 -5.492 -0.945) 7.253 10.942 ( 1.018 1.784 -4.306) 4.771 11.127 ( 5.478 -10.166 -0.243) 11.551 11.421 ( -1.473 3.268 -0.869) 3.689 11.545 ( -1.469 -0.444 -3.236) 3.581 11.629 ( 3.517 -4.435 1.210) 5.788 11.771 ( -3.240 5.454 -2.974) 7.006 11.943 ( -0.393 -0.601 2.879) 2.968 12.095 ( 4.625 -2.197 -2.081) 5.527 12.163 ( -1.477 0.632 6.554) 6.748 12.323 ( 6.669 1.764 3.388) 7.686 12.595 ( -1.922 6.104 -9.009) 11.050 12.737 ( -14.544 -4.029 1.047) 15.128 13.181 ( -9.029 9.489 3.101) 13.460 14.606 ( 0.267 0.753 2.410) 2.539 14.655 ( -4.685 2.768 0.050) 5.442 14.895 ( -2.145 -6.017 1.858) 6.652 15.019 ( 2.918 7.268 -1.414) 7.958 15.179 ( 1.659 1.552 -0.796) 2.407 15.451 ( 5.332 2.500 -3.166) 6.686 15.533 ( 3.396 2.772 2.563) 5.078 15.587 ( -1.679 0.553 -1.389) 2.249 15.740 ( 8.195 1.866 -5.824) 10.225 15.938 ( -10.764 1.579 1.863) 11.037 16.076 ( -2.822 2.688 3.645) 5.336 16.451 ( -1.542 -6.133 2.051) 6.648 16.985 ( 12.725 4.202 4.273) 14.066 17.245 ( 5.266 4.829 3.055) 7.771 17.446 ( -3.988 2.901 -7.459) 8.942 17.701 ( 0.369 -1.198 -0.752) 1.462 25.629 ( 1.435 -1.866 0.701) 2.456 25.674 ( 0.594 -1.203 -1.564) 2.060 25.727 ( -1.362 -1.908 1.745) 2.922 25.771 ( -1.853 -0.277 1.914) 2.678 25.913 ( -0.995 3.298 0.229) 3.452 26.233 ( -0.372 -1.970 -3.806) 4.302 26.367 ( 0.090 1.083 0.622) 1.252 26.435 ( 2.928 -0.571 3.132) 4.325 26.875 ( -2.318 -0.544 -1.875) 3.031 27.301 ( 3.075 6.702 10.216) 12.599 27.712 ( -4.568 -8.171 0.170) 9.363 27.929 ( -9.475 -5.987 -6.730) 13.074 28.376 ( -2.799 -8.769 -0.446) 9.215 28.487 ( -1.663 -6.387 -2.173) 6.948 29.151 ( 5.303 -0.607 3.495) 6.380 30.331 ( 13.054 22.372 -6.494) 26.704 ======================= Grid point 108 (46/140) ======================= q-point: ( 0.56 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.675 ( -5.781 -3.840 8.816) 11.220 1.949 ( 0.951 -7.660 1.532) 7.869 1.987 ( 6.603 -2.717 1.296) 7.257 2.323 ( -1.479 -5.812 -2.361) 6.445 2.439 ( 0.262 -10.275 -7.724) 12.857 2.664 ( -3.751 -7.305 -11.071) 13.784 2.696 ( -0.295 -7.336 3.582) 8.169 2.776 ( 1.902 -4.159 3.184) 5.572 2.904 ( 1.256 0.032 -0.969) 1.587 2.980 ( -3.310 -1.771 -0.391) 3.774 3.083 ( 0.457 -1.639 3.179) 3.606 3.226 ( -3.662 -7.805 4.243) 9.609 3.240 ( 0.114 -1.924 -7.656) 7.895 3.478 ( -5.482 1.113 3.263) 6.476 3.569 ( 1.992 -0.554 4.651) 5.090 3.776 ( -1.282 0.329 4.266) 4.466 3.986 ( -1.596 -0.166 0.688) 1.746 4.339 ( 5.990 -4.945 5.182) 9.337 4.447 ( -6.070 -2.713 -5.570) 8.673 4.578 ( 6.193 -0.197 -6.248) 8.800 4.664 ( 2.167 2.759 -1.563) 3.841 4.755 ( 5.688 2.168 0.729) 6.130 4.829 ( -1.888 1.147 -3.773) 4.372 5.101 ( 5.918 -0.172 -2.579) 6.458 5.326 ( -2.375 -0.670 3.444) 4.237 5.428 ( -3.229 -2.349 -7.117) 8.160 5.631 ( -3.076 -8.188 3.509) 9.424 5.815 ( 2.971 0.913 4.472) 5.447 5.830 ( 1.400 2.491 -0.245) 2.868 6.125 ( -2.192 3.871 -3.231) 5.498 6.200 ( 3.115 0.452 -0.270) 3.159 6.329 ( 2.248 1.689 3.046) 4.146 6.527 ( 1.729 1.255 1.954) 2.895 6.722 ( -4.434 1.975 -1.805) 5.179 6.758 ( -0.415 1.509 3.285) 3.639 6.868 ( -2.500 2.698 -3.687) 5.208 7.021 ( 0.346 -2.672 8.093) 8.530 7.225 ( -4.073 -2.517 -0.820) 4.857 7.571 ( 0.893 0.028 1.099) 1.416 7.605 ( 0.926 1.023 -2.314) 2.695 8.533 ( -5.491 -0.424 2.976) 6.260 8.777 ( 1.933 -8.616 3.337) 9.439 8.873 ( -5.126 -9.213 0.320) 10.548 8.968 ( 0.392 -5.559 -0.034) 5.573 9.184 ( -1.495 -1.781 -1.669) 2.862 9.293 ( 0.572 -10.274 1.879) 10.460 9.516 ( -0.125 7.648 2.190) 7.956 9.866 ( 2.861 -4.052 -2.741) 5.667 10.062 ( -3.172 3.996 1.130) 5.226 10.694 ( 1.314 3.179 -1.656) 3.817 10.900 ( 0.827 -0.920 -8.601) 8.690 11.054 ( 1.169 -2.372 4.909) 5.576 11.252 ( 5.084 0.629 0.266) 5.130 11.388 ( 0.508 -1.253 3.590) 3.837 11.482 ( -1.098 4.653 -2.951) 5.618 11.589 ( -2.530 4.634 0.763) 5.335 11.828 ( 2.938 -8.333 -7.766) 11.764 11.970 ( 2.361 -0.204 1.020) 2.580 12.141 ( 1.764 -1.556 -3.633) 4.328 12.171 ( 0.007 0.106 4.592) 4.593 12.381 ( 10.207 2.307 5.221) 11.695 12.438 ( -3.182 3.782 -7.738) 9.181 12.699 ( -7.779 -1.106 -2.120) 8.139 12.954 ( -11.666 7.053 3.001) 13.959 14.601 ( -2.289 0.323 -0.630) 2.396 14.640 ( 0.328 -2.609 1.628) 3.093 14.931 ( -0.530 2.736 2.297) 3.611 14.981 ( 1.164 -2.363 -3.482) 4.366 15.165 ( 1.221 0.608 2.518) 2.863 15.423 ( 3.110 2.698 -3.280) 5.264 15.540 ( 0.658 0.932 0.017) 1.141 15.559 ( 2.124 1.719 1.483) 3.109 15.720 ( 1.852 2.688 -5.090) 6.047 15.819 ( -6.641 3.493 1.660) 7.685 16.052 ( -3.028 0.511 6.352) 7.056 16.529 ( -0.194 -3.256 0.394) 3.286 17.043 ( 12.775 5.261 4.863) 14.647 17.203 ( 1.113 5.176 2.468) 5.841 17.330 ( -6.315 0.122 -5.588) 8.433 17.715 ( 0.252 -0.892 -1.488) 1.753 25.672 ( -0.657 0.016 0.232) 0.697 25.683 ( 1.504 -1.913 -0.159) 2.438 25.752 ( -1.885 -1.417 -0.106) 2.360 25.773 ( -0.687 -0.572 1.942) 2.138 25.844 ( -0.602 3.758 -0.843) 3.898 26.247 ( 0.986 -1.722 -4.469) 4.890 26.376 ( 0.428 -0.701 3.934) 4.019 26.461 ( 0.671 0.432 1.661) 1.843 26.877 ( -0.500 -2.631 -6.699) 7.214 27.213 ( -1.227 7.897 7.709) 11.103 27.800 ( -1.337 -6.325 -1.551) 6.648 28.006 ( -2.553 -8.182 1.738) 8.746 28.476 ( -1.532 -5.326 -2.869) 6.240 28.601 ( -2.284 -10.440 -0.907) 10.725 29.210 ( 1.995 -0.394 4.082) 4.560 29.993 ( 8.262 24.366 -4.465) 26.113 ======================= Grid point 109 (47/140) ======================= q-point: (-0.33 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.605 ( -8.263 7.527 8.360) 13.958 1.997 ( 2.697 4.709 1.694) 5.685 2.126 ( -0.895 -7.075 4.987) 8.702 2.365 ( -4.255 -3.075 -5.479) 7.588 2.530 ( 5.876 1.025 0.493) 5.985 2.637 ( -0.924 1.824 -13.371) 13.526 2.769 ( -1.210 -2.174 -3.434) 4.241 2.833 ( -1.284 -1.025 -0.162) 1.651 2.907 ( 5.957 -7.551 -0.225) 9.621 3.049 ( -0.930 -0.001 -0.910) 1.301 3.091 ( 0.269 1.055 4.588) 4.715 3.283 ( -0.641 -7.846 0.660) 7.900 3.370 ( -1.144 -4.738 5.134) 7.080 3.454 ( -3.467 -1.722 3.475) 5.202 3.687 ( 5.336 -6.709 0.429) 8.583 3.764 ( -1.863 1.499 2.037) 3.141 3.971 ( -4.829 0.061 4.365) 6.510 4.348 ( -6.768 1.905 -5.838) 9.138 4.433 ( -0.242 6.609 2.114) 6.943 4.535 ( 4.519 2.150 -3.731) 6.241 4.616 ( 4.726 2.833 1.815) 5.802 4.728 ( 1.221 2.097 -2.827) 3.725 4.818 ( 1.391 0.334 -6.002) 6.170 5.145 ( 4.158 1.246 1.730) 4.673 5.343 ( -2.972 -4.844 -5.249) 7.736 5.451 ( 1.733 -4.392 -5.031) 6.900 5.711 ( -0.662 -1.428 2.050) 2.585 5.811 ( -0.944 -0.313 4.472) 4.581 5.881 ( 1.942 0.877 7.119) 7.431 6.059 ( -0.328 0.920 -2.167) 2.376 6.173 ( -2.927 1.438 -1.307) 3.513 6.359 ( 5.611 0.510 0.924) 5.709 6.554 ( -0.626 -1.498 0.260) 1.644 6.636 ( -3.529 2.295 1.456) 4.455 6.781 ( -0.821 -1.163 3.347) 3.637 6.829 ( -0.016 -2.241 -3.615) 4.254 7.126 ( 0.902 -5.451 6.355) 8.421 7.233 ( -2.537 -1.864 -1.315) 3.412 7.489 ( -2.167 4.671 -3.385) 6.162 7.640 ( 1.157 -1.830 -2.352) 3.197 8.529 ( -2.551 -1.169 5.061) 5.787 8.939 ( 0.929 -6.447 2.029) 6.822 8.984 ( -0.153 -5.621 4.738) 7.353 9.055 ( 2.129 -4.661 -3.057) 5.966 9.187 ( 1.196 0.165 -1.943) 2.287 9.375 ( -1.857 3.233 2.964) 4.763 9.521 ( -0.380 -7.787 3.448) 8.525 9.869 ( -0.830 4.056 -5.644) 6.999 10.008 ( -1.774 -0.205 4.066) 4.441 10.632 ( 0.252 4.406 0.824) 4.489 10.870 ( 1.081 1.553 -5.786) 6.087 11.013 ( -3.343 6.350 1.701) 7.375 11.289 ( 5.450 -1.096 -4.657) 7.252 11.401 ( 2.518 2.242 3.018) 4.525 11.483 ( -0.680 -4.295 5.167) 6.753 11.513 ( -2.024 2.909 1.471) 3.837 11.834 ( 1.642 4.501 -5.993) 7.672 11.988 ( 1.859 2.430 -0.568) 3.111 12.115 ( -5.500 0.298 -3.607) 6.584 12.238 ( 1.585 -3.048 -2.321) 4.146 12.303 ( -0.994 3.965 -1.915) 4.514 12.451 ( 8.301 0.811 -6.921) 10.838 12.688 ( -1.560 -7.062 0.669) 7.264 12.898 ( -4.626 -4.692 7.639) 10.089 14.578 ( -1.447 1.132 0.559) 1.920 14.700 ( -0.393 -3.558 -0.581) 3.626 14.932 ( -1.174 -1.457 1.877) 2.650 14.962 ( 4.239 1.967 -4.605) 6.561 15.201 ( -3.944 -1.240 4.248) 5.927 15.382 ( 1.753 3.224 -1.318) 3.899 15.506 ( 0.342 1.692 -1.930) 2.589 15.565 ( 4.480 2.020 -0.736) 4.969 15.666 ( -1.329 -0.711 -0.943) 1.778 15.771 ( -2.663 -0.167 1.523) 3.073 16.066 ( -3.837 -1.030 7.688) 8.654 16.562 ( 1.317 -0.617 -1.286) 1.941 16.994 ( 0.996 8.409 1.677) 8.632 17.115 ( -0.664 5.394 0.132) 5.436 17.352 ( 1.434 -5.345 -0.666) 5.574 17.722 ( 0.531 -0.745 -2.326) 2.499 25.648 ( -1.422 1.349 0.708) 2.084 25.713 ( 0.380 1.046 0.061) 1.114 25.757 ( -0.068 -1.333 0.041) 1.335 25.767 ( -1.216 1.667 -0.730) 2.189 25.813 ( 0.138 -1.162 1.291) 1.742 26.256 ( 1.908 -0.503 -4.682) 5.081 26.428 ( 0.082 -2.307 3.968) 4.591 26.463 ( 0.025 0.146 2.836) 2.840 26.852 ( -0.938 0.268 -11.013) 11.056 27.152 ( -3.016 1.152 6.408) 7.175 27.895 ( 2.279 -4.786 0.631) 5.338 28.140 ( 0.892 -6.040 5.987) 8.551 28.524 ( 1.944 -2.978 -3.103) 4.719 28.763 ( -2.089 -10.876 -1.041) 11.123 29.213 ( -1.449 2.704 1.577) 3.450 29.627 ( 2.764 21.597 -3.349) 22.029 ======================= Grid point 110 (48/140) ======================= q-point: (-0.22 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.430 ( -7.164 11.568 10.866) 17.413 1.901 ( 2.332 12.057 9.130) 15.303 2.119 ( -4.469 7.181 -0.112) 8.459 2.355 ( -1.731 -0.834 -1.521) 2.450 2.507 ( 5.222 5.656 -1.580) 7.859 2.525 ( 2.358 5.833 -4.324) 7.635 2.743 ( 2.403 3.960 -4.542) 6.488 2.846 ( -3.095 -2.427 -2.282) 4.547 3.002 ( 3.449 3.659 -0.409) 5.045 3.095 ( 3.944 -6.232 1.642) 7.555 3.119 ( 0.757 -3.180 0.855) 3.379 3.368 ( 0.706 7.250 6.542) 9.791 3.447 ( 0.113 -9.779 1.462) 9.888 3.491 ( -4.527 -1.741 3.477) 5.968 3.703 ( -0.498 4.785 -1.577) 5.063 3.807 ( -1.214 -5.509 -5.114) 7.614 4.016 ( -4.364 -7.051 8.268) 11.710 4.211 ( -3.029 5.447 -5.266) 8.159 4.270 ( -4.646 8.067 0.579) 9.327 4.527 ( 2.795 0.932 -1.755) 3.429 4.620 ( 4.833 3.917 5.323) 8.187 4.734 ( 3.216 0.867 -6.735) 7.514 4.750 ( 2.309 2.171 -2.557) 4.072 5.157 ( -0.709 0.050 3.203) 3.281 5.374 ( 1.259 -3.319 -7.128) 7.963 5.522 ( 3.725 -3.207 -4.989) 7.004 5.712 ( 0.436 0.791 0.089) 0.907 5.808 ( -2.793 3.154 2.988) 5.165 5.873 ( -2.183 2.200 6.002) 6.755 6.048 ( -0.607 -0.046 -1.329) 1.462 6.136 ( -0.601 -0.738 -2.506) 2.681 6.391 ( 0.607 -0.493 0.996) 1.267 6.541 ( 2.504 2.309 2.027) 3.964 6.626 ( 1.569 -0.077 -1.764) 2.362 6.771 ( -5.324 0.836 3.638) 6.502 6.926 ( 1.360 -8.286 -2.927) 8.893 7.204 ( -0.700 -0.779 -4.819) 4.931 7.291 ( -2.952 -6.583 5.410) 9.018 7.407 ( -0.096 -0.285 -1.856) 1.881 7.636 ( -2.342 -0.744 -4.836) 5.425 8.593 ( 1.119 -3.371 6.544) 7.445 9.023 ( -2.592 -2.127 -0.784) 3.443 9.043 ( 3.816 1.290 1.999) 4.497 9.120 ( 0.776 -1.093 -3.116) 3.392 9.176 ( 3.677 2.469 1.131) 4.571 9.360 ( -3.763 -2.295 8.774) 9.819 9.591 ( -1.051 3.012 -1.378) 3.475 9.738 ( -1.499 4.699 -1.920) 5.293 10.041 ( -2.975 -2.733 2.933) 4.992 10.576 ( -0.574 3.570 6.900) 7.790 10.820 ( 1.347 3.349 -2.751) 4.539 10.895 ( 0.823 4.681 -1.004) 4.858 11.295 ( 6.924 2.651 -4.595) 8.723 11.413 ( -1.702 1.176 1.439) 2.520 11.517 ( 1.449 -2.499 2.427) 3.773 11.532 ( -2.037 -1.486 -2.083) 3.271 11.759 ( 2.204 3.337 5.376) 6.700 11.902 ( 0.023 5.900 -3.126) 6.677 11.999 ( -6.750 4.119 -2.104) 8.182 12.209 ( 0.599 -0.068 -6.391) 6.420 12.305 ( -1.549 -1.690 -4.805) 5.324 12.507 ( 6.864 -6.708 -12.274) 15.581 12.860 ( -2.742 -9.420 8.462) 12.956 13.083 ( 4.225 -12.244 8.315) 15.392 14.546 ( -1.468 1.772 2.105) 3.119 14.717 ( -0.428 0.908 -0.671) 1.208 14.957 ( 4.222 -1.984 -0.466) 4.688 14.986 ( -3.693 -2.441 -0.505) 4.455 15.163 ( -3.699 0.698 -1.556) 4.074 15.316 ( -0.124 4.552 0.348) 4.567 15.485 ( -0.193 2.002 -0.018) 2.011 15.553 ( 5.431 1.492 -5.461) 7.845 15.732 ( 0.014 -4.653 1.836) 5.002 15.798 ( -0.571 -5.264 3.503) 6.349 16.097 ( -5.501 -2.330 7.959) 9.952 16.559 ( 2.840 1.750 -2.831) 4.375 16.845 ( -5.605 6.992 0.419) 8.971 17.030 ( -0.316 4.488 0.814) 4.573 17.458 ( 4.129 -4.594 -1.863) 6.452 17.727 ( 1.096 -0.820 -3.504) 3.762 25.624 ( -1.383 0.899 2.489) 2.986 25.672 ( 0.165 3.238 0.360) 3.262 25.726 ( -0.257 1.473 -0.593) 1.609 25.792 ( 0.186 -1.054 1.531) 1.868 25.846 ( -0.464 -2.169 0.048) 2.219 26.246 ( 1.919 0.558 -4.779) 5.180 26.450 ( -1.499 -1.155 -2.078) 2.810 26.525 ( 1.910 -1.874 10.161) 10.507 26.761 ( -1.852 2.476 -10.604) 11.046 27.166 ( -5.233 -3.435 1.487) 6.434 27.986 ( 0.527 -3.408 2.038) 4.006 28.271 ( 3.085 -3.363 7.104) 8.443 28.612 ( 10.287 -4.067 0.906) 11.099 28.899 ( -1.058 -7.207 -3.394) 8.036 29.092 ( -1.960 9.877 -1.228) 10.144 29.318 ( -3.954 12.401 -3.093) 13.379 ======================= Grid point 111 (49/140) ======================= q-point: (-0.11 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.228 ( -2.486 14.649 13.094) 19.805 1.706 ( -0.194 17.762 10.215) 20.491 1.967 ( 5.532 12.105 9.370) 16.277 2.195 ( -6.243 12.451 -0.829) 13.953 2.398 ( 3.727 11.464 1.493) 12.147 2.513 ( 1.582 1.022 -1.978) 2.731 2.651 ( 7.047 6.947 -3.829) 10.611 2.826 ( -0.865 2.464 -1.570) 3.047 3.000 ( 2.751 0.638 0.937) 2.976 3.105 ( -0.236 6.404 2.856) 7.016 3.187 ( 2.416 1.787 -2.045) 3.635 3.239 ( -2.647 8.695 3.821) 9.860 3.425 ( -3.040 5.160 2.550) 6.509 3.527 ( -4.184 -0.337 -4.663) 6.274 3.704 ( 3.326 -5.221 2.346) 6.620 3.853 ( -6.068 -7.874 -6.591) 11.927 4.028 ( -0.212 5.610 0.730) 5.661 4.109 ( -6.809 2.602 -6.223) 9.584 4.229 ( 0.359 -5.531 8.215) 9.910 4.547 ( 1.803 0.278 3.075) 3.575 4.593 ( 0.630 2.790 -1.608) 3.281 4.699 ( 6.188 0.666 -2.320) 6.642 4.785 ( 5.242 0.714 1.989) 5.652 5.156 ( -4.289 -0.722 1.822) 4.716 5.393 ( 1.665 -1.550 -10.473) 10.717 5.543 ( 4.090 1.087 -2.861) 5.108 5.671 ( -3.345 5.890 -3.602) 7.672 5.748 ( 2.802 -0.812 1.886) 3.474 5.877 ( -2.029 -2.075 3.536) 4.575 6.026 ( -1.521 0.611 -2.209) 2.750 6.169 ( 1.284 -3.357 -0.492) 3.628 6.386 ( -1.447 0.198 -0.642) 1.596 6.561 ( 8.971 3.286 3.784) 10.276 6.626 ( 1.493 0.039 -1.170) 1.897 6.716 ( -8.584 0.555 2.316) 8.908 7.048 ( 1.326 -6.919 -4.503) 8.361 7.177 ( -2.431 -1.175 -4.804) 5.511 7.313 ( -3.990 -1.896 -4.002) 5.961 7.514 ( -5.905 -8.009 2.483) 10.255 7.624 ( 0.598 -2.459 0.387) 2.560 8.679 ( 2.834 0.023 4.479) 5.300 8.929 ( -4.704 6.176 -4.116) 8.787 9.018 ( 3.254 7.346 2.091) 8.302 9.070 ( -1.351 2.971 -0.503) 3.302 9.221 ( 2.656 -0.239 -1.723) 3.175 9.359 ( -4.493 2.851 0.084) 5.322 9.518 ( -3.056 -1.129 7.511) 8.187 9.658 ( -1.248 5.764 3.470) 6.843 10.064 ( -3.952 -1.727 1.967) 4.740 10.587 ( 1.282 0.799 8.971) 9.098 10.750 ( 0.290 3.664 1.076) 3.829 10.889 ( 7.795 0.533 -3.579) 8.594 11.246 ( 1.022 4.641 -3.791) 6.080 11.416 ( 3.293 3.259 -3.348) 5.715 11.432 ( 3.137 1.650 2.399) 4.281 11.689 ( 2.349 -10.840 -0.042) 11.092 11.744 ( -2.476 3.458 3.096) 5.261 11.811 ( 0.310 2.822 -2.599) 3.849 11.948 ( -1.229 -1.515 6.431) 6.720 12.185 ( -1.796 -2.052 -10.480) 10.829 12.281 ( -0.097 0.340 -5.496) 5.507 12.623 ( 4.325 -7.783 -9.998) 13.388 13.006 ( -5.000 -6.150 9.532) 12.397 13.385 ( -0.986 -15.218 7.327) 16.919 14.534 ( -2.796 -0.821 4.748) 5.571 14.686 ( -0.779 1.302 1.094) 1.871 14.934 ( -4.437 3.386 0.124) 5.583 15.020 ( 2.437 -0.870 -2.364) 3.505 15.176 ( -0.754 -5.708 -2.868) 6.432 15.257 ( 1.610 2.636 -1.154) 3.297 15.427 ( -1.197 3.654 1.487) 4.123 15.551 ( 5.848 0.570 -7.222) 9.310 15.768 ( -6.855 -2.776 3.232) 8.071 15.995 ( 9.054 -9.509 2.262) 13.323 16.137 ( -8.108 -4.531 8.516) 12.601 16.518 ( 4.498 4.358 -4.315) 7.606 16.693 ( -8.195 5.110 0.979) 9.707 16.973 ( 1.610 3.716 2.156) 4.589 17.533 ( 4.937 -1.984 -4.685) 7.089 17.731 ( 1.653 -0.830 -5.548) 5.848 25.608 ( -0.275 2.307 1.529) 2.782 25.640 ( -0.079 1.119 3.478) 3.655 25.709 ( -0.025 0.354 0.828) 0.901 25.807 ( -0.537 0.205 2.265) 2.337 25.872 ( -0.552 -1.530 -0.635) 1.746 26.226 ( 2.435 1.142 -4.032) 4.847 26.434 ( -1.706 0.315 -2.587) 3.115 26.609 ( -0.796 0.496 -0.719) 1.182 26.673 ( 0.275 -0.448 3.045) 3.090 27.183 ( -7.350 -4.156 -1.653) 8.604 28.017 ( -5.275 -1.407 1.230) 5.596 28.342 ( 1.334 -0.040 3.768) 3.997 28.738 ( 1.614 6.872 1.037) 7.134 28.870 ( -2.808 9.641 -0.730) 10.068 29.005 ( 6.341 -4.231 -1.544) 7.777 29.192 ( 8.940 -5.410 -4.036) 11.202 ======================= Grid point 115 (50/140) ======================= q-point: ( 0.33 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.276 ( 1.763 0.000 -13.022) 13.141 1.434 ( -1.692 -0.000 -3.367) 3.768 1.792 ( 4.296 0.000 7.688) 8.807 1.856 ( 5.483 0.000 4.514) 7.101 1.907 ( 5.386 0.000 15.664) 16.564 2.243 ( -4.762 -0.000 -7.319) 8.732 2.401 ( 6.765 0.000 -2.034) 7.064 2.567 ( -5.678 -0.000 -4.209) 7.068 2.762 ( 2.117 0.000 7.051) 7.362 2.854 ( -9.226 -0.000 2.177) 9.480 3.057 ( 11.949 0.000 3.269) 12.388 3.204 ( -6.943 -0.000 -6.542) 9.539 3.270 ( 0.070 0.000 -5.327) 5.328 3.610 ( 12.467 0.000 21.840) 25.148 3.753 ( -4.755 -0.000 -6.957) 8.427 3.778 ( -1.029 -0.000 -7.637) 7.706 3.987 ( -4.013 -0.000 1.137) 4.171 4.033 ( -6.705 -0.000 1.283) 6.827 4.130 ( 7.293 0.000 1.766) 7.504 4.390 ( -5.885 -0.000 -3.355) 6.774 4.734 ( -1.475 -0.000 -0.538) 1.570 4.786 ( 4.810 0.000 -8.731) 9.969 4.867 ( -3.015 -0.000 5.921) 6.644 5.153 ( 4.722 0.000 2.982) 5.584 5.347 ( -0.543 -0.000 -9.635) 9.650 5.354 ( 2.042 0.000 -2.578) 3.289 5.504 ( 0.896 0.000 4.703) 4.788 5.832 ( 7.861 0.000 -1.246) 7.959 6.072 ( -7.271 -0.000 -3.551) 8.092 6.124 ( -0.703 -0.000 0.739) 1.020 6.395 ( 9.911 0.000 5.060) 11.128 6.483 ( -0.475 -0.000 4.081) 4.109 6.556 ( -2.558 -0.000 -1.818) 3.138 6.794 ( 0.776 0.000 -3.261) 3.352 6.819 ( 3.538 0.000 3.348) 4.871 7.039 ( -4.532 -0.000 0.660) 4.580 7.082 ( 1.718 0.000 5.721) 5.974 7.261 ( -19.118 -0.000 -2.676) 19.304 7.349 ( -3.189 -0.000 -1.703) 3.615 7.721 ( 3.204 0.000 -1.777) 3.663 8.354 ( -3.704 -0.000 -6.275) 7.287 8.533 ( -5.227 -0.000 3.197) 6.128 8.559 ( -0.672 -0.000 3.663) 3.724 8.767 ( -3.183 -0.000 7.695) 8.328 8.954 ( -4.121 -0.000 0.848) 4.207 9.284 ( 4.391 0.000 -0.423) 4.411 9.581 ( 1.235 0.000 -7.780) 7.877 9.831 ( 0.861 0.000 -0.613) 1.057 10.177 ( -3.557 -0.000 3.283) 4.841 10.717 ( -0.582 -0.000 -3.150) 3.204 10.759 ( 2.616 0.000 4.384) 5.106 10.851 ( 6.241 0.000 -5.003) 7.998 11.023 ( 1.815 0.000 -2.947) 3.461 11.414 ( -5.163 -0.000 -0.326) 5.173 11.547 ( 2.950 0.000 8.493) 8.991 11.586 ( 4.301 0.000 -4.915) 6.532 11.915 ( -4.940 -0.000 -4.959) 7.000 11.942 ( -3.026 -0.000 1.750) 3.496 12.031 ( 5.687 0.000 2.589) 6.248 12.163 ( -5.358 -0.000 2.791) 6.041 12.351 ( 1.071 0.000 6.481) 6.569 12.572 ( -9.469 -0.000 1.437) 9.578 12.783 ( -3.242 -0.000 -9.005) 9.571 13.361 ( -2.590 -0.000 3.163) 4.088 14.687 ( -0.588 -0.000 -0.247) 0.638 14.731 ( -1.395 -0.000 2.585) 2.937 14.793 ( -8.851 -0.000 1.137) 8.924 15.009 ( 2.948 0.000 0.535) 2.996 15.396 ( 3.623 0.000 -0.386) 3.644 15.523 ( 6.233 0.000 -6.124) 8.738 15.527 ( -4.299 -0.000 -1.074) 4.431 15.615 ( 4.930 0.000 -3.135) 5.843 15.799 ( 7.864 0.000 -1.742) 8.054 15.902 ( -5.435 -0.000 2.199) 5.863 16.213 ( -0.941 -0.000 -0.094) 0.945 16.226 ( -3.670 -0.000 5.909) 6.956 17.057 ( 6.549 0.000 3.590) 7.469 17.443 ( 10.369 0.000 -7.462) 12.775 17.450 ( -2.972 -0.000 3.109) 4.301 17.666 ( 0.663 0.000 -0.682) 0.951 25.598 ( 1.105 0.000 0.401) 1.175 25.640 ( 1.749 0.000 -1.621) 2.385 25.683 ( -1.974 -0.000 1.749) 2.637 25.762 ( -1.705 -0.000 1.858) 2.521 25.974 ( -1.439 -0.000 0.167) 1.449 26.201 ( -0.576 -0.000 -2.226) 2.299 26.399 ( -0.408 -0.000 0.500) 0.645 26.414 ( 2.841 0.000 2.811) 3.997 26.896 ( -3.667 -0.000 -1.631) 4.014 27.423 ( 6.925 0.000 8.789) 11.190 27.432 ( -5.388 -0.000 9.153) 10.621 27.915 ( -13.990 -0.000 -11.737) 18.261 28.194 ( -1.770 -0.000 0.570) 1.859 28.365 ( 0.726 0.000 -1.412) 1.588 29.146 ( 6.036 0.000 3.125) 6.797 30.762 ( 12.806 0.000 -11.625) 17.295 ======================= Grid point 116 (51/140) ======================= q-point: ( 0.44 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.253 ( -0.010 -8.336 -8.710) 12.056 1.633 ( 0.328 -15.699 3.604) 16.111 1.819 ( -2.257 -10.047 -0.690) 10.320 2.034 ( 8.587 -5.487 -1.647) 10.323 2.120 ( 3.034 -9.951 1.616) 10.528 2.246 ( -1.797 -7.004 -0.733) 7.268 2.463 ( 4.131 -3.701 -0.825) 5.607 2.569 ( -3.207 -6.689 -1.119) 7.502 2.750 ( -8.628 0.182 0.087) 8.630 2.895 ( -0.411 -5.952 10.026) 11.667 3.112 ( 3.761 3.386 0.873) 5.135 3.137 ( -0.283 0.842 -1.302) 1.576 3.244 ( -0.578 -0.140 -8.051) 8.073 3.553 ( -3.176 7.284 -4.363) 9.065 3.752 ( 0.377 1.229 14.383) 14.441 3.841 ( 1.330 5.404 0.790) 5.621 3.987 ( -4.274 -0.362 -0.450) 4.313 4.010 ( -0.297 -11.304 -2.238) 11.527 4.213 ( 5.306 -4.845 2.728) 7.686 4.429 ( 0.662 -7.288 -5.121) 8.932 4.700 ( 0.526 1.932 -2.081) 2.888 4.782 ( 5.203 0.718 -6.372) 8.258 4.881 ( -5.516 -2.523 3.171) 6.844 5.155 ( 0.245 1.539 -5.194) 5.423 5.303 ( -0.630 -0.064 -7.298) 7.325 5.407 ( 3.819 -2.272 6.937) 8.238 5.499 ( -0.261 3.407 3.413) 4.830 5.876 ( 5.284 1.484 1.898) 5.808 5.969 ( -2.647 4.460 -0.112) 5.187 6.137 ( -0.932 -2.002 -2.254) 3.155 6.359 ( 2.949 8.107 1.264) 8.719 6.481 ( 3.868 4.746 2.937) 6.790 6.593 ( 0.159 -1.443 1.021) 1.774 6.775 ( 0.239 0.997 -4.293) 4.414 6.861 ( 0.669 0.227 4.626) 4.680 6.974 ( -4.622 6.943 -0.539) 8.358 6.985 ( -5.600 2.375 1.912) 6.376 7.161 ( -5.142 -2.049 4.043) 6.855 7.444 ( -4.934 -9.631 -1.920) 10.990 7.679 ( 4.081 5.506 -2.285) 7.225 8.389 ( -1.578 -8.310 -4.315) 9.496 8.558 ( -2.898 -3.471 5.822) 7.372 8.600 ( -2.316 -3.731 5.477) 7.020 8.777 ( -7.017 -4.086 2.912) 8.626 8.993 ( 0.506 -4.073 3.568) 5.438 9.234 ( 1.631 4.995 -1.246) 5.400 9.665 ( 3.983 -8.353 -6.130) 11.100 9.785 ( 0.799 5.602 -0.616) 5.692 10.139 ( -3.923 1.208 -1.216) 4.281 10.707 ( -1.186 -2.155 -7.098) 7.512 10.821 ( 1.443 -4.671 -8.887) 10.143 10.935 ( 3.909 -6.444 -2.438) 7.922 11.055 ( 5.301 -0.944 11.564) 12.756 11.404 ( -3.322 -1.941 -0.045) 3.847 11.563 ( 3.856 3.024 -3.161) 5.832 11.611 ( 0.933 -1.281 2.499) 2.959 11.819 ( -3.975 4.324 -2.590) 6.419 11.943 ( -0.120 -0.553 2.981) 3.035 12.096 ( 4.691 -2.038 -1.849) 5.439 12.145 ( -5.057 -1.257 3.160) 6.094 12.362 ( -5.605 -1.176 1.753) 5.990 12.545 ( -5.684 -2.616 0.151) 6.259 12.691 ( 1.398 5.482 -5.115) 7.627 13.296 ( -3.220 6.977 1.230) 7.782 14.650 ( 0.207 2.539 1.898) 3.177 14.682 ( -4.617 4.459 -0.102) 6.420 14.800 ( -1.639 -4.828 2.905) 5.868 15.071 ( 2.935 -2.711 -0.827) 4.080 15.285 ( -0.476 10.372 -0.431) 10.392 15.500 ( 1.897 0.566 -4.197) 4.641 15.537 ( -0.736 -0.836 -2.599) 2.828 15.633 ( 4.776 1.827 -0.134) 5.116 15.819 ( 7.456 2.787 -3.537) 8.710 15.896 ( -5.231 -0.305 3.546) 6.327 16.131 ( -2.195 4.100 3.559) 5.857 16.335 ( -1.863 -7.429 2.996) 8.224 17.126 ( 9.140 0.435 3.350) 9.744 17.387 ( -0.574 4.783 3.921) 6.211 17.451 ( 1.821 4.023 -4.855) 6.563 17.677 ( -0.116 -1.203 -0.719) 1.407 25.617 ( 1.242 -1.101 0.217) 1.674 25.653 ( 1.134 -0.887 -1.695) 2.224 25.691 ( -1.689 -1.579 1.297) 2.651 25.761 ( -1.886 -0.379 1.947) 2.738 25.944 ( -1.346 1.748 -1.752) 2.817 26.195 ( 0.019 -0.750 -2.124) 2.252 26.385 ( -0.447 1.048 1.261) 1.699 26.456 ( 1.666 -1.265 1.647) 2.662 26.849 ( -2.166 1.158 -3.349) 4.153 27.443 ( -1.662 1.610 11.049) 11.289 27.555 ( -1.621 -6.516 -0.552) 6.737 27.774 ( -4.850 -1.178 -4.061) 6.435 28.237 ( -1.518 -5.669 0.532) 5.893 28.392 ( 0.188 -3.284 -1.954) 3.826 29.207 ( 3.776 0.190 6.126) 7.199 30.683 ( 10.156 13.145 -9.757) 19.265 ======================= Grid point 117 (52/140) ======================= q-point: (-0.44 -0.67 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.477 ( -1.772 -17.492 1.454) 17.642 1.788 ( -5.245 -7.419 1.713) 9.246 2.042 ( 4.562 -4.658 -1.318) 6.652 2.171 ( 0.785 -8.350 -7.752) 11.420 2.233 ( 4.721 -10.663 -3.796) 12.264 2.402 ( -4.918 -12.274 -4.253) 13.889 2.589 ( 1.432 -7.919 1.844) 8.256 2.690 ( -4.999 -4.667 -1.050) 6.919 2.764 ( -1.422 -12.006 2.575) 12.361 3.029 ( 0.456 0.692 2.600) 2.729 3.088 ( 2.638 -0.194 7.312) 7.776 3.137 ( -0.139 -3.052 2.768) 4.122 3.172 ( -0.850 1.416 -11.995) 12.109 3.459 ( -0.956 1.259 -0.890) 1.815 3.684 ( -1.655 8.613 9.761) 13.122 3.814 ( -1.602 0.345 6.139) 6.353 3.962 ( -2.051 -0.713 -1.488) 2.632 4.229 ( 1.063 -10.936 -1.504) 11.090 4.333 ( -0.450 -6.552 -0.324) 6.575 4.546 ( 6.993 -4.870 -8.707) 12.183 4.685 ( 1.928 -0.121 -1.796) 2.638 4.786 ( 3.601 0.079 -3.415) 4.963 4.863 ( -4.020 1.824 -1.672) 4.721 5.097 ( 0.577 0.250 -4.339) 4.385 5.285 ( -3.351 -3.773 -3.763) 6.295 5.402 ( -2.098 6.953 1.482) 7.412 5.545 ( 2.826 -4.706 6.315) 8.367 5.866 ( 0.333 3.131 3.408) 4.640 5.939 ( 6.079 2.489 7.170) 9.724 6.125 ( -2.181 0.729 -6.104) 6.523 6.280 ( 3.415 5.379 2.767) 6.947 6.414 ( 3.435 4.833 -0.874) 5.994 6.567 ( -3.739 2.294 1.979) 4.812 6.715 ( -1.707 1.731 -4.076) 4.746 6.822 ( -0.947 4.449 4.163) 6.166 6.894 ( -3.532 3.526 1.214) 5.136 7.008 ( 1.025 -4.303 6.308) 7.705 7.161 ( -3.176 -0.801 0.365) 3.295 7.529 ( -2.063 -4.427 -2.816) 5.638 7.622 ( 1.625 2.401 -2.240) 3.664 8.484 ( -2.032 -4.097 0.652) 4.620 8.670 ( 0.573 -8.318 5.353) 9.909 8.707 ( -1.363 -7.361 6.530) 9.934 8.841 ( -4.435 -7.696 0.420) 8.892 9.116 ( 1.214 -6.997 3.695) 8.006 9.193 ( -0.410 -0.718 -0.871) 1.200 9.662 ( -0.192 8.431 -0.174) 8.435 9.790 ( 3.295 -5.748 -4.614) 8.074 10.076 ( -3.313 1.529 -3.322) 4.934 10.691 ( -0.261 -1.118 -9.343) 9.414 10.841 ( 1.890 -2.386 -7.660) 8.243 11.042 ( 2.008 -3.691 2.120) 4.707 11.257 ( 4.690 -7.674 9.426) 13.028 11.387 ( -2.654 1.508 0.173) 3.057 11.524 ( 2.645 2.680 -0.833) 3.856 11.656 ( 1.381 -3.979 -3.635) 5.564 11.706 ( -1.885 4.201 -1.662) 4.895 11.982 ( 2.229 -1.105 1.915) 3.140 12.114 ( -4.237 -0.286 -1.233) 4.422 12.170 ( 1.953 -1.838 -0.078) 2.683 12.333 ( -7.033 -3.233 -6.025) 9.809 12.569 ( -5.529 -5.473 -1.540) 7.931 12.596 ( 7.846 8.748 4.165) 12.467 13.090 ( -4.749 13.421 -0.448) 14.244 14.593 ( -2.863 1.954 -0.455) 3.496 14.638 ( 0.819 0.687 2.109) 2.365 14.895 ( -0.594 -5.640 2.841) 6.343 15.048 ( 2.905 8.350 -1.930) 9.049 15.178 ( -1.334 -0.405 -0.569) 1.506 15.468 ( 1.972 2.810 -4.267) 5.477 15.529 ( -1.015 -0.761 -1.398) 1.888 15.641 ( 4.479 2.374 3.011) 5.896 15.766 ( -1.738 4.748 -3.048) 5.904 15.858 ( 0.691 3.070 0.796) 3.246 16.086 ( -2.381 2.136 6.136) 6.920 16.450 ( -1.261 -6.054 1.793) 6.439 17.224 ( 10.376 -0.750 4.321) 11.264 17.287 ( -7.697 5.317 -0.955) 9.403 17.342 ( 3.516 8.803 1.466) 9.592 17.690 ( -0.243 -1.144 -1.622) 2.000 25.655 ( 1.008 -2.006 0.085) 2.247 25.665 ( 0.184 -0.811 -0.930) 1.247 25.712 ( -1.335 -1.756 0.093) 2.208 25.763 ( -1.805 -0.522 1.776) 2.585 25.885 ( -0.888 2.681 -2.368) 3.686 26.208 ( 1.218 -1.633 -2.551) 3.265 26.384 ( -0.220 -0.137 2.406) 2.420 26.482 ( -0.164 -0.148 1.320) 1.338 26.805 ( -1.380 -0.536 -6.238) 6.411 27.343 ( -5.940 7.133 -0.379) 9.290 27.673 ( 0.917 -8.069 2.656) 8.544 27.880 ( 2.251 -8.048 6.675) 10.695 28.349 ( -0.466 -7.889 0.112) 7.904 28.452 ( 0.006 -5.385 -2.418) 5.903 29.248 ( 0.535 0.746 6.590) 6.654 30.409 ( 6.645 21.631 -8.058) 24.020 ======================= Grid point 118 (53/140) ======================= q-point: (-0.33 -0.67 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.635 ( -7.997 -2.442 5.317) 9.909 1.949 ( -1.619 -13.739 0.278) 13.837 2.025 ( -0.916 0.919 -2.068) 2.441 2.283 ( 1.717 -4.765 -0.320) 5.075 2.451 ( 1.386 -11.632 -11.701) 16.557 2.533 ( -0.036 -7.527 1.751) 7.729 2.673 ( -2.742 -3.634 -5.650) 7.256 2.767 ( 0.103 -9.042 -0.440) 9.054 2.908 ( 4.299 3.569 -5.563) 7.885 3.000 ( -0.358 -4.379 5.079) 6.716 3.127 ( 0.847 -3.847 -2.939) 4.915 3.207 ( 2.593 -1.852 6.177) 6.950 3.256 ( -0.162 -7.066 5.210) 8.781 3.438 ( -1.423 -0.276 0.898) 1.706 3.643 ( -0.687 0.483 7.330) 7.378 3.822 ( -0.529 0.895 5.921) 6.011 3.950 ( -2.030 -0.211 -1.443) 2.499 4.274 ( -4.568 -1.153 -4.664) 6.630 4.512 ( 4.648 -9.087 0.657) 10.227 4.546 ( 0.695 4.731 -8.443) 9.703 4.640 ( -0.091 2.417 -5.948) 6.421 4.755 ( -1.548 2.687 -3.287) 4.519 4.820 ( 0.894 0.129 0.567) 1.067 5.165 ( 2.720 -7.951 -8.512) 11.961 5.266 ( 0.660 7.297 3.245) 8.013 5.350 ( -2.093 -6.190 1.162) 6.637 5.643 ( -0.303 -4.371 -1.910) 4.780 5.870 ( 1.908 1.933 10.481) 10.827 5.989 ( 4.891 2.693 9.030) 10.616 6.052 ( -0.372 1.354 -7.207) 7.343 6.208 ( -2.418 5.097 2.811) 6.303 6.417 ( 6.878 0.574 -2.288) 7.271 6.510 ( -7.395 0.243 2.852) 7.929 6.680 ( 1.445 1.402 2.005) 2.842 6.766 ( 0.010 1.181 -1.863) 2.206 6.833 ( -2.981 2.292 3.635) 5.230 7.112 ( 0.980 -2.481 8.467) 8.877 7.163 ( -0.915 -2.246 -3.355) 4.140 7.508 ( -2.535 2.174 -5.189) 6.171 7.602 ( -0.827 -0.756 -3.542) 3.715 8.524 ( -0.389 -1.410 4.512) 4.743 8.816 ( -2.927 -7.867 2.540) 8.770 8.916 ( 5.041 -9.000 10.168) 14.485 8.949 ( -0.578 -7.574 -1.706) 7.785 9.178 ( 1.329 -0.738 -0.730) 1.687 9.317 ( -0.339 -10.238 2.658) 10.583 9.523 ( -2.179 6.705 2.332) 7.426 9.852 ( 0.065 -2.275 -5.581) 6.028 10.011 ( -2.539 1.537 -1.625) 3.384 10.658 ( 0.901 0.221 -6.705) 6.769 10.867 ( 2.125 -1.506 -4.144) 4.895 11.070 ( -2.344 2.059 0.127) 3.122 11.305 ( 0.943 2.305 0.816) 2.621 11.406 ( -3.799 -2.237 3.407) 5.572 11.524 ( 5.860 1.844 4.543) 7.641 11.600 ( 0.336 6.317 2.382) 6.760 11.784 ( 4.435 -8.016 -8.539) 12.524 12.011 ( 0.839 -1.375 -5.228) 5.470 12.049 ( -6.166 1.559 -2.128) 6.706 12.201 ( 1.404 -0.935 -0.580) 1.784 12.315 ( -3.527 -1.125 -3.637) 5.189 12.567 ( 5.623 2.201 1.527) 6.229 12.609 ( -0.320 0.739 -0.160) 0.821 12.862 ( -2.766 4.893 1.872) 5.924 14.571 ( -1.267 -1.220 -0.759) 1.915 14.651 ( 0.060 -0.696 0.852) 1.102 14.933 ( -1.556 3.218 1.150) 3.755 14.990 ( 4.234 -1.806 -2.843) 5.410 15.180 ( -2.552 -0.276 2.681) 3.712 15.417 ( 0.729 1.626 -3.500) 3.927 15.527 ( 0.882 0.610 -1.546) 1.881 15.608 ( -4.439 4.722 0.588) 6.507 15.685 ( 3.193 1.237 1.166) 3.617 15.816 ( 3.218 4.050 -0.524) 5.199 16.076 ( -3.295 0.741 7.925) 8.614 16.528 ( -0.501 -3.538 0.054) 3.574 17.104 ( -8.754 7.114 -2.188) 11.490 17.228 ( -0.512 7.475 2.471) 7.890 17.343 ( 10.632 -0.766 4.310) 11.498 17.698 ( 0.277 -1.099 -2.549) 2.790 25.657 ( -0.830 0.501 -0.193) 0.989 25.710 ( 0.205 -3.049 0.139) 3.059 25.724 ( -0.419 -0.448 -0.105) 0.623 25.764 ( -1.635 -0.286 0.400) 1.708 25.831 ( 0.033 2.041 -0.666) 2.147 26.235 ( 2.477 -1.380 -3.821) 4.758 26.400 ( -0.639 -1.111 -0.049) 1.282 26.490 ( -0.588 -0.224 5.411) 5.448 26.775 ( -1.966 -1.267 -8.886) 9.189 27.195 ( -4.488 4.704 -0.672) 6.536 27.829 ( 2.091 -6.254 4.792) 8.152 28.076 ( 3.687 -7.783 8.103) 11.825 28.468 ( 3.503 -5.416 -1.374) 6.595 28.569 ( -0.313 -10.001 -1.535) 10.123 29.246 ( -2.617 2.042 4.425) 5.532 30.012 ( 1.652 24.697 -6.973) 25.716 ======================= Grid point 119 (54/140) ======================= q-point: (-0.22 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.579 ( -4.975 5.371 8.189) 10.984 2.011 ( -2.057 -3.279 -1.211) 4.056 2.101 ( -4.199 -1.070 -1.116) 4.475 2.320 ( 0.677 -2.723 0.868) 2.937 2.516 ( -0.687 -1.269 -4.906) 5.114 2.639 ( 3.526 -0.919 2.712) 4.542 2.715 ( 0.556 -4.950 -7.199) 8.754 2.808 ( 1.336 1.861 -1.893) 2.971 2.991 ( 5.497 -8.372 -2.011) 10.216 3.058 ( 2.894 -2.543 0.616) 3.902 3.170 ( 2.808 4.223 4.190) 6.579 3.291 ( 1.373 -7.694 0.290) 7.821 3.389 ( -1.922 -6.087 3.507) 7.283 3.481 ( -1.941 -1.007 9.628) 9.873 3.654 ( -5.991 -1.399 -0.263) 6.158 3.829 ( 4.931 4.492 -1.172) 6.772 3.943 ( -3.221 -3.574 3.975) 6.241 4.200 ( -4.081 2.579 -5.647) 7.429 4.391 ( -1.805 6.499 -1.540) 6.918 4.558 ( 2.343 2.282 -3.160) 4.548 4.660 ( -0.418 -1.796 -11.829) 11.972 4.704 ( -1.763 -1.263 0.727) 2.287 4.827 ( 4.732 1.970 4.521) 6.835 5.152 ( -6.956 -0.437 -0.954) 7.035 5.306 ( 9.532 -1.924 -4.794) 10.841 5.462 ( 2.453 -5.686 1.024) 6.276 5.682 ( -1.453 -2.766 -4.216) 5.248 5.873 ( -2.034 3.308 7.998) 8.891 5.972 ( -0.424 6.024 5.620) 8.249 6.032 ( 2.004 -0.528 -4.732) 5.166 6.139 ( -0.444 2.250 2.851) 3.659 6.401 ( -1.504 2.412 0.392) 2.870 6.518 ( -4.095 -4.988 -0.620) 6.483 6.678 ( 4.258 3.770 4.859) 7.480 6.796 ( -2.849 2.108 4.820) 5.983 6.817 ( 4.063 -5.597 -2.701) 7.425 7.165 ( -0.016 -0.700 -5.426) 5.470 7.209 ( -0.776 -4.550 8.099) 9.322 7.404 ( -2.787 3.422 -6.524) 7.877 7.582 ( -2.570 -0.898 -4.160) 4.971 8.586 ( 2.255 -2.353 5.556) 6.441 8.914 ( -4.194 -5.649 1.905) 7.289 9.046 ( 2.650 -5.060 -4.156) 7.064 9.124 ( 4.549 -3.031 10.033) 11.425 9.198 ( 0.793 -1.514 -1.332) 2.167 9.377 ( -2.557 3.002 3.655) 5.377 9.537 ( -1.997 -6.991 4.009) 8.303 9.790 ( -1.203 4.306 -6.599) 7.971 9.996 ( -2.507 -1.762 1.160) 3.276 10.632 ( -1.081 1.637 0.985) 2.195 10.865 ( 3.253 1.166 -3.323) 4.794 10.981 ( -0.044 4.830 -2.348) 5.371 11.316 ( -1.409 -2.733 0.582) 3.130 11.413 ( 2.155 0.502 0.577) 2.287 11.505 ( -1.873 4.507 1.803) 5.203 11.568 ( 2.818 0.865 2.491) 3.860 11.841 ( 0.492 0.590 0.777) 1.093 11.962 ( -0.686 2.751 -7.314) 7.845 11.970 ( -3.166 2.499 -4.871) 6.324 12.229 ( 0.386 0.660 -1.418) 1.611 12.268 ( 0.339 1.129 -0.664) 1.353 12.460 ( 4.488 3.954 -11.227) 12.721 12.722 ( -0.058 -8.684 6.596) 10.905 12.951 ( 1.361 -9.582 4.836) 10.819 14.583 ( 0.738 0.560 1.079) 1.423 14.675 ( -0.859 -3.037 -1.401) 3.453 14.914 ( -1.950 -2.302 -0.528) 3.063 14.991 ( 3.744 3.351 -2.640) 5.676 15.170 ( -3.453 0.829 3.736) 5.155 15.380 ( -0.683 3.131 -1.135) 3.399 15.495 ( 0.304 1.045 -2.356) 2.596 15.538 ( -2.729 -0.808 -2.318) 3.670 15.742 ( 3.656 -3.252 2.380) 5.442 15.770 ( 3.264 4.200 1.431) 5.509 16.081 ( -4.325 -0.048 8.044) 9.133 16.565 ( 0.505 -1.430 -1.231) 1.954 16.911 ( -8.089 7.130 -1.080) 10.837 17.118 ( -0.826 5.752 1.351) 5.966 17.447 ( 7.454 -1.423 1.494) 7.734 17.706 ( 1.043 -0.879 -3.098) 3.385 25.641 ( -0.987 0.713 1.902) 2.258 25.714 ( -0.283 0.971 -0.029) 1.012 25.742 ( -1.055 1.300 -0.499) 1.747 25.765 ( 0.488 -2.648 0.399) 2.722 25.820 ( -0.277 -0.416 0.567) 0.756 26.244 ( 2.820 -0.037 -5.685) 6.346 26.411 ( -0.708 -1.278 -1.020) 1.782 26.544 ( -0.258 -2.158 7.595) 7.900 26.721 ( -2.346 0.599 -7.665) 8.039 27.118 ( -3.366 0.827 -0.691) 3.534 27.940 ( -0.713 -3.507 4.123) 5.459 28.255 ( 3.075 -5.339 6.821) 9.192 28.608 ( 10.145 -6.508 0.271) 12.056 28.737 ( 1.494 -10.165 -1.657) 10.407 29.175 ( -4.677 4.746 0.650) 6.695 29.576 ( -3.286 22.343 -5.421) 23.225 ======================= Grid point 120 (55/140) ======================= q-point: (-0.11 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.485 ( 1.015 9.002 9.854) 13.386 1.937 ( -4.501 9.777 1.131) 10.822 2.086 ( 0.228 -2.555 -0.958) 2.738 2.338 ( -2.001 6.877 5.906) 9.284 2.499 ( 1.663 -1.014 -1.699) 2.585 2.630 ( 3.924 7.100 4.625) 9.338 2.741 ( 3.614 0.513 -4.227) 5.585 2.802 ( 0.427 -1.601 -2.513) 3.010 3.049 ( 2.946 0.528 -1.037) 3.167 3.151 ( 1.043 -0.330 0.589) 1.243 3.179 ( 4.493 0.054 1.771) 4.830 3.392 ( -3.931 0.057 -1.205) 4.113 3.445 ( -2.108 -0.946 1.217) 2.612 3.476 ( -3.375 2.278 5.138) 6.556 3.625 ( -6.103 -5.530 -2.414) 8.582 3.749 ( 2.226 4.104 -1.127) 4.803 4.029 ( -0.513 -2.333 -0.446) 2.430 4.119 ( -0.081 1.173 -2.321) 2.602 4.296 ( -0.326 5.825 6.868) 9.012 4.549 ( -0.216 0.057 -0.785) 0.816 4.610 ( 3.016 -0.879 -6.228) 6.975 4.694 ( -1.122 -0.556 -2.951) 3.206 4.879 ( 6.333 1.047 4.048) 7.589 5.112 ( -7.830 -0.752 0.360) 7.874 5.350 ( 6.444 0.711 -9.405) 11.423 5.561 ( 4.449 -2.293 1.342) 5.182 5.666 ( -2.195 0.174 -3.960) 4.531 5.850 ( 0.990 2.138 4.005) 4.647 5.868 ( -3.292 4.785 2.150) 6.193 6.016 ( 1.124 1.008 -4.233) 4.494 6.153 ( 1.042 -0.411 4.067) 4.219 6.366 ( -2.064 -0.015 0.006) 2.064 6.552 ( -7.356 -4.352 -1.194) 8.630 6.686 ( 5.179 2.134 3.081) 6.393 6.745 ( -0.469 4.249 2.881) 5.155 6.933 ( 2.829 -5.026 -1.454) 5.948 7.138 ( -0.302 -0.024 -5.287) 5.296 7.265 ( -2.208 1.272 -2.726) 3.732 7.368 ( -3.858 -5.970 2.555) 7.553 7.579 ( -0.787 -2.729 -0.810) 2.954 8.681 ( 2.371 -3.296 4.714) 6.222 8.924 ( -7.376 0.362 -1.639) 7.565 9.110 ( 0.817 1.327 -1.837) 2.409 9.136 ( 4.376 1.766 -0.290) 4.728 9.224 ( -0.730 1.165 1.754) 2.229 9.356 ( -4.025 0.004 5.175) 6.556 9.555 ( -3.180 4.168 1.428) 5.434 9.725 ( 1.490 0.902 0.232) 1.757 10.019 ( -2.432 -2.212 1.995) 3.845 10.608 ( -3.359 -0.204 5.331) 6.304 10.862 ( 3.909 4.587 1.326) 6.171 10.931 ( 6.759 -0.052 -3.857) 7.782 11.301 ( -1.676 4.207 -1.884) 4.905 11.432 ( -1.627 -4.086 0.487) 4.425 11.480 ( 1.851 2.269 -5.249) 6.010 11.582 ( 4.012 -2.570 4.340) 6.445 11.811 ( -1.907 3.317 3.615) 5.263 11.863 ( -0.160 5.759 -2.433) 6.254 11.928 ( 0.625 -2.741 -1.255) 3.079 12.160 ( 1.139 3.738 -4.336) 5.837 12.275 ( 1.638 0.682 -3.294) 3.741 12.467 ( 3.970 -6.028 -11.339) 13.441 12.889 ( -4.209 -8.310 7.431) 11.916 13.168 ( -2.733 -12.656 5.144) 13.932 14.569 ( 1.038 2.608 2.828) 3.985 14.702 ( -0.393 -0.507 -0.735) 0.975 14.928 ( -2.496 1.964 0.093) 3.177 14.988 ( -0.344 -6.592 -1.515) 6.773 15.132 ( 1.362 4.017 0.007) 4.242 15.304 ( -0.529 2.915 -0.875) 3.089 15.469 ( -0.570 1.915 -0.900) 2.191 15.551 ( 1.193 -2.534 -4.107) 4.971 15.724 ( -1.402 1.645 1.475) 2.616 15.897 ( 4.744 -8.492 2.903) 10.151 16.085 ( -5.598 -0.552 7.221) 9.154 16.574 ( 1.906 0.471 -1.624) 2.548 16.737 ( -5.930 6.735 -0.493) 8.987 17.050 ( 0.818 3.139 1.715) 3.669 17.516 ( 4.767 -1.653 -2.894) 5.817 17.712 ( 1.561 -0.469 -3.264) 3.649 25.639 ( -0.638 0.691 3.583) 3.704 25.689 ( 0.826 2.127 1.388) 2.671 25.717 ( -0.542 0.704 -0.253) 0.924 25.805 ( -0.301 -1.349 1.339) 1.924 25.832 ( -0.984 -1.583 -0.396) 1.906 26.237 ( 3.507 0.066 -5.494) 6.518 26.414 ( -0.753 -0.053 -0.916) 1.187 26.572 ( -3.969 -0.144 -5.590) 6.857 26.701 ( 1.399 -0.862 8.610) 8.766 27.095 ( -2.849 -1.349 -1.741) 3.601 27.973 ( -3.974 -0.789 2.653) 4.843 28.343 ( -0.917 -1.591 2.229) 2.887 28.778 ( 3.430 -3.975 -5.207) 7.395 28.932 ( 4.663 -1.226 7.719) 9.101 29.068 ( 6.447 -1.703 -4.395) 7.986 29.203 ( -4.757 13.134 -3.049) 14.298 ======================= Grid point 125 (56/140) ======================= q-point: (-0.56 -0.56 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.209 ( 7.012 0.000 -12.941) 14.719 1.374 ( 1.131 0.000 -7.083) 7.173 1.762 ( -11.599 -0.000 10.033) 15.336 1.845 ( -0.268 -0.000 -9.183) 9.187 2.183 ( -1.227 -0.000 -0.977) 1.569 2.223 ( 8.772 0.000 6.499) 10.917 2.462 ( -1.809 -0.000 -3.728) 4.144 2.463 ( 3.678 0.000 -1.596) 4.010 2.668 ( -9.018 -0.000 -3.126) 9.545 2.918 ( 1.718 0.000 16.043) 16.134 3.106 ( 0.571 0.000 -1.522) 1.626 3.197 ( -0.676 -0.000 -8.742) 8.768 3.217 ( 1.948 0.000 3.106) 3.666 3.664 ( 3.214 0.000 -4.965) 5.915 3.698 ( -6.482 -0.000 0.378) 6.493 3.881 ( 2.352 0.000 -0.933) 2.530 3.942 ( -4.473 -0.000 -2.283) 5.022 3.966 ( 1.003 0.000 14.169) 14.205 4.245 ( 4.303 0.000 -4.367) 6.131 4.308 ( -1.446 -0.000 0.200) 1.460 4.708 ( -1.432 -0.000 -0.653) 1.574 4.796 ( 8.090 0.000 -9.640) 12.585 4.819 ( -6.442 -0.000 2.653) 6.967 5.117 ( -2.982 -0.000 -6.756) 7.385 5.302 ( 3.031 0.000 -4.024) 5.038 5.452 ( 3.108 0.000 6.921) 7.587 5.549 ( 0.840 0.000 2.927) 3.046 5.953 ( 4.967 0.000 6.326) 8.043 6.003 ( -0.353 -0.000 2.849) 2.871 6.083 ( -2.229 -0.000 -4.151) 4.712 6.491 ( -1.822 -0.000 3.580) 4.017 6.507 ( -1.969 -0.000 0.686) 2.085 6.608 ( 7.225 0.000 -1.015) 7.296 6.764 ( 1.751 0.000 -7.219) 7.428 6.899 ( 0.934 0.000 4.016) 4.123 6.972 ( -6.116 -0.000 0.787) 6.167 7.011 ( -5.999 -0.000 3.723) 7.061 7.127 ( -3.983 -0.000 5.017) 6.405 7.303 ( 0.457 0.000 -1.762) 1.820 7.746 ( 2.678 0.000 -3.822) 4.667 8.294 ( 2.627 0.000 -3.264) 4.190 8.518 ( -3.746 -0.000 7.815) 8.666 8.608 ( -3.245 -0.000 10.868) 11.342 8.682 ( -5.509 -0.000 -2.799) 6.180 8.985 ( -1.022 -0.000 5.408) 5.504 9.331 ( 2.365 0.000 -1.127) 2.620 9.552 ( 5.906 0.000 -7.899) 9.863 9.833 ( 0.449 0.000 -1.367) 1.439 10.098 ( -5.521 -0.000 -4.519) 7.135 10.578 ( -2.083 -0.000 -17.363) 17.488 10.780 ( -1.312 -0.000 0.920) 1.602 10.908 ( 5.404 0.000 -2.283) 5.867 11.155 ( 5.251 0.000 12.675) 13.720 11.363 ( -1.940 -0.000 0.834) 2.112 11.596 ( -4.379 -0.000 0.436) 4.401 11.619 ( 5.982 0.000 -4.986) 7.787 11.820 ( -2.079 -0.000 -1.604) 2.626 11.956 ( 0.315 0.000 4.805) 4.815 12.079 ( 0.878 0.000 -3.633) 3.738 12.106 ( -4.349 -0.000 1.122) 4.491 12.279 ( -9.195 -0.000 -1.455) 9.310 12.480 ( -3.131 -0.000 -5.008) 5.906 12.784 ( 7.974 0.000 3.448) 8.688 13.338 ( -2.410 -0.000 -0.768) 2.529 14.694 ( -3.939 -0.000 -0.066) 3.939 14.696 ( 1.212 0.000 0.882) 1.499 14.756 ( -0.833 -0.000 5.085) 5.153 15.055 ( 2.127 0.000 -0.356) 2.157 15.400 ( -5.356 -0.000 -3.831) 6.585 15.440 ( 1.927 0.000 0.013) 1.927 15.542 ( 3.096 0.000 -3.842) 4.935 15.675 ( 4.292 0.000 -1.745) 4.634 15.873 ( -4.244 -0.000 5.057) 6.602 15.903 ( 7.716 0.000 -2.407) 8.083 16.213 ( -5.174 -0.000 5.092) 7.259 16.218 ( 0.531 0.000 1.486) 1.578 17.204 ( 8.220 0.000 2.432) 8.572 17.390 ( -9.452 -0.000 4.870) 10.633 17.532 ( 6.781 0.000 -2.159) 7.117 17.666 ( 1.087 0.000 -0.252) 1.116 25.615 ( 0.990 0.000 -0.396) 1.067 25.649 ( 1.675 0.000 -2.015) 2.620 25.668 ( -2.314 -0.000 1.805) 2.935 25.751 ( -1.934 -0.000 1.602) 2.511 25.934 ( -1.441 -0.000 -3.385) 3.679 26.183 ( 0.581 0.000 -1.571) 1.675 26.400 ( -0.404 -0.000 0.929) 1.013 26.444 ( -0.678 -0.000 -0.352) 0.764 26.835 ( -1.570 -0.000 -2.791) 3.202 27.441 ( -6.759 -0.000 -11.106) 13.001 27.471 ( -3.575 -0.000 12.354) 12.861 27.791 ( 6.242 0.000 5.583) 8.374 28.183 ( -0.727 -0.000 1.217) 1.418 28.360 ( 0.683 0.000 -1.827) 1.951 29.267 ( 1.168 0.000 9.174) 9.248 30.817 ( 8.705 0.000 -10.453) 13.603 ======================= Grid point 126 (57/140) ======================= q-point: (-0.44 -0.56 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.209 ( 3.331 -9.151 -7.188) 12.104 1.612 ( -3.578 -13.839 -1.987) 14.431 1.793 ( 2.023 -15.007 -2.222) 15.305 1.944 ( -1.102 -12.704 -5.751) 13.988 2.173 ( -6.885 0.002 -0.862) 6.938 2.245 ( -5.899 -3.602 -1.321) 7.037 2.484 ( 0.997 -3.846 -1.729) 4.333 2.541 ( -2.734 -8.122 -0.634) 8.593 2.654 ( 4.572 -2.360 0.552) 5.175 3.028 ( 1.461 -2.001 9.825) 10.133 3.112 ( 0.406 -0.223 -1.228) 1.313 3.154 ( 2.504 0.597 -0.227) 2.585 3.182 ( -1.531 3.480 -2.301) 4.444 3.540 ( 2.878 6.354 1.417) 7.118 3.750 ( -7.703 -3.340 -5.091) 9.819 3.867 ( 1.446 4.770 5.163) 7.176 3.918 ( -2.865 -1.273 1.145) 3.337 4.070 ( 2.073 -6.478 3.916) 7.848 4.239 ( -1.315 -3.258 -0.254) 3.523 4.426 ( 3.494 -9.276 -6.589) 11.903 4.688 ( -0.397 0.378 -1.552) 1.646 4.792 ( -3.898 -0.839 -2.198) 4.553 4.818 ( 6.367 0.369 -3.690) 7.368 5.065 ( -3.825 -0.453 -5.576) 6.777 5.273 ( 2.029 3.219 -1.015) 3.939 5.504 ( 1.127 1.419 2.246) 2.886 5.549 ( 2.069 1.137 4.183) 4.803 5.971 ( 3.011 4.332 7.630) 9.276 6.018 ( 1.410 -0.544 -1.426) 2.078 6.090 ( 0.629 -1.031 3.551) 3.750 6.408 ( -2.102 5.662 2.124) 6.402 6.512 ( 3.011 3.335 -2.815) 5.302 6.559 ( -6.173 2.262 0.509) 6.595 6.715 ( 0.354 2.064 -7.320) 7.614 6.898 ( -5.335 3.051 3.123) 6.894 6.948 ( 1.639 2.934 3.826) 5.092 6.998 ( 3.902 -0.437 6.391) 7.501 7.131 ( -3.024 -1.716 3.157) 4.696 7.398 ( 1.255 -7.862 -2.370) 8.307 7.686 ( 0.661 5.206 -4.213) 6.730 8.388 ( 4.722 -6.889 -0.841) 8.395 8.569 ( -2.415 -4.363 5.020) 7.076 8.651 ( -5.885 -5.789 8.047) 11.528 8.702 ( 0.280 -4.030 4.283) 5.888 9.033 ( -2.208 -4.547 5.006) 7.114 9.244 ( 1.700 6.228 -1.548) 6.639 9.680 ( 5.192 -7.995 -6.166) 11.353 9.774 ( -1.055 5.815 -1.801) 6.178 10.032 ( -3.790 -0.518 -6.872) 7.865 10.551 ( 0.293 -7.055 -18.139) 19.464 10.784 ( -1.439 -1.932 -1.017) 2.615 10.973 ( 2.081 -4.414 -1.012) 4.984 11.265 ( 3.948 -1.765 13.814) 14.475 11.378 ( -0.449 -1.188 0.931) 1.575 11.551 ( -7.070 -2.242 -4.778) 8.823 11.604 ( 4.100 3.357 -1.967) 5.653 11.787 ( 2.050 3.372 0.362) 3.962 11.977 ( -2.523 -0.246 2.322) 3.438 12.078 ( -1.649 0.058 0.594) 1.753 12.114 ( -0.993 -5.739 -6.756) 8.920 12.212 ( -4.789 -0.295 -3.326) 5.838 12.463 ( -0.715 -2.542 -3.099) 4.071 12.818 ( 8.039 6.279 6.306) 11.992 13.242 ( -2.966 8.031 -2.725) 8.984 14.623 ( -2.990 4.048 0.404) 5.048 14.687 ( 1.975 2.308 1.870) 3.567 14.828 ( 0.242 -4.432 5.068) 6.738 15.096 ( 0.031 -3.677 -1.588) 4.005 15.245 ( -0.113 10.440 -2.975) 10.856 15.478 ( 1.433 -1.751 -4.475) 5.015 15.525 ( 0.600 2.298 -0.677) 2.470 15.704 ( 4.011 -0.068 0.455) 4.037 15.818 ( -5.041 4.752 1.901) 7.184 15.930 ( 5.639 2.051 -0.869) 6.063 16.137 ( -3.239 2.973 5.540) 7.073 16.332 ( -1.722 -7.402 2.112) 7.888 17.257 ( -2.420 1.915 2.076) 3.719 17.325 ( -1.895 1.324 4.046) 4.660 17.529 ( 5.871 4.767 1.100) 7.643 17.675 ( 1.854 0.775 -0.228) 2.022 25.630 ( 0.454 -1.359 -0.941) 1.714 25.651 ( -0.160 -0.334 -0.434) 0.570 25.676 ( -0.853 -1.603 0.213) 1.828 25.748 ( -1.822 -0.475 1.352) 2.318 25.895 ( -1.089 1.190 -3.503) 3.857 26.189 ( 1.654 -0.825 -1.920) 2.665 26.392 ( -0.504 0.524 0.592) 0.937 26.451 ( -2.222 -2.125 -0.740) 3.162 26.789 ( -1.110 2.046 -3.478) 4.185 27.320 ( -7.532 1.011 -10.520) 12.978 27.579 ( -0.746 -7.486 10.346) 12.792 27.886 ( 8.126 -0.829 8.391) 11.711 28.235 ( 0.148 -5.408 1.167) 5.535 28.379 ( 0.940 -2.698 -2.293) 3.663 29.304 ( -1.710 1.256 10.382) 10.596 30.713 ( 6.622 13.451 -10.054) 18.052 ======================= Grid point 127 (58/140) ======================= q-point: (-0.33 -0.56 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.438 ( -3.354 -15.506 0.069) 15.865 1.718 ( -4.347 -9.535 -1.351) 10.566 2.040 ( -6.300 2.108 1.080) 6.730 2.106 ( -2.342 -14.603 -11.895) 18.980 2.196 ( 3.657 -15.800 1.824) 16.319 2.334 ( -5.671 -12.278 -2.283) 13.716 2.538 ( -3.090 -4.268 -7.342) 9.037 2.646 ( 3.200 -8.917 -1.547) 9.599 2.831 ( 2.719 -11.004 5.146) 12.448 3.036 ( 0.621 -1.063 -4.929) 5.080 3.059 ( 0.273 6.731 -3.736) 7.703 3.205 ( 1.533 -4.684 7.134) 8.671 3.247 ( 6.800 -2.919 8.199) 11.044 3.473 ( 2.763 5.583 -0.885) 6.291 3.739 ( -3.751 -3.727 1.241) 5.431 3.799 ( -3.577 5.783 7.888) 10.415 3.926 ( -1.888 -1.262 0.390) 2.304 4.213 ( 1.043 -5.193 -1.884) 5.622 4.295 ( -5.064 -8.818 -4.181) 10.994 4.537 ( 2.882 -3.351 -8.029) 9.165 4.662 ( -1.415 2.205 -2.131) 3.377 4.744 ( -2.107 0.429 -7.810) 8.101 4.846 ( 4.116 1.172 3.220) 5.356 5.038 ( -0.511 -3.446 -7.431) 8.207 5.280 ( 1.467 -2.254 5.058) 5.728 5.441 ( 3.035 7.097 4.294) 8.833 5.580 ( 0.575 -1.458 -2.453) 2.911 5.986 ( 3.095 2.885 9.562) 10.456 5.993 ( -0.656 -0.494 -8.479) 8.518 6.133 ( 2.672 2.807 9.239) 10.019 6.297 ( -3.590 4.734 2.640) 6.502 6.437 ( -4.550 2.471 0.090) 5.179 6.521 ( 0.401 2.993 0.822) 3.129 6.682 ( 3.673 -1.642 -4.797) 6.261 6.825 ( -3.132 3.364 3.842) 5.990 6.880 ( -1.099 4.935 4.294) 6.633 7.089 ( 1.855 -2.701 1.478) 3.595 7.165 ( 1.674 -0.489 5.459) 5.731 7.478 ( 0.360 -1.431 -4.852) 5.072 7.583 ( -1.547 2.675 -4.956) 5.840 8.511 ( 2.995 -3.532 2.868) 5.447 8.682 ( -0.389 -8.049 1.503) 8.197 8.790 ( -1.920 -9.584 2.529) 10.096 8.858 ( 3.325 -8.210 12.750) 15.525 9.149 ( -3.083 -7.449 1.733) 8.246 9.197 ( 2.503 -0.448 2.447) 3.530 9.627 ( -3.430 7.608 -1.665) 8.510 9.764 ( -0.343 -3.812 -6.460) 7.509 9.992 ( -0.871 -0.254 -6.173) 6.240 10.598 ( 4.043 -4.502 -11.942) 13.387 10.814 ( -0.986 -3.425 -1.831) 4.007 11.039 ( -1.605 -2.956 -2.200) 4.019 11.331 ( -5.319 1.203 -0.281) 5.460 11.398 ( 1.444 0.261 7.349) 7.494 11.577 ( -0.730 -6.630 -6.261) 9.149 11.616 ( 6.258 -3.128 2.666) 7.487 11.745 ( 3.983 5.245 3.006) 7.239 11.933 ( -6.616 -0.387 -4.805) 8.186 12.039 ( -4.103 1.144 -3.511) 5.521 12.191 ( -1.498 -6.402 -0.468) 6.592 12.204 ( 3.187 -0.465 -1.726) 3.654 12.526 ( 2.045 -5.331 -2.223) 6.127 12.769 ( 5.820 9.301 5.535) 12.289 13.022 ( -1.222 12.656 -3.827) 13.278 14.547 ( -2.575 1.703 -0.791) 3.187 14.680 ( 1.738 1.737 2.612) 3.586 14.933 ( 0.213 -4.090 4.787) 6.299 15.060 ( 1.587 9.112 -2.775) 9.657 15.144 ( -0.557 -3.038 -2.092) 3.730 15.441 ( -0.072 3.331 -3.567) 4.881 15.522 ( 1.392 -1.055 -1.495) 2.299 15.668 ( -6.836 6.960 1.115) 9.819 15.738 ( 4.358 0.823 -0.507) 4.464 15.922 ( 5.658 3.808 0.662) 6.852 16.108 ( -3.842 1.482 7.774) 8.797 16.440 ( -1.443 -5.987 0.397) 6.171 17.121 ( -11.131 5.636 1.321) 12.547 17.319 ( -2.553 3.836 3.481) 5.775 17.519 ( 12.223 5.421 4.284) 14.041 17.671 ( 0.639 -0.331 -2.373) 2.480 25.648 ( -0.348 -0.904 -1.457) 1.750 25.658 ( -1.935 -1.766 0.650) 2.699 25.705 ( 0.490 -1.907 -0.326) 1.996 25.749 ( -1.527 -0.435 0.971) 1.861 25.855 ( -0.092 1.351 -1.771) 2.229 26.216 ( 3.340 -1.456 -3.545) 5.083 26.381 ( -1.206 -0.213 -0.992) 1.576 26.475 ( -1.930 -2.520 1.666) 3.584 26.732 ( -1.202 1.471 -3.280) 3.791 27.198 ( -5.266 2.190 -7.106) 9.112 27.766 ( 1.468 -7.591 8.514) 11.501 28.036 ( 6.621 -5.545 7.940) 11.732 28.364 ( 1.744 -8.601 0.741) 8.807 28.442 ( 2.131 -5.044 -2.912) 6.202 29.295 ( -4.086 2.969 9.061) 10.374 30.386 ( 1.581 23.164 -9.721) 25.171 ======================= Grid point 128 (59/140) ======================= q-point: (-0.22 -0.56 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.590 ( -3.822 -4.388 6.329) 8.598 1.818 ( -10.689 -9.565 -1.446) 14.417 2.046 ( 0.133 -5.028 -2.633) 5.677 2.197 ( -6.580 -8.172 -8.278) 13.364 2.408 ( 0.955 -9.500 0.475) 9.560 2.545 ( 3.247 -10.764 -2.668) 11.555 2.593 ( -1.963 -7.728 0.329) 7.981 2.835 ( 5.482 -7.344 -1.262) 9.251 2.920 ( 5.129 2.609 -7.316) 9.308 3.047 ( 1.575 -2.915 4.339) 5.459 3.098 ( -0.076 -9.901 -2.145) 10.131 3.292 ( -0.100 0.316 3.379) 3.395 3.358 ( 5.344 0.251 5.801) 7.891 3.466 ( 1.680 -4.487 4.047) 6.272 3.680 ( -3.552 7.696 7.498) 11.317 3.838 ( -2.230 -7.517 0.525) 7.858 3.924 ( 1.325 1.865 0.182) 2.295 4.203 ( -0.222 3.174 -3.310) 4.592 4.412 ( -3.705 -9.981 -11.251) 15.490 4.467 ( -7.199 1.984 -1.350) 7.588 4.599 ( -2.174 2.183 -0.776) 3.178 4.696 ( 2.516 1.512 -7.822) 8.354 4.886 ( 2.542 -1.374 2.204) 3.634 5.062 ( -0.924 -1.810 -5.914) 6.253 5.391 ( 7.204 -1.889 2.921) 8.000 5.428 ( 4.981 -0.096 8.863) 10.167 5.595 ( 0.004 -2.856 -5.287) 6.009 5.911 ( -3.320 1.982 -6.505) 7.567 6.021 ( -2.702 2.303 4.707) 5.896 6.101 ( 2.260 3.508 4.156) 5.889 6.235 ( 1.348 5.500 5.019) 7.567 6.382 ( -11.410 -2.190 2.600) 11.905 6.463 ( 1.639 3.293 -1.197) 3.868 6.745 ( 1.515 -1.362 -3.032) 3.653 6.810 ( -0.340 -0.996 8.833) 8.896 6.841 ( 6.293 3.413 4.609) 8.514 7.128 ( 1.482 -1.443 -3.170) 3.785 7.217 ( 1.517 -0.402 7.068) 7.240 7.403 ( -4.130 3.454 -5.772) 7.893 7.537 ( -0.041 0.191 -5.972) 5.975 8.603 ( 4.365 -2.032 4.635) 6.683 8.810 ( -1.303 -5.850 2.907) 6.661 8.938 ( 1.919 -7.819 -1.927) 8.279 9.079 ( 0.052 -7.881 7.427) 10.829 9.196 ( 1.712 -2.020 3.125) 4.096 9.347 ( 0.357 -8.434 3.779) 9.249 9.483 ( -5.591 3.918 1.396) 6.969 9.764 ( -2.611 -1.944 -6.202) 7.004 9.965 ( 0.161 0.012 -3.528) 3.532 10.631 ( 1.485 -0.813 -3.742) 4.107 10.854 ( 0.191 -2.725 -2.494) 3.699 11.014 ( -1.015 1.608 -3.872) 4.314 11.256 ( -6.295 -0.056 -1.128) 6.396 11.442 ( 2.580 -1.255 4.508) 5.343 11.582 ( 0.401 3.551 -3.262) 4.838 11.662 ( 3.144 6.178 4.622) 8.332 11.785 ( -1.109 -4.538 -3.607) 5.902 11.932 ( 3.494 -5.188 -2.837) 6.868 11.949 ( -6.245 2.093 -4.608) 8.038 12.232 ( 1.883 -0.707 -0.644) 2.112 12.275 ( -0.613 -2.548 3.502) 4.374 12.573 ( 4.969 7.495 -5.707) 10.651 12.675 ( 1.372 0.352 2.153) 2.578 12.890 ( 4.146 0.785 -0.867) 4.308 14.537 ( -1.472 -3.247 -1.389) 3.826 14.676 ( 1.381 1.593 2.023) 2.922 14.905 ( -2.271 3.601 -0.292) 4.267 15.054 ( 5.920 -0.744 -0.918) 6.037 15.158 ( -2.902 -0.515 2.412) 3.809 15.385 ( -1.153 0.364 -2.123) 2.443 15.503 ( -6.685 4.079 -1.089) 7.906 15.535 ( 1.959 1.805 -2.299) 3.519 15.751 ( 3.202 0.593 -1.141) 3.451 15.899 ( 5.679 4.994 2.487) 7.961 16.099 ( -4.063 0.979 8.718) 9.668 16.511 ( -0.578 -3.962 -1.462) 4.262 16.947 ( -10.375 5.787 1.889) 12.029 17.209 ( -4.871 6.167 2.991) 8.409 17.548 ( 9.816 4.289 2.039) 10.905 17.681 ( 1.530 -1.509 -3.079) 3.755 25.646 ( -1.355 -0.075 1.535) 2.049 25.682 ( -2.062 -2.623 -0.314) 3.351 25.739 ( 0.115 -1.699 -0.055) 1.703 25.745 ( -0.360 0.143 -0.080) 0.395 25.832 ( 0.701 1.171 -0.057) 1.366 26.237 ( 4.181 -0.272 -6.970) 8.132 26.387 ( -0.253 -1.354 1.108) 1.768 26.512 ( -2.045 -2.603 -0.197) 3.316 26.701 ( -0.704 0.421 1.899) 2.069 27.106 ( -2.953 1.544 -4.714) 5.773 27.902 ( -0.190 -3.766 5.995) 7.083 28.217 ( 4.169 -5.741 5.088) 8.731 28.552 ( 6.005 -7.003 -2.787) 9.637 28.570 ( 4.611 -12.228 0.605) 13.082 29.228 ( -5.749 4.989 6.125) 9.770 29.914 ( -4.628 25.372 -8.358) 27.111 ======================= Grid point 129 (60/140) ======================= q-point: (-0.11 -0.56 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.610 ( -3.208 1.408 8.929) 9.592 1.944 ( -3.635 -11.396 0.640) 11.978 2.004 ( -3.820 2.915 -6.984) 8.478 2.311 ( -1.017 -7.861 -0.812) 7.968 2.528 ( 0.311 -1.116 6.495) 6.598 2.653 ( -0.517 -6.644 -5.111) 8.399 2.718 ( 3.395 -2.528 2.495) 4.913 2.834 ( 3.946 2.553 -3.419) 5.812 3.026 ( 3.455 -4.870 -3.392) 6.867 3.144 ( 3.933 -3.840 2.332) 5.971 3.186 ( -2.726 -3.011 -1.152) 4.222 3.303 ( 0.386 -2.239 -4.021) 4.619 3.420 ( 2.568 -1.217 1.175) 3.075 3.508 ( -5.661 4.586 7.046) 10.135 3.603 ( -1.777 1.804 5.484) 6.041 3.831 ( -1.988 3.198 -1.822) 4.184 3.988 ( 6.300 -3.764 1.115) 7.423 4.135 ( 1.258 2.014 -1.864) 3.019 4.375 ( -3.672 2.399 4.143) 6.033 4.497 ( -7.621 -7.091 -5.213) 11.642 4.572 ( 2.427 -1.194 -0.864) 2.840 4.652 ( 2.300 0.849 -7.412) 7.807 4.933 ( 1.475 -1.187 -0.611) 1.989 5.033 ( -2.531 0.151 -3.336) 4.190 5.439 ( 8.041 3.947 0.895) 9.002 5.561 ( 5.879 -3.536 3.574) 7.736 5.618 ( -0.945 -2.389 -2.017) 3.266 5.832 ( -3.584 0.165 -4.320) 5.616 5.927 ( -6.755 3.402 0.616) 7.588 6.098 ( 6.056 4.916 0.972) 7.861 6.192 ( -0.264 1.683 4.198) 4.531 6.340 ( -9.936 -1.162 4.157) 10.833 6.445 ( 0.487 -0.418 -2.220) 2.311 6.747 ( 1.710 0.337 -0.620) 1.850 6.798 ( -1.482 2.679 4.039) 5.068 6.940 ( 4.397 -0.796 6.299) 7.723 7.131 ( 3.806 1.766 -5.266) 6.733 7.281 ( 0.889 -1.587 6.411) 6.664 7.290 ( -3.293 1.145 -3.880) 5.216 7.521 ( -0.106 -1.841 -3.595) 4.040 8.685 ( 3.454 -1.360 4.143) 5.562 8.860 ( -4.295 -1.306 1.319) 4.679 9.057 ( 3.647 -5.810 -4.800) 8.372 9.167 ( -2.151 -1.985 -1.992) 3.540 9.231 ( -2.435 1.439 4.262) 5.115 9.373 ( -2.350 1.075 4.527) 5.213 9.540 ( -1.719 -5.559 2.689) 6.410 9.754 ( 1.935 0.260 1.084) 2.233 9.964 ( -1.082 -1.950 -2.010) 3.002 10.599 ( -4.699 1.007 0.904) 4.890 10.903 ( 5.052 -2.916 -2.137) 6.212 10.975 ( 1.726 1.954 -1.714) 3.120 11.254 ( -4.979 -5.659 -0.533) 7.557 11.416 ( -1.309 7.734 -6.366) 10.102 11.539 ( 4.186 2.248 1.495) 4.981 11.612 ( -0.080 0.676 4.565) 4.615 11.822 ( -2.802 -4.332 0.866) 5.231 11.851 ( -3.291 1.846 -2.764) 4.677 11.988 ( 4.517 3.027 -1.558) 5.656 12.230 ( 0.557 3.261 1.553) 3.655 12.291 ( 1.895 1.197 -1.533) 2.715 12.444 ( 6.974 4.755 -6.931) 10.922 12.766 ( 0.764 -6.204 -0.022) 6.251 12.986 ( -1.353 -8.251 1.860) 8.565 14.607 ( 1.002 -4.028 0.690) 4.208 14.668 ( 0.603 0.587 0.116) 0.849 14.867 ( -2.156 -1.804 -1.540) 3.205 15.023 ( 1.876 6.283 0.020) 6.557 15.188 ( 0.456 -1.083 4.056) 4.223 15.337 ( -2.823 3.446 -1.436) 4.680 15.450 ( -1.621 -3.384 -2.683) 4.612 15.510 ( 1.032 1.169 -1.926) 2.478 15.753 ( 0.759 0.692 -1.544) 1.854 15.885 ( 3.835 1.928 2.869) 5.163 16.089 ( -4.560 1.201 8.050) 9.329 16.553 ( 0.368 -2.368 -2.329) 3.342 16.801 ( -6.078 5.121 2.626) 8.370 17.106 ( -2.643 3.486 1.959) 4.793 17.543 ( 4.368 2.497 -2.462) 5.601 17.705 ( 2.441 -0.696 -2.140) 3.320 25.652 ( -1.647 -0.470 3.934) 4.290 25.706 ( -0.739 -1.513 0.114) 1.688 25.725 ( -0.656 1.117 -0.083) 1.298 25.773 ( 0.352 -1.938 -0.356) 2.002 25.822 ( 0.141 0.746 0.333) 0.830 26.234 ( 4.675 -0.117 -7.348) 8.710 26.415 ( 0.288 -0.294 1.765) 1.812 26.506 ( -3.585 -0.844 -4.933) 6.157 26.744 ( 2.009 -1.211 10.582) 10.839 27.055 ( -1.625 -0.059 -4.369) 4.662 27.953 ( -2.340 -0.812 3.926) 4.642 28.309 ( -0.638 -2.146 0.272) 2.256 28.685 ( 3.707 -6.366 -6.378) 9.745 28.883 ( 13.184 -15.567 2.677) 20.575 29.099 ( -6.499 7.558 3.113) 10.443 29.445 ( -6.935 20.361 -3.640) 21.816 ======================= Grid point 135 (61/140) ======================= q-point: (-0.44 -0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.229 ( 8.130 0.000 -9.733) 12.682 1.308 ( -0.892 -0.000 -8.958) 9.003 1.682 ( -6.956 -0.000 6.067) 9.230 1.813 ( 3.972 0.000 -2.216) 4.549 2.088 ( -22.386 -0.000 -3.922) 22.727 2.104 ( -2.592 -0.000 -5.490) 6.071 2.431 ( -0.369 -0.000 -0.949) 1.018 2.487 ( -0.409 -0.000 1.453) 1.509 2.693 ( 6.524 0.000 -0.736) 6.566 3.080 ( -0.666 -0.000 8.154) 8.181 3.082 ( -3.114 -0.000 -9.240) 9.751 3.174 ( 1.080 0.000 3.204) 3.381 3.214 ( 5.195 0.000 4.569) 6.918 3.527 ( -11.068 -0.000 -1.512) 11.171 3.734 ( 6.456 0.000 -3.620) 7.401 3.883 ( 1.037 0.000 -4.097) 4.226 3.890 ( 1.033 0.000 1.087) 1.499 4.113 ( -2.150 -0.000 8.413) 8.683 4.182 ( -1.925 -0.000 -0.597) 2.015 4.330 ( 3.171 0.000 -1.265) 3.414 4.670 ( 0.108 0.000 -3.809) 3.811 4.777 ( -3.203 -0.000 2.788) 4.246 4.857 ( 10.373 0.000 -6.296) 12.134 5.006 ( -5.131 -0.000 -1.716) 5.411 5.316 ( 1.844 0.000 -2.664) 3.240 5.515 ( 0.383 0.000 0.677) 0.778 5.611 ( 2.315 0.000 4.644) 5.189 5.961 ( -2.612 -0.000 -8.455) 8.849 6.098 ( 5.599 0.000 5.945) 8.166 6.129 ( 1.451 0.000 13.860) 13.936 6.410 ( -8.578 -0.000 -3.192) 9.152 6.530 ( 3.510 0.000 2.009) 4.044 6.556 ( -6.115 -0.000 -0.821) 6.169 6.703 ( 0.817 0.000 -9.612) 9.647 6.870 ( -7.272 -0.000 2.142) 7.581 7.066 ( -7.337 -0.000 2.331) 7.698 7.070 ( 13.935 0.000 4.512) 14.648 7.106 ( 3.887 0.000 8.489) 9.337 7.327 ( 3.889 0.000 -1.010) 4.018 7.716 ( -0.504 -0.000 -5.893) 5.915 8.376 ( 9.028 0.000 0.932) 9.076 8.530 ( -5.660 -0.000 -4.881) 7.474 8.568 ( -1.039 -0.000 9.981) 10.035 8.724 ( -0.369 -0.000 12.985) 12.990 8.994 ( -2.948 -0.000 4.215) 5.144 9.332 ( -0.825 -0.000 -1.084) 1.362 9.605 ( 8.863 0.000 -6.126) 10.774 9.814 ( -0.563 -0.000 -2.287) 2.356 9.945 ( -4.982 -0.000 -8.932) 10.227 10.376 ( 0.202 0.000 -19.508) 19.509 10.745 ( -3.951 -0.000 -0.009) 3.951 10.948 ( 1.177 0.000 -1.093) 1.606 11.360 ( 3.335 0.000 13.624) 14.026 11.371 ( 1.462 0.000 1.837) 2.348 11.424 ( -11.440 -0.000 -6.536) 13.175 11.649 ( 2.418 0.000 -2.780) 3.684 11.840 ( 2.111 0.000 1.435) 2.553 11.949 ( -8.475 -0.000 -9.965) 13.081 12.004 ( 2.027 0.000 0.166) 2.034 12.090 ( 1.248 0.000 4.340) 4.516 12.181 ( 1.415 0.000 -4.421) 4.642 12.440 ( 2.612 0.000 -2.279) 3.467 12.959 ( 5.661 0.000 6.690) 8.764 13.269 ( -2.961 -0.000 -4.295) 5.217 14.655 ( -1.038 -0.000 -0.475) 1.141 14.735 ( 0.950 0.000 3.116) 3.257 14.821 ( 1.974 0.000 6.645) 6.933 15.033 ( -3.736 -0.000 -1.489) 4.021 15.352 ( 5.674 0.000 -6.216) 8.417 15.426 ( -0.738 -0.000 -5.137) 5.190 15.572 ( 1.462 0.000 2.960) 3.301 15.720 ( 3.844 0.000 -1.140) 4.010 15.839 ( -6.222 -0.000 4.085) 7.443 15.985 ( 5.477 0.000 -1.687) 5.731 16.161 ( -7.785 -0.000 4.590) 9.038 16.255 ( 1.617 0.000 2.667) 3.119 17.244 ( -11.992 -0.000 4.802) 12.917 17.364 ( 5.420 0.000 2.836) 6.118 17.561 ( 0.333 0.000 -2.733) 2.753 17.757 ( 7.703 0.000 5.126) 9.252 25.611 ( -0.718 -0.000 -1.799) 1.937 25.650 ( 0.763 0.000 -1.962) 2.105 25.653 ( -1.803 -0.000 2.389) 2.993 25.736 ( -1.283 -0.000 0.836) 1.532 25.879 ( -0.872 -0.000 -3.439) 3.548 26.183 ( 1.764 0.000 -2.781) 3.294 26.393 ( -3.648 -0.000 -1.849) 4.090 26.402 ( -0.152 -0.000 0.369) 0.399 26.789 ( -1.286 -0.000 -2.399) 2.722 27.221 ( -4.599 -0.000 -11.841) 12.702 27.547 ( -2.824 -0.000 12.568) 12.881 27.994 ( 9.349 0.000 5.958) 11.086 28.197 ( 0.591 0.000 1.924) 2.013 28.353 ( 0.975 0.000 -2.044) 2.265 29.353 ( -3.941 -0.000 13.176) 13.752 30.836 ( 7.367 0.000 -10.774) 13.052 ======================= Grid point 136 (62/140) ======================= q-point: (-0.33 -0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.188 ( 0.274 -8.208 -4.640) 9.433 1.496 ( -4.380 -13.671 -8.531) 16.699 1.803 ( -1.258 -12.075 -0.110) 12.141 1.884 ( -20.729 -4.760 -4.014) 21.644 1.976 ( 0.041 -13.680 3.987) 14.249 2.148 ( 3.761 -6.989 -3.849) 8.821 2.455 ( -5.154 -2.390 -6.870) 8.915 2.478 ( -0.383 -3.254 -0.292) 3.289 2.737 ( -2.833 -5.920 1.479) 6.728 3.014 ( 1.396 0.374 -4.316) 4.551 3.083 ( -4.761 -1.904 -2.000) 5.503 3.235 ( 2.839 0.838 12.345) 12.695 3.317 ( 12.583 -1.154 2.342) 12.851 3.517 ( -7.574 -7.344 -1.682) 10.683 3.646 ( 3.812 10.035 -2.746) 11.081 3.857 ( -0.631 -1.863 -2.651) 3.301 3.981 ( 1.413 -0.640 5.177) 5.405 4.058 ( -4.822 1.297 1.643) 5.257 4.229 ( 0.472 -3.380 1.630) 3.782 4.423 ( 3.330 -6.940 -5.816) 9.648 4.664 ( 1.380 -0.997 -5.116) 5.392 4.727 ( -2.936 3.900 -0.364) 4.895 4.916 ( 3.768 1.227 0.940) 4.073 4.973 ( 1.181 -1.503 -2.756) 3.355 5.306 ( 1.743 0.213 1.817) 2.526 5.513 ( -0.304 0.313 -1.517) 1.578 5.624 ( 3.119 3.184 3.732) 5.813 5.908 ( -3.400 -1.308 -9.929) 10.576 6.120 ( 3.889 3.697 8.067) 9.689 6.216 ( -0.116 0.660 7.331) 7.362 6.308 ( -6.380 1.303 0.733) 6.553 6.457 ( -6.809 4.374 0.932) 8.146 6.590 ( 3.482 2.327 0.171) 4.191 6.649 ( 1.707 -1.893 -5.900) 6.427 6.835 ( -4.804 0.218 2.781) 5.555 6.987 ( -2.586 3.181 2.368) 4.735 7.128 ( 8.314 4.457 2.948) 9.883 7.199 ( 2.765 -1.302 8.251) 8.799 7.429 ( 5.999 -4.899 -2.881) 8.264 7.619 ( -2.388 5.567 -6.202) 8.670 8.486 ( 3.015 -3.653 -0.384) 4.752 8.546 ( 3.528 -7.827 -1.810) 8.775 8.671 ( 0.004 -6.159 8.604) 10.581 8.830 ( 0.778 -4.806 14.496) 15.292 9.032 ( -2.299 -4.414 3.126) 5.877 9.253 ( -0.100 4.204 0.972) 4.316 9.676 ( 1.596 -1.526 -7.433) 7.754 9.712 ( -3.065 6.290 -3.134) 7.667 9.921 ( -0.650 -3.658 -7.862) 8.695 10.428 ( 6.595 -12.712 -16.100) 21.547 10.727 ( -5.192 -2.572 -0.887) 5.862 10.965 ( -1.253 -2.523 -1.613) 3.247 11.296 ( -8.079 0.913 -5.186) 9.644 11.427 ( 1.104 -4.782 2.453) 5.486 11.446 ( -0.910 -0.013 6.496) 6.560 11.647 ( 2.174 -0.347 0.879) 2.371 11.833 ( -2.708 0.524 1.043) 2.949 11.853 ( -5.305 -0.666 -7.547) 9.249 12.004 ( 2.584 2.691 -4.853) 6.121 12.154 ( 3.306 -1.806 7.192) 8.119 12.204 ( 4.695 -2.006 -3.264) 6.060 12.472 ( 4.221 -2.312 -2.714) 5.525 12.970 ( 3.107 6.000 5.951) 9.004 13.160 ( -1.724 7.543 -5.579) 9.539 14.588 ( -1.800 5.125 -0.092) 5.433 14.747 ( 2.315 1.869 3.107) 4.302 14.903 ( 1.502 -3.206 7.304) 8.116 15.037 ( -3.191 -4.313 -2.405) 5.880 15.247 ( 3.312 10.169 -5.321) 11.945 15.452 ( 3.230 -2.170 -6.775) 7.813 15.539 ( -0.568 4.238 2.437) 4.922 15.740 ( -6.624 6.687 1.345) 9.508 15.767 ( 4.480 -0.829 -0.970) 4.658 16.010 ( 4.326 1.105 0.829) 4.542 16.123 ( -6.328 -0.163 6.279) 8.916 16.334 ( 0.371 -5.285 1.388) 5.476 17.131 ( -12.764 4.127 4.160) 14.045 17.378 ( -0.662 3.613 2.929) 4.698 17.584 ( 2.902 -3.314 -2.788) 5.213 17.790 ( 8.254 6.823 6.531) 12.543 25.602 ( -1.785 -1.381 -1.997) 3.014 25.642 ( -1.065 -0.082 0.845) 1.362 25.671 ( -0.357 -1.771 0.143) 1.812 25.736 ( -0.666 -0.445 0.524) 0.957 25.858 ( -0.064 0.263 -1.832) 1.852 26.196 ( 2.766 -1.744 -4.812) 5.818 26.360 ( -2.652 -0.186 -0.096) 2.661 26.422 ( -0.503 -2.125 -0.453) 2.230 26.748 ( -1.442 1.909 -0.966) 2.580 27.138 ( -3.639 0.199 -8.752) 9.481 27.668 ( -1.214 -8.758 9.810) 13.206 28.080 ( 7.813 -0.310 4.725) 9.136 28.261 ( 1.499 -5.261 1.284) 5.619 28.378 ( 1.775 -3.035 -2.303) 4.202 29.362 ( -5.430 2.540 13.436) 14.712 30.693 ( 4.273 16.462 -11.620) 20.598 ======================= Grid point 137 (63/140) ======================= q-point: (-0.22 -0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.404 ( -3.207 -17.169 1.312) 17.516 1.603 ( -10.675 -6.089 -0.705) 12.310 1.840 ( -10.645 -12.578 -3.043) 16.757 1.901 ( -12.832 -10.294 -9.355) 18.924 2.284 ( 5.643 -8.493 -0.117) 10.197 2.350 ( 4.913 -17.041 0.996) 17.763 2.446 ( -2.689 -5.923 0.681) 6.540 2.642 ( 2.201 -14.943 -5.762) 16.166 2.874 ( -2.335 -10.746 1.821) 11.147 2.992 ( 2.557 2.465 -6.890) 7.752 3.089 ( 0.498 -0.822 3.040) 3.188 3.314 ( 2.243 -1.555 8.339) 8.774 3.422 ( 5.532 -1.713 2.684) 6.383 3.488 ( 0.852 6.020 -1.282) 6.214 3.631 ( -1.521 -8.034 -3.240) 8.795 3.893 ( 3.190 5.128 7.216) 9.410 3.925 ( -0.475 1.045 4.923) 5.055 4.107 ( -8.164 -9.952 -3.247) 13.276 4.260 ( 2.723 2.230 -0.931) 3.641 4.484 ( 0.367 -0.700 -7.313) 7.355 4.605 ( -5.046 4.642 0.514) 6.875 4.679 ( 3.655 -2.466 -9.514) 10.486 4.863 ( -2.787 1.757 -2.033) 3.871 5.052 ( 5.996 -1.503 0.308) 6.189 5.397 ( 4.649 -4.560 7.979) 10.299 5.500 ( 0.836 -0.103 -0.724) 1.111 5.607 ( 5.633 3.530 1.324) 6.778 5.847 ( -3.800 -0.605 -10.696) 11.367 6.073 ( -6.828 5.539 2.286) 9.085 6.179 ( 2.483 1.989 2.695) 4.170 6.294 ( -9.128 -0.023 4.107) 10.010 6.351 ( -0.749 4.750 2.515) 5.427 6.520 ( -0.374 3.067 -1.354) 3.373 6.716 ( 1.319 -2.377 -0.503) 2.764 6.818 ( -3.699 0.043 7.426) 8.296 7.000 ( 9.999 1.436 4.720) 11.150 7.118 ( 3.382 1.518 -1.347) 3.945 7.257 ( 0.413 0.266 7.089) 7.106 7.428 ( -1.830 5.231 -3.555) 6.584 7.531 ( 3.673 0.754 -6.176) 7.225 8.596 ( 3.364 -6.539 0.867) 7.404 8.718 ( 4.900 -7.102 1.994) 8.856 8.826 ( 1.353 -6.887 4.750) 8.474 8.985 ( -1.533 -5.290 3.846) 6.718 9.132 ( -1.112 -8.127 7.305) 10.984 9.271 ( 1.561 -3.204 4.354) 5.626 9.523 ( -5.733 6.713 -4.921) 10.107 9.670 ( -3.331 -1.905 -4.115) 5.626 9.942 ( 2.173 -1.923 -5.755) 6.446 10.596 ( 5.023 -3.937 -6.326) 8.986 10.757 ( -2.490 -6.159 -2.523) 7.106 10.984 ( -1.072 -1.982 -3.362) 4.047 11.205 ( -5.248 0.619 -5.683) 7.760 11.445 ( -2.186 -0.984 2.857) 3.730 11.568 ( 3.100 -6.455 -0.274) 7.166 11.690 ( -0.778 -2.432 -1.006) 2.744 11.791 ( -3.393 1.911 0.575) 3.936 11.842 ( -1.887 -2.561 -0.323) 3.197 11.928 ( 2.052 3.033 -4.463) 5.773 12.240 ( 2.545 -0.252 4.735) 5.381 12.260 ( 3.188 -2.212 2.794) 4.781 12.561 ( 7.026 -5.299 -6.194) 10.761 12.868 ( 3.062 12.486 2.559) 13.108 12.988 ( 1.880 7.147 -4.281) 8.541 14.505 ( -1.537 1.978 -0.398) 2.537 14.741 ( 2.207 2.856 3.095) 4.755 14.965 ( -1.325 2.796 2.221) 3.808 15.073 ( 0.537 -0.801 3.226) 3.367 15.117 ( 1.246 -0.520 -4.858) 5.042 15.406 ( -1.073 4.414 -1.830) 4.898 15.516 ( -0.930 1.314 -2.502) 2.975 15.579 ( -3.164 5.323 -0.515) 6.214 15.784 ( 4.145 1.202 -3.504) 5.559 16.011 ( 0.726 2.655 3.708) 4.618 16.132 ( -1.162 0.072 7.424) 7.514 16.425 ( 0.555 -4.852 -1.064) 4.998 16.970 ( -12.031 5.556 4.172) 13.893 17.275 ( -7.625 5.881 4.178) 10.497 17.647 ( 1.838 -2.398 -3.304) 4.477 17.745 ( 9.204 8.498 3.370) 12.972 25.613 ( -1.842 -2.651 -1.381) 3.512 25.642 ( -2.399 -0.204 3.035) 3.874 25.701 ( -0.331 -2.209 -0.923) 2.417 25.742 ( -0.044 -0.307 0.216) 0.378 25.853 ( 1.077 0.327 -0.190) 1.141 26.227 ( 4.697 -1.366 -7.034) 8.567 26.368 ( -0.366 -1.628 2.618) 3.105 26.448 ( -0.711 -2.131 -3.093) 3.823 26.725 ( -0.840 0.214 5.319) 5.389 27.073 ( -2.019 0.494 -6.445) 6.772 27.848 ( -0.158 -7.005 5.793) 9.091 28.191 ( 5.570 -3.771 2.509) 7.180 28.405 ( 2.740 -9.966 -0.089) 10.336 28.466 ( 4.409 -6.778 -1.893) 8.304 29.313 ( -6.107 5.275 11.451) 14.009 30.261 ( -4.805 26.552 -11.965) 29.517 ======================= Grid point 138 (64/140) ======================= q-point: (-0.11 -0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.572 ( -14.632 -3.442 7.672) 16.877 1.682 ( -4.297 -17.399 2.069) 18.040 1.868 ( -5.797 -7.264 -10.234) 13.823 2.117 ( 0.259 -16.253 0.211) 16.257 2.449 ( 0.263 -9.908 -4.052) 10.707 2.541 ( 0.744 -4.297 3.670) 5.700 2.626 ( 1.308 -10.759 1.634) 10.960 2.868 ( 6.055 -6.348 -6.910) 11.167 2.936 ( 3.290 -0.952 -2.253) 4.099 3.046 ( -2.178 -10.059 -2.856) 10.682 3.115 ( -1.357 -1.559 2.583) 3.309 3.338 ( 2.617 4.374 2.723) 5.779 3.439 ( 0.997 0.548 0.243) 1.163 3.540 ( 0.582 -3.885 5.908) 7.095 3.674 ( -3.049 -1.003 0.073) 3.210 3.818 ( 1.097 6.629 2.539) 7.182 4.023 ( 7.451 -3.222 4.788) 9.425 4.181 ( -2.998 -3.523 -2.787) 5.400 4.221 ( -3.588 -3.909 -3.183) 6.187 4.419 ( -3.569 3.822 4.198) 6.706 4.543 ( -1.063 -1.657 -2.572) 3.239 4.701 ( 7.166 1.774 -7.923) 10.829 4.821 ( -5.294 -3.863 -7.571) 10.014 5.078 ( 2.779 2.446 1.291) 3.921 5.504 ( 2.060 -1.782 -1.547) 3.132 5.584 ( 4.262 -4.487 7.571) 9.779 5.620 ( 8.491 2.857 1.125) 9.029 5.770 ( -4.549 -0.414 -7.676) 8.932 5.925 ( -8.448 4.004 -0.564) 9.366 6.179 ( -1.847 1.038 1.289) 2.480 6.223 ( -4.185 1.914 1.027) 4.716 6.293 ( -2.209 2.306 2.965) 4.357 6.487 ( 2.839 1.935 -0.170) 3.440 6.735 ( -1.600 -1.137 -0.132) 1.967 6.846 ( -2.863 -0.365 7.807) 8.324 7.012 ( 3.830 5.725 1.893) 7.144 7.196 ( 9.527 -3.128 0.896) 10.067 7.265 ( -1.066 2.352 2.120) 3.341 7.325 ( -0.744 2.728 2.432) 3.730 7.510 ( 4.073 1.574 -5.269) 6.843 8.711 ( 2.098 -1.614 2.744) 3.812 8.844 ( 2.935 -1.673 3.800) 5.085 8.942 ( 1.423 -6.965 -4.437) 8.380 9.067 ( -1.978 -6.614 1.137) 6.996 9.246 ( -2.046 0.882 -0.710) 2.338 9.380 ( -2.922 1.223 0.356) 3.188 9.410 ( -1.185 -9.527 4.958) 10.805 9.709 ( -2.346 -5.846 2.757) 6.876 9.959 ( 3.992 0.550 -2.838) 4.929 10.575 ( -5.164 1.205 -2.833) 6.012 10.844 ( 0.478 -5.563 -0.781) 5.638 10.987 ( 0.681 -0.311 -1.786) 1.937 11.154 ( -1.419 -1.252 -4.636) 5.008 11.466 ( -1.206 0.287 -5.017) 5.167 11.593 ( 0.434 1.142 4.613) 4.772 11.693 ( -1.290 4.683 -0.090) 4.858 11.743 ( 0.632 1.001 -2.293) 2.580 11.794 ( -7.814 -3.372 -2.328) 8.823 12.003 ( 3.719 -3.725 0.935) 5.346 12.260 ( 1.263 0.087 3.374) 3.603 12.334 ( 1.908 0.089 4.534) 4.920 12.657 ( 12.220 8.534 -3.754) 15.370 12.681 ( 1.587 0.504 -6.007) 6.234 12.938 ( 3.334 1.102 -0.901) 3.625 14.522 ( 0.924 -4.475 0.325) 4.581 14.704 ( -1.140 3.135 0.603) 3.390 14.880 ( -0.485 3.533 1.569) 3.896 15.122 ( 3.222 2.047 -3.086) 4.909 15.157 ( -0.540 -3.912 5.455) 6.735 15.341 ( -2.756 0.075 -1.045) 2.949 15.401 ( -4.394 3.690 -0.762) 5.788 15.541 ( 2.599 1.771 -3.691) 4.849 15.770 ( 3.209 1.473 -4.429) 5.664 15.974 ( -1.741 3.503 4.251) 5.777 16.143 ( -0.425 3.136 7.930) 8.538 16.493 ( 1.488 -3.657 -3.209) 5.087 16.829 ( -9.484 3.281 5.434) 11.412 17.144 ( -7.315 4.115 3.386) 9.051 17.624 ( 1.316 4.134 -3.584) 5.628 17.724 ( 5.766 1.946 -1.074) 6.179 25.642 ( -2.736 -0.639 3.699) 4.645 25.647 ( -1.924 -3.295 -0.319) 3.829 25.726 ( -0.958 -1.302 -0.082) 1.619 25.749 ( 0.993 -0.500 -0.706) 1.317 25.852 ( 1.320 1.290 0.432) 1.896 26.241 ( 5.727 0.126 -6.562) 8.711 26.407 ( -0.731 -1.305 -0.636) 1.625 26.456 ( -0.295 -1.244 -0.683) 1.449 26.789 ( 1.924 -2.120 11.348) 11.704 27.027 ( 0.137 0.826 -5.435) 5.499 27.938 ( -0.935 -2.104 3.289) 4.014 28.271 ( 0.964 -2.132 -1.720) 2.904 28.566 ( 3.572 -7.779 -5.162) 9.996 28.713 ( 8.839 -15.152 0.196) 17.543 29.207 ( -6.108 7.460 8.865) 13.098 29.712 ( -10.993 23.234 -7.813) 26.864 ======================= Grid point 145 (65/140) ======================= q-point: (-0.33 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.124 ( -11.091 -0.000 -11.639) 16.077 1.215 ( 1.691 0.000 -8.051) 8.227 1.602 ( -25.307 -0.000 -9.795) 27.136 1.742 ( -0.492 -0.000 7.745) 7.761 1.888 ( 2.000 0.000 6.609) 6.905 2.083 ( 7.298 0.000 -5.128) 8.919 2.371 ( -20.945 -0.000 -9.151) 22.857 2.434 ( 2.429 0.000 -0.312) 2.449 2.605 ( -8.294 -0.000 4.465) 9.420 2.995 ( -6.990 -0.000 -2.727) 7.503 3.016 ( 1.433 0.000 -1.321) 1.949 3.300 ( 4.338 0.000 7.355) 8.539 3.425 ( 12.898 0.000 3.302) 13.314 3.479 ( 3.908 0.000 2.619) 4.704 3.748 ( 0.492 0.000 -0.596) 0.773 3.802 ( -3.885 -0.000 -6.054) 7.193 3.991 ( 7.371 0.000 1.998) 7.637 4.058 ( -0.187 -0.000 -4.544) 4.548 4.249 ( -1.510 -0.000 8.365) 8.500 4.341 ( 2.192 0.000 -4.969) 5.431 4.644 ( 2.296 0.000 -5.399) 5.867 4.752 ( -4.635 -0.000 3.818) 6.005 4.931 ( -4.212 -0.000 2.596) 4.948 5.001 ( 10.951 0.000 -0.894) 10.988 5.309 ( -0.363 -0.000 0.006) 0.363 5.503 ( 0.125 0.000 -2.201) 2.205 5.693 ( 2.721 0.000 3.747) 4.631 5.816 ( -4.677 -0.000 -10.022) 11.059 6.207 ( -6.957 -0.000 2.153) 7.283 6.229 ( 4.827 0.000 1.738) 5.130 6.282 ( -4.159 -0.000 4.638) 6.229 6.472 ( -5.180 -0.000 3.857) 6.458 6.594 ( -1.633 -0.000 -9.022) 9.168 6.647 ( 6.808 0.000 1.368) 6.944 6.800 ( -5.066 -0.000 3.323) 6.058 6.981 ( -4.859 -0.000 1.337) 5.039 7.235 ( 1.388 0.000 8.901) 9.009 7.336 ( 15.144 0.000 2.260) 15.312 7.396 ( 6.092 0.000 -1.181) 6.205 7.621 ( -2.701 -0.000 -7.621) 8.085 8.404 ( -2.514 -0.000 -7.021) 7.457 8.561 ( 10.777 0.000 3.740) 11.408 8.673 ( 1.636 0.000 9.618) 9.756 8.861 ( 0.267 0.000 14.750) 14.752 9.007 ( 0.685 0.000 2.820) 2.902 9.290 ( -3.114 -0.000 -0.638) 3.179 9.682 ( 6.814 0.000 -3.101) 7.487 9.773 ( -0.590 -0.000 -4.013) 4.057 9.787 ( -3.967 -0.000 -8.958) 9.797 10.228 ( 3.712 0.000 -15.944) 16.371 10.654 ( -6.429 -0.000 -2.273) 6.819 10.925 ( -2.164 -0.000 -1.110) 2.432 11.195 ( -8.829 -0.000 -5.837) 10.585 11.435 ( 3.173 0.000 2.752) 4.200 11.450 ( -7.216 -0.000 5.721) 9.209 11.648 ( 0.381 0.000 -2.984) 3.008 11.771 ( -0.548 -0.000 -4.798) 4.830 11.792 ( -6.756 -0.000 -0.230) 6.760 12.082 ( 7.036 0.000 -3.623) 7.914 12.191 ( 4.129 0.000 -2.688) 4.926 12.226 ( 7.440 0.000 9.460) 12.035 12.473 ( 3.971 0.000 -3.658) 5.399 13.053 ( -1.820 -0.000 5.990) 6.261 13.189 ( 0.306 0.000 -6.056) 6.064 14.647 ( 0.870 0.000 -0.865) 1.227 14.774 ( -1.253 -0.000 4.943) 5.100 14.941 ( 4.456 0.000 7.399) 8.637 14.956 ( -2.835 -0.000 -2.293) 3.646 15.332 ( -3.830 -0.000 -6.023) 7.137 15.412 ( 9.616 0.000 -7.854) 12.416 15.621 ( 0.155 0.000 3.224) 3.227 15.766 ( -1.782 -0.000 -0.234) 1.797 15.789 ( 2.382 0.000 0.600) 2.456 16.040 ( 2.349 0.000 0.376) 2.379 16.063 ( -10.358 -0.000 4.402) 11.254 16.319 ( 3.026 0.000 3.169) 4.382 17.081 ( -14.480 -0.000 4.825) 15.263 17.453 ( 2.044 0.000 2.345) 3.111 17.531 ( 0.942 0.000 -4.392) 4.492 17.968 ( 9.114 0.000 10.571) 13.958 25.564 ( -2.252 -0.000 -1.979) 2.998 25.635 ( -0.360 -0.000 -1.478) 1.522 25.658 ( -1.610 -0.000 4.231) 4.527 25.731 ( 0.010 0.000 0.114) 0.114 25.851 ( 0.098 0.000 -0.867) 0.873 26.157 ( 0.464 0.000 -6.953) 6.969 26.343 ( -1.790 -0.000 2.089) 2.751 26.404 ( 0.388 0.000 -0.394) 0.553 26.744 ( -2.059 -0.000 -1.713) 2.678 27.077 ( -2.196 -0.000 -7.774) 8.078 27.612 ( -3.098 -0.000 9.704) 10.187 28.154 ( 6.989 0.000 0.168) 6.991 28.235 ( 1.512 0.000 2.306) 2.758 28.353 ( 1.515 0.000 -1.762) 2.323 29.411 ( -6.293 -0.000 15.358) 16.598 30.834 ( 7.598 0.000 -13.858) 15.804 ======================= Grid point 146 (66/140) ======================= q-point: (-0.22 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.068 ( -11.677 -13.871 -4.612) 18.709 1.330 ( -10.008 -10.899 -10.541) 18.167 1.440 ( -17.985 -15.492 -7.542) 24.907 1.758 ( -11.905 1.708 4.234) 12.751 2.069 ( -1.459 -13.385 3.129) 13.823 2.210 ( -4.202 -7.866 -2.994) 9.407 2.253 ( 5.470 -14.627 -1.236) 15.665 2.492 ( 2.746 -3.291 0.879) 4.375 2.670 ( -5.296 -9.147 3.798) 11.231 2.965 ( -5.000 -3.774 -2.862) 6.887 3.029 ( -0.310 -1.704 -0.700) 1.868 3.389 ( 2.884 -1.730 6.473) 7.295 3.440 ( -0.028 6.387 -1.648) 6.596 3.532 ( 11.207 0.367 1.535) 11.317 3.688 ( 2.774 4.960 -3.836) 6.857 3.844 ( 1.040 -6.120 4.705) 7.790 3.974 ( -0.253 -0.327 -1.209) 1.278 4.114 ( 3.157 5.851 6.807) 9.515 4.252 ( 3.411 -4.895 -2.930) 6.646 4.390 ( 0.245 -3.750 -6.459) 7.473 4.628 ( 1.133 0.535 -6.324) 6.447 4.680 ( -5.896 5.736 4.265) 9.266 4.889 ( -1.910 2.638 0.533) 3.300 5.084 ( 7.583 -0.613 0.225) 7.612 5.368 ( 1.266 -5.740 5.236) 7.872 5.498 ( 1.528 -0.214 -1.756) 2.338 5.704 ( 1.687 2.108 0.043) 2.700 5.745 ( -2.997 -1.224 -8.856) 9.429 6.108 ( -7.002 4.397 -2.003) 8.507 6.240 ( 2.660 1.840 0.772) 3.325 6.263 ( -7.601 1.674 3.867) 8.691 6.419 ( -2.149 3.737 2.354) 4.912 6.537 ( -0.481 0.745 -4.844) 4.924 6.684 ( -2.321 -0.568 2.952) 3.798 6.833 ( -0.981 -1.073 6.165) 6.334 6.983 ( 2.209 -4.889 -0.849) 5.432 7.283 ( 1.795 3.195 2.358) 4.358 7.320 ( 8.568 5.201 6.663) 12.036 7.483 ( 0.989 3.230 -4.239) 5.421 7.552 ( 5.155 0.147 -3.591) 6.284 8.441 ( 0.012 -9.068 -4.328) 10.047 8.696 ( 8.203 -4.320 3.869) 10.046 8.775 ( 2.390 -4.923 7.367) 9.177 8.944 ( -0.396 -0.263 2.466) 2.511 9.057 ( 1.123 -4.305 8.506) 9.599 9.264 ( -0.571 -0.769 1.613) 1.876 9.566 ( -3.788 7.766 -7.793) 11.635 9.658 ( -3.428 4.416 1.369) 5.755 9.872 ( 3.186 -5.671 -5.061) 8.242 10.457 ( 13.323 -19.558 -9.909) 25.656 10.608 ( -6.874 -3.506 -3.156) 8.337 10.916 ( -2.363 -2.021 -2.090) 3.747 11.125 ( -5.580 -1.445 -4.628) 7.392 11.397 ( -9.216 -0.770 0.345) 9.255 11.496 ( 1.395 -4.086 4.750) 6.419 11.633 ( -1.853 -1.925 -6.784) 7.291 11.737 ( -5.217 1.181 0.763) 5.403 11.809 ( 3.143 -3.182 -0.399) 4.490 12.040 ( 3.776 6.299 -2.546) 7.772 12.256 ( 4.326 -2.970 1.651) 5.500 12.319 ( 5.344 1.779 7.530) 9.403 12.508 ( 5.981 -3.487 -6.713) 9.643 13.028 ( -3.418 2.931 6.242) 7.697 13.110 ( 4.496 7.782 -6.072) 10.846 14.573 ( -0.017 6.315 0.450) 6.331 14.809 ( 1.288 0.207 3.540) 3.772 14.976 ( -1.636 -5.626 -0.671) 5.898 15.007 ( 2.916 0.767 3.698) 4.771 15.206 ( -2.203 6.936 -2.662) 7.748 15.466 ( 6.816 0.006 -7.364) 10.034 15.535 ( -3.524 6.865 2.700) 8.176 15.659 ( -4.158 7.276 -0.288) 8.385 15.820 ( 5.821 1.004 -4.429) 7.383 16.024 ( -8.880 -0.734 6.475) 11.015 16.113 ( 2.373 -5.178 1.114) 5.803 16.383 ( 3.824 -2.317 2.206) 4.985 16.969 ( -13.448 2.922 4.152) 14.374 17.355 ( -5.660 8.428 3.237) 10.656 17.593 ( 2.123 -4.132 -3.515) 5.825 17.994 ( 7.749 10.155 7.461) 14.793 25.553 ( -2.182 -1.725 -1.243) 3.047 25.637 ( -1.056 -0.857 1.405) 1.955 25.668 ( -1.683 -0.165 3.494) 3.881 25.737 ( 0.342 -0.450 0.111) 0.576 25.857 ( 0.808 -0.524 0.085) 0.967 26.178 ( 3.394 -4.771 -6.313) 8.610 26.357 ( -0.068 -0.934 2.533) 2.700 26.412 ( 0.503 -0.814 -1.169) 1.511 26.726 ( -2.379 -1.021 2.448) 3.563 27.038 ( 0.107 -0.680 -5.279) 5.324 27.720 ( -1.849 -9.403 5.565) 11.081 28.200 ( 5.055 -0.897 -1.039) 5.238 28.298 ( 1.821 -4.895 0.800) 5.284 28.392 ( 2.610 -4.041 -1.510) 5.042 29.405 ( -6.584 3.602 14.333) 16.178 30.595 ( -0.424 23.653 -17.643) 29.511 ======================= Grid point 147 (67/140) ======================= q-point: (-0.11 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.278 ( -12.480 -21.603 -4.596) 25.369 1.330 ( -22.097 -11.333 4.711) 25.277 1.671 ( -11.494 -9.205 1.740) 14.828 1.764 ( 1.264 -23.919 -4.290) 24.334 2.237 ( -3.364 -10.158 1.477) 10.802 2.434 ( 6.248 -12.722 -2.686) 14.425 2.541 ( 3.252 -4.468 5.780) 7.997 2.641 ( 5.552 -17.450 -5.585) 19.145 2.825 ( -3.673 -11.859 -0.591) 12.429 2.987 ( 2.584 0.133 -2.269) 3.441 3.077 ( -4.470 -5.062 2.237) 7.114 3.326 ( -6.801 -0.622 -0.032) 6.829 3.443 ( 1.371 0.654 4.083) 4.356 3.584 ( 3.974 2.097 3.376) 5.621 3.646 ( 6.502 1.921 -6.890) 9.666 3.969 ( -1.584 -3.378 2.041) 4.253 4.026 ( 3.771 0.584 5.886) 7.015 4.042 ( 1.686 1.593 6.948) 7.325 4.303 ( 6.215 3.944 -3.921) 8.340 4.444 ( 3.228 -7.002 -4.894) 9.132 4.521 ( -7.461 7.062 2.914) 10.678 4.612 ( -3.294 -2.527 -6.372) 7.606 4.824 ( 2.986 4.561 -5.546) 7.777 5.131 ( 2.587 0.643 2.182) 3.445 5.479 ( 1.284 -2.093 -0.424) 2.492 5.572 ( 4.428 -5.409 5.375) 8.818 5.659 ( -5.517 -2.277 -8.438) 10.335 5.736 ( 6.586 1.969 0.319) 6.881 5.948 ( -6.643 6.603 -2.172) 9.615 6.167 ( -6.965 2.646 0.611) 7.476 6.242 ( 0.659 0.613 2.270) 2.442 6.335 ( -2.165 3.555 -2.622) 4.919 6.527 ( 1.816 0.568 0.177) 1.911 6.679 ( -6.826 -1.743 1.418) 7.187 6.840 ( -3.523 0.017 6.051) 7.002 7.138 ( 3.705 -6.061 -1.252) 7.213 7.209 ( 7.398 7.921 2.231) 11.066 7.360 ( 2.918 1.475 4.192) 5.317 7.400 ( 4.388 4.969 2.694) 7.156 7.565 ( 5.872 2.067 -3.592) 7.187 8.622 ( 0.945 -11.028 -0.348) 11.074 8.836 ( -0.294 -3.226 0.408) 3.265 8.886 ( 5.785 -0.691 -0.309) 5.834 8.947 ( -0.511 -7.450 3.091) 8.082 9.216 ( -0.074 -3.504 1.495) 3.811 9.292 ( -0.363 -5.066 1.608) 5.327 9.400 ( -2.289 4.666 -2.380) 5.716 9.622 ( -4.773 -2.237 5.766) 7.812 9.969 ( 5.923 -3.456 -0.027) 6.858 10.527 ( -6.287 0.044 -3.987) 7.444 10.760 ( 2.031 -4.399 0.250) 4.852 10.959 ( 3.087 -3.580 -3.393) 5.819 11.112 ( 1.290 -2.086 -6.778) 7.208 11.372 ( -6.306 -4.171 -2.417) 7.937 11.602 ( -10.477 -4.584 -7.174) 13.500 11.630 ( 2.648 -3.504 2.775) 5.196 11.699 ( 0.078 0.660 3.499) 3.562 11.844 ( 1.932 3.968 -3.154) 5.424 11.982 ( 1.667 -0.089 2.792) 3.253 12.308 ( 1.441 1.775 2.728) 3.560 12.370 ( 4.594 -1.481 6.709) 8.265 12.592 ( 6.109 -4.106 -10.431) 12.766 12.969 ( 10.232 11.320 -5.393) 16.184 13.005 ( 3.307 3.261 6.266) 7.800 14.511 ( 1.941 1.450 1.658) 2.936 14.782 ( -1.284 6.433 1.609) 6.755 14.944 ( -2.826 3.954 1.784) 5.177 15.075 ( 2.054 -6.206 -4.156) 7.747 15.151 ( 1.257 0.375 5.790) 5.937 15.354 ( -5.307 5.434 0.057) 7.596 15.462 ( -1.952 5.785 -1.849) 6.379 15.562 ( 2.129 0.891 -3.608) 4.283 15.805 ( 5.313 2.079 -6.792) 8.870 15.995 ( -7.963 0.497 6.889) 10.541 16.212 ( 3.256 -1.689 2.604) 4.499 16.456 ( 4.763 -1.360 -0.618) 4.992 16.827 ( -12.420 3.756 5.195) 13.977 17.172 ( -11.964 6.247 5.718) 14.658 17.627 ( -0.038 -0.928 -3.453) 3.576 17.871 ( 4.983 9.992 -1.693) 11.293 25.575 ( -1.856 -3.136 -0.435) 3.670 25.639 ( -3.375 0.654 5.211) 6.243 25.684 ( -0.347 -2.025 -0.994) 2.283 25.751 ( 0.640 -0.450 0.589) 0.979 25.875 ( 1.272 -0.114 0.283) 1.308 26.254 ( 6.969 -1.450 -5.124) 8.771 26.371 ( -0.924 -0.650 -1.877) 2.191 26.442 ( 1.194 -1.802 2.439) 3.259 26.785 ( -1.164 -4.059 6.187) 7.490 27.058 ( 7.502 0.679 1.107) 7.614 27.879 ( 0.427 -6.682 0.872) 6.753 28.241 ( 2.192 -1.382 -2.955) 3.930 28.435 ( 3.306 -8.488 -3.090) 9.619 28.539 ( 5.275 -11.506 -0.133) 12.658 29.329 ( -6.560 6.764 11.400) 14.790 29.971 ( -16.569 27.641 -15.949) 35.957 ======================= Grid point 155 (68/140) ======================= q-point: (-0.22 -0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.762 ( -20.681 -0.000 -9.352) 22.697 1.015 ( -31.158 -0.000 -16.359) 35.191 1.185 ( 1.805 0.000 -3.059) 3.552 1.609 ( -38.903 -0.000 4.655) 39.181 1.976 ( 3.678 0.000 1.435) 3.948 2.063 ( 1.735 0.000 6.387) 6.618 2.193 ( 8.549 0.000 0.172) 8.551 2.513 ( 6.010 0.000 2.423) 6.480 2.594 ( -3.371 -0.000 5.013) 6.041 2.857 ( -7.158 -0.000 -3.270) 7.870 3.014 ( -0.989 -0.000 -0.324) 1.041 3.396 ( 4.297 0.000 -1.970) 4.727 3.584 ( 2.828 0.000 2.832) 4.002 3.617 ( 7.876 0.000 1.412) 8.001 3.693 ( -3.274 -0.000 -3.448) 4.755 3.773 ( -0.738 -0.000 6.238) 6.281 4.066 ( 7.122 0.000 -3.702) 8.027 4.127 ( 10.553 0.000 -3.543) 11.132 4.261 ( -2.034 -0.000 0.510) 2.097 4.334 ( 2.288 0.000 -0.678) 2.386 4.630 ( 1.665 0.000 -4.628) 4.918 4.712 ( -6.335 -0.000 6.928) 9.388 4.895 ( -3.961 -0.000 2.194) 4.528 5.156 ( 8.039 0.000 0.662) 8.066 5.318 ( -1.642 -0.000 4.970) 5.235 5.489 ( -1.978 -0.000 -0.627) 2.075 5.633 ( -3.091 -0.000 -11.551) 11.958 5.762 ( 3.476 0.000 0.122) 3.478 6.081 ( -5.545 -0.000 -3.309) 6.457 6.256 ( -6.276 -0.000 4.851) 7.932 6.270 ( 0.526 0.000 -0.821) 0.975 6.472 ( -0.821 -0.000 -9.003) 9.040 6.488 ( -1.844 -0.000 8.396) 8.596 6.730 ( 1.778 0.000 -2.212) 2.839 6.772 ( -3.598 -0.000 3.880) 5.292 6.952 ( -1.369 -0.000 0.755) 1.564 7.301 ( -2.176 -0.000 5.392) 5.815 7.430 ( 1.803 0.000 -7.349) 7.567 7.562 ( 3.530 0.000 -1.046) 3.682 7.571 ( 12.378 0.000 2.068) 12.550 8.337 ( 1.019 0.000 -3.276) 3.431 8.739 ( 6.705 0.000 2.474) 7.147 8.777 ( 0.869 0.000 6.784) 6.840 8.961 ( 1.200 0.000 -3.798) 3.983 9.085 ( 3.881 0.000 7.517) 8.460 9.244 ( -1.787 -0.000 -0.184) 1.797 9.655 ( -3.437 -0.000 -5.582) 6.555 9.735 ( 2.543 0.000 -5.570) 6.123 9.789 ( 4.476 0.000 12.749) 13.512 10.195 ( 6.567 0.000 -7.369) 9.870 10.516 ( -6.763 -0.000 -3.768) 7.742 10.876 ( -2.439 -0.000 -1.147) 2.695 11.055 ( -4.876 -0.000 -1.383) 5.069 11.308 ( -10.511 -0.000 0.401) 10.519 11.435 ( -8.967 -0.000 -4.325) 9.956 11.601 ( 3.794 0.000 -2.819) 4.727 11.738 ( -2.656 -0.000 3.751) 4.596 11.802 ( 3.756 0.000 -0.023) 3.756 12.115 ( 2.221 0.000 -2.620) 3.434 12.267 ( 6.745 0.000 1.269) 6.864 12.429 ( 5.160 0.000 7.723) 9.288 12.462 ( 1.900 0.000 -8.711) 8.916 13.031 ( -9.106 -0.000 8.390) 12.382 13.204 ( 9.162 0.000 -3.351) 9.756 14.670 ( 2.969 0.000 -0.272) 2.982 14.791 ( -1.460 -0.000 3.118) 3.443 14.908 ( -1.564 -0.000 -0.808) 1.760 15.075 ( 3.413 0.000 3.103) 4.613 15.223 ( -3.351 -0.000 0.080) 3.352 15.471 ( 6.821 0.000 -6.778) 9.616 15.615 ( -2.047 -0.000 -3.264) 3.853 15.729 ( -1.535 -0.000 1.055) 1.863 15.877 ( 10.155 0.000 -4.946) 11.295 15.933 ( -13.053 -0.000 7.867) 15.241 16.072 ( 1.013 0.000 0.702) 1.233 16.409 ( 4.534 0.000 2.991) 5.432 16.901 ( -14.117 -0.000 3.794) 14.618 17.466 ( -3.159 -0.000 2.263) 3.886 17.514 ( 2.969 0.000 -5.004) 5.819 18.223 ( 10.486 0.000 8.051) 13.220 25.517 ( -2.047 -0.000 -0.652) 2.149 25.616 ( -0.447 -0.000 -0.810) 0.925 25.715 ( -0.549 -0.000 14.754) 14.765 25.737 ( 0.537 0.000 0.135) 0.553 25.860 ( 0.412 0.000 1.656) 1.706 26.087 ( -0.203 -0.000 -6.164) 6.167 26.366 ( 0.369 0.000 3.096) 3.118 26.409 ( 0.880 0.000 -0.236) 0.911 26.696 ( -3.303 -0.000 1.813) 3.768 26.992 ( -1.086 -0.000 -4.731) 4.854 27.635 ( -3.470 -0.000 5.243) 6.287 28.215 ( 3.926 0.000 -3.860) 5.505 28.279 ( 1.391 0.000 1.585) 2.109 28.367 ( 2.213 0.000 -1.398) 2.617 29.454 ( -7.110 -0.000 14.049) 15.746 30.756 ( 6.051 0.000 -30.159) 30.760 ======================= Grid point 156 (69/140) ======================= q-point: (-0.11 -0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.770 ( -17.788 -20.867 -3.630) 27.659 0.919 ( -21.371 -20.915 0.538) 29.907 1.321 ( -28.585 -13.044 7.675) 32.344 1.390 ( -8.903 -13.048 -1.544) 15.871 2.126 ( 5.565 -10.070 3.877) 12.141 2.241 ( 3.925 -10.875 2.730) 11.880 2.370 ( 8.532 -14.152 -2.962) 16.788 2.560 ( -0.665 0.484 2.347) 2.487 2.644 ( -0.110 -6.682 2.100) 7.005 2.859 ( -6.637 -8.306 -0.285) 10.635 3.010 ( -1.400 -0.808 0.346) 1.653 3.381 ( 0.464 5.200 -5.587) 7.647 3.495 ( 0.667 5.699 3.641) 6.795 3.635 ( -1.417 0.156 1.755) 2.261 3.681 ( 4.932 0.509 -3.455) 6.043 3.935 ( -0.289 -9.519 4.899) 10.710 4.042 ( 8.811 4.522 3.937) 10.657 4.190 ( 0.906 5.079 -0.546) 5.188 4.285 ( 4.347 -8.249 -7.731) 12.113 4.369 ( 6.400 0.334 -0.815) 6.461 4.571 ( -0.854 4.804 -4.298) 6.502 4.644 ( -6.843 5.859 8.160) 12.155 4.875 ( 1.596 1.362 -4.390) 4.865 5.185 ( 4.089 1.633 3.532) 5.645 5.425 ( -0.239 -6.779 4.526) 8.155 5.470 ( -7.966 -4.241 -2.373) 9.332 5.598 ( 5.540 -0.399 -9.051) 10.620 5.788 ( 4.745 -0.743 -1.395) 5.001 5.996 ( -3.561 4.450 -3.032) 6.455 6.180 ( -7.089 4.252 3.568) 9.003 6.257 ( -0.904 0.531 -0.880) 1.369 6.374 ( -0.484 4.717 -3.001) 5.612 6.527 ( -2.379 -0.010 -0.380) 2.409 6.615 ( -7.415 0.087 4.083) 8.465 6.870 ( -2.380 2.938 4.142) 5.608 7.025 ( 5.462 -11.299 -3.040) 12.913 7.311 ( -0.816 -0.307 0.730) 1.138 7.427 ( 6.439 0.295 1.089) 6.537 7.566 ( 7.944 4.151 4.887) 10.209 7.619 ( 5.504 2.998 -3.909) 7.386 8.442 ( 2.427 -10.005 1.103) 10.354 8.776 ( -2.165 -1.058 -3.089) 3.918 8.858 ( 0.783 -5.110 4.945) 7.154 8.906 ( 2.068 -0.481 -7.618) 7.909 9.179 ( 1.219 -2.589 4.282) 5.150 9.240 ( -0.798 -1.210 -1.671) 2.212 9.483 ( -1.020 8.415 1.222) 8.564 9.643 ( -4.008 4.217 8.668) 10.439 9.959 ( 7.256 -4.064 6.715) 10.689 10.454 ( -5.553 -0.496 -2.868) 6.269 10.680 ( 20.797 -21.633 -2.602) 30.120 10.865 ( 1.334 -5.151 -4.875) 7.217 11.036 ( -3.206 -1.666 -1.806) 4.039 11.248 ( -8.292 -2.138 -1.246) 8.654 11.373 ( -12.153 -6.479 -5.810) 14.947 11.647 ( 4.608 -1.133 4.987) 6.884 11.730 ( -1.314 0.793 3.366) 3.699 11.850 ( 2.856 -1.828 -1.222) 3.604 12.062 ( 0.866 5.544 0.538) 5.637 12.352 ( 3.008 0.149 2.339) 3.813 12.414 ( 5.907 -0.921 -1.191) 6.096 12.523 ( 3.452 -3.486 -6.889) 8.457 13.010 ( -4.824 -1.035 7.003) 8.566 13.246 ( 15.471 5.635 4.122) 16.973 14.607 ( 3.004 6.067 2.129) 7.096 14.847 ( -0.235 -0.722 2.004) 2.142 14.940 ( -1.376 -4.928 -1.803) 5.425 15.024 ( -1.466 4.641 -2.322) 5.393 15.226 ( 2.355 2.106 7.207) 7.869 15.448 ( -6.427 10.468 -4.064) 12.939 15.502 ( 0.746 1.257 -1.896) 2.394 15.602 ( -1.507 7.114 -1.996) 7.541 15.859 ( 5.613 3.224 -6.254) 9.001 15.939 ( -8.475 -2.729 7.057) 11.361 16.168 ( 4.506 -6.010 -1.070) 7.587 16.489 ( 6.120 -2.175 2.863) 7.098 16.801 ( -12.611 1.892 3.065) 13.115 17.262 ( -13.403 13.834 5.866) 20.136 17.579 ( 0.823 -2.902 -3.881) 4.915 18.092 ( -0.469 16.435 -6.524) 17.689 25.517 ( -1.625 -1.900 0.026) 2.500 25.630 ( -0.511 -1.784 -0.364) 1.891 25.708 ( -2.579 5.382 10.293) 11.898 25.752 ( 0.391 -0.156 2.235) 2.275 25.873 ( 0.697 -0.795 0.253) 1.087 26.226 ( 8.771 -7.251 -5.072) 12.460 26.372 ( 0.408 0.624 3.470) 3.549 26.433 ( 0.949 -1.476 1.840) 2.542 26.727 ( -2.505 -2.768 5.588) 6.720 27.122 ( 16.451 -10.058 8.282) 20.985 27.721 ( -0.867 -10.985 -0.153) 11.020 28.228 ( 2.909 -0.705 -3.921) 4.933 28.329 ( 1.629 -4.712 -0.137) 4.987 28.425 ( 2.983 -5.673 -1.119) 6.507 29.425 ( -7.579 4.147 11.257) 14.190 30.209 ( -22.473 32.683 -37.291) 54.441 ======================= Grid point 165 (70/140) ======================= q-point: (-0.11 -0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.400 ( -19.267 -0.000 8.219) 20.947 0.472 ( -20.844 -0.000 15.418) 25.927 0.983 ( -45.130 -0.000 21.613) 50.039 1.265 ( 0.728 0.000 0.378) 0.820 2.026 ( 2.158 0.000 -0.486) 2.212 2.217 ( 4.492 0.000 6.960) 8.284 2.321 ( 11.101 0.000 -5.365) 12.330 2.555 ( -4.724 -0.000 -0.675) 4.772 2.629 ( 1.933 0.000 6.137) 6.434 2.712 ( -7.247 -0.000 -2.810) 7.773 2.995 ( -2.054 -0.000 2.249) 3.045 3.395 ( 1.873 0.000 -7.697) 7.921 3.608 ( -0.273 -0.000 0.102) 0.291 3.634 ( -1.339 -0.000 -1.741) 2.196 3.692 ( 2.222 0.000 -1.322) 2.586 3.832 ( -1.864 -0.000 9.210) 9.397 4.177 ( 6.619 0.000 -0.381) 6.630 4.215 ( 6.846 0.000 -4.095) 7.977 4.224 ( 0.945 0.000 -3.608) 3.730 4.433 ( 9.589 0.000 -1.115) 9.654 4.606 ( 1.349 0.000 -3.481) 3.734 4.707 ( -4.489 -0.000 5.389) 7.014 4.830 ( -6.038 -0.000 -1.135) 6.144 5.252 ( 3.361 0.000 0.888) 3.477 5.355 ( -1.387 -0.000 6.451) 6.599 5.360 ( -7.958 -0.000 -1.521) 8.102 5.587 ( 5.756 0.000 -8.743) 10.468 5.796 ( 2.871 0.000 -3.530) 4.550 5.999 ( -1.365 -0.000 -2.086) 2.493 6.200 ( -6.630 -0.000 5.230) 8.444 6.247 ( -1.356 -0.000 -2.343) 2.708 6.367 ( -7.787 -0.000 -9.057) 11.944 6.547 ( -1.711 -0.000 8.005) 8.186 6.726 ( 7.517 0.000 10.768) 13.132 6.753 ( -3.467 -0.000 3.174) 4.700 6.921 ( -2.064 -0.000 -0.704) 2.181 7.276 ( -3.853 -0.000 -0.243) 3.860 7.485 ( 9.825 0.000 6.600) 11.836 7.598 ( 2.667 0.000 -5.158) 5.806 7.746 ( 6.775 0.000 2.728) 7.303 8.398 ( 7.158 0.000 3.315) 7.888 8.761 ( -11.937 -0.000 -16.749) 20.568 8.775 ( -0.331 -0.000 -2.076) 2.102 8.842 ( 0.192 0.000 2.728) 2.735 9.175 ( -0.950 -0.000 2.120) 2.323 9.223 ( -1.131 -0.000 -0.731) 1.347 9.616 ( 1.709 0.000 1.074) 2.019 9.762 ( 6.555 0.000 -3.643) 7.499 10.255 ( 24.687 0.000 31.726) 40.199 10.260 ( 5.194 0.000 -1.015) 5.292 10.412 ( -2.203 -0.000 -0.206) 2.213 10.842 ( -0.340 -0.000 0.527) 0.628 11.008 ( -2.132 -0.000 2.498) 3.284 11.185 ( -6.719 -0.000 2.545) 7.185 11.193 ( -6.511 -0.000 3.760) 7.519 11.703 ( 2.920 0.000 9.541) 9.978 11.734 ( -1.647 -0.000 2.179) 2.731 11.851 ( 2.857 0.000 -0.426) 2.888 12.156 ( 5.169 0.000 4.430) 6.808 12.358 ( -1.366 -0.000 -11.056) 11.140 12.415 ( 9.971 0.000 0.075) 9.971 12.490 ( -1.698 -0.000 -0.395) 1.744 12.972 ( -11.817 -0.000 14.311) 18.559 13.478 ( 25.850 0.000 11.983) 28.493 14.736 ( 4.641 0.000 1.140) 4.779 14.794 ( 0.353 0.000 -0.145) 0.381 14.883 ( -2.165 -0.000 0.916) 2.351 15.030 ( -3.441 -0.000 -3.012) 4.573 15.316 ( 3.377 0.000 8.894) 9.513 15.431 ( -13.712 -0.000 -14.285) 19.801 15.487 ( 3.268 0.000 -5.681) 6.553 15.733 ( 0.391 0.000 0.366) 0.536 15.894 ( -0.177 -0.000 13.048) 13.049 15.994 ( 12.566 0.000 -7.685) 14.730 16.087 ( -0.039 -0.000 1.339) 1.339 16.498 ( 0.779 0.000 3.989) 4.064 16.744 ( -7.773 -0.000 1.648) 7.946 17.412 ( -6.032 -0.000 2.093) 6.385 17.524 ( 4.046 0.000 -4.190) 5.825 18.151 ( -22.492 -0.000 -47.609) 52.654 25.492 ( -1.089 -0.000 0.661) 1.274 25.607 ( -0.105 -0.000 -0.330) 0.346 25.750 ( 0.443 0.000 0.883) 0.988 25.865 ( 1.066 0.000 0.368) 1.127 26.035 ( 9.036 0.000 16.389) 18.715 26.050 ( 1.473 0.000 -2.969) 3.314 26.393 ( -0.342 -0.000 1.701) 1.735 26.433 ( 0.455 0.000 0.895) 1.004 26.953 ( 0.577 0.000 -2.021) 2.102 26.965 ( 36.122 0.000 63.472) 73.031 27.608 ( -3.400 -0.000 0.360) 3.419 28.227 ( 3.262 0.000 -3.864) 5.057 28.302 ( 0.377 0.000 0.147) 0.405 28.389 ( 2.185 0.000 -1.293) 2.539 29.447 ( -8.811 -0.000 8.740) 12.410 30.057 ( -47.164 -0.000 -86.695) 98.694 ======================= Grid point 166 (71/140) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.016 ( 8.048 0.000 24.174) 25.479 1.180 ( -18.110 -0.000 27.098) 32.593 1.434 ( -0.286 -0.000 8.195) 8.200 1.862 ( 14.559 0.000 29.631) 33.014 1.931 ( -1.234 -0.000 -6.931) 7.040 2.163 ( 9.983 0.000 -16.600) 19.371 2.180 ( -0.257 -0.000 -4.680) 4.687 2.513 ( -5.055 -0.000 12.805) 13.767 2.596 ( 3.687 0.000 -0.472) 3.717 2.855 ( -5.826 -0.000 10.597) 12.092 3.091 ( -11.668 -0.000 -11.145) 16.135 3.135 ( -0.022 -0.000 8.343) 8.343 3.342 ( 2.870 0.000 -12.313) 12.643 3.500 ( 0.193 0.000 -10.120) 10.122 3.863 ( 0.813 0.000 7.579) 7.623 3.977 ( -2.784 -0.000 -4.746) 5.502 3.977 ( -0.951 -0.000 -2.771) 2.930 4.297 ( 8.417 0.000 -9.821) 12.935 4.358 ( 4.144 0.000 -0.491) 4.173 4.366 ( -2.904 -0.000 0.934) 3.050 4.631 ( 1.915 0.000 6.562) 6.836 4.666 ( -4.589 -0.000 3.638) 5.856 4.788 ( 0.140 0.000 6.000) 6.002 5.243 ( 2.310 0.000 -16.825) 16.983 5.340 ( -6.511 -0.000 1.723) 6.736 5.361 ( -2.494 -0.000 0.654) 2.578 5.362 ( 7.008 0.000 2.125) 7.324 5.622 ( -0.461 -0.000 -9.750) 9.761 6.024 ( 0.257 0.000 2.671) 2.684 6.144 ( 5.520 0.000 -3.070) 6.316 6.278 ( -4.573 -0.000 5.079) 6.834 6.350 ( 3.860 0.000 1.107) 4.015 6.689 ( -4.601 -0.000 5.366) 7.068 6.813 ( -6.078 -0.000 5.917) 8.483 6.818 ( -1.243 -0.000 -2.982) 3.231 7.056 ( 13.424 0.000 -3.669) 13.916 7.138 ( -2.129 -0.000 -1.893) 2.849 7.275 ( -5.241 -0.000 -8.919) 10.345 7.882 ( -2.091 -0.000 3.192) 3.816 7.894 ( 3.989 0.000 3.588) 5.366 8.439 ( -1.710 -0.000 4.830) 5.124 8.620 ( 3.043 0.000 -2.715) 4.078 8.634 ( -1.080 -0.000 -5.326) 5.434 8.739 ( -4.405 -0.000 -6.056) 7.489 9.178 ( -2.048 -0.000 0.855) 2.219 9.233 ( 5.926 0.000 0.096) 5.927 9.704 ( -4.379 -0.000 3.237) 5.445 9.800 ( 4.890 0.000 -1.563) 5.134 10.336 ( -12.044 -0.000 3.391) 12.512 10.353 ( 6.855 0.000 2.935) 7.457 10.579 ( 4.457 0.000 5.190) 6.841 10.759 ( -1.632 -0.000 -3.803) 4.138 11.141 ( -2.632 -0.000 4.982) 5.634 11.362 ( -1.139 -0.000 10.824) 10.883 11.367 ( 15.428 0.000 -9.633) 18.189 11.660 ( -3.466 -0.000 -3.041) 4.611 11.889 ( -0.940 -0.000 1.699) 1.942 11.973 ( 4.632 0.000 -0.309) 4.642 12.035 ( 3.620 0.000 -5.437) 6.532 12.207 ( -5.724 -0.000 -10.695) 12.131 12.499 ( -2.947 -0.000 5.180) 5.960 12.593 ( 8.092 0.000 0.296) 8.097 13.304 ( -11.032 -0.000 17.673) 20.834 13.847 ( 2.516 0.000 -10.045) 10.355 14.776 ( 2.402 0.000 -2.463) 3.440 14.777 ( 1.109 0.000 -1.794) 2.109 14.875 ( -1.053 -0.000 1.235) 1.623 14.907 ( -4.254 -0.000 -0.426) 4.275 15.130 ( 3.179 0.000 4.120) 5.204 15.334 ( 1.713 0.000 -6.908) 7.117 15.500 ( -11.247 -0.000 8.271) 13.961 15.724 ( 2.413 0.000 -1.199) 2.694 15.865 ( -2.904 -0.000 -5.481) 6.203 15.914 ( 7.566 0.000 -8.881) 11.667 16.481 ( 20.333 0.000 1.745) 20.407 16.505 ( -11.238 -0.000 1.400) 11.325 16.744 ( -29.416 -0.000 4.850) 29.813 16.800 ( 10.363 0.000 1.842) 10.526 17.374 ( -6.432 -0.000 2.052) 6.751 17.496 ( 7.213 0.000 -3.616) 8.069 25.544 ( 0.448 0.000 2.505) 2.545 25.601 ( 0.353 0.000 -0.466) 0.585 25.786 ( 0.208 0.000 0.646) 0.679 25.807 ( -2.930 -0.000 -1.456) 3.271 26.067 ( -3.667 -0.000 2.366) 4.364 26.089 ( 5.121 0.000 0.812) 5.185 26.379 ( -2.488 -0.000 -0.110) 2.490 26.402 ( -0.094 -0.000 -1.233) 1.237 27.023 ( 5.757 0.000 4.151) 7.098 27.320 ( -8.893 -0.000 -9.998) 13.381 28.117 ( -32.957 -0.000 3.153) 33.107 28.214 ( 8.348 0.000 -2.459) 8.702 28.296 ( -4.332 -0.000 1.458) 4.571 28.382 ( 3.184 0.000 -1.747) 3.632 29.296 ( 58.044 0.000 3.476) 58.148 29.357 ( -21.837 -0.000 0.282) 21.839 ======================= Grid point 167 (72/140) ======================= q-point: ( 0.11 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.176 ( -5.256 -4.922 22.563) 23.684 1.365 ( 4.535 -12.202 19.324) 23.300 1.618 ( -4.221 -15.681 0.089) 16.239 1.939 ( -4.484 -7.315 -3.238) 9.171 2.078 ( 9.632 -6.780 -2.384) 12.018 2.237 ( 13.560 -7.023 -16.553) 22.521 2.296 ( 1.702 -8.838 19.379) 21.367 2.700 ( 2.376 -12.420 8.846) 15.432 2.721 ( 6.971 -10.504 7.649) 14.746 2.870 ( -7.190 -1.492 11.083) 13.295 2.967 ( -11.400 -3.777 -12.439) 17.290 3.176 ( 0.633 0.209 7.807) 7.835 3.310 ( 2.437 -0.644 -10.957) 11.243 3.434 ( -1.117 1.591 -9.701) 9.894 3.845 ( -5.006 4.021 -5.239) 8.287 3.919 ( 0.383 0.585 4.569) 4.622 3.986 ( -1.538 -0.675 3.380) 3.775 4.233 ( 1.972 5.836 -6.534) 8.981 4.335 ( -7.175 0.538 -4.460) 8.465 4.382 ( 2.518 -2.087 -4.158) 5.290 4.659 ( 4.617 2.198 5.859) 7.776 4.683 ( 3.038 0.514 5.343) 6.167 4.867 ( 2.892 -3.521 8.218) 9.397 5.149 ( -6.062 -0.556 -16.329) 17.426 5.272 ( -1.871 4.204 1.122) 4.736 5.387 ( 0.304 -3.103 -0.970) 3.266 5.467 ( 8.045 -3.045 2.654) 9.002 5.609 ( -2.447 -5.446 -9.653) 11.350 5.992 ( 1.408 5.225 2.085) 5.799 6.130 ( 2.940 5.161 -3.591) 6.941 6.275 ( 0.662 -0.419 4.478) 4.546 6.387 ( 4.315 0.953 -0.878) 4.506 6.648 ( -5.163 3.272 5.565) 8.267 6.725 ( -0.770 3.402 1.743) 3.899 6.814 ( -2.522 1.681 3.503) 4.632 7.099 ( 9.271 3.942 -6.619) 12.054 7.135 ( -1.952 -1.035 -0.755) 2.334 7.210 ( -4.621 -1.588 -5.639) 7.461 7.786 ( -6.082 7.149 3.781) 10.120 7.863 ( -3.615 4.757 1.014) 6.060 8.528 ( 2.013 -6.453 4.590) 8.171 8.632 ( 0.411 -4.354 -3.781) 5.781 8.683 ( -2.639 -7.436 -1.223) 7.985 8.777 ( -2.815 -9.470 -6.456) 11.802 9.166 ( -1.951 0.031 2.945) 3.533 9.316 ( 4.703 -3.293 -2.027) 6.089 9.676 ( -5.789 -0.750 3.394) 6.752 9.773 ( -0.068 4.411 0.565) 4.448 10.239 ( -7.521 2.375 7.974) 11.216 10.549 ( 10.548 -9.565 -2.729) 14.498 10.646 ( 3.783 -1.576 5.062) 6.513 10.734 ( -0.702 -0.531 -4.207) 4.298 11.124 ( -4.374 0.571 0.029) 4.411 11.368 ( 7.705 2.931 -2.851) 8.722 11.451 ( 2.424 -1.833 4.704) 5.601 11.640 ( -2.080 -2.367 -3.014) 4.360 11.857 ( -0.595 3.185 3.263) 4.598 11.992 ( 4.702 2.382 -0.164) 5.273 12.045 ( 4.355 1.255 -4.639) 6.486 12.079 ( -3.368 3.667 -9.269) 10.522 12.415 ( -6.404 5.614 6.835) 10.920 12.639 ( 5.132 1.936 -4.638) 7.184 13.298 ( -12.840 -0.398 14.636) 19.474 13.737 ( -9.210 3.439 -5.312) 11.174 14.748 ( 0.760 1.804 1.131) 2.261 14.804 ( -2.649 -2.497 0.033) 3.640 14.880 ( 3.507 4.244 -0.537) 5.532 14.945 ( 0.216 -3.951 0.945) 4.068 15.130 ( 3.295 2.801 0.276) 4.333 15.246 ( 3.522 5.566 -4.265) 7.847 15.459 ( -6.585 -0.131 1.135) 6.683 15.599 ( 1.353 11.376 -0.657) 11.475 15.811 ( -3.968 -2.606 2.324) 5.285 16.049 ( 4.711 -7.399 -8.875) 12.478 16.400 ( -15.719 2.404 0.929) 15.929 16.510 ( -0.449 0.320 6.654) 6.677 16.674 ( 5.799 5.036 1.451) 7.816 16.916 ( 9.598 -1.798 3.445) 10.355 17.384 ( -0.138 -3.586 -1.974) 4.096 17.560 ( 5.972 -2.682 -4.021) 7.683 25.568 ( 0.509 -1.041 2.053) 2.358 25.611 ( 0.532 -1.082 -0.822) 1.459 25.790 ( -2.515 -0.974 0.464) 2.737 25.801 ( -0.735 -1.312 0.526) 1.593 26.014 ( -1.846 3.863 4.847) 6.468 26.137 ( 4.447 -0.470 -1.127) 4.611 26.357 ( -1.940 -0.240 -0.401) 1.995 26.411 ( -0.425 -0.884 -3.087) 3.239 27.047 ( 6.410 4.553 9.917) 12.655 27.194 ( -9.583 1.299 -8.418) 12.822 28.008 ( -21.201 -7.035 4.679) 22.823 28.238 ( 1.339 -2.094 -1.737) 3.032 28.396 ( 1.973 -9.170 1.916) 9.574 28.427 ( -1.111 -4.493 -0.674) 4.677 29.152 ( -17.935 3.401 -4.827) 18.882 29.602 ( 45.379 11.116 -3.606) 46.860 ======================= Grid point 168 (73/140) ======================= q-point: ( 0.22 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.376 ( 1.345 -9.026 15.961) 18.386 1.694 ( 5.703 -11.685 10.990) 17.025 1.778 ( -8.327 -13.444 -4.828) 16.534 2.111 ( 0.033 -13.130 1.044) 13.172 2.285 ( 7.015 -9.428 -2.568) 12.029 2.381 ( 13.205 -7.764 -12.166) 19.562 2.584 ( -0.495 -12.290 13.797) 18.484 2.849 ( -1.776 -5.823 -7.052) 9.316 2.896 ( -8.846 -5.447 0.445) 10.399 2.964 ( -5.523 -8.877 1.742) 10.599 3.096 ( 2.518 -12.470 11.182) 16.937 3.217 ( 2.743 0.246 4.351) 5.150 3.275 ( -0.691 0.255 -10.558) 10.583 3.404 ( 6.373 -3.996 -0.895) 7.575 3.734 ( -7.094 1.096 -0.972) 7.244 3.856 ( -4.210 5.549 3.258) 7.690 4.045 ( 0.231 -0.052 2.392) 2.403 4.107 ( 0.166 5.058 3.990) 6.445 4.271 ( -4.503 -3.719 -7.172) 9.250 4.435 ( 6.055 -2.357 -4.128) 7.698 4.647 ( 3.484 3.235 -1.853) 5.102 4.732 ( 5.372 1.250 2.076) 5.894 4.974 ( 0.001 -0.635 4.133) 4.181 5.028 ( -6.486 -0.283 -10.410) 12.268 5.209 ( 0.177 2.230 3.970) 4.557 5.443 ( 4.193 -2.215 -4.107) 6.274 5.590 ( 2.146 -5.672 2.227) 6.461 5.669 ( -2.663 -7.902 -4.764) 9.603 5.920 ( 1.929 4.927 0.750) 5.344 6.023 ( 2.344 7.330 -3.037) 8.274 6.298 ( 0.025 1.425 4.292) 4.523 6.361 ( 1.624 2.620 -3.258) 4.485 6.614 ( -3.005 -1.097 0.895) 3.322 6.698 ( -1.567 1.891 2.613) 3.585 6.780 ( 2.350 4.055 5.919) 7.550 7.010 ( 2.001 4.284 -7.346) 8.736 7.134 ( -2.618 0.998 0.771) 2.905 7.194 ( 1.404 -0.190 -0.559) 1.523 7.624 ( -8.244 6.741 2.493) 10.937 7.762 ( -2.156 4.434 0.601) 4.967 8.656 ( -3.123 -7.568 -1.309) 8.291 8.748 ( 4.264 -6.516 2.895) 8.308 8.813 ( -4.901 -10.287 -0.730) 11.419 8.896 ( -3.073 -11.022 -5.133) 12.541 9.177 ( -1.600 -0.900 4.745) 5.088 9.341 ( -1.109 0.272 -3.364) 3.552 9.680 ( -5.016 2.369 1.930) 5.873 9.710 ( -0.057 -1.592 3.244) 3.614 10.202 ( -5.375 1.416 8.282) 9.974 10.699 ( 0.045 -0.643 -2.009) 2.110 10.743 ( 6.593 -4.037 1.762) 7.929 10.788 ( 11.064 -5.672 -2.704) 12.724 11.064 ( -6.066 -0.877 -6.531) 8.956 11.370 ( 6.734 1.096 -3.972) 7.895 11.510 ( -0.349 -1.214 5.024) 5.180 11.673 ( -0.375 -3.921 -3.082) 5.002 11.830 ( 3.336 4.286 5.296) 7.586 11.872 ( -3.663 7.657 -3.101) 9.037 12.011 ( 3.893 1.089 -1.754) 4.407 12.065 ( 6.032 0.601 -3.820) 7.165 12.316 ( -6.010 4.896 6.461) 10.092 12.556 ( 3.206 7.164 -7.888) 11.127 13.239 ( -13.902 2.371 8.693) 16.567 13.560 ( -9.467 6.825 -3.120) 12.081 14.718 ( -4.958 4.144 4.963) 8.148 14.764 ( -0.184 4.409 2.354) 5.002 14.853 ( 1.526 -1.042 -1.346) 2.287 14.980 ( -2.251 -2.461 2.934) 4.442 15.125 ( 2.826 1.316 -4.898) 5.806 15.253 ( 8.701 -0.806 -1.536) 8.872 15.423 ( 0.734 0.064 -4.800) 4.856 15.473 ( 1.773 5.381 2.659) 6.258 15.805 ( -7.968 -0.132 2.547) 8.366 16.113 ( 2.152 -0.602 -5.566) 5.997 16.271 ( -10.552 0.935 2.178) 10.815 16.569 ( -0.583 -3.197 6.723) 7.467 16.608 ( 5.079 6.794 0.741) 8.515 17.030 ( 8.994 -0.720 3.725) 9.762 17.426 ( 1.327 -1.988 -4.435) 5.038 17.619 ( 5.208 -1.507 -4.025) 6.752 25.602 ( 0.235 -1.757 1.233) 2.159 25.638 ( 1.180 -1.832 -0.891) 2.354 25.795 ( -2.446 -0.975 2.209) 3.437 25.819 ( -1.136 -1.026 0.756) 1.708 25.959 ( -1.972 3.864 3.836) 5.791 26.160 ( 5.239 0.995 -3.761) 6.525 26.355 ( -1.535 -1.124 0.098) 1.905 26.407 ( 0.081 -1.389 -1.990) 2.428 27.022 ( -5.462 3.581 0.740) 6.573 27.125 ( 5.066 2.840 5.323) 7.878 27.991 ( -12.199 -3.771 3.819) 13.327 28.263 ( -4.724 -2.909 -5.812) 8.035 28.525 ( -6.013 -10.454 0.201) 12.062 28.576 ( -3.211 -10.122 1.241) 10.692 28.990 ( -3.102 0.693 -4.779) 5.739 29.634 ( 31.930 17.522 -2.981) 36.544 ======================= Grid point 169 (74/140) ======================= q-point: ( 0.33 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.621 ( 6.120 -7.919 10.424) 14.451 1.896 ( -5.150 -6.791 9.884) 13.051 1.951 ( 1.540 -11.152 -2.519) 11.537 2.291 ( -1.567 -7.878 -3.080) 8.603 2.432 ( 11.494 -5.160 -8.363) 15.122 2.589 ( 6.232 -9.396 -1.448) 11.368 2.745 ( -1.631 -2.854 3.227) 4.606 2.858 ( -4.392 -0.736 3.463) 5.641 2.924 ( -6.887 -5.714 -9.418) 12.991 3.062 ( -1.034 -3.380 1.965) 4.044 3.129 ( -5.092 -1.158 -8.687) 10.136 3.257 ( 0.993 -1.529 0.064) 1.824 3.347 ( -3.780 -10.315 5.233) 12.169 3.518 ( 1.160 3.496 5.241) 6.406 3.708 ( -5.117 3.589 -0.842) 6.307 3.794 ( 1.521 -4.751 7.740) 9.209 3.973 ( -0.544 0.670 0.821) 1.191 4.182 ( 2.358 -1.975 6.793) 7.457 4.307 ( 4.408 -3.658 -6.675) 8.796 4.490 ( 4.928 0.031 -0.849) 5.000 4.609 ( 4.172 3.775 -1.890) 5.936 4.751 ( 1.808 -2.473 -6.686) 7.354 4.895 ( -7.198 1.778 -2.479) 7.818 4.976 ( 1.076 3.789 -0.995) 4.063 5.272 ( 1.409 -4.732 6.274) 7.984 5.458 ( 3.203 0.420 -8.111) 8.730 5.716 ( -0.898 -5.838 5.340) 7.963 5.760 ( -2.213 -6.205 -1.003) 6.664 5.851 ( -1.663 3.673 -4.969) 6.399 5.956 ( 7.271 1.549 1.759) 7.640 6.261 ( -3.439 2.189 0.411) 4.097 6.351 ( 3.295 0.003 0.052) 3.296 6.575 ( -9.868 1.388 1.508) 10.079 6.690 ( 2.065 -0.812 1.870) 2.902 6.759 ( 2.802 2.209 -1.585) 3.904 6.978 ( 0.933 0.791 -0.057) 1.224 7.072 ( -3.985 1.714 2.793) 5.160 7.235 ( 6.645 0.243 1.865) 6.906 7.491 ( -4.891 3.586 1.672) 6.291 7.674 ( -0.820 5.371 -0.120) 5.434 8.731 ( -6.051 -6.356 -1.049) 8.838 8.831 ( -1.234 -0.023 4.297) 4.471 8.957 ( -2.159 -10.218 -0.567) 10.459 9.004 ( -2.407 -5.745 -5.594) 8.372 9.212 ( -1.452 -0.229 1.359) 2.002 9.330 ( 0.595 -4.552 0.510) 4.619 9.593 ( -6.906 2.385 1.480) 7.454 9.783 ( 2.003 -3.260 1.593) 4.144 10.170 ( -5.009 3.123 8.383) 10.252 10.672 ( -1.942 1.185 -0.915) 2.452 10.875 ( 9.294 -1.005 -2.719) 9.736 10.924 ( 7.524 -3.997 2.314) 8.828 11.029 ( -1.831 -3.986 -11.012) 11.853 11.396 ( 1.460 -1.662 -1.314) 2.573 11.502 ( -0.710 4.631 -1.264) 4.853 11.716 ( 2.137 -0.864 -2.745) 3.584 11.741 ( -5.083 -1.962 1.060) 5.551 11.870 ( 8.875 1.487 8.279) 12.228 12.036 ( 5.026 -0.848 -0.756) 5.152 12.091 ( 4.176 -1.023 -5.229) 6.770 12.189 ( -4.149 8.042 2.143) 9.299 12.431 ( 3.337 6.004 -4.108) 8.003 13.083 ( -13.462 6.852 2.915) 15.384 13.339 ( -8.922 8.973 -2.267) 12.855 14.638 ( -1.719 2.111 1.335) 3.032 14.728 ( -0.741 1.640 2.621) 3.179 14.890 ( -0.611 -3.108 1.507) 3.507 15.015 ( -1.666 3.673 -3.209) 5.154 15.100 ( 1.181 -3.768 3.266) 5.124 15.299 ( 5.280 1.321 -0.207) 5.447 15.412 ( 3.995 1.063 -4.549) 6.147 15.490 ( 3.605 -2.052 -0.064) 4.148 15.736 ( -6.991 1.288 0.781) 7.152 16.057 ( -1.859 4.820 -1.491) 5.377 16.207 ( -7.696 0.183 5.348) 9.373 16.555 ( 0.204 1.599 -2.331) 2.834 16.681 ( 5.964 -3.393 6.463) 9.426 17.101 ( 6.482 1.303 2.330) 7.010 17.424 ( -1.218 -0.713 -4.340) 4.564 17.656 ( 4.157 -0.710 -2.825) 5.076 25.644 ( 0.498 -2.406 0.652) 2.543 25.676 ( 1.031 -1.935 -0.661) 2.290 25.802 ( -2.181 -0.313 3.015) 3.734 25.819 ( -1.451 0.242 0.454) 1.539 25.885 ( -2.428 4.176 0.536) 4.860 26.153 ( 5.882 2.072 -4.348) 7.602 26.373 ( -1.462 -1.890 1.117) 2.638 26.444 ( 0.733 -2.233 1.488) 2.781 26.934 ( -3.937 0.722 -5.066) 6.457 27.132 ( 5.458 6.165 9.886) 12.866 27.985 ( -9.293 -2.958 3.573) 10.387 28.216 ( -8.067 -2.702 -6.964) 10.994 28.588 ( -6.207 -3.360 -4.250) 8.239 28.722 ( -5.362 -13.134 -2.249) 14.363 29.061 ( 6.033 -5.417 3.070) 8.670 29.521 ( 21.727 18.679 -1.071) 28.672 ======================= Grid point 170 (75/140) ======================= q-point: (-0.56 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.781 ( 2.258 -1.413 5.811) 6.393 1.953 ( -5.704 -0.228 7.711) 9.594 2.112 ( 1.680 -5.038 5.485) 7.634 2.336 ( 2.060 -0.603 -1.670) 2.720 2.509 ( 5.136 2.120 -9.286) 10.821 2.667 ( 0.556 1.180 -3.500) 3.735 2.802 ( 0.848 0.323 -5.309) 5.386 2.856 ( -7.331 -4.993 -4.382) 9.893 2.876 ( -1.162 -5.021 -0.781) 5.213 3.062 ( -0.117 3.335 -1.595) 3.699 3.120 ( -0.839 -2.104 -1.861) 2.932 3.322 ( -2.231 -3.546 6.256) 7.529 3.436 ( -2.755 1.577 -0.947) 3.313 3.482 ( 0.263 -1.523 5.275) 5.496 3.626 ( -2.982 -2.295 -0.218) 3.769 3.882 ( -5.850 -0.136 5.618) 8.112 4.042 ( 4.594 -4.112 2.609) 6.695 4.255 ( 5.682 0.082 6.661) 8.756 4.371 ( 6.513 -2.329 -6.396) 9.421 4.469 ( 4.188 5.500 -4.865) 8.453 4.565 ( -1.238 3.495 3.804) 5.312 4.738 ( -5.226 -1.082 -8.821) 10.310 4.826 ( -0.819 5.644 6.013) 8.288 4.955 ( 4.968 -1.996 -4.418) 6.942 5.401 ( -0.029 -6.263 1.741) 6.500 5.422 ( 0.997 0.029 -8.411) 8.470 5.744 ( 2.093 2.867 -0.291) 3.562 5.791 ( -3.695 -2.471 0.707) 4.501 5.862 ( -0.539 -3.590 3.696) 5.181 6.046 ( 5.986 -3.051 0.304) 6.725 6.189 ( -6.061 1.409 -1.780) 6.472 6.401 ( 5.716 -1.718 0.362) 5.980 6.477 ( -8.791 2.826 4.566) 10.301 6.731 ( 3.760 -0.325 -1.397) 4.024 6.777 ( -0.159 -4.095 0.980) 4.214 6.914 ( -6.002 1.548 -4.163) 7.467 7.117 ( 0.335 -3.950 8.517) 9.394 7.268 ( 3.915 1.670 -0.823) 4.336 7.468 ( 3.998 0.354 1.850) 4.420 7.567 ( -0.923 6.182 0.546) 6.274 8.749 ( -9.564 -2.498 2.045) 10.094 8.848 ( 2.018 -1.540 2.767) 3.755 8.991 ( 2.770 2.395 -7.055) 7.949 9.064 ( -3.654 -4.464 -0.291) 5.776 9.190 ( -2.250 -0.593 -1.142) 2.592 9.481 ( 2.135 -7.018 3.825) 8.273 9.514 ( -6.998 0.948 0.159) 7.064 9.847 ( 2.694 -1.709 -2.051) 3.793 10.101 ( -4.878 5.262 11.003) 13.136 10.628 ( -2.219 2.244 1.076) 3.335 10.888 ( 7.235 2.011 -7.283) 10.461 10.994 ( 1.193 0.225 -6.069) 6.190 11.099 ( 4.275 -5.122 -1.491) 6.836 11.362 ( -4.136 5.412 3.932) 7.865 11.454 ( 0.509 -3.169 0.554) 3.257 11.692 ( -4.383 0.073 -0.493) 4.411 11.814 ( 2.577 -2.536 -5.409) 6.506 11.949 ( 1.133 4.464 2.876) 5.430 12.066 ( 8.196 -0.381 5.445) 9.847 12.093 ( 4.327 -2.487 -3.539) 6.118 12.161 ( 2.291 -4.289 -0.792) 4.926 12.370 ( 3.962 2.279 -3.552) 5.789 12.859 ( -10.873 7.988 -0.747) 13.513 13.133 ( -6.255 7.145 0.170) 9.498 14.627 ( -0.175 -0.641 -1.249) 1.415 14.735 ( -0.529 -0.639 4.338) 4.416 14.874 ( -0.113 6.886 -2.912) 7.477 14.957 ( 0.154 -3.960 0.618) 4.011 15.228 ( -0.482 -6.166 4.525) 7.664 15.306 ( 3.443 1.354 -0.051) 3.700 15.405 ( 2.631 0.834 -3.551) 4.497 15.507 ( 0.685 2.174 -0.892) 2.447 15.692 ( -1.917 -0.220 -2.348) 3.039 15.952 ( -3.621 2.917 1.675) 4.942 16.211 ( -6.012 -2.701 7.891) 10.281 16.515 ( 1.376 2.357 -3.950) 4.801 16.812 ( 4.196 -3.357 4.928) 7.292 17.117 ( 2.447 1.277 0.742) 2.859 17.407 ( -2.253 -1.638 -3.637) 4.581 17.679 ( 3.009 -0.159 -2.206) 3.735 25.691 ( 0.517 -2.041 -0.117) 2.109 25.701 ( -0.792 -0.728 0.543) 1.205 25.784 ( -1.678 2.946 -1.383) 3.661 25.802 ( -1.104 1.042 2.165) 2.644 25.817 ( -1.194 0.217 0.654) 1.378 26.153 ( 5.838 1.287 -2.704) 6.561 26.400 ( -0.302 -1.049 2.428) 2.663 26.488 ( -0.429 -1.563 2.232) 2.759 26.878 ( -1.451 0.211 -8.893) 9.013 27.125 ( 4.309 4.330 11.881) 13.359 27.962 ( -7.986 -1.615 -1.742) 8.332 28.199 ( -4.050 -3.353 -1.603) 5.497 28.556 ( -1.970 -0.254 -6.676) 6.966 28.879 ( -4.121 -10.227 -1.348) 11.108 29.186 ( 3.217 -1.254 1.432) 3.738 29.383 ( 11.400 10.992 2.500) 16.032 ======================= Grid point 171 (76/140) ======================= q-point: (-0.44 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.756 ( -6.658 4.960 5.690) 10.065 1.893 ( -6.291 7.711 11.288) 15.049 2.176 ( 3.528 4.902 12.100) 13.524 2.330 ( 2.804 7.444 0.275) 7.960 2.367 ( 0.735 6.203 -11.817) 13.366 2.599 ( -4.534 1.383 -7.929) 9.238 2.696 ( -0.014 5.973 -3.223) 6.787 2.870 ( 3.121 2.124 -2.394) 4.471 2.947 ( -2.034 1.435 -4.768) 5.379 3.040 ( 0.422 -6.618 -0.465) 6.648 3.135 ( -0.109 -0.650 0.997) 1.195 3.313 ( 1.867 5.168 3.536) 6.534 3.446 ( -0.433 -4.549 2.761) 5.339 3.575 ( 0.532 -2.636 0.836) 2.816 3.676 ( 1.341 -4.743 -2.299) 5.438 3.828 ( -6.311 2.256 5.917) 8.941 4.156 ( 3.711 -4.594 2.290) 6.334 4.295 ( 0.217 5.451 -0.299) 5.463 4.351 ( 4.796 4.564 -0.150) 6.622 4.409 ( 1.454 0.927 1.975) 2.622 4.546 ( -1.999 -1.749 0.161) 2.661 4.650 ( -3.543 3.999 -0.175) 5.346 4.703 ( -0.585 8.954 -1.854) 9.162 5.043 ( 6.869 -3.444 -2.997) 8.248 5.410 ( 2.234 -1.743 -6.044) 6.675 5.459 ( -4.060 -3.124 -3.807) 6.382 5.754 ( 1.646 -0.064 1.450) 2.195 5.786 ( -0.998 -0.364 0.301) 1.104 5.899 ( 0.084 1.703 4.022) 4.369 6.096 ( -2.372 -0.221 -2.055) 3.146 6.144 ( 0.836 -1.392 -1.271) 2.062 6.390 ( -7.035 2.332 3.380) 8.145 6.479 ( 5.914 -1.263 -0.066) 6.048 6.748 ( -2.168 0.442 0.735) 2.331 6.824 ( -3.553 -0.784 -3.905) 5.337 6.904 ( 1.129 -8.500 0.392) 8.584 7.233 ( -0.202 -2.798 -0.470) 2.845 7.280 ( 2.282 -3.437 6.320) 7.548 7.422 ( 0.116 5.047 -3.970) 6.422 7.561 ( 6.191 0.278 4.010) 7.382 8.724 ( -8.914 -2.249 3.846) 9.965 8.934 ( 5.982 1.123 -0.618) 6.117 8.942 ( 5.207 -0.815 -4.128) 6.694 9.050 ( -3.642 1.088 -1.057) 3.946 9.179 ( 0.530 1.474 -0.288) 1.593 9.433 ( -3.903 3.489 2.028) 5.614 9.579 ( 0.604 -0.110 1.263) 1.404 9.825 ( -1.825 2.656 -4.018) 5.151 10.093 ( -0.404 -0.319 14.015) 14.025 10.570 ( -2.068 3.876 2.936) 5.285 10.870 ( 8.573 3.078 -6.555) 11.222 10.962 ( -3.155 -1.784 -8.107) 8.881 11.076 ( -4.157 5.700 0.479) 7.071 11.376 ( 2.486 -1.612 7.336) 7.912 11.528 ( -0.521 -4.837 -1.502) 5.092 11.663 ( -4.752 -1.828 -0.582) 5.125 11.717 ( -1.930 5.805 -5.638) 8.319 11.902 ( 1.757 6.849 3.446) 7.865 12.102 ( 4.735 1.443 1.852) 5.285 12.172 ( 0.506 -4.161 -4.265) 5.980 12.331 ( 2.718 -9.247 -0.953) 9.685 12.391 ( 0.526 -3.533 -8.685) 9.390 12.729 ( 3.438 0.141 3.860) 5.171 13.040 ( -0.563 1.507 4.666) 4.936 14.623 ( -2.127 -0.452 -1.389) 2.581 14.698 ( 2.552 6.603 3.395) 7.851 14.867 ( -0.075 -5.319 0.568) 5.349 15.027 ( 1.829 -3.748 -2.165) 4.699 15.263 ( -0.320 1.217 -0.785) 1.483 15.333 ( -1.694 1.823 2.632) 3.622 15.398 ( 0.816 -0.507 1.905) 2.133 15.452 ( 1.586 1.560 -3.163) 3.867 15.669 ( -0.190 0.019 -3.347) 3.353 15.963 ( -1.897 -4.555 2.239) 5.419 16.266 ( -5.193 -3.936 8.723) 10.888 16.459 ( 2.652 3.447 -4.819) 6.491 16.876 ( -1.113 -0.126 3.059) 3.258 17.120 ( -2.572 -1.452 0.922) 3.094 17.421 ( -0.244 -3.504 -4.401) 5.631 17.686 ( 2.110 0.275 -2.647) 3.396 25.687 ( -1.375 2.401 0.421) 2.799 25.696 ( -2.253 0.068 0.845) 2.408 25.732 ( -0.283 1.369 -0.853) 1.638 25.786 ( -0.313 0.206 1.899) 1.936 25.841 ( 0.623 -1.759 0.451) 1.920 26.166 ( 4.562 0.696 -2.749) 5.371 26.431 ( 2.231 -0.006 4.650) 5.157 26.510 ( -1.608 -1.044 1.366) 2.354 26.808 ( -1.425 1.411 -9.277) 9.491 27.190 ( 5.238 -0.811 11.468) 12.634 27.915 ( -3.581 -0.407 -4.419) 5.703 28.227 ( -0.126 -1.155 1.667) 2.032 28.505 ( 0.464 1.720 -6.369) 6.613 28.914 ( 3.089 6.547 -3.071) 7.864 29.194 ( -4.561 -4.757 1.775) 6.826 29.385 ( -1.141 -1.767 2.050) 2.937 ======================= Grid point 172 (77/140) ======================= q-point: (-0.33 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.596 ( -8.717 10.842 10.229) 17.267 1.733 ( -7.972 13.189 19.288) 24.688 2.000 ( -6.295 18.701 1.790) 19.813 2.157 ( 2.674 15.753 6.403) 17.214 2.283 ( 6.140 3.950 -6.045) 9.478 2.464 ( -2.623 5.392 -10.020) 11.677 2.624 ( -1.898 3.248 2.365) 4.444 2.772 ( 3.724 7.567 -5.539) 10.090 2.926 ( 2.386 1.377 0.314) 2.773 3.086 ( 1.358 5.390 2.941) 6.288 3.142 ( 1.069 0.313 1.688) 2.023 3.293 ( -1.242 -1.680 -4.861) 5.290 3.509 ( 1.782 2.018 0.979) 2.864 3.574 ( -0.539 1.075 0.868) 1.482 3.696 ( -1.889 1.044 4.129) 4.659 3.852 ( 0.838 -5.669 -1.898) 6.037 4.125 ( -4.248 6.615 2.175) 8.156 4.289 ( 3.264 -3.985 1.298) 5.312 4.361 ( 6.682 2.255 -4.759) 8.508 4.405 ( -6.532 -1.255 1.246) 6.767 4.485 ( -0.313 7.760 2.425) 8.136 4.590 ( -0.583 -0.052 -2.079) 2.160 4.624 ( 3.525 -0.236 3.456) 4.942 5.123 ( 5.282 -2.356 -3.341) 6.679 5.431 ( -4.273 -0.436 -4.391) 6.142 5.446 ( 2.944 -1.989 -3.844) 5.234 5.743 ( -3.753 -1.873 -1.323) 4.398 5.806 ( -0.091 2.260 0.643) 2.351 5.846 ( 3.361 5.390 1.212) 6.467 6.072 ( -3.259 -1.988 -2.482) 4.553 6.169 ( 0.374 -0.687 -0.815) 1.129 6.340 ( -2.032 0.480 2.099) 2.960 6.538 ( 3.692 -1.624 0.789) 4.110 6.661 ( -10.542 1.978 -0.124) 10.727 6.831 ( 1.568 -0.464 -1.365) 2.130 7.073 ( -0.650 -8.990 -2.105) 9.256 7.239 ( -1.709 -1.469 -3.227) 3.936 7.336 ( 4.543 1.618 -0.825) 4.892 7.454 ( 2.417 -6.861 4.835) 8.734 7.607 ( 4.789 0.382 0.184) 4.808 8.714 ( -5.990 -0.015 3.234) 6.807 8.908 ( 7.388 6.723 0.459) 10.000 8.925 ( -0.041 3.297 -4.565) 5.631 9.054 ( 2.131 0.082 -2.257) 3.105 9.142 ( 1.644 2.956 0.696) 3.453 9.391 ( 2.823 1.700 3.678) 4.938 9.515 ( -2.658 4.985 -0.028) 5.650 9.751 ( -1.782 3.161 2.105) 4.195 10.193 ( 0.234 -2.705 11.342) 11.662 10.508 ( -0.481 4.043 4.469) 6.045 10.857 ( 6.670 3.828 -1.613) 7.857 10.914 ( -7.201 -1.497 -9.120) 11.716 10.964 ( -0.401 3.528 -0.239) 3.559 11.364 ( -1.438 6.182 0.893) 6.410 11.529 ( -4.873 2.587 -3.549) 6.559 11.656 ( 0.749 -4.187 0.093) 4.255 11.722 ( 2.394 -3.504 1.982) 4.683 11.815 ( -0.796 3.969 4.262) 5.878 12.118 ( -2.460 0.093 3.803) 4.530 12.197 ( 0.129 -2.145 -7.373) 7.680 12.332 ( -5.571 -2.290 -12.554) 13.925 12.461 ( 4.589 -4.107 -2.313) 6.579 12.959 ( 13.975 -9.229 8.760) 18.900 13.127 ( 5.895 -6.220 7.133) 11.150 14.610 ( 1.054 -0.250 0.664) 1.271 14.677 ( -0.230 -0.852 3.215) 3.334 14.944 ( -1.300 -2.673 0.414) 3.001 15.092 ( 5.360 -2.890 -4.236) 7.418 15.204 ( -1.971 6.621 0.325) 6.916 15.259 ( -5.538 -1.308 -0.204) 5.694 15.409 ( -1.046 -1.071 -2.360) 2.795 15.492 ( 2.287 -1.646 2.078) 3.501 15.675 ( 3.920 -1.297 -2.351) 4.752 16.034 ( -3.276 -3.571 2.560) 5.481 16.310 ( -1.357 1.653 2.843) 3.557 16.437 ( 1.455 -3.173 -0.197) 3.496 16.840 ( -5.297 1.948 1.264) 5.783 17.134 ( -8.929 -4.255 2.727) 10.259 17.456 ( 0.797 -2.741 -6.551) 7.146 17.678 ( 1.722 0.226 -4.767) 5.073 25.625 ( -1.127 3.347 0.617) 3.585 25.691 ( -1.226 2.018 -0.430) 2.400 25.708 ( -1.519 -1.780 3.862) 4.516 25.803 ( 0.420 -0.421 2.098) 2.180 25.872 ( 0.716 -1.035 -0.427) 1.329 26.165 ( 2.706 0.986 -3.574) 4.590 26.475 ( 2.072 0.244 2.513) 3.266 26.519 ( 0.699 -0.120 3.519) 3.590 26.727 ( -2.294 1.330 -6.940) 7.429 27.335 ( 3.626 -6.196 7.726) 10.547 27.896 ( 5.867 1.237 -0.999) 6.079 28.237 ( 3.425 2.170 -0.026) 4.055 28.454 ( 3.396 2.852 -3.179) 5.456 28.742 ( 4.002 13.135 -3.023) 14.060 29.257 ( -12.017 -6.466 -3.951) 14.206 29.402 ( -9.550 -5.257 2.892) 11.278 ======================= Grid point 173 (78/140) ======================= q-point: (-0.22 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.399 ( -10.093 12.292 19.280) 24.993 1.449 ( -4.546 25.079 8.386) 26.832 1.696 ( -9.480 12.615 22.438) 27.431 1.880 ( 2.575 22.953 11.396) 25.755 2.221 ( 10.200 7.657 -10.838) 16.737 2.319 ( -1.591 2.884 -11.543) 12.004 2.468 ( -5.385 11.468 -1.582) 12.767 2.701 ( 3.888 8.542 6.492) 11.412 2.864 ( 1.107 6.565 3.481) 7.513 3.013 ( 1.048 10.177 -3.609) 10.849 3.072 ( -2.014 3.491 3.724) 5.487 3.273 ( -2.112 -1.072 -0.934) 2.546 3.455 ( -5.152 5.329 1.039) 7.485 3.523 ( 2.606 -2.517 -7.997) 8.779 3.768 ( 2.294 -2.197 6.624) 7.346 3.943 ( 0.631 -6.025 -5.304) 8.052 4.045 ( -3.990 1.902 2.057) 4.875 4.219 ( -2.883 2.637 -9.890) 10.634 4.359 ( 5.444 3.363 2.350) 6.817 4.405 ( 2.898 0.058 -1.244) 3.154 4.474 ( 7.284 1.441 2.387) 7.799 4.630 ( -6.858 -6.573 3.550) 10.141 4.705 ( 3.554 -2.963 3.034) 5.533 5.178 ( 4.830 -2.717 -5.823) 8.039 5.373 ( 0.039 2.771 -2.780) 3.925 5.459 ( -2.303 -1.232 -3.693) 4.523 5.632 ( -5.439 9.123 -1.487) 10.725 5.806 ( 5.422 5.282 -4.625) 8.871 5.834 ( -1.487 -7.632 1.347) 7.891 6.090 ( -2.188 -4.280 -4.182) 6.371 6.180 ( -1.551 -1.306 3.141) 3.739 6.361 ( 0.944 -1.050 1.747) 2.246 6.545 ( -4.532 0.398 3.934) 6.014 6.640 ( -1.821 -5.443 1.899) 6.045 6.831 ( -0.477 0.239 0.139) 0.551 7.093 ( -2.276 1.663 -4.126) 4.997 7.234 ( -1.944 -1.801 -4.405) 5.140 7.397 ( 1.097 -3.810 -7.017) 8.059 7.597 ( 7.360 -5.000 2.805) 9.329 7.670 ( 4.825 -2.906 4.450) 7.178 8.632 ( -4.280 6.039 1.674) 7.589 8.790 ( 3.768 9.666 -1.229) 10.447 8.848 ( 1.576 6.624 -4.317) 8.061 9.006 ( 1.996 5.610 -3.956) 7.149 9.141 ( 0.291 -0.770 4.247) 4.326 9.349 ( -1.307 4.979 -3.587) 6.274 9.515 ( 3.298 -2.156 8.435) 9.310 9.731 ( 1.130 -0.029 2.426) 2.677 10.263 ( -3.024 -0.535 9.777) 10.248 10.485 ( 2.447 2.221 4.974) 5.972 10.773 ( -1.305 7.088 -11.008) 13.158 10.830 ( -5.060 1.295 2.746) 5.901 10.994 ( 9.796 -2.614 -1.599) 10.264 11.251 ( -0.192 4.801 0.170) 4.808 11.422 ( -4.378 4.348 2.936) 6.833 11.723 ( 0.151 -1.778 -2.720) 3.253 11.802 ( 2.057 -2.613 0.425) 3.353 11.824 ( -0.328 -2.572 6.381) 6.888 12.097 ( -6.293 -1.261 -0.370) 6.429 12.223 ( 4.895 -2.858 -1.539) 5.873 12.297 ( -6.374 -4.907 -10.687) 13.376 12.532 ( 7.120 -0.347 -1.511) 7.287 13.184 ( 1.920 -4.586 12.196) 13.171 13.411 ( 19.641 -10.487 2.889) 22.452 14.666 ( 3.738 -2.043 3.335) 5.410 14.746 ( -2.863 -7.364 0.860) 7.948 14.933 ( -0.345 2.224 -0.815) 2.394 15.071 ( 0.637 5.918 -0.303) 5.959 15.177 ( -1.511 -5.145 -4.507) 7.005 15.239 ( -8.432 -1.211 -0.403) 8.528 15.417 ( 1.301 -3.782 -4.491) 6.013 15.535 ( -1.216 -2.316 2.055) 3.326 15.751 ( 8.881 -1.395 0.648) 9.013 16.045 ( -2.836 0.236 2.218) 3.608 16.247 ( 2.866 4.874 -0.568) 5.683 16.555 ( 0.701 -7.017 2.916) 7.631 16.759 ( -7.648 2.309 0.364) 7.998 17.132 ( -18.535 -5.548 3.262) 19.620 17.444 ( 1.104 0.617 -7.442) 7.548 17.648 ( 0.732 1.532 -8.324) 8.496 25.571 ( -0.748 2.754 1.483) 3.216 25.647 ( -0.513 2.022 -0.607) 2.172 25.767 ( -0.506 -2.454 4.329) 5.002 25.830 ( -0.569 -2.081 4.421) 4.919 25.879 ( 0.633 0.236 -0.896) 1.122 26.144 ( 1.457 1.195 -3.495) 3.970 26.455 ( -1.803 1.353 -1.664) 2.802 26.534 ( 1.950 3.090 -2.156) 4.243 26.717 ( 0.746 -3.956 4.525) 6.057 27.472 ( -6.687 -7.812 -2.529) 10.589 28.000 ( 20.466 -0.664 7.633) 21.854 28.207 ( 7.104 4.447 -4.167) 9.360 28.453 ( 11.240 4.604 3.249) 12.573 28.556 ( 5.479 10.047 -1.401) 11.529 29.100 ( -23.305 3.314 -13.181) 26.979 29.460 ( -15.094 -8.379 6.267) 18.366 ======================= Grid point 174 (79/140) ======================= q-point: (-0.11 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.043 ( -0.701 21.020 16.453) 26.703 1.257 ( -16.229 6.933 24.407) 30.119 1.553 ( 0.141 15.413 11.751) 19.382 1.687 ( 6.931 11.935 36.059) 38.610 2.075 ( 5.372 11.183 -10.034) 15.956 2.195 ( -1.465 2.226 -13.928) 14.181 2.274 ( 2.512 5.937 -6.566) 9.202 2.565 ( -1.460 9.098 8.513) 12.545 2.733 ( -1.930 13.772 -2.655) 14.158 2.851 ( -2.981 1.443 9.390) 9.957 3.090 ( -0.233 -0.827 5.565) 5.631 3.229 ( -9.059 1.190 -2.896) 9.585 3.379 ( 1.963 0.189 -10.478) 10.662 3.531 ( 1.316 -1.575 -10.172) 10.377 3.826 ( 0.819 0.736 8.855) 8.924 3.973 ( -3.786 -2.334 -4.628) 6.419 4.004 ( -0.593 -0.657 -1.868) 2.067 4.226 ( 6.193 -3.930 -5.330) 9.067 4.349 ( 5.506 3.277 0.186) 6.410 4.396 ( 3.256 2.482 -2.528) 4.811 4.552 ( 4.691 -2.775 3.962) 6.739 4.673 ( -7.994 -3.488 2.207) 8.996 4.774 ( -0.186 -0.912 4.169) 4.272 5.239 ( 5.751 -3.473 -8.699) 10.991 5.333 ( 4.514 3.252 1.049) 5.662 5.412 ( -8.245 0.390 -4.062) 9.200 5.442 ( -4.671 5.845 -1.273) 7.590 5.708 ( 2.060 5.181 -8.354) 10.044 5.959 ( -0.464 -5.796 2.748) 6.431 6.122 ( 1.379 -2.026 -4.288) 4.939 6.231 ( -3.020 -4.020 5.742) 7.633 6.356 ( -0.163 1.733 0.899) 1.959 6.634 ( -0.864 -7.065 6.805) 9.848 6.732 ( -2.773 -5.803 3.890) 7.516 6.830 ( -1.560 -1.295 0.370) 2.061 7.027 ( 5.282 3.600 -4.206) 7.652 7.197 ( -3.486 1.579 -3.293) 5.048 7.362 ( -2.952 0.339 -10.505) 10.917 7.773 ( 2.457 -6.960 4.128) 8.457 7.798 ( 9.704 -3.298 4.320) 11.122 8.502 ( -4.125 5.909 2.712) 7.700 8.657 ( 2.807 6.550 -3.250) 7.832 8.728 ( 0.274 5.847 -4.511) 7.390 8.865 ( -0.829 7.543 -5.416) 9.323 9.176 ( -2.527 -1.022 3.244) 4.237 9.250 ( 1.498 4.632 -0.232) 4.874 9.644 ( 3.848 -4.961 4.972) 8.009 9.762 ( 2.321 -0.391 0.284) 2.371 10.278 ( -4.673 -0.890 7.901) 9.223 10.506 ( 3.128 2.450 -0.242) 3.981 10.560 ( -2.105 8.818 -1.439) 9.179 10.793 ( -2.885 0.227 -1.751) 3.383 11.115 ( 2.209 -1.791 5.231) 5.954 11.247 ( 12.122 -1.323 -4.569) 13.022 11.363 ( -1.195 3.068 7.606) 8.288 11.706 ( -3.010 0.367 -2.473) 3.913 11.850 ( 0.441 -2.518 1.713) 3.078 11.915 ( 3.803 -2.712 1.721) 4.978 12.062 ( -1.390 -0.153 -6.952) 7.091 12.271 ( -6.613 -3.809 -10.316) 12.831 12.364 ( 3.029 -7.297 8.161) 11.359 12.572 ( 7.915 2.002 -0.876) 8.211 13.284 ( -5.917 -1.269 15.738) 16.862 13.726 ( 21.354 -7.162 -5.323) 23.143 14.741 ( 2.630 -2.407 1.052) 3.717 14.796 ( -3.310 0.063 -1.447) 3.613 14.905 ( 1.550 2.044 -0.258) 2.578 15.037 ( 3.377 4.372 -0.896) 5.596 15.062 ( -16.546 -2.247 0.516) 16.706 15.287 ( -0.490 -6.567 -5.006) 8.272 15.519 ( -0.765 -3.404 1.018) 3.634 15.601 ( -0.268 -9.764 -0.793) 9.799 15.809 ( 3.295 0.672 -0.077) 3.364 16.027 ( 6.114 4.283 -4.491) 8.711 16.261 ( 10.377 -1.949 5.466) 11.889 16.640 ( -6.332 5.445 0.321) 8.357 16.683 ( -0.806 -6.327 2.386) 6.810 17.017 ( -31.037 -1.585 -1.252) 31.103 17.408 ( 0.903 0.868 -3.054) 3.301 17.545 ( 0.863 6.072 -6.154) 8.688 25.542 ( -0.077 1.428 2.263) 2.677 25.613 ( 0.024 1.335 -0.449) 1.409 25.787 ( 0.281 0.545 1.098) 1.258 25.843 ( -1.993 0.754 -1.280) 2.486 25.959 ( 0.970 -6.593 6.276) 9.154 26.116 ( 0.546 1.521 -2.141) 2.682 26.406 ( -2.161 1.133 -2.123) 3.235 26.455 ( -0.698 3.776 -2.895) 4.809 26.878 ( 4.364 -7.578 6.689) 11.010 27.442 ( -10.015 -0.989 -9.284) 13.692 28.170 ( 4.997 -0.132 -2.582) 5.627 28.234 ( 6.044 -4.204 -0.223) 7.366 28.361 ( 0.683 8.134 -0.582) 8.184 28.600 ( 1.497 13.054 -6.713) 14.755 28.819 ( 17.178 -1.602 10.278) 20.082 29.467 ( -19.358 -4.783 4.378) 20.415 ======================= Grid point 176 (80/140) ======================= q-point: ( 0.11 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.278 ( -2.301 -0.000 21.353) 21.476 1.363 ( 8.483 0.000 15.640) 17.792 1.418 ( -2.036 -0.000 -5.327) 5.703 1.802 ( -5.926 -0.000 -3.020) 6.651 2.068 ( 7.638 0.000 -1.661) 7.817 2.206 ( 15.434 0.000 -17.951) 23.674 2.271 ( -6.075 -0.000 12.893) 14.253 2.660 ( 3.817 0.000 -9.097) 9.866 2.774 ( -7.926 -0.000 -8.139) 11.361 2.795 ( 12.883 0.000 26.792) 29.728 2.865 ( -6.483 -0.000 11.645) 13.328 3.225 ( 2.575 0.000 2.236) 3.410 3.281 ( 2.441 0.000 -2.982) 3.854 3.384 ( -2.955 -0.000 -9.567) 10.013 3.851 ( -2.399 -0.000 -5.689) 6.175 3.900 ( -2.972 -0.000 -6.429) 7.082 3.983 ( -0.598 -0.000 9.955) 9.973 4.256 ( -9.005 -0.000 -0.655) 9.029 4.273 ( -1.490 -0.000 -9.246) 9.365 4.356 ( 1.467 0.000 -0.571) 1.574 4.715 ( 2.404 0.000 2.830) 3.713 4.780 ( 5.661 0.000 6.889) 8.917 4.878 ( 0.989 0.000 7.522) 7.587 5.018 ( -4.979 -0.000 -13.729) 14.604 5.304 ( 0.110 0.000 -1.230) 1.235 5.363 ( 0.119 0.000 -0.441) 0.457 5.511 ( -1.007 -0.000 -6.212) 6.293 5.522 ( 9.684 0.000 0.995) 9.735 6.065 ( 2.961 0.000 1.269) 3.221 6.191 ( 3.145 0.000 -5.449) 6.291 6.265 ( -2.458 -0.000 4.228) 4.890 6.447 ( 7.419 0.000 -1.260) 7.525 6.661 ( -7.049 -0.000 7.126) 10.024 6.780 ( -3.039 -0.000 3.346) 4.520 6.789 ( 0.311 0.000 -0.571) 0.650 7.115 ( -4.768 -0.000 -5.819) 7.523 7.125 ( -0.799 -0.000 2.475) 2.601 7.208 ( 11.154 0.000 -4.015) 11.854 7.791 ( -12.423 -0.000 0.740) 12.445 7.864 ( -8.451 -0.000 1.610) 8.603 8.525 ( 3.376 0.000 4.299) 5.466 8.543 ( -5.182 -0.000 -4.714) 7.005 8.631 ( -1.969 -0.000 -4.672) 5.070 8.639 ( 2.962 0.000 3.356) 4.476 9.176 ( 1.159 0.000 0.922) 1.481 9.284 ( -1.667 -0.000 -2.750) 3.216 9.613 ( -7.550 -0.000 1.573) 7.712 9.818 ( 0.309 0.000 -1.707) 1.735 10.262 ( -3.581 -0.000 4.532) 5.776 10.534 ( 10.775 0.000 3.936) 11.472 10.686 ( 3.222 0.000 4.320) 5.389 10.706 ( 1.078 0.000 -5.944) 6.041 11.087 ( -5.848 -0.000 -2.977) 6.562 11.435 ( 6.646 0.000 -9.286) 11.419 11.475 ( 1.159 0.000 11.483) 11.541 11.580 ( -2.804 -0.000 -3.730) 4.667 11.899 ( 0.861 0.000 3.677) 3.776 12.004 ( -0.466 -0.000 -5.200) 5.221 12.047 ( -0.444 -0.000 -7.678) 7.691 12.122 ( 8.629 0.000 1.507) 8.760 12.415 ( -11.045 -0.000 3.989) 11.744 12.674 ( 3.507 0.000 -3.142) 4.709 13.234 ( -18.742 -0.000 13.381) 23.028 13.640 ( -14.365 -0.000 -0.470) 14.373 14.760 ( -2.026 -0.000 -0.741) 2.157 14.785 ( -0.438 -0.000 0.082) 0.445 14.917 ( 3.633 0.000 2.055) 4.174 14.963 ( 9.624 0.000 -4.309) 10.544 15.194 ( -0.414 -0.000 1.544) 1.598 15.313 ( 5.600 0.000 -6.217) 8.367 15.415 ( -6.264 -0.000 6.117) 8.755 15.732 ( -2.941 -0.000 2.470) 3.840 15.772 ( -4.366 -0.000 0.343) 4.379 15.918 ( 5.527 0.000 -10.335) 11.720 16.342 ( -8.523 -0.000 -1.058) 8.589 16.417 ( -12.860 -0.000 7.116) 14.697 16.902 ( 23.357 0.000 -5.485) 23.992 16.995 ( 4.927 0.000 8.707) 10.004 17.342 ( 2.925 0.000 -0.242) 2.936 17.571 ( 5.921 0.000 -2.205) 6.318 25.574 ( 0.582 0.000 1.682) 1.779 25.601 ( 0.690 0.000 -1.234) 1.414 25.756 ( -2.838 -0.000 0.568) 2.894 25.794 ( -0.215 -0.000 1.173) 1.193 26.038 ( -2.807 -0.000 1.454) 3.161 26.164 ( 4.005 0.000 -1.319) 4.217 26.356 ( -0.776 -0.000 2.082) 2.222 26.398 ( 0.504 0.000 -0.329) 0.602 27.094 ( -8.344 -0.000 -7.355) 11.123 27.186 ( 7.585 0.000 7.740) 10.837 27.790 ( -20.191 -0.000 12.413) 23.702 28.265 ( -2.624 -0.000 1.290) 2.924 28.301 ( 3.291 0.000 -0.655) 3.355 28.394 ( -4.386 -0.000 -0.176) 4.390 29.026 ( -10.336 -0.000 -7.804) 12.951 29.997 ( 39.023 0.000 -11.487) 40.679 ======================= Grid point 177 (81/140) ======================= q-point: ( 0.22 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.401 ( 8.598 -1.891 14.171) 16.683 1.424 ( -8.832 -14.354 -9.471) 19.333 1.633 ( 6.912 -10.825 11.774) 17.424 1.869 ( -2.241 -11.021 -1.150) 11.305 2.204 ( 8.099 -7.913 3.575) 11.874 2.262 ( 6.809 -5.512 -17.728) 19.774 2.386 ( -5.276 -13.183 6.533) 15.630 2.636 ( 0.145 -7.348 -18.801) 20.186 2.786 ( 0.315 -1.858 5.336) 5.659 2.898 ( -3.198 -1.765 11.677) 12.235 3.028 ( 0.542 -4.635 11.585) 12.490 3.230 ( 1.312 -0.396 -4.665) 4.862 3.284 ( -0.694 2.497 -4.851) 5.499 3.393 ( 10.941 -4.772 6.671) 13.674 3.734 ( -5.691 4.649 0.529) 7.368 3.893 ( -2.227 -0.921 -2.738) 3.648 4.053 ( 0.979 -2.121 6.616) 7.017 4.154 ( -7.371 0.497 -1.329) 7.506 4.173 ( -5.504 3.680 -2.688) 7.146 4.408 ( 5.525 -3.307 -4.273) 7.727 4.690 ( -0.251 3.629 -4.905) 6.106 4.798 ( -2.940 -0.627 -3.299) 4.463 4.912 ( -0.254 0.924 1.302) 1.617 5.010 ( 5.598 -1.665 1.447) 6.017 5.278 ( 0.786 2.416 1.682) 3.047 5.402 ( -0.825 -5.962 -0.964) 6.096 5.496 ( 0.291 -0.347 -2.564) 2.603 5.617 ( 8.311 -2.011 0.139) 8.552 6.032 ( 1.005 6.427 0.265) 6.511 6.132 ( 2.313 4.271 -3.764) 6.145 6.304 ( -0.419 -2.013 3.456) 4.022 6.432 ( 2.498 5.432 -3.486) 6.921 6.609 ( -4.375 2.398 3.201) 5.928 6.743 ( 0.351 2.313 2.425) 3.370 6.860 ( 2.216 -2.986 5.787) 6.878 7.033 ( -2.450 4.120 -7.365) 8.788 7.130 ( -2.815 0.519 2.754) 3.973 7.234 ( 6.285 1.761 0.465) 6.543 7.675 ( -9.707 3.977 0.741) 10.516 7.752 ( -9.917 1.762 -0.600) 10.091 8.563 ( -0.759 -3.639 -0.379) 3.737 8.567 ( -5.470 -8.409 -1.961) 10.222 8.685 ( -2.215 -8.006 -2.467) 8.665 8.734 ( 5.899 -3.412 7.121) 9.857 9.187 ( 1.021 0.331 2.303) 2.541 9.256 ( -9.797 -2.808 -1.210) 10.263 9.617 ( -1.943 -4.747 -1.386) 5.313 9.767 ( -0.460 4.697 -0.921) 4.809 10.233 ( -2.766 2.140 4.498) 5.697 10.685 ( 1.954 0.299 -5.053) 5.426 10.722 ( 10.476 -8.487 0.171) 13.483 10.756 ( 4.415 -3.790 2.386) 6.289 10.997 ( -6.052 2.473 -5.525) 8.560 11.417 ( 4.647 1.717 -7.306) 8.828 11.534 ( 0.706 0.301 6.871) 6.914 11.578 ( -2.109 -3.724 -1.125) 4.425 11.916 ( -2.107 2.992 -2.863) 4.647 11.930 ( 2.568 2.176 -0.586) 3.417 12.024 ( 0.945 -0.305 -2.580) 2.765 12.172 ( 9.082 3.908 3.690) 10.553 12.341 ( -8.426 1.314 4.766) 9.769 12.636 ( 1.397 4.064 -7.358) 8.521 13.142 ( -21.411 -1.256 7.908) 22.859 13.530 ( -11.727 1.939 0.532) 11.898 14.733 ( -6.162 0.490 3.236) 6.977 14.779 ( 0.536 0.755 0.883) 1.280 14.923 ( -2.278 2.685 -0.602) 3.572 14.998 ( 7.171 1.788 -2.933) 7.951 15.154 ( 1.893 2.114 1.155) 3.064 15.330 ( 7.094 3.482 0.295) 7.907 15.402 ( 2.619 -1.226 -3.499) 4.540 15.628 ( 1.206 8.508 2.780) 9.031 15.742 ( -6.360 -1.337 -0.168) 6.501 16.016 ( 1.069 -7.520 -5.706) 9.500 16.235 ( -7.071 2.966 1.072) 7.742 16.445 ( -6.833 -6.092 4.287) 10.109 16.893 ( 11.859 11.021 1.089) 16.226 17.114 ( 8.027 -1.719 6.882) 10.713 17.398 ( 5.690 -1.003 -3.203) 6.606 17.617 ( 4.859 -1.436 -2.432) 5.620 25.590 ( 0.431 -0.711 0.799) 1.153 25.614 ( 1.101 -1.447 -1.257) 2.210 25.755 ( -2.455 -1.623 1.292) 3.214 25.805 ( -0.747 -0.715 1.694) 1.985 26.003 ( -2.554 2.175 0.411) 3.379 26.180 ( 2.454 -0.161 -3.169) 4.011 26.368 ( 1.704 0.501 3.747) 4.147 26.394 ( 0.246 0.369 -0.181) 0.479 26.987 ( -6.844 1.800 -6.192) 9.403 27.276 ( 8.185 1.505 11.616) 14.289 27.799 ( -14.378 -7.948 8.448) 18.473 28.172 ( -9.859 2.883 -4.166) 11.085 28.364 ( -6.882 -4.387 -0.791) 8.199 28.401 ( -3.217 -8.028 -1.156) 8.726 28.980 ( 5.747 -0.415 -2.170) 6.157 30.097 ( 29.544 11.924 -11.267) 33.793 ======================= Grid point 178 (82/140) ======================= q-point: ( 0.33 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.581 ( 0.925 -15.639 0.042) 15.667 1.670 ( 4.688 -9.704 9.406) 14.304 1.869 ( 3.604 -5.902 7.269) 10.033 2.064 ( -0.336 -14.792 -5.650) 15.838 2.311 ( -1.384 -9.128 -18.298) 20.496 2.440 ( 7.635 -10.792 -0.208) 13.222 2.622 ( -4.656 -13.471 1.408) 14.322 2.735 ( 5.041 -8.209 -9.107) 13.257 2.820 ( -5.014 -0.296 9.092) 10.387 2.999 ( 0.282 -6.182 2.906) 6.837 3.037 ( -4.294 0.319 -2.331) 4.896 3.227 ( -2.987 -1.102 2.272) 3.911 3.237 ( -1.202 -1.793 -4.432) 4.930 3.633 ( -7.650 0.832 2.287) 8.027 3.646 ( 11.675 -2.639 6.965) 13.849 3.837 ( -5.294 4.166 10.640) 12.593 4.014 ( -0.469 4.007 -3.209) 5.155 4.157 ( -0.609 -5.980 -0.179) 6.014 4.224 ( 3.950 -6.408 2.015) 7.792 4.501 ( 6.672 -4.222 -3.830) 8.776 4.590 ( -3.346 0.286 -10.667) 11.183 4.744 ( -3.223 2.226 -2.286) 4.535 4.886 ( 1.629 3.303 -0.052) 3.683 5.034 ( 2.733 2.400 -4.319) 5.646 5.290 ( 2.777 -0.245 5.674) 6.322 5.478 ( 1.148 2.188 -0.949) 2.647 5.549 ( -2.742 -11.546 2.162) 12.062 5.703 ( 5.095 -1.813 0.982) 5.496 5.913 ( -0.944 6.280 -2.504) 6.826 6.067 ( 4.757 4.390 -0.795) 6.522 6.288 ( -4.227 4.394 -0.838) 6.155 6.381 ( 3.707 0.081 1.155) 3.883 6.553 ( -3.220 2.428 0.819) 4.115 6.726 ( 1.375 1.645 2.580) 3.355 6.843 ( 0.880 7.215 -3.214) 7.948 6.991 ( -0.696 -1.922 3.736) 4.258 7.084 ( -4.491 2.076 3.790) 6.232 7.279 ( 2.413 -1.058 2.357) 3.535 7.525 ( -3.811 5.176 0.437) 6.443 7.694 ( -5.767 -0.426 -1.688) 6.025 8.622 ( -1.278 -3.526 2.263) 4.380 8.688 ( -7.901 -11.645 -1.283) 14.131 8.796 ( -2.274 -8.901 -1.467) 9.303 8.883 ( 3.766 -4.740 5.419) 8.125 9.206 ( -0.609 -0.753 2.070) 2.285 9.233 ( -8.194 -4.364 -0.258) 9.287 9.642 ( -0.304 5.346 -1.197) 5.487 9.718 ( -0.148 -4.843 -1.005) 4.948 10.200 ( -4.131 1.259 3.960) 5.859 10.675 ( 2.415 0.353 -4.337) 4.977 10.848 ( -3.245 -4.667 -7.986) 9.803 10.906 ( 2.961 -1.385 1.152) 3.466 10.968 ( 13.684 -5.912 -0.887) 14.933 11.389 ( 1.764 0.752 -4.029) 4.462 11.542 ( 0.192 0.932 -0.788) 1.236 11.639 ( -1.152 -4.129 1.721) 4.619 11.775 ( -2.447 6.225 -3.621) 7.606 11.968 ( 3.740 -0.037 5.564) 6.705 12.029 ( -0.076 -0.971 -4.034) 4.150 12.178 ( 8.839 5.676 5.076) 11.667 12.287 ( -1.717 2.968 2.257) 4.105 12.515 ( 0.447 5.467 -7.212) 9.061 13.023 ( -19.750 -0.279 1.909) 19.844 13.370 ( -11.448 6.607 -0.880) 13.248 14.678 ( -5.272 3.167 4.276) 7.490 14.735 ( -4.078 1.948 0.675) 4.570 14.886 ( 3.077 -0.050 -3.803) 4.892 15.007 ( 0.302 0.013 5.080) 5.088 15.134 ( 2.498 2.838 -1.002) 3.911 15.333 ( 3.553 0.575 -2.489) 4.376 15.466 ( 9.531 -1.586 -4.028) 10.468 15.541 ( 3.291 5.842 3.499) 7.563 15.696 ( -6.076 0.127 -1.237) 6.202 16.057 ( -3.715 -0.486 -2.621) 4.573 16.174 ( -5.632 0.152 3.781) 6.785 16.508 ( -3.514 -3.874 1.561) 5.458 16.840 ( 12.122 6.839 5.005) 14.791 17.206 ( 5.856 1.632 7.077) 9.329 17.398 ( 1.344 1.438 -5.337) 5.689 17.658 ( 3.460 -1.004 -2.594) 4.439 25.617 ( 0.857 -1.764 0.299) 1.984 25.647 ( 0.969 -1.989 -1.004) 2.430 25.773 ( -2.279 -1.659 1.291) 3.100 25.816 ( -1.402 -0.313 2.079) 2.527 25.931 ( -2.236 3.670 -1.635) 4.598 26.179 ( 1.998 -0.090 -4.388) 4.823 26.382 ( 1.094 0.832 4.518) 4.722 26.426 ( 1.793 -1.754 2.345) 3.433 26.884 ( -4.332 1.096 -6.958) 8.270 27.342 ( 6.615 6.002 12.765) 15.580 27.845 ( -11.735 -5.575 1.955) 13.138 28.040 ( -12.554 -4.162 -6.603) 14.783 28.431 ( -5.518 -7.674 -0.844) 9.489 28.495 ( -2.593 -8.402 -2.709) 9.201 29.082 ( 9.620 -2.156 5.392) 11.237 29.985 ( 21.458 18.351 -8.491) 29.484 ======================= Grid point 179 (83/140) ======================= q-point: ( 0.44 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.836 ( 8.969 -0.697 4.682) 10.142 1.884 ( -5.360 -13.253 9.592) 17.216 1.976 ( 0.158 -6.973 0.605) 7.001 2.265 ( 3.519 -9.735 -4.777) 11.401 2.384 ( -4.830 -11.275 -12.370) 17.421 2.615 ( 4.260 -3.434 -6.661) 8.620 2.713 ( -2.703 -5.032 -4.557) 7.306 2.806 ( 3.897 0.044 -3.747) 5.406 2.824 ( -4.945 -0.438 1.925) 5.324 3.027 ( -2.118 -6.002 0.097) 6.365 3.115 ( 1.559 0.013 5.738) 5.946 3.211 ( -3.082 -4.368 -3.581) 6.435 3.340 ( -4.046 -9.230 6.131) 11.797 3.566 ( -4.365 0.617 1.965) 4.827 3.618 ( -1.710 8.072 2.896) 8.744 3.870 ( -3.338 -0.207 8.742) 9.359 4.008 ( 1.646 -2.956 1.878) 3.870 4.288 ( 5.453 -5.624 0.717) 7.866 4.353 ( 7.365 -3.299 -2.024) 8.320 4.522 ( -1.115 -0.204 -7.332) 7.419 4.600 ( -2.778 -1.488 -7.403) 8.046 4.669 ( 5.347 2.477 0.729) 5.938 4.860 ( -2.261 -0.509 0.180) 2.325 4.970 ( 3.570 2.824 -6.283) 7.759 5.362 ( 1.799 -1.791 4.420) 5.097 5.416 ( -0.735 2.742 -3.110) 4.211 5.717 ( -3.944 -6.810 2.284) 8.194 5.782 ( 4.429 -2.786 2.916) 5.990 5.812 ( 0.902 2.335 -0.033) 2.504 6.078 ( 6.425 0.178 0.075) 6.428 6.177 ( -4.614 3.167 -1.803) 5.879 6.409 ( -1.145 -0.396 2.392) 2.682 6.492 ( 0.165 2.679 0.453) 2.722 6.736 ( -1.127 -0.618 1.193) 1.754 6.769 ( 3.583 1.777 -0.403) 4.019 6.925 ( -5.548 5.521 1.823) 8.037 7.111 ( -0.994 -1.842 8.151) 8.415 7.284 ( -3.356 -0.179 -1.248) 3.585 7.506 ( 5.259 -0.510 0.979) 5.374 7.624 ( -3.967 3.108 -2.591) 5.666 8.660 ( -5.805 -2.212 3.518) 7.139 8.803 ( -2.417 -6.902 2.382) 7.691 8.924 ( -1.037 -7.949 -1.176) 8.102 8.974 ( -0.105 -3.065 1.524) 3.425 9.181 ( -1.378 1.095 -3.220) 3.670 9.330 ( -1.964 -9.136 2.977) 9.807 9.543 ( -1.009 4.112 1.549) 4.509 9.806 ( 1.487 -4.446 -1.942) 5.075 10.158 ( -6.092 1.780 5.467) 8.377 10.654 ( 0.814 1.484 -3.693) 4.062 10.811 ( -2.227 -3.266 -10.369) 11.097 11.054 ( 4.655 -5.092 3.993) 7.971 11.088 ( 13.133 2.369 -4.769) 14.172 11.404 ( 0.841 -1.313 3.608) 3.931 11.484 ( -0.099 4.546 -1.231) 4.710 11.659 ( -5.342 1.161 0.595) 5.499 11.726 ( 1.627 -4.624 -4.810) 6.868 11.977 ( -2.963 1.211 -3.965) 5.096 12.057 ( 4.355 -3.161 1.010) 5.476 12.170 ( 6.890 5.585 4.379) 9.891 12.267 ( 8.287 2.571 2.642) 9.070 12.416 ( -1.228 3.727 -3.511) 5.265 12.855 ( -15.027 3.921 -2.426) 15.719 13.157 ( -11.579 5.845 -1.043) 13.013 14.623 ( -1.287 1.165 0.324) 1.766 14.699 ( -3.970 -1.081 1.577) 4.407 14.901 ( 0.006 -1.500 -1.594) 2.189 14.994 ( 0.421 4.969 0.914) 5.070 15.165 ( 1.762 -4.274 5.042) 6.840 15.331 ( 3.210 0.590 -4.139) 5.271 15.487 ( 7.542 4.581 -2.112) 9.073 15.531 ( 1.135 0.593 0.192) 1.295 15.659 ( -1.597 -0.602 -1.815) 2.491 15.972 ( -7.823 3.649 1.023) 8.692 16.170 ( -4.447 -1.402 6.622) 8.099 16.528 ( 0.055 -0.282 -1.421) 1.450 16.894 ( 11.865 2.229 5.253) 13.166 17.207 ( 2.923 5.376 3.473) 7.036 17.351 ( -2.880 -0.287 -3.269) 4.366 17.680 ( 1.971 -0.632 -2.434) 3.195 25.661 ( 1.190 -2.168 -0.225) 2.483 25.679 ( -0.041 -1.643 0.035) 1.644 25.780 ( -1.876 -0.573 -0.141) 1.966 25.813 ( -1.592 0.403 2.328) 2.849 25.844 ( -1.121 3.535 -2.001) 4.214 26.179 ( 2.317 -0.279 -3.805) 4.464 26.415 ( 1.070 -0.562 6.324) 6.439 26.468 ( 0.103 -0.903 1.249) 1.545 26.821 ( -1.579 -0.475 -8.369) 8.530 27.300 ( 1.244 7.554 9.044) 11.849 27.838 ( -7.424 -4.454 -3.498) 9.337 28.079 ( -4.175 -7.235 2.560) 8.737 28.473 ( -2.951 -3.533 -4.762) 6.623 28.644 ( -3.771 -12.131 -0.221) 12.705 29.205 ( 5.340 -1.390 6.111) 8.234 29.763 ( 14.276 19.875 -6.020) 25.200 ======================= Grid point 180 (84/140) ======================= q-point: (-0.44 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.826 ( -4.517 4.933 7.019) 9.696 1.977 ( -0.450 -0.060 5.733) 5.751 2.188 ( 0.222 -9.654 6.561) 11.674 2.363 ( 0.128 -1.689 -6.305) 6.529 2.437 ( -0.026 -2.045 -7.527) 7.800 2.539 ( -0.578 4.856 -7.592) 9.031 2.747 ( 0.190 1.667 -3.622) 3.992 2.807 ( 3.074 -8.007 -4.068) 9.493 2.888 ( -2.590 -3.621 3.269) 5.523 3.040 ( -0.375 3.261 -1.678) 3.686 3.120 ( 0.319 0.576 1.981) 2.088 3.312 ( -2.397 -9.210 0.735) 9.546 3.442 ( -0.018 0.967 6.471) 6.543 3.545 ( -3.725 -3.870 1.634) 5.615 3.602 ( 5.419 -1.485 1.855) 5.917 3.846 ( -4.849 1.858 5.409) 7.498 4.084 ( -2.744 -4.485 3.226) 6.169 4.372 ( 5.426 -0.402 -9.837) 11.241 4.383 ( -0.910 4.563 -1.948) 5.044 4.465 ( -2.499 2.208 -2.510) 4.174 4.543 ( 3.862 -1.293 2.820) 4.953 4.713 ( 5.036 1.528 -0.495) 5.286 4.777 ( -6.945 5.346 -0.606) 8.785 5.024 ( 8.895 -4.468 -5.333) 11.293 5.345 ( -3.553 -0.954 -4.936) 6.156 5.419 ( 1.502 0.026 1.510) 2.129 5.742 ( -2.155 -0.407 -0.088) 2.195 5.814 ( 4.104 -0.697 2.370) 4.791 5.909 ( 1.896 -2.304 4.964) 5.792 6.076 ( -3.601 0.861 -1.787) 4.111 6.150 ( 4.405 0.043 0.258) 4.413 6.374 ( -6.364 0.872 0.952) 6.494 6.516 ( 5.985 -0.593 1.428) 6.182 6.722 ( -4.648 -0.090 -1.186) 4.798 6.810 ( 2.354 -1.657 3.292) 4.373 6.821 ( -2.892 1.644 0.541) 3.370 7.173 ( -1.683 -2.696 3.344) 4.613 7.275 ( -1.249 -2.112 2.158) 3.268 7.482 ( -1.038 5.200 -5.941) 7.963 7.592 ( 1.947 -1.471 0.204) 2.449 8.654 ( -6.728 -1.362 5.511) 8.803 8.909 ( 3.925 -3.980 0.803) 5.647 8.990 ( 1.876 0.792 -2.942) 3.578 9.033 ( 0.970 -4.132 2.197) 4.779 9.157 ( -1.423 -1.367 -1.895) 2.736 9.438 ( -2.244 -2.220 2.180) 3.836 9.552 ( 1.194 -3.595 4.242) 5.688 9.830 ( -0.259 1.246 -4.397) 4.577 10.127 ( -5.569 -0.224 9.561) 11.067 10.617 ( -0.255 0.785 -3.023) 3.133 10.809 ( -0.805 -1.806 -6.470) 6.765 11.046 ( 7.692 5.758 -4.741) 10.714 11.132 ( 0.613 2.937 -1.483) 3.347 11.424 ( 2.353 0.360 9.050) 9.358 11.492 ( 2.768 -1.031 2.657) 3.973 11.602 ( -6.300 0.335 0.569) 6.334 11.736 ( 0.692 0.428 -10.319) 10.351 11.967 ( 0.684 -1.251 0.196) 1.439 12.132 ( -0.269 -1.138 -1.620) 1.998 12.162 ( 3.461 -1.487 -3.462) 5.116 12.284 ( 6.127 7.607 3.750) 10.463 12.340 ( -1.381 0.362 -5.478) 5.661 12.720 ( -3.682 -2.117 0.611) 4.291 13.041 ( -6.491 -0.483 2.161) 6.859 14.604 ( -1.559 0.363 -0.236) 1.618 14.732 ( -2.467 -4.199 1.177) 5.011 14.874 ( 2.109 4.445 -1.954) 5.293 14.959 ( -0.572 -2.086 0.477) 2.215 15.259 ( -0.141 -0.897 1.426) 1.690 15.350 ( 1.860 -2.609 1.813) 3.681 15.455 ( 6.375 4.113 -2.205) 7.900 15.491 ( -0.539 3.543 -2.155) 4.182 15.654 ( 0.039 -0.134 -2.010) 2.015 15.889 ( -6.794 -1.024 3.257) 7.603 16.210 ( -4.452 -2.795 8.507) 9.999 16.510 ( 2.615 2.132 -3.317) 4.732 16.944 ( 6.733 3.813 2.617) 8.168 17.131 ( -1.378 4.241 -0.886) 4.547 17.352 ( -1.293 -2.643 0.303) 2.958 17.685 ( 0.928 -0.174 -2.801) 2.956 25.680 ( -1.289 -0.379 0.608) 1.475 25.709 ( 0.451 -0.350 0.628) 0.848 25.750 ( -0.428 1.669 -1.706) 2.425 25.793 ( -1.410 0.727 0.808) 1.781 25.822 ( 0.055 -0.946 1.227) 1.550 26.182 ( 2.095 -0.108 -3.767) 4.311 26.467 ( -2.538 -1.995 0.627) 3.288 26.481 ( 3.022 0.130 5.875) 6.608 26.774 ( -0.780 0.536 -8.365) 8.419 27.247 ( -2.132 1.703 4.631) 5.376 27.865 ( 1.122 -2.868 0.040) 3.080 28.190 ( -0.172 -5.070 5.233) 7.288 28.474 ( -0.718 -1.511 -5.115) 5.381 28.809 ( -4.302 -11.000 -0.191) 11.812 29.240 ( 1.007 3.593 2.102) 4.283 29.518 ( 6.391 15.094 -3.229) 16.706 ======================= Grid point 181 (85/140) ======================= q-point: (-0.33 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.708 ( -9.849 7.577 11.008) 16.601 1.969 ( -0.336 5.843 11.856) 13.222 2.164 ( -6.215 9.719 -7.333) 13.670 2.365 ( 4.343 -0.066 -1.912) 4.746 2.395 ( 1.989 4.121 1.531) 4.825 2.463 ( 1.270 4.154 -1.532) 4.606 2.696 ( 0.260 4.027 -0.963) 4.149 2.852 ( 0.445 3.551 -5.264) 6.365 2.938 ( 2.942 -1.363 1.775) 3.697 3.045 ( 0.710 -6.758 -0.835) 6.846 3.137 ( 0.097 -1.472 0.298) 1.505 3.388 ( 2.741 5.974 3.909) 7.647 3.475 ( 0.182 -6.302 3.147) 7.046 3.573 ( -2.298 0.472 0.759) 2.466 3.692 ( 3.767 -3.396 -2.741) 5.765 3.809 ( -4.872 0.769 4.532) 6.698 4.168 ( -5.131 -7.295 4.190) 9.854 4.215 ( -3.210 6.391 -6.046) 9.365 4.364 ( -2.457 1.792 -6.415) 7.100 4.405 ( 1.366 2.270 0.647) 2.727 4.619 ( 0.530 1.416 -6.835) 7.000 4.629 ( 3.094 5.066 7.067) 9.230 4.696 ( 3.542 3.385 2.966) 5.727 5.121 ( 6.264 -1.822 -2.581) 7.016 5.330 ( -3.985 -3.579 -6.467) 8.397 5.441 ( 3.327 -0.310 -0.122) 3.344 5.714 ( -1.519 0.815 -0.764) 1.886 5.852 ( 1.049 1.915 0.926) 2.371 5.932 ( 1.555 2.417 3.465) 4.502 6.031 ( -2.721 0.311 -3.268) 4.264 6.164 ( -1.105 0.487 1.666) 2.057 6.348 ( 1.593 -0.409 -0.051) 1.646 6.556 ( 1.901 0.477 1.575) 2.514 6.644 ( -5.410 3.329 1.113) 6.449 6.833 ( 1.347 -0.667 0.670) 1.646 6.901 ( -1.179 -8.142 -0.937) 8.280 7.183 ( -2.655 -1.325 -3.707) 4.748 7.363 ( -2.258 1.632 -3.795) 4.708 7.387 ( 2.459 -5.762 5.268) 8.185 7.610 ( -0.054 -0.733 -3.219) 3.301 8.679 ( -3.698 -2.469 7.155) 8.424 8.959 ( 3.938 2.821 -3.328) 5.877 8.992 ( 4.859 -2.219 -2.839) 6.050 9.098 ( 2.354 1.461 1.319) 3.069 9.161 ( -0.392 -0.491 1.121) 1.285 9.465 ( 1.072 -0.758 7.679) 7.790 9.576 ( -0.231 5.249 -2.776) 5.942 9.766 ( -2.720 0.517 -0.600) 2.833 10.173 ( -5.024 -3.190 11.216) 12.697 10.600 ( 1.879 1.202 0.491) 2.285 10.782 ( -2.618 0.014 -4.306) 5.040 10.961 ( -4.209 5.915 1.395) 7.392 11.065 ( 10.699 4.324 -6.026) 13.018 11.452 ( -1.157 4.728 0.318) 4.878 11.511 ( 0.490 0.210 -0.690) 0.872 11.578 ( -3.895 -3.422 1.249) 5.333 11.738 ( 5.179 -1.136 3.774) 6.508 11.918 ( -2.326 6.272 1.168) 6.791 12.098 ( -7.200 -0.113 -2.946) 7.780 12.134 ( 0.666 1.116 -5.572) 5.722 12.243 ( 0.100 2.363 -10.577) 10.838 12.352 ( 2.131 -8.418 -3.503) 9.363 12.909 ( 7.705 -11.751 7.943) 16.141 13.091 ( 0.983 -5.752 5.304) 7.885 14.586 ( -1.573 -0.056 0.416) 1.628 14.738 ( -1.790 2.139 1.680) 3.256 14.884 ( 3.613 -3.436 -0.739) 5.041 15.014 ( -0.794 -4.883 -1.911) 5.303 15.224 ( -4.131 2.313 -0.689) 4.785 15.328 ( -1.101 6.214 0.515) 6.332 15.422 ( 4.381 3.354 -4.138) 6.896 15.483 ( 1.112 -1.765 0.929) 2.284 15.675 ( 4.331 -2.303 0.848) 4.978 15.927 ( -5.947 -5.930 3.177) 8.979 16.269 ( -5.595 -3.734 8.744) 11.032 16.469 ( 4.112 3.629 -4.199) 6.907 16.897 ( 0.921 5.497 0.517) 5.597 17.055 ( -4.914 1.006 -2.010) 5.403 17.405 ( 1.586 -2.620 -0.019) 3.063 17.673 ( 0.634 0.350 -3.980) 4.045 25.674 ( -0.926 2.721 0.800) 2.983 25.686 ( -1.433 -0.311 2.865) 3.219 25.723 ( 0.113 1.528 -0.275) 1.557 25.802 ( 0.289 -1.206 1.398) 1.869 25.851 ( 0.106 -1.575 0.170) 1.588 26.174 ( 1.406 0.289 -4.361) 4.591 26.460 ( -2.430 -0.943 -2.349) 3.509 26.557 ( 4.020 -0.937 5.937) 7.231 26.711 ( -1.433 1.631 -4.622) 5.107 27.250 ( -4.861 -3.683 -0.718) 6.141 27.953 ( 7.461 -2.185 4.689) 9.079 28.279 ( 3.006 -1.334 3.522) 4.819 28.481 ( 4.046 -1.143 -2.046) 4.675 28.900 ( -1.574 -0.649 -2.322) 2.879 29.133 ( -3.878 4.904 -0.264) 6.257 29.351 ( -3.806 5.744 -2.037) 7.185 ======================= Grid point 182 (86/140) ======================= q-point: (-0.22 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.535 ( -14.346 9.578 15.265) 23.034 1.822 ( -3.320 18.212 5.623) 19.347 1.954 ( 1.507 8.416 6.392) 10.675 2.250 ( 2.938 10.747 -0.510) 11.153 2.342 ( 2.872 10.046 -0.541) 10.463 2.412 ( 5.153 4.726 -0.078) 6.992 2.585 ( -1.620 8.815 0.507) 8.977 2.821 ( 3.695 0.510 2.894) 4.721 2.973 ( 2.218 1.048 1.980) 3.152 3.103 ( 1.157 2.039 -4.643) 5.202 3.145 ( -1.047 1.968 0.617) 2.313 3.296 ( 2.261 6.463 2.566) 7.312 3.504 ( -1.127 4.258 -2.495) 5.063 3.540 ( -5.411 4.383 0.297) 6.970 3.724 ( -1.001 -4.810 5.347) 7.261 3.830 ( 0.638 -5.466 -5.515) 7.791 4.079 ( -4.396 3.404 0.915) 5.634 4.167 ( -8.777 4.103 -5.547) 11.164 4.359 ( 0.372 -5.915 5.633) 8.177 4.404 ( 4.796 0.201 -5.188) 7.068 4.536 ( -0.280 0.231 -7.960) 7.968 4.636 ( 5.365 5.006 6.841) 10.032 4.744 ( 5.324 -1.306 6.493) 8.497 5.159 ( 3.755 -0.188 -3.668) 5.253 5.332 ( -4.067 -3.801 -5.772) 8.019 5.445 ( 3.029 2.361 -3.548) 5.229 5.732 ( 1.340 -2.214 2.250) 3.429 5.741 ( -5.787 6.868 -0.396) 8.990 5.899 ( 1.140 3.679 -2.082) 4.378 6.007 ( -0.349 -1.607 -5.044) 5.306 6.173 ( -0.431 -1.122 4.387) 4.548 6.374 ( 2.429 0.196 -0.970) 2.623 6.544 ( -3.435 1.328 3.896) 5.361 6.602 ( 2.534 0.027 2.298) 3.421 6.835 ( -2.210 0.605 1.255) 2.612 7.000 ( -2.687 -6.156 -5.869) 8.920 7.163 ( -1.917 -1.610 -4.227) 4.913 7.320 ( -2.073 -1.514 -5.612) 6.171 7.570 ( 4.920 -7.715 3.968) 9.974 7.615 ( -2.223 -3.377 -0.308) 4.055 8.706 ( -0.410 2.391 4.830) 5.405 8.918 ( 2.400 4.525 -1.631) 5.375 8.993 ( -0.657 9.566 -2.167) 9.830 9.037 ( 4.028 -0.508 -2.460) 4.747 9.191 ( 2.097 0.279 2.890) 3.582 9.403 ( -3.990 7.420 -5.311) 9.959 9.564 ( 5.377 -1.598 8.787) 10.425 9.746 ( -3.022 0.753 2.515) 4.003 10.231 ( -8.507 -2.854 10.955) 14.161 10.604 ( 6.007 3.594 3.087) 7.651 10.742 ( -0.856 0.118 -6.160) 6.220 10.840 ( -6.847 3.627 3.149) 8.364 11.093 ( 14.696 1.942 -4.140) 15.391 11.329 ( -1.563 5.758 -2.805) 6.593 11.465 ( -1.451 2.584 1.473) 3.309 11.663 ( 0.103 -5.176 -0.336) 5.188 11.792 ( 1.740 0.377 0.928) 2.008 11.838 ( -3.140 1.953 6.337) 7.337 12.035 ( -5.287 -0.804 -0.263) 5.354 12.114 ( -2.888 -3.904 -11.344) 12.340 12.206 ( 3.103 -1.438 -4.137) 5.367 12.485 ( 2.812 -7.226 -5.710) 9.629 13.156 ( -0.509 -7.226 11.146) 13.293 13.329 ( 11.241 -13.955 2.762) 18.131 14.610 ( -0.953 -3.985 1.902) 4.517 14.709 ( -0.970 0.482 1.888) 2.176 14.959 ( 3.006 -0.698 1.240) 3.326 15.052 ( -6.571 -1.285 -1.010) 6.771 15.136 ( -0.780 0.308 -4.609) 4.685 15.240 ( -0.790 4.138 -0.709) 4.272 15.387 ( 3.361 1.677 -3.355) 5.036 15.490 ( -1.862 -0.827 -1.477) 2.517 15.801 ( 8.422 -3.389 3.755) 9.824 15.989 ( -5.018 -4.948 3.153) 7.720 16.319 ( -3.191 -1.247 5.028) 6.084 16.433 ( -0.185 -0.480 -1.415) 1.505 16.808 ( -1.709 4.713 0.880) 5.090 16.992 ( -7.059 0.157 -2.539) 7.504 17.442 ( 2.300 -0.248 -1.499) 2.757 17.645 ( 1.335 1.014 -5.951) 6.183 25.623 ( -0.347 3.050 1.105) 3.263 25.671 ( -0.905 1.772 -0.026) 1.990 25.744 ( -0.352 -2.201 5.729) 6.147 25.832 ( 0.435 -0.747 2.793) 2.924 25.870 ( -0.109 -0.940 -0.906) 1.311 26.154 ( 1.240 0.639 -4.346) 4.564 26.439 ( -2.089 0.021 -2.757) 3.459 26.561 ( -0.193 2.580 -7.296) 7.741 26.725 ( 2.948 -2.016 10.237) 10.842 27.272 ( -7.878 -5.996 -4.880) 11.037 28.073 ( 3.956 -2.622 5.240) 7.069 28.303 ( 5.533 2.315 -2.074) 6.346 28.608 ( 16.641 -2.907 5.738) 17.841 28.772 ( 5.019 10.740 -1.886) 12.004 29.023 ( -11.545 5.645 -4.507) 13.618 29.249 ( -11.744 -3.567 -0.877) 12.305 ======================= Grid point 183 (87/140) ======================= q-point: (-0.11 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.320 ( -15.548 11.497 18.216) 26.566 1.522 ( 2.079 18.762 10.335) 21.521 1.853 ( 1.502 11.870 7.381) 14.058 2.096 ( 0.958 10.465 6.118) 12.160 2.175 ( 4.152 10.949 -2.119) 11.900 2.342 ( 11.641 9.110 -6.934) 16.328 2.406 ( -0.212 12.172 5.457) 13.341 2.839 ( 4.207 9.563 9.965) 14.438 2.904 ( -1.521 6.135 5.747) 8.543 2.958 ( -0.277 14.100 -5.437) 15.115 3.085 ( -2.936 0.235 2.277) 3.722 3.218 ( -5.636 5.408 1.603) 7.974 3.370 ( -0.927 3.729 -6.377) 7.445 3.452 ( -1.125 -1.803 -9.146) 9.390 3.845 ( -2.748 -5.048 3.998) 7.001 3.881 ( -1.031 -1.526 -5.023) 5.350 3.999 ( -3.724 3.401 4.957) 7.072 4.112 ( 0.324 -7.775 -4.926) 9.210 4.400 ( 5.802 1.541 -9.094) 10.897 4.425 ( -6.090 0.043 0.832) 6.147 4.547 ( 5.234 -2.967 0.802) 6.070 4.647 ( 3.025 0.817 4.125) 5.180 4.836 ( 5.002 0.801 8.929) 10.266 5.176 ( 3.445 -2.718 -7.241) 8.467 5.304 ( -10.181 -1.586 -5.730) 11.790 5.414 ( 6.082 2.090 -3.685) 7.412 5.546 ( -3.186 9.622 1.622) 10.265 5.777 ( -1.580 5.688 -6.587) 8.845 5.867 ( 2.319 -5.806 1.790) 6.504 6.040 ( 0.534 -5.183 -3.979) 6.556 6.227 ( 2.339 -1.137 4.990) 5.627 6.369 ( -0.116 -0.159 -1.120) 1.138 6.572 ( 0.358 -2.626 7.637) 8.084 6.660 ( 1.517 -3.100 1.710) 3.852 6.804 ( -5.391 -0.305 2.055) 5.778 7.029 ( 2.467 -2.912 -6.891) 7.877 7.164 ( -2.006 -1.343 -3.043) 3.884 7.286 ( -3.934 -0.554 -7.505) 8.491 7.680 ( -1.730 -5.982 3.530) 7.158 7.753 ( 1.642 -7.842 1.930) 8.242 8.632 ( 1.199 8.318 3.598) 9.142 8.780 ( -3.291 8.854 -4.814) 10.602 8.830 ( 2.167 8.759 -0.596) 9.043 8.991 ( -0.039 8.284 -6.673) 10.637 9.171 ( -2.957 1.135 5.124) 6.024 9.328 ( 3.654 0.975 -2.046) 4.300 9.645 ( 2.473 -0.621 6.760) 7.225 9.739 ( -3.796 -1.672 2.352) 4.768 10.240 ( -10.717 -1.366 10.362) 14.970 10.601 ( 7.235 3.803 0.908) 8.224 10.679 ( 4.683 5.957 -4.885) 9.015 10.775 ( -3.757 0.892 -0.383) 3.880 11.140 ( 1.791 0.887 1.232) 2.348 11.284 ( 8.681 -0.552 -5.543) 10.314 11.441 ( 0.519 2.239 6.794) 7.172 11.694 ( 0.736 0.620 -3.451) 3.582 11.805 ( -3.790 -1.694 2.697) 4.951 11.877 ( 1.834 -5.654 2.707) 6.531 12.033 ( 1.591 -0.571 -2.898) 3.355 12.095 ( -4.593 -4.219 -11.564) 13.139 12.296 ( 0.368 -5.973 6.004) 8.477 12.578 ( 3.892 -4.536 -6.444) 8.789 13.279 ( -5.743 -3.309 13.122) 14.701 13.637 ( 6.752 -12.155 -3.401) 14.314 14.710 ( 0.516 -3.700 1.152) 3.909 14.739 ( -1.218 -5.945 3.216) 6.868 14.911 ( -7.621 4.159 4.477) 9.768 15.002 ( -2.956 0.833 -1.155) 3.281 15.133 ( 2.017 4.155 -4.527) 6.468 15.177 ( 4.022 -1.803 -5.219) 6.831 15.425 ( 2.389 -5.434 -0.656) 5.972 15.489 ( -3.399 -2.275 -1.691) 4.425 15.864 ( -2.029 1.544 4.084) 4.814 16.080 ( 7.122 -2.527 -2.674) 8.017 16.342 ( 8.056 -0.598 4.682) 9.337 16.453 ( -13.289 -5.527 1.948) 14.524 16.724 ( -7.311 2.844 3.497) 8.589 16.918 ( -0.810 2.679 -2.388) 3.679 17.435 ( 1.682 1.903 -2.009) 3.239 17.601 ( 3.308 2.608 -6.870) 8.059 25.584 ( 0.137 2.266 1.783) 2.886 25.636 ( 0.019 1.665 -0.611) 1.774 25.794 ( -0.893 -0.752 3.048) 3.264 25.840 ( -1.874 1.028 0.843) 2.297 25.912 ( 0.982 -3.826 5.422) 6.708 26.135 ( 2.146 0.841 -3.280) 4.009 26.399 ( -2.161 1.238 -2.316) 3.401 26.468 ( -1.422 2.253 -7.147) 7.628 26.869 ( 5.415 -4.193 12.029) 13.842 27.263 ( -9.981 -4.412 -7.429) 13.201 28.119 ( -6.377 -1.698 2.632) 7.104 28.293 ( 6.236 2.891 -3.781) 7.844 28.539 ( 1.320 11.680 0.610) 11.770 28.701 ( -13.508 14.931 -5.899) 20.981 29.033 ( 33.963 -10.835 7.619) 36.454 29.242 ( -11.959 -6.410 -2.237) 13.751 ======================= Grid point 186 (88/140) ======================= q-point: ( 0.22 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.182 ( -5.110 -0.000 -13.065) 14.028 1.431 ( -3.693 -0.000 -6.315) 7.316 1.622 ( 14.470 0.000 12.449) 19.088 1.817 ( 3.029 0.000 1.440) 3.354 2.159 ( 0.968 0.000 -14.921) 14.952 2.192 ( -7.171 -0.000 15.973) 17.509 2.259 ( 5.562 0.000 -3.529) 6.587 2.507 ( 5.104 0.000 -14.258) 15.144 2.842 ( 7.613 0.000 4.744) 8.971 2.937 ( 0.452 0.000 12.842) 12.850 3.004 ( -6.535 -0.000 0.763) 6.579 3.232 ( 0.449 0.000 1.482) 1.549 3.233 ( -5.028 -0.000 -7.567) 9.085 3.512 ( 16.831 0.000 7.164) 18.292 3.772 ( -5.786 -0.000 -5.452) 7.950 3.795 ( -1.787 -0.000 5.045) 5.352 4.059 ( -1.261 -0.000 5.071) 5.225 4.131 ( -5.180 -0.000 1.714) 5.456 4.137 ( -6.387 -0.000 -3.596) 7.330 4.394 ( 2.871 0.000 -1.657) 3.314 4.657 ( -5.258 -0.000 -15.932) 16.777 4.744 ( 0.010 0.000 0.007) 0.012 4.953 ( -0.841 -0.000 7.102) 7.152 5.059 ( 7.549 0.000 -1.906) 7.786 5.289 ( -2.499 -0.000 -6.329) 6.804 5.342 ( 2.444 0.000 7.930) 8.298 5.524 ( 1.816 0.000 2.310) 2.938 5.671 ( 10.297 0.000 -0.920) 10.338 6.118 ( 1.486 0.000 -0.337) 1.524 6.123 ( -3.684 -0.000 -5.106) 6.296 6.320 ( 4.903 0.000 5.016) 7.014 6.508 ( 3.945 0.000 -4.217) 5.775 6.614 ( -7.305 -0.000 6.918) 10.061 6.791 ( -1.107 -0.000 -1.176) 1.615 6.803 ( 1.939 0.000 3.050) 3.614 7.057 ( 2.678 0.000 -1.583) 3.111 7.137 ( -3.519 -0.000 5.805) 6.788 7.323 ( 6.639 0.000 -1.531) 6.813 7.528 ( -18.924 -0.000 -3.394) 19.226 7.735 ( -7.398 -0.000 -0.442) 7.411 8.391 ( -7.414 -0.000 -4.644) 8.748 8.584 ( 1.497 0.000 4.078) 4.344 8.599 ( -0.191 -0.000 1.175) 1.191 8.804 ( 7.665 0.000 8.614) 11.530 9.126 ( -13.865 -0.000 -0.182) 13.867 9.224 ( 3.288 0.000 0.750) 3.372 9.530 ( -3.219 -0.000 -4.042) 5.168 9.800 ( 0.800 0.000 -2.810) 2.922 10.248 ( -3.408 -0.000 0.843) 3.510 10.671 ( 1.827 0.000 -6.497) 6.749 10.691 ( 5.808 0.000 -6.985) 9.085 10.753 ( 1.301 0.000 3.575) 3.805 10.993 ( 0.970 0.000 2.068) 2.284 11.418 ( 2.520 0.000 -8.453) 8.821 11.509 ( -1.238 -0.000 -3.160) 3.394 11.603 ( 1.399 0.000 9.657) 9.758 11.898 ( -2.198 -0.000 -6.451) 6.815 11.971 ( 4.067 0.000 1.113) 4.216 12.011 ( -1.693 -0.000 -0.241) 1.710 12.297 ( -8.408 -0.000 3.273) 9.022 12.310 ( 9.666 0.000 6.378) 11.581 12.629 ( -1.553 -0.000 -8.493) 8.634 12.983 ( -24.096 -0.000 4.717) 24.554 13.477 ( -8.058 -0.000 1.739) 8.244 14.713 ( -2.877 -0.000 -0.153) 2.881 14.779 ( -1.515 -0.000 2.062) 2.559 14.971 ( -7.548 -0.000 2.340) 7.902 14.978 ( 2.128 0.000 1.026) 2.362 15.222 ( 9.255 0.000 -7.092) 11.659 15.414 ( 11.160 0.000 -1.701) 11.289 15.431 ( 0.945 0.000 3.628) 3.749 15.651 ( -7.473 -0.000 -2.442) 7.862 15.753 ( 0.047 0.000 2.204) 2.205 15.921 ( 3.465 0.000 -2.197) 4.103 16.243 ( -2.977 -0.000 -0.979) 3.134 16.347 ( -5.603 -0.000 5.632) 7.945 17.085 ( -2.324 -0.000 8.834) 9.135 17.152 ( 17.425 0.000 -6.558) 18.619 17.461 ( 6.993 0.000 4.334) 8.227 17.626 ( 3.501 0.000 -1.806) 3.939 25.592 ( 0.427 0.000 0.640) 0.769 25.600 ( 1.238 0.000 -2.010) 2.360 25.732 ( -2.023 -0.000 1.836) 2.732 25.801 ( -0.950 -0.000 1.821) 2.054 25.998 ( -2.563 -0.000 -1.474) 2.957 26.176 ( 0.779 0.000 -2.663) 2.775 26.400 ( 2.297 0.000 2.840) 3.652 26.408 ( 0.231 0.000 0.893) 0.922 26.934 ( -5.041 -0.000 -4.314) 6.635 27.392 ( 7.751 0.000 8.963) 11.849 27.682 ( -11.523 -0.000 13.886) 18.044 28.071 ( -22.138 -0.000 -13.260) 25.805 28.238 ( -2.630 -0.000 1.611) 3.084 28.335 ( 1.073 0.000 -1.610) 1.935 29.053 ( 11.669 0.000 4.906) 12.659 30.340 ( 24.149 0.000 -14.982) 28.419 ======================= Grid point 187 (89/140) ======================= q-point: ( 0.33 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.209 ( -4.403 -15.722 -9.256) 18.768 1.595 ( 2.090 -20.604 -3.735) 21.043 1.780 ( 6.752 -3.382 -1.104) 7.632 1.884 ( 5.097 -6.281 -3.744) 8.913 2.113 ( -0.742 -1.057 -1.559) 2.025 2.309 ( -3.811 -11.209 -3.095) 12.237 2.383 ( 4.669 -8.028 5.805) 10.952 2.575 ( 2.842 -9.702 -5.212) 11.374 2.882 ( -3.684 3.114 4.588) 6.657 2.953 ( 5.113 -0.300 -4.916) 7.099 3.020 ( 0.724 -1.372 7.815) 7.967 3.169 ( -3.745 -0.674 -4.893) 6.198 3.221 ( -3.674 0.789 3.056) 4.843 3.601 ( -2.410 1.938 1.041) 3.263 3.747 ( 8.144 -1.327 -0.115) 8.252 3.874 ( -0.660 -3.511 7.434) 8.247 4.038 ( -3.304 1.339 -1.690) 3.946 4.056 ( -5.510 0.642 2.427) 6.055 4.171 ( 1.821 -5.124 4.467) 7.038 4.423 ( -1.696 -3.132 -3.006) 4.661 4.547 ( 2.802 1.306 -15.265) 15.575 4.735 ( -0.716 0.600 -0.689) 1.161 4.964 ( -1.248 1.858 3.931) 4.524 5.070 ( 3.935 1.599 -5.867) 7.243 5.275 ( -1.947 -3.166 -2.706) 4.598 5.433 ( 2.202 -2.836 9.374) 10.038 5.529 ( 0.520 1.531 2.390) 2.886 5.754 ( 10.385 -0.129 -0.065) 10.386 6.006 ( -2.286 6.247 -0.903) 6.714 6.125 ( 0.201 0.417 -1.969) 2.023 6.349 ( -0.066 6.101 1.611) 6.310 6.445 ( 5.201 2.959 0.366) 5.995 6.590 ( -1.094 1.998 0.901) 2.450 6.777 ( -0.397 1.345 2.299) 2.693 6.897 ( -1.637 -5.498 0.373) 5.749 6.987 ( 1.839 7.869 -0.814) 8.122 7.112 ( -5.422 2.401 5.880) 8.351 7.277 ( -3.837 0.536 2.264) 4.488 7.533 ( -7.780 -9.315 -3.418) 12.608 7.617 ( -2.359 6.706 -1.676) 7.303 8.415 ( -6.560 -10.255 -3.423) 12.646 8.624 ( 2.094 -1.342 6.141) 6.626 8.661 ( -0.853 -4.803 2.741) 5.596 8.903 ( 3.796 -1.027 7.994) 8.909 9.067 ( -10.860 -4.734 0.409) 11.854 9.222 ( -0.124 1.743 1.744) 2.469 9.568 ( -0.017 -7.994 -5.705) 9.821 9.753 ( 1.137 4.781 -2.431) 5.483 10.193 ( -5.127 1.475 -1.460) 5.531 10.656 ( -5.434 -4.439 -13.821) 15.500 10.700 ( 5.394 -0.341 -6.175) 8.206 10.849 ( 4.557 -6.638 0.462) 8.065 11.046 ( 8.436 0.249 9.431) 12.656 11.392 ( 2.105 0.404 -7.136) 7.451 11.508 ( -0.817 -1.813 -2.392) 3.110 11.642 ( 0.380 0.890 6.177) 6.252 11.825 ( -1.750 3.559 -4.465) 5.972 12.001 ( -1.873 0.328 3.383) 3.880 12.009 ( 4.009 -0.747 -1.599) 4.380 12.264 ( -6.009 -1.327 2.331) 6.580 12.366 ( 5.754 3.548 3.686) 7.700 12.551 ( 1.442 3.359 -8.007) 8.802 12.832 ( -22.387 -2.060 1.365) 22.523 13.392 ( -7.293 4.665 0.254) 8.661 14.684 ( -3.004 0.888 1.711) 3.569 14.772 ( -3.684 2.724 2.128) 5.052 14.869 ( -4.016 1.367 2.014) 4.697 15.037 ( 1.487 -1.695 -0.201) 2.264 15.221 ( 6.358 4.494 -3.427) 8.507 15.388 ( 2.765 4.587 -1.420) 5.541 15.496 ( 7.317 -0.825 -1.424) 7.500 15.621 ( -4.356 -2.271 -1.050) 5.024 15.704 ( 4.371 6.040 0.866) 7.506 15.988 ( -1.821 -3.400 1.017) 3.989 16.183 ( -1.875 2.676 1.493) 3.593 16.408 ( -3.340 -6.051 3.493) 7.744 17.054 ( 6.767 5.698 4.764) 10.048 17.269 ( 8.255 -1.511 -0.201) 8.394 17.476 ( 1.909 5.255 4.457) 7.150 17.651 ( 2.293 -1.057 -2.216) 3.360 25.602 ( 1.124 -0.878 -0.387) 1.478 25.618 ( 0.864 -1.613 -1.170) 2.172 25.737 ( -2.025 -1.273 1.760) 2.970 25.806 ( -1.531 -0.558 1.917) 2.516 25.951 ( -2.381 1.980 -2.673) 4.090 26.166 ( 0.491 0.057 -3.128) 3.166 26.407 ( -0.166 0.201 2.019) 2.036 26.444 ( 2.440 -1.025 2.640) 3.738 26.854 ( -3.441 2.637 -4.659) 6.364 27.516 ( 7.100 -1.319 11.767) 13.806 27.676 ( -14.052 -0.685 0.671) 14.084 27.849 ( -11.913 -2.916 -6.228) 13.756 28.280 ( -3.219 -5.654 0.857) 6.562 28.370 ( -0.104 -4.086 -2.258) 4.669 29.182 ( 10.348 0.022 10.525) 14.760 30.337 ( 18.923 11.054 -14.241) 26.135 ======================= Grid point 188 (90/140) ======================= q-point: ( 0.44 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.528 ( -2.903 -25.243 0.936) 25.427 1.840 ( 1.178 -7.128 -6.556) 9.756 1.926 ( 2.981 -8.484 -5.452) 10.516 2.052 ( 7.775 -10.595 0.483) 13.151 2.156 ( -0.081 -5.952 -0.892) 6.019 2.461 ( -4.769 -11.398 -3.958) 12.974 2.556 ( 1.844 -9.104 -3.175) 9.816 2.777 ( 0.886 -7.541 0.551) 7.613 2.793 ( -5.959 -1.520 -2.520) 6.646 2.970 ( 5.425 2.187 -0.643) 5.884 3.093 ( -1.076 -4.261 0.551) 4.429 3.132 ( -1.511 -1.715 -2.291) 3.236 3.244 ( -3.107 -2.521 11.131) 11.829 3.522 ( -7.868 1.265 0.114) 7.969 3.757 ( 1.086 5.355 2.289) 5.924 3.925 ( -1.375 1.379 11.281) 11.448 3.994 ( -1.944 0.839 1.630) 2.672 4.158 ( 4.299 -11.292 -4.628) 12.939 4.319 ( 3.798 -7.097 0.630) 8.074 4.410 ( -3.706 -2.266 -7.708) 8.848 4.545 ( 6.544 -2.261 -10.568) 12.634 4.722 ( 1.810 0.375 -1.755) 2.549 4.899 ( -1.069 5.418 1.738) 5.789 5.020 ( 2.681 3.343 -6.335) 7.648 5.334 ( -2.226 -5.346 1.591) 6.005 5.451 ( -2.721 3.989 1.312) 5.004 5.583 ( -0.910 -5.523 5.097) 7.570 5.835 ( 9.083 -0.307 2.347) 9.386 5.899 ( 1.846 5.675 2.008) 6.297 6.117 ( 0.528 0.594 -0.918) 1.214 6.223 ( 1.321 5.838 -0.508) 6.007 6.435 ( -1.184 3.715 2.000) 4.382 6.550 ( 2.722 2.229 -1.519) 3.832 6.740 ( -3.190 2.373 0.394) 3.995 6.848 ( 4.089 3.598 1.942) 5.783 6.994 ( -5.349 3.913 5.854) 8.843 7.080 ( -3.003 -4.435 5.414) 7.615 7.240 ( -5.888 1.512 -0.065) 6.080 7.539 ( 0.372 -0.213 -1.718) 1.770 7.576 ( -2.549 -1.658 -3.974) 5.004 8.538 ( -5.666 -9.453 -0.812) 11.051 8.719 ( 2.845 -4.199 8.141) 9.592 8.770 ( -1.252 -7.702 2.802) 8.291 8.953 ( -3.810 -1.527 4.361) 5.989 9.114 ( -1.280 -4.819 -1.239) 5.138 9.229 ( -1.858 -3.416 4.244) 5.756 9.644 ( 2.168 5.771 -2.023) 6.488 9.700 ( 1.222 -7.054 -3.421) 7.935 10.129 ( -6.823 -0.164 -0.971) 6.893 10.602 ( -4.425 -2.500 -15.050) 15.885 10.729 ( 5.248 -1.637 -5.081) 7.486 11.005 ( 4.331 -6.807 0.686) 8.097 11.194 ( 11.615 -1.264 4.728) 12.604 11.386 ( 2.226 -2.255 -1.473) 3.494 11.513 ( -0.934 0.131 -0.167) 0.958 11.639 ( -1.903 0.290 -0.040) 1.925 11.724 ( -1.745 4.828 -1.327) 5.303 11.976 ( -0.281 2.189 -2.096) 3.043 12.053 ( 2.744 -1.220 0.586) 3.059 12.267 ( -3.191 -2.062 1.944) 4.267 12.337 ( -0.816 1.476 -2.508) 3.022 12.487 ( 7.831 6.493 0.782) 10.203 12.722 ( -16.491 -2.758 -2.592) 16.920 13.200 ( -9.215 9.827 -1.337) 13.538 14.650 ( -3.083 2.817 2.787) 5.020 14.680 ( -3.385 1.796 1.257) 4.033 14.881 ( 1.279 -1.125 -2.625) 3.130 15.047 ( -1.064 1.897 3.368) 4.009 15.172 ( 1.750 1.298 0.379) 2.212 15.357 ( 4.790 1.493 -5.421) 7.386 15.524 ( 0.607 -0.200 -2.291) 2.379 15.629 ( 1.870 1.777 4.378) 5.082 15.654 ( 5.759 3.620 -3.727) 7.756 15.968 ( -6.749 2.194 1.704) 7.299 16.165 ( -1.570 0.114 5.090) 5.328 16.488 ( -1.349 -3.871 1.006) 4.221 17.077 ( 12.858 3.817 4.577) 14.172 17.316 ( 1.490 0.681 1.745) 2.393 17.374 ( -1.815 8.463 2.940) 9.141 17.666 ( 0.974 -0.783 -2.805) 3.071 25.635 ( 1.605 -1.899 -0.719) 2.588 25.648 ( 0.254 -1.982 -0.330) 2.025 25.751 ( -2.146 -1.220 1.034) 2.676 25.810 ( -1.973 -0.331 1.779) 2.678 25.879 ( -1.283 2.928 -2.562) 4.096 26.159 ( 0.974 -0.691 -3.850) 4.031 26.419 ( -1.382 -0.731 2.336) 2.811 26.488 ( 1.840 -0.580 2.859) 3.449 26.773 ( -1.635 1.193 -5.736) 6.082 27.441 ( -8.622 7.913 -3.559) 12.232 27.694 ( 0.708 -7.012 4.434) 8.327 27.937 ( -2.050 -8.830 6.258) 11.015 28.361 ( -1.992 -5.532 -1.698) 6.120 28.447 ( -1.820 -7.876 -1.011) 8.146 29.289 ( 5.505 1.319 10.937) 12.315 30.150 ( 13.689 18.063 -12.151) 25.715 ======================= Grid point 189 (91/140) ======================= q-point: ( 0.56 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.849 ( -10.241 -8.624 6.537) 14.899 1.948 ( 5.567 -2.255 -3.870) 7.146 1.982 ( -0.768 -12.142 0.528) 12.178 2.247 ( 1.758 -7.031 -2.613) 7.704 2.311 ( 4.727 -9.050 -6.173) 11.931 2.552 ( -2.202 -4.745 1.181) 5.363 2.690 ( -0.814 -5.658 -9.191) 10.823 2.721 ( 0.034 -2.064 -3.800) 4.325 2.834 ( -0.424 0.045 -0.011) 0.427 3.034 ( -0.596 -1.228 2.156) 2.551 3.118 ( -1.841 -8.103 -1.732) 8.488 3.230 ( 3.067 0.111 7.355) 7.969 3.346 ( -3.546 -8.256 5.896) 10.747 3.467 ( -3.917 -1.904 -1.529) 4.616 3.705 ( 2.694 3.914 7.306) 8.715 3.901 ( -2.363 4.735 6.965) 8.747 4.007 ( -3.925 -3.331 2.374) 5.669 4.298 ( -1.384 -5.061 -6.157) 8.090 4.374 ( -0.562 -0.106 -11.046) 11.061 4.487 ( 3.066 -7.577 -3.049) 8.724 4.521 ( 4.856 3.008 -5.827) 8.160 4.739 ( 3.047 -0.292 -1.619) 3.462 4.834 ( -1.632 3.520 3.986) 5.562 4.988 ( 6.821 -1.892 -8.655) 11.181 5.331 ( -4.165 4.078 0.354) 5.840 5.421 ( -2.176 -2.434 4.291) 5.392 5.663 ( -3.903 -4.818 -0.991) 6.279 5.876 ( 5.545 1.367 4.107) 7.034 5.936 ( 6.721 -1.199 1.269) 6.944 6.070 ( -2.747 2.975 2.627) 4.827 6.214 ( 6.664 1.896 1.816) 7.162 6.359 ( -3.750 2.222 0.439) 4.381 6.555 ( 3.826 -0.121 0.198) 3.833 6.683 ( -3.389 0.434 -1.320) 3.663 6.841 ( -2.694 3.849 5.218) 7.022 6.892 ( -0.508 4.237 5.519) 6.976 7.161 ( -2.232 1.288 1.563) 3.014 7.193 ( -3.138 -5.976 1.873) 7.005 7.506 ( -4.340 2.686 -6.593) 8.338 7.564 ( 1.393 -1.379 -3.067) 3.640 8.605 ( -4.589 -3.224 3.967) 6.869 8.874 ( 1.959 -6.059 5.014) 8.105 8.910 ( -1.158 -7.244 -0.347) 7.344 8.984 ( 1.122 -3.728 6.176) 7.301 9.137 ( 1.166 -0.262 -3.459) 3.659 9.355 ( -0.149 -7.653 4.511) 8.885 9.570 ( 0.456 2.798 3.358) 4.394 9.796 ( 0.622 -3.565 -3.959) 5.364 10.088 ( -7.554 -1.671 2.821) 8.235 10.547 ( -1.162 -2.620 -13.863) 14.156 10.782 ( 5.165 -1.791 -2.992) 6.232 11.101 ( -0.861 -1.045 -1.064) 1.722 11.225 ( 8.412 4.935 -1.623) 9.887 11.485 ( -1.384 -0.228 2.642) 2.991 11.522 ( 3.810 -1.248 9.042) 9.891 11.614 ( 0.507 2.873 0.383) 2.942 11.650 ( -0.719 -2.902 -7.454) 8.031 11.933 ( 1.122 -0.204 -6.251) 6.355 12.074 ( -0.594 -0.274 -2.094) 2.194 12.247 ( -4.793 2.948 2.372) 6.106 12.309 ( -0.009 1.113 -3.522) 3.694 12.483 ( 9.039 4.496 4.567) 11.080 12.635 ( -7.105 -1.089 -3.970) 8.211 12.983 ( -9.702 3.377 -0.438) 10.282 14.602 ( -2.318 0.781 1.307) 2.773 14.670 ( -0.831 -1.174 0.261) 1.461 14.878 ( 0.840 0.084 -2.847) 2.969 14.997 ( -1.653 3.196 0.428) 3.623 15.231 ( 0.145 -4.076 4.271) 5.905 15.347 ( 3.741 0.651 -3.632) 5.255 15.505 ( -0.039 1.026 -2.381) 2.593 15.588 ( 4.953 5.988 -2.605) 8.196 15.657 ( 2.127 0.307 1.367) 2.547 15.869 ( -7.391 3.046 3.036) 8.552 16.192 ( -2.180 -1.136 7.784) 8.163 16.523 ( 0.701 -1.005 -1.649) 2.054 17.115 ( 10.345 6.812 1.926) 12.535 17.217 ( -3.055 7.695 -0.369) 8.288 17.326 ( -0.293 -0.788 4.948) 5.019 17.667 ( 0.104 -0.640 -3.316) 3.378 25.664 ( 0.029 -1.086 -0.189) 1.103 25.694 ( 1.155 -2.449 0.603) 2.774 25.749 ( -1.761 -0.004 -0.164) 1.769 25.799 ( -1.961 0.714 0.617) 2.176 25.829 ( -0.085 1.236 0.313) 1.277 26.161 ( 1.132 -0.929 -5.400) 5.595 26.421 ( -2.386 -0.902 -0.731) 2.653 26.530 ( 1.766 -0.754 5.074) 5.425 26.733 ( -0.901 -0.164 -4.790) 4.877 27.260 ( -7.023 3.747 -4.653) 9.220 27.839 ( 4.054 -4.705 7.300) 9.585 28.112 ( 1.075 -8.046 6.978) 10.704 28.409 ( 0.295 -3.271 -3.585) 4.862 28.590 ( -3.176 -10.993 -0.168) 11.443 29.320 ( 0.746 3.383 7.399) 8.170 29.854 ( 7.900 20.417 -9.805) 23.987 ======================= Grid point 190 (92/140) ======================= q-point: (-0.33 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.812 ( -9.272 5.685 12.491) 16.562 1.991 ( 0.511 -3.943 -2.932) 4.940 2.157 ( -5.468 -3.040 -3.953) 7.400 2.312 ( 0.508 -5.218 -3.330) 6.211 2.409 ( 6.737 -1.307 -2.994) 7.487 2.589 ( 4.626 2.535 2.421) 5.804 2.683 ( -2.735 -3.476 -3.725) 5.783 2.827 ( -2.001 -2.826 1.202) 3.666 2.886 ( 4.129 -8.164 -0.768) 9.181 3.036 ( 1.011 0.702 1.044) 1.614 3.163 ( 2.004 4.223 2.017) 5.091 3.293 ( -0.709 -8.077 0.361) 8.117 3.485 ( -4.030 -7.136 4.346) 9.277 3.537 ( 2.891 -3.899 3.497) 5.983 3.701 ( 2.661 3.260 0.761) 4.276 3.822 ( -4.864 4.361 4.235) 7.785 4.055 ( -5.247 -4.673 4.830) 8.527 4.221 ( -6.307 3.756 -7.951) 10.822 4.338 ( 2.607 -1.812 -8.160) 8.756 4.455 ( 4.108 2.000 -7.928) 9.151 4.588 ( -2.261 0.686 -1.891) 3.026 4.745 ( 2.870 1.291 4.615) 5.586 4.785 ( 1.666 3.395 1.743) 4.164 5.085 ( 6.923 -6.422 -11.466) 14.855 5.258 ( -2.956 1.870 3.789) 5.157 5.462 ( 0.950 -1.167 3.457) 3.770 5.682 ( -3.181 -2.298 -3.093) 4.997 5.923 ( 5.989 2.394 3.136) 7.172 5.964 ( -2.610 -1.954 -6.284) 7.080 6.026 ( 0.165 4.663 6.451) 7.962 6.200 ( -1.396 3.319 4.723) 5.939 6.353 ( 3.957 -0.875 -1.112) 4.203 6.581 ( -1.124 0.073 2.733) 2.956 6.686 ( 2.517 0.371 1.762) 3.094 6.768 ( -3.448 -0.997 0.015) 3.590 6.885 ( -0.433 2.090 5.676) 6.064 7.124 ( -2.286 -0.753 -4.532) 5.131 7.303 ( -1.366 -5.924 6.518) 8.913 7.378 ( -2.815 4.039 -7.807) 9.230 7.566 ( -1.238 -1.310 -5.037) 5.350 8.646 ( -2.493 -2.609 6.587) 7.510 8.945 ( 2.603 -2.818 -4.666) 6.041 9.001 ( -2.017 -4.841 1.468) 5.446 9.098 ( 4.649 1.692 1.480) 5.164 9.175 ( 4.712 -3.778 4.306) 7.417 9.459 ( -1.531 -2.731 4.705) 5.652 9.604 ( -0.046 -2.393 4.590) 5.177 9.762 ( -2.502 2.747 -4.352) 5.722 10.110 ( -7.645 -4.283 7.585) 11.590 10.552 ( 3.774 -4.119 -10.666) 12.041 10.817 ( 3.326 1.373 0.548) 3.640 11.014 ( -6.417 5.246 -1.256) 8.383 11.202 ( 10.630 4.617 -2.464) 11.849 11.500 ( -5.302 -1.049 5.412) 7.648 11.515 ( -1.722 2.810 -3.883) 5.093 11.559 ( 2.706 3.089 2.932) 5.046 11.760 ( 7.423 -4.159 1.071) 8.576 11.928 ( -2.108 -1.847 -7.540) 8.044 12.018 ( -6.883 2.085 -2.765) 7.705 12.190 ( 1.513 2.558 -2.095) 3.636 12.249 ( -0.457 1.134 -2.529) 2.809 12.340 ( 1.000 11.257 -4.532) 12.176 12.776 ( 3.081 -12.446 6.151) 14.221 12.986 ( -2.901 -7.705 1.558) 8.379 14.590 ( -0.387 0.413 1.010) 1.158 14.695 ( -2.546 -2.705 -0.483) 3.746 14.887 ( 2.503 -1.359 -2.427) 3.742 14.948 ( -0.824 0.360 -0.755) 1.174 15.256 ( -1.818 2.785 2.027) 3.895 15.376 ( -0.461 -0.484 0.471) 0.818 15.464 ( 0.585 1.786 -2.191) 2.886 15.511 ( 2.766 3.540 -3.989) 6.008 15.689 ( 4.935 -0.649 2.967) 5.794 15.821 ( -5.748 -1.918 2.710) 6.637 16.233 ( -4.098 -1.391 9.199) 10.166 16.523 ( 2.661 1.064 -3.244) 4.329 17.009 ( -3.508 7.664 0.505) 8.444 17.090 ( 2.521 6.717 -2.642) 7.645 17.392 ( 2.633 -2.124 4.490) 5.621 17.657 ( 0.219 -0.263 -4.232) 4.246 25.681 ( -0.579 -0.631 3.065) 3.183 25.717 ( -0.077 1.818 0.299) 1.844 25.739 ( 0.298 -0.188 -0.571) 0.671 25.781 ( -1.143 -0.926 0.959) 1.756 25.832 ( -0.293 -0.792 0.998) 1.307 26.149 ( 0.797 -0.666 -7.561) 7.632 26.418 ( -1.291 -1.007 -0.874) 1.856 26.580 ( 0.794 -1.253 0.783) 1.678 26.712 ( -0.234 0.455 1.749) 1.822 27.162 ( -5.536 -0.240 -4.708) 7.271 27.979 ( 3.824 -3.503 7.820) 9.383 28.268 ( 2.672 -4.943 4.233) 7.035 28.469 ( 5.664 -3.901 -0.745) 6.918 28.738 ( -3.744 -9.995 -1.577) 10.789 29.252 ( -2.376 7.216 2.794) 8.094 29.526 ( 1.603 17.661 -6.929) 19.039 ======================= Grid point 191 (93/140) ======================= q-point: (-0.22 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.673 ( -9.523 9.346 13.158) 18.739 2.024 ( -1.598 7.328 -6.357) 9.832 2.037 ( -1.191 0.472 3.370) 3.605 2.367 ( 6.956 0.561 -8.523) 11.016 2.447 ( -2.541 1.897 6.848) 7.547 2.559 ( 6.440 7.179 0.885) 9.685 2.695 ( 0.310 0.941 2.389) 2.587 2.826 ( -1.698 -1.777 1.675) 2.974 3.028 ( 1.296 1.437 2.553) 3.203 3.062 ( 6.659 -3.966 -0.231) 7.754 3.158 ( 1.972 -0.035 0.146) 1.977 3.423 ( -2.962 -7.549 -3.867) 8.984 3.506 ( 0.342 8.444 4.464) 9.557 3.551 ( -1.655 1.289 2.676) 3.401 3.704 ( -0.998 -4.499 -3.811) 5.980 3.734 ( -5.306 2.754 2.885) 6.638 4.064 ( -5.748 1.471 -2.400) 6.400 4.141 ( -4.256 -1.439 2.393) 5.090 4.367 ( 6.636 0.497 -2.650) 7.163 4.428 ( 2.482 0.081 -3.057) 3.939 4.492 ( -2.094 2.401 -5.975) 6.772 4.749 ( -0.713 1.784 5.170) 5.516 4.797 ( 6.611 0.531 1.023) 6.711 5.152 ( 2.417 -4.285 -13.019) 13.917 5.243 ( -1.579 1.818 6.205) 6.656 5.494 ( 3.282 1.132 -1.384) 3.737 5.685 ( -1.658 -2.109 0.550) 2.739 5.869 ( 0.452 7.752 2.616) 8.194 5.922 ( -4.248 0.938 -3.479) 5.570 5.976 ( 0.510 1.687 -3.844) 4.229 6.195 ( 0.640 0.530 7.226) 7.273 6.371 ( -0.206 0.086 -2.186) 2.197 6.594 ( 1.829 0.132 3.728) 4.154 6.668 ( 1.995 3.500 5.174) 6.558 6.832 ( -2.500 0.571 -0.245) 2.576 6.855 ( -0.864 -4.348 -2.835) 5.262 7.108 ( -1.255 -1.446 -3.451) 3.946 7.268 ( -2.881 1.499 -6.437) 7.210 7.446 ( -1.822 -8.418 4.554) 9.743 7.565 ( 0.144 -2.407 -2.742) 3.651 8.719 ( -0.642 -3.134 6.637) 7.368 8.980 ( 1.314 0.590 -5.469) 5.655 9.039 ( 0.256 -2.097 0.127) 2.116 9.077 ( 3.126 3.821 -1.003) 5.038 9.246 ( 3.122 2.347 4.915) 6.278 9.444 ( -5.804 4.028 -3.251) 7.777 9.627 ( 2.068 0.298 7.127) 7.427 9.728 ( -2.001 -0.936 0.672) 2.309 10.157 ( -9.745 -3.922 9.629) 14.250 10.633 ( 8.380 -4.332 -6.628) 11.528 10.794 ( 0.690 3.653 3.458) 5.077 10.873 ( -4.207 5.368 -0.509) 6.840 11.223 ( 11.762 3.079 -1.706) 12.278 11.385 ( -2.098 5.393 -6.170) 8.459 11.504 ( -1.719 0.028 2.413) 2.963 11.582 ( -0.371 -2.323 3.135) 3.920 11.826 ( 0.128 2.265 -2.205) 3.163 11.870 ( -3.913 2.053 -2.566) 5.109 11.957 ( -1.445 -2.581 2.957) 4.182 12.099 ( 1.480 5.791 -3.643) 7.000 12.206 ( 2.090 1.889 -4.469) 5.283 12.326 ( 1.392 -8.186 -6.842) 10.759 13.030 ( -2.709 -11.676 8.053) 14.441 13.174 ( 4.332 -12.961 1.437) 13.742 14.592 ( 0.506 0.191 2.639) 2.693 14.698 ( -1.932 -0.696 -1.677) 2.651 14.935 ( 1.732 -2.829 -0.599) 3.371 14.981 ( -0.821 -5.034 -1.012) 5.200 15.161 ( -3.151 6.517 1.947) 7.496 15.301 ( -0.823 5.106 -2.430) 5.715 15.459 ( 3.676 1.733 -3.143) 5.138 15.469 ( -0.607 1.320 -1.660) 2.206 15.796 ( 3.226 -4.017 4.297) 6.709 15.863 ( -2.786 -6.668 2.150) 7.540 16.260 ( -6.565 -1.670 8.624) 10.967 16.499 ( 4.488 3.054 -3.511) 6.465 16.855 ( -7.972 5.622 1.086) 9.815 17.007 ( 4.196 4.176 -3.889) 7.084 17.452 ( 1.835 -0.665 2.169) 2.918 17.641 ( 1.691 0.276 -5.290) 5.560 25.674 ( -0.380 2.710 1.112) 2.954 25.695 ( -0.107 1.423 0.941) 1.709 25.743 ( -0.242 -0.989 4.568) 4.680 25.820 ( 0.148 -2.547 1.302) 2.865 25.847 ( -0.920 -0.826 0.508) 1.336 26.130 ( 1.353 -0.964 -8.271) 8.436 26.419 ( -0.445 0.073 -0.284) 0.534 26.553 ( -2.043 1.524 -6.845) 7.304 26.768 ( 2.700 -1.915 11.071) 11.555 27.124 ( -5.161 -2.721 -5.470) 7.997 28.069 ( -1.709 -1.757 6.491) 6.938 28.338 ( 2.982 -0.784 -2.243) 3.813 28.657 ( 12.293 -7.766 4.654) 15.267 28.838 ( 0.295 -5.538 -2.954) 6.284 29.080 ( -3.452 10.715 0.862) 11.290 29.240 ( -4.848 11.685 -4.932) 13.579 ======================= Grid point 192 (94/140) ======================= q-point: (-0.11 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.501 ( -6.668 10.998 13.960) 18.981 1.837 ( 1.568 12.367 3.232) 12.878 1.997 ( -2.014 5.858 -0.858) 6.254 2.284 ( 3.414 11.359 3.000) 12.234 2.398 ( 0.621 2.360 -7.623) 8.004 2.463 ( 9.625 10.746 -0.472) 14.435 2.674 ( 1.981 6.723 10.050) 12.252 2.880 ( -2.140 -2.400 4.064) 5.183 3.028 ( -0.105 2.147 -1.404) 2.568 3.085 ( 0.916 3.330 1.169) 3.646 3.161 ( 4.008 3.079 1.749) 5.348 3.345 ( -4.015 12.300 5.378) 14.012 3.357 ( -4.939 1.034 -12.961) 13.908 3.481 ( -2.383 8.161 1.585) 8.648 3.744 ( -0.627 -3.495 0.278) 3.562 3.782 ( -2.470 -7.342 -0.357) 7.754 3.998 ( -3.241 -1.044 -0.883) 3.518 4.100 ( -1.309 5.036 5.963) 7.914 4.361 ( -1.678 0.002 -6.122) 6.348 4.435 ( 3.182 1.040 -0.617) 3.404 4.530 ( 7.820 -4.845 -2.877) 9.639 4.728 ( 2.294 3.284 1.252) 4.197 4.884 ( 4.201 -3.918 4.974) 7.599 5.131 ( -2.953 -1.246 -13.792) 14.160 5.213 ( -3.557 2.659 5.802) 7.306 5.469 ( 5.060 2.169 -6.743) 8.705 5.682 ( -3.388 5.382 5.233) 8.236 5.793 ( 1.192 2.096 2.358) 3.372 5.864 ( 1.175 1.819 -2.911) 3.628 5.942 ( -1.287 -2.839 -6.469) 7.181 6.241 ( 0.902 -1.222 5.923) 6.115 6.349 ( -0.664 -0.293 -2.743) 2.837 6.627 ( 3.341 1.246 4.401) 5.664 6.680 ( 4.868 0.988 3.592) 6.130 6.740 ( -10.646 0.003 -0.060) 10.646 6.941 ( 3.798 -4.750 -5.819) 8.417 7.120 ( -1.132 -1.814 -0.005) 2.138 7.213 ( -3.023 -0.689 -5.147) 6.009 7.558 ( -5.646 -6.471 2.355) 8.905 7.655 ( 2.595 -6.478 1.062) 7.059 8.769 ( 1.495 2.175 5.068) 5.714 8.856 ( -5.653 7.298 -3.646) 9.925 8.990 ( 0.671 7.717 -0.953) 7.805 9.066 ( 2.259 3.312 -4.168) 5.783 9.217 ( -2.751 4.205 2.955) 5.829 9.322 ( 0.434 0.394 -2.442) 2.511 9.681 ( -5.406 -1.910 4.908) 7.547 9.716 ( 1.593 2.122 3.352) 4.275 10.183 ( -9.163 -2.395 10.233) 13.943 10.710 ( 3.440 0.181 -0.939) 3.571 10.769 ( 4.010 2.184 -4.268) 6.250 10.786 ( 4.873 3.945 2.403) 6.715 11.174 ( -3.454 4.473 -4.035) 6.944 11.331 ( 9.091 1.411 -4.631) 10.300 11.512 ( 0.348 1.320 5.309) 5.482 11.660 ( 3.572 -5.118 -2.546) 6.741 11.780 ( -2.848 0.211 1.296) 3.136 11.810 ( -3.859 -0.537 1.361) 4.127 12.001 ( 1.913 -0.402 -6.023) 6.332 12.042 ( 3.098 0.749 -0.242) 3.196 12.233 ( -0.760 -4.269 2.675) 5.095 12.443 ( 2.087 -8.466 -8.443) 12.137 13.191 ( -7.580 -7.699 8.601) 13.810 13.434 ( 0.628 -13.497 -1.570) 13.602 14.634 ( -0.761 -3.756 4.523) 5.928 14.698 ( 0.313 -1.161 -0.351) 1.253 14.936 ( -6.590 1.689 1.289) 6.924 15.034 ( 1.304 4.497 3.600) 5.906 15.096 ( 0.007 -4.732 -4.893) 6.807 15.220 ( 4.018 2.633 -3.177) 5.759 15.432 ( 2.975 2.405 -0.056) 3.826 15.440 ( 0.057 0.249 -4.046) 4.054 15.837 ( -7.996 -2.135 3.934) 9.163 16.032 ( 6.101 -7.679 -0.031) 9.808 16.280 ( -8.271 -3.569 5.969) 10.806 16.470 ( 6.966 3.199 -0.557) 7.686 16.713 ( -10.051 3.965 1.798) 10.953 16.985 ( 7.156 2.049 -1.737) 7.644 17.460 ( 0.420 0.915 -1.129) 1.513 17.626 ( 3.972 0.917 -5.339) 6.717 25.632 ( -0.013 2.608 1.204) 2.873 25.666 ( 0.694 1.995 -0.513) 2.173 25.788 ( -1.321 -1.171 5.159) 5.453 25.844 ( -1.590 0.302 0.097) 1.622 25.881 ( -0.149 -3.436 4.143) 5.384 26.129 ( 3.467 -1.322 -6.862) 7.801 26.399 ( -1.109 1.538 -0.392) 1.936 26.465 ( -1.750 2.695 -5.685) 6.530 26.902 ( 3.587 -3.868 12.512) 13.579 27.107 ( -5.008 -3.120 -6.293) 8.627 28.073 ( -7.217 0.269 4.682) 8.607 28.335 ( 1.404 1.072 -5.005) 5.308 28.710 ( -4.259 5.844 -0.300) 7.238 28.842 ( -6.185 13.482 -3.100) 15.154 29.031 ( -0.492 0.193 0.059) 0.532 29.137 ( 21.067 -12.215 0.783) 24.365 ======================= Grid point 196 (95/140) ======================= q-point: ( 0.33 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.032 ( 2.174 0.000 -10.677) 10.896 1.298 ( -1.638 -0.000 -8.772) 8.923 1.691 ( 1.562 0.000 -21.437) 21.494 1.908 ( 4.948 0.000 4.292) 6.550 2.169 ( 1.120 0.000 6.339) 6.437 2.186 ( 2.560 0.000 4.325) 5.026 2.400 ( 5.309 0.000 6.735) 8.576 2.458 ( 0.008 0.000 -5.338) 5.338 2.797 ( -12.426 -0.000 -9.195) 15.458 3.036 ( 1.449 0.000 9.715) 9.823 3.088 ( 12.841 0.000 -2.255) 13.037 3.137 ( -0.955 -0.000 4.440) 4.542 3.197 ( -5.783 -0.000 0.140) 5.784 3.623 ( -6.608 -0.000 -4.654) 8.082 3.715 ( 7.772 0.000 -0.585) 7.794 3.865 ( -2.668 -0.000 0.570) 2.728 4.015 ( -6.319 -0.000 -1.078) 6.411 4.069 ( 1.892 0.000 8.647) 8.852 4.155 ( 0.997 0.000 1.956) 2.196 4.367 ( -4.951 -0.000 0.919) 5.036 4.526 ( 9.405 0.000 -16.276) 18.798 4.737 ( -1.763 -0.000 1.365) 2.230 4.955 ( -6.131 -0.000 3.262) 6.945 5.076 ( 1.546 0.000 -5.530) 5.742 5.241 ( 1.495 0.000 -0.278) 1.521 5.480 ( 1.873 0.000 8.181) 8.393 5.553 ( 0.503 0.000 0.487) 0.700 5.843 ( 11.708 0.000 -0.919) 11.744 6.044 ( -1.995 -0.000 0.587) 2.080 6.102 ( -1.703 -0.000 1.054) 2.003 6.475 ( 7.899 0.000 1.968) 8.140 6.508 ( 1.528 0.000 -3.445) 3.769 6.590 ( -4.178 -0.000 6.001) 7.312 6.728 ( -3.400 -0.000 -3.052) 4.568 6.890 ( 4.339 0.000 3.870) 5.814 7.115 ( -7.674 -0.000 6.696) 10.185 7.122 ( 6.065 0.000 -1.792) 6.325 7.207 ( -15.550 -0.000 -2.090) 15.690 7.346 ( -4.055 -0.000 1.376) 4.282 7.664 ( 1.022 0.000 -4.087) 4.213 8.266 ( -2.854 -0.000 -2.841) 4.027 8.635 ( -0.991 -0.000 7.281) 7.349 8.668 ( 2.033 0.000 5.161) 5.546 8.886 ( -13.255 -0.000 6.618) 14.815 9.025 ( 4.799 0.000 5.782) 7.514 9.273 ( 2.985 0.000 -0.928) 3.126 9.425 ( -2.170 -0.000 -7.320) 7.635 9.793 ( 1.912 0.000 -3.347) 3.855 10.146 ( -6.644 -0.000 -5.494) 8.621 10.470 ( -6.335 -0.000 -18.027) 19.108 10.755 ( 9.390 0.000 -4.738) 10.518 10.803 ( 0.425 0.000 2.462) 2.499 11.164 ( 8.076 0.000 11.329) 13.913 11.370 ( 1.236 0.000 -5.468) 5.606 11.488 ( 2.784 0.000 -3.856) 4.756 11.675 ( -2.557 -0.000 4.654) 5.310 11.820 ( -1.325 -0.000 -3.988) 4.202 12.017 ( 2.780 0.000 -3.507) 4.475 12.018 ( -0.894 -0.000 6.582) 6.643 12.206 ( -6.627 -0.000 0.959) 6.696 12.364 ( -5.958 -0.000 -9.726) 11.406 12.572 ( -5.762 -0.000 -1.207) 5.888 12.708 ( -3.081 -0.000 4.854) 5.749 13.392 ( -4.782 -0.000 -0.536) 4.812 14.686 ( -0.097 -0.000 -0.243) 0.261 14.770 ( -3.352 -0.000 2.360) 4.099 14.873 ( -7.983 -0.000 6.363) 10.208 15.019 ( 2.271 0.000 0.895) 2.441 15.291 ( 9.836 0.000 -10.670) 14.512 15.465 ( -7.119 -0.000 -5.604) 9.060 15.500 ( 2.398 0.000 4.929) 5.482 15.580 ( 6.814 0.000 -0.099) 6.815 15.800 ( 3.791 0.000 0.606) 3.840 15.962 ( -0.525 -0.000 4.295) 4.327 16.222 ( 0.331 0.000 0.136) 0.358 16.326 ( -3.994 -0.000 4.146) 5.757 17.153 ( 2.436 0.000 6.230) 6.689 17.338 ( 13.936 0.000 -3.852) 14.458 17.562 ( -3.430 -0.000 8.942) 9.577 17.641 ( 1.091 0.000 -2.236) 2.488 25.602 ( 0.461 0.000 0.055) 0.465 25.603 ( 1.762 0.000 -2.125) 2.761 25.721 ( -2.002 -0.000 1.991) 2.823 25.796 ( -1.882 -0.000 1.528) 2.424 25.934 ( -2.508 -0.000 -2.887) 3.824 26.157 ( 0.210 0.000 -2.519) 2.528 26.417 ( -0.413 -0.000 0.911) 1.000 26.446 ( 0.624 0.000 0.524) 0.815 26.849 ( -2.671 -0.000 -1.465) 3.046 27.451 ( -8.895 -0.000 -11.866) 14.830 27.683 ( -6.886 -0.000 14.526) 16.075 27.747 ( 2.404 0.000 -0.292) 2.421 28.219 ( -2.009 -0.000 1.960) 2.806 28.330 ( 0.599 0.000 -1.954) 2.043 29.323 ( 7.542 0.000 15.842) 17.546 30.490 ( 16.175 0.000 -16.620) 23.192 ======================= Grid point 197 (96/140) ======================= q-point: ( 0.44 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.122 ( 1.050 -16.928 -3.928) 17.410 1.545 ( 2.271 -24.992 -9.126) 26.702 1.682 ( 4.917 -6.112 -13.967) 16.019 1.991 ( -3.833 -8.775 2.034) 9.790 2.214 ( 8.049 4.031 6.722) 11.234 2.253 ( -2.267 -6.703 0.121) 7.077 2.430 ( 1.767 -3.751 -4.158) 5.872 2.608 ( -2.251 -11.080 3.329) 11.786 2.670 ( -8.537 -2.290 -6.195) 10.794 3.057 ( -1.554 0.105 0.880) 1.789 3.077 ( 2.421 3.344 -6.472) 7.677 3.148 ( 6.588 4.662 5.948) 10.026 3.232 ( -3.831 -3.420 9.250) 10.580 3.515 ( -3.534 3.478 -1.300) 5.126 3.810 ( 2.672 -0.061 -4.428) 5.172 3.869 ( -5.184 -7.614 0.603) 9.231 3.984 ( -2.534 -3.663 0.745) 4.516 4.113 ( 1.090 4.474 10.055) 11.059 4.206 ( 1.464 -6.755 -4.092) 8.033 4.345 ( -1.146 -0.438 -2.326) 2.629 4.537 ( 10.666 -0.157 -11.935) 16.007 4.729 ( -1.000 -0.348 0.664) 1.250 4.917 ( -7.218 0.104 0.828) 7.266 5.051 ( 0.515 1.390 -4.557) 4.792 5.263 ( 0.527 -1.034 3.524) 3.710 5.511 ( 0.267 2.300 2.167) 3.172 5.558 ( 0.391 -0.642 2.665) 2.769 5.899 ( 7.159 -0.068 -6.009) 9.347 6.008 ( 1.165 3.997 4.496) 6.128 6.132 ( 1.662 -0.264 7.100) 7.296 6.381 ( 4.930 9.006 -0.007) 10.267 6.505 ( -1.540 4.142 -1.009) 4.533 6.575 ( 0.341 0.824 -3.192) 3.314 6.728 ( -5.961 -1.386 0.125) 6.121 6.941 ( 3.163 0.024 3.208) 4.506 7.011 ( 1.713 3.347 4.369) 5.764 7.066 ( -8.104 2.845 6.749) 10.923 7.216 ( -4.354 -1.117 0.740) 4.556 7.394 ( -5.124 -7.611 -2.898) 9.622 7.614 ( 2.712 3.770 -4.425) 6.414 8.338 ( 0.138 -9.378 -0.876) 9.420 8.663 ( -3.372 -2.630 3.591) 5.584 8.739 ( 0.703 -4.140 5.615) 7.011 8.875 ( -8.756 -3.396 11.333) 14.718 9.097 ( 4.485 -1.081 5.207) 6.956 9.209 ( -2.376 2.781 0.029) 3.658 9.528 ( 3.859 -10.633 -7.344) 13.487 9.751 ( 1.394 4.489 -2.685) 5.413 10.054 ( -7.074 0.087 -6.089) 9.334 10.395 ( -4.407 -6.111 -20.158) 21.520 10.760 ( 4.988 1.563 -0.981) 5.319 10.908 ( 3.284 -7.137 -0.891) 7.906 11.287 ( 8.346 -1.028 11.005) 13.850 11.368 ( 2.516 -0.564 -4.465) 5.156 11.505 ( 2.958 -0.764 -1.017) 3.220 11.638 ( -5.874 1.454 0.433) 6.067 11.774 ( -0.680 2.774 -1.643) 3.295 12.002 ( 0.623 1.262 -4.652) 4.860 12.063 ( 1.239 -0.909 5.643) 5.848 12.168 ( -6.969 -2.389 -1.783) 7.580 12.266 ( -7.338 -1.189 -8.556) 11.335 12.511 ( -9.888 -3.506 -2.803) 10.859 12.731 ( 9.112 6.304 6.998) 13.105 13.288 ( -5.547 7.206 -2.287) 9.377 14.679 ( 0.560 1.185 1.176) 1.761 14.715 ( -6.014 3.832 3.063) 7.761 14.863 ( -0.189 -1.010 3.307) 3.463 15.064 ( 1.475 -1.607 0.882) 2.353 15.238 ( 0.414 6.519 -5.439) 8.500 15.378 ( 1.360 0.236 -6.781) 6.920 15.523 ( 1.039 1.237 1.614) 2.284 15.653 ( 4.248 -1.289 1.353) 4.641 15.787 ( 5.342 5.033 -0.071) 7.340 15.965 ( -4.302 1.206 3.275) 5.539 16.195 ( 0.294 1.720 3.084) 3.543 16.391 ( -2.799 -6.292 1.901) 7.144 17.211 ( 6.834 -0.050 5.372) 8.693 17.391 ( 8.839 3.906 -1.569) 9.790 17.506 ( -5.930 5.936 8.269) 11.781 17.644 ( 0.261 -0.652 -2.787) 2.874 25.617 ( 1.766 -1.170 -1.741) 2.741 25.618 ( 0.242 -1.506 -0.244) 1.545 25.722 ( -2.109 -0.897 1.760) 2.890 25.792 ( -2.239 -0.572 1.164) 2.588 25.892 ( -1.879 1.349 -2.026) 3.075 26.143 ( 0.726 0.130 -3.569) 3.644 26.411 ( -1.180 0.227 0.359) 1.254 26.468 ( -0.730 -2.439 -0.412) 2.579 26.791 ( -1.360 3.399 -0.944) 3.781 27.329 ( -10.496 -2.142 -16.152) 19.382 27.715 ( 0.013 -1.125 13.448) 13.495 27.849 ( 4.333 -4.930 6.713) 9.389 28.256 ( -1.368 -4.557 1.284) 4.928 28.348 ( 0.085 -2.827 -2.145) 3.550 29.427 ( 2.922 2.468 16.990) 17.415 30.429 ( 13.042 10.845 -16.473) 23.644 ======================= Grid point 198 (97/140) ======================= q-point: ( 0.56 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.487 ( -2.701 -23.939 -0.603) 24.099 1.771 ( -2.844 -9.682 -3.235) 10.597 1.894 ( 7.592 -14.439 -8.703) 18.490 2.176 ( 2.440 -8.946 4.336) 10.237 2.195 ( -2.143 0.760 2.617) 3.467 2.405 ( -1.157 -11.508 2.323) 11.797 2.491 ( -3.991 -6.574 -12.009) 14.261 2.615 ( -3.128 -6.726 -3.818) 8.343 2.842 ( 1.669 -6.162 3.053) 7.076 2.970 ( -0.801 -0.521 -4.920) 5.012 3.077 ( -0.425 4.360 3.107) 5.370 3.170 ( 3.232 -6.172 1.564) 7.141 3.318 ( -2.197 -4.540 8.977) 10.297 3.442 ( -0.399 4.145 -1.149) 4.320 3.805 ( 0.854 0.879 4.072) 4.252 3.911 ( -6.264 -2.957 2.822) 7.480 4.027 ( -3.495 5.270 9.225) 11.184 4.141 ( 1.830 -8.653 -8.090) 11.986 4.286 ( -2.309 -3.317 -5.769) 7.044 4.372 ( 6.297 -5.125 -9.640) 12.603 4.564 ( 8.134 0.773 -6.030) 10.154 4.746 ( -0.068 -1.317 0.348) 1.364 4.857 ( -4.169 0.608 0.294) 4.223 4.990 ( 0.046 2.376 -5.457) 5.952 5.325 ( -1.223 -3.154 5.012) 6.047 5.449 ( 0.493 5.041 3.918) 6.403 5.579 ( -2.285 -1.410 -0.740) 2.786 5.897 ( 1.438 -0.417 -9.737) 9.851 6.004 ( 4.752 2.275 6.724) 8.542 6.176 ( 3.953 3.274 10.007) 11.247 6.334 ( 9.300 3.861 0.981) 10.118 6.390 ( -4.741 4.714 1.000) 6.760 6.560 ( 1.695 -0.846 -3.568) 4.040 6.669 ( -6.303 1.656 0.510) 6.537 6.931 ( -0.749 4.908 5.600) 7.484 6.971 ( -5.412 3.511 6.933) 9.470 7.087 ( -0.328 -3.340 0.809) 3.452 7.190 ( 0.217 0.338 3.428) 3.451 7.433 ( -2.684 -2.875 -7.024) 8.050 7.555 ( -0.558 1.841 -4.745) 5.120 8.504 ( 0.722 -8.046 2.006) 8.324 8.730 ( -4.700 -7.904 0.415) 9.205 8.845 ( -0.569 -4.756 3.665) 6.031 8.969 ( 0.786 -4.817 13.902) 14.734 9.141 ( 3.802 0.896 -1.257) 4.104 9.246 ( -2.571 -7.222 7.053) 10.416 9.654 ( 0.923 4.178 -1.287) 4.468 9.686 ( 0.832 -6.475 -4.548) 7.956 9.996 ( -6.656 -2.211 -3.475) 7.827 10.391 ( 1.237 -6.514 -19.379) 20.482 10.789 ( 4.190 -0.916 0.155) 4.291 11.027 ( -0.111 -5.372 -3.361) 6.338 11.350 ( 5.164 3.183 -0.823) 6.122 11.443 ( 1.901 -4.026 5.201) 6.847 11.534 ( -2.325 -2.806 -4.205) 5.564 11.590 ( 1.768 0.553 5.697) 5.990 11.715 ( 1.485 4.106 1.593) 4.648 11.924 ( -1.720 2.847 -9.670) 10.226 12.076 ( -0.425 1.111 -0.977) 1.539 12.183 ( -7.895 -3.048 -0.976) 8.519 12.244 ( -1.830 -5.760 0.673) 6.081 12.518 ( -4.263 -5.093 -3.972) 7.738 12.696 ( 9.577 9.367 5.616) 14.526 13.056 ( -6.813 12.099 -3.175) 14.243 14.616 ( -4.857 3.120 3.102) 6.553 14.680 ( 1.307 1.145 1.287) 2.163 14.897 ( 4.208 0.362 -2.053) 4.696 15.032 ( -2.310 4.708 -0.969) 5.332 15.180 ( -1.932 -3.133 1.836) 4.113 15.368 ( 3.413 0.443 -5.455) 6.449 15.510 ( 0.224 1.044 0.148) 1.078 15.669 ( 2.276 2.967 -3.901) 5.404 15.742 ( 3.706 4.193 4.450) 7.150 15.895 ( -3.927 3.778 1.766) 5.729 16.208 ( -0.595 -0.067 6.462) 6.490 16.467 ( -1.739 -4.368 -0.971) 4.800 17.286 ( -5.138 4.028 4.027) 7.671 17.323 ( 11.541 4.520 2.807) 12.708 17.401 ( -0.225 7.247 4.052) 8.306 17.637 ( -0.220 -0.566 -3.848) 3.896 25.641 ( 0.325 -1.683 -0.787) 1.886 25.658 ( 0.895 -2.558 -0.297) 2.726 25.731 ( -1.814 -0.807 1.695) 2.611 25.788 ( -2.267 -0.359 0.771) 2.422 25.851 ( -0.782 1.445 -0.129) 1.648 26.130 ( 1.399 -0.244 -6.409) 6.564 26.395 ( -1.522 -0.071 -0.643) 1.654 26.505 ( -1.471 -3.127 -0.900) 3.571 26.739 ( -0.033 1.994 2.065) 2.870 27.205 ( -6.854 0.679 -11.144) 13.100 27.838 ( 2.193 -4.448 11.269) 12.312 28.022 ( 3.643 -7.877 6.337) 10.746 28.338 ( 1.092 -4.699 -1.314) 5.000 28.414 ( -1.319 -7.054 -0.985) 7.244 29.444 ( -1.005 5.250 13.865) 14.859 30.186 ( 8.355 18.494 -14.936) 25.197 ======================= Grid point 199 (98/140) ======================= q-point: (-0.33 -0.67 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.747 ( -6.956 -10.864 4.996) 13.834 1.922 ( -4.647 -10.013 -1.018) 11.085 2.039 ( 1.791 2.154 2.033) 3.462 2.170 ( -1.059 -8.981 -6.391) 11.074 2.402 ( 6.264 -7.139 0.173) 9.499 2.487 ( -6.751 -8.621 -9.970) 14.809 2.604 ( 2.260 -7.469 3.131) 8.408 2.759 ( 3.321 -9.724 -1.685) 10.413 2.821 ( 0.897 2.276 1.162) 2.708 3.053 ( 1.128 0.197 3.903) 4.068 3.102 ( -0.289 -9.648 -1.337) 9.744 3.316 ( -2.179 -1.182 -2.010) 3.191 3.348 ( 2.879 -1.013 6.228) 6.936 3.459 ( 1.606 -7.831 1.956) 8.230 3.793 ( -1.097 5.699 6.668) 8.839 3.916 ( -2.568 1.992 3.717) 4.937 3.966 ( -5.604 -1.059 4.962) 7.560 4.185 ( -3.797 1.260 -5.252) 6.602 4.257 ( 2.858 -3.985 -14.274) 15.093 4.448 ( 7.464 -2.069 -11.589) 13.939 4.588 ( -0.715 -0.321 3.317) 3.409 4.742 ( -6.697 -1.449 0.522) 6.872 4.855 ( 3.391 1.617 1.219) 3.949 4.969 ( 2.702 -3.561 -9.429) 10.435 5.341 ( 2.979 2.981 5.336) 6.799 5.465 ( 0.877 -1.067 8.085) 8.202 5.579 ( -3.303 -3.661 -3.884) 6.277 5.859 ( -1.623 -1.586 -10.909) 11.143 6.053 ( 6.038 2.126 7.617) 9.949 6.147 ( -1.288 6.098 4.184) 7.507 6.289 ( -1.954 5.414 4.988) 7.616 6.375 ( 6.014 -0.036 -1.719) 6.255 6.566 ( -6.067 0.298 2.973) 6.762 6.658 ( 4.709 -3.963 -2.152) 6.520 6.840 ( -1.589 6.292 6.818) 9.413 6.944 ( -2.706 1.662 7.711) 8.340 7.080 ( -1.197 -0.099 -4.591) 4.745 7.263 ( 2.016 -2.346 7.114) 7.758 7.374 ( -2.137 2.545 -8.948) 9.545 7.504 ( -2.520 -0.813 -6.155) 6.700 8.616 ( 0.130 -3.441 5.201) 6.238 8.838 ( -1.703 -8.190 -3.948) 9.250 8.920 ( -0.500 -3.141 3.652) 4.843 9.120 ( 0.824 -4.153 -1.770) 4.589 9.197 ( 7.068 -2.359 11.525) 13.724 9.392 ( -1.040 -6.654 4.397) 8.043 9.597 ( -3.579 0.781 4.948) 6.156 9.735 ( -1.345 -1.758 -5.317) 5.760 9.995 ( -7.409 -4.702 1.450) 8.894 10.450 ( 8.365 -6.252 -14.623) 17.969 10.843 ( 2.387 -1.254 1.381) 3.030 11.015 ( -4.538 1.661 -5.093) 7.021 11.335 ( 3.958 2.623 2.032) 5.164 11.444 ( -5.837 -0.139 0.587) 5.868 11.538 ( 0.962 1.122 -3.370) 3.680 11.669 ( 2.292 4.243 5.117) 7.032 11.730 ( 5.635 -5.044 1.747) 7.762 11.835 ( -0.128 -1.252 -10.177) 10.255 12.020 ( -4.734 2.675 0.225) 5.442 12.169 ( 0.507 -1.246 -3.291) 3.555 12.324 ( -0.410 0.415 3.227) 3.280 12.495 ( -1.042 6.525 -4.980) 8.274 12.688 ( 4.906 -0.815 4.981) 7.039 12.860 ( -3.788 -0.533 -2.227) 4.426 14.576 ( -3.261 -0.839 1.821) 3.828 14.676 ( 1.070 1.139 0.498) 1.641 14.886 ( 3.026 1.885 -2.601) 4.413 14.965 ( 0.155 1.443 -2.398) 2.803 15.246 ( -3.179 -3.796 4.244) 6.522 15.365 ( 1.899 -0.049 -1.905) 2.691 15.492 ( 0.667 1.324 -1.487) 2.100 15.565 ( -2.098 5.619 -3.955) 7.185 15.745 ( 1.055 0.949 4.298) 4.527 15.827 ( 2.104 3.814 0.504) 4.385 16.239 ( -2.589 -0.329 8.773) 9.153 16.503 ( -0.443 -2.413 -3.329) 4.135 17.110 ( -7.636 8.845 3.197) 12.115 17.263 ( 3.150 10.416 -0.157) 10.883 17.421 ( 6.195 -0.716 4.449) 7.660 17.627 ( 0.312 -0.882 -4.759) 4.850 25.674 ( 0.165 -1.895 1.797) 2.617 25.707 ( -0.026 -2.659 -0.287) 2.674 25.734 ( -0.703 0.108 1.620) 1.769 25.774 ( -1.931 0.384 0.506) 2.032 25.832 ( -0.499 0.583 1.135) 1.370 26.106 ( 1.945 -0.207 -9.649) 9.846 26.399 ( 0.047 -0.988 1.199) 1.554 26.529 ( -2.506 -2.564 -3.759) 5.195 26.746 ( 0.970 0.369 7.341) 7.414 27.102 ( -4.267 0.758 -7.913) 9.022 27.976 ( 0.723 -3.987 9.212) 10.063 28.204 ( 2.952 -7.081 2.808) 8.170 28.433 ( 5.739 -5.328 -0.431) 7.843 28.542 ( -1.545 -9.824 -1.742) 10.096 29.375 ( -3.610 7.527 9.143) 12.380 29.827 ( 2.709 20.837 -11.849) 24.123 ======================= Grid point 200 (99/140) ======================= q-point: (-0.22 -0.67 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.796 ( -8.019 4.559 12.888) 15.849 1.976 ( -0.032 -5.180 -0.365) 5.193 2.033 ( -5.044 -2.061 -3.815) 6.652 2.292 ( 2.674 -6.238 -4.647) 8.225 2.513 ( 5.896 -0.040 -2.685) 6.479 2.557 ( -0.787 -8.592 -5.677) 10.328 2.727 ( 3.505 -1.437 5.791) 6.920 2.798 ( -1.678 -0.597 1.312) 2.212 2.965 ( 2.771 -7.672 2.263) 8.465 3.111 ( 4.216 -1.569 3.897) 5.951 3.187 ( 0.901 -0.593 -1.821) 2.116 3.270 ( -1.339 -2.975 -4.541) 5.592 3.460 ( -4.674 -4.955 3.659) 7.732 3.617 ( 3.323 -4.769 1.974) 6.139 3.678 ( -6.828 6.173 2.955) 9.667 3.803 ( 3.023 7.544 -0.752) 8.162 4.012 ( -6.723 -3.591 4.829) 9.023 4.113 ( -1.035 0.487 -0.965) 1.496 4.339 ( 7.181 -6.317 -7.641) 12.242 4.434 ( 6.532 2.864 -11.443) 13.484 4.550 ( -5.451 4.128 6.087) 9.155 4.730 ( -7.012 -3.170 2.902) 8.224 4.860 ( 5.125 1.353 -2.741) 5.967 5.004 ( -0.303 -4.257 -9.659) 10.560 5.362 ( 5.762 3.858 7.772) 10.416 5.507 ( 1.105 -0.495 -1.737) 2.117 5.632 ( -0.049 -4.330 2.878) 5.200 5.827 ( -2.975 -2.447 -8.579) 9.404 6.019 ( -4.974 5.297 -0.076) 7.266 6.049 ( 4.380 7.930 3.508) 9.715 6.251 ( -0.469 1.153 6.349) 6.469 6.378 ( 1.034 1.917 -2.241) 3.125 6.551 ( -7.451 -3.618 3.684) 9.065 6.726 ( -0.376 -0.509 -1.907) 2.010 6.819 ( 4.947 1.569 3.755) 6.405 6.919 ( 3.964 4.986 5.588) 8.474 7.064 ( -1.259 -1.161 -2.169) 2.763 7.262 ( -1.275 3.524 -7.547) 8.426 7.351 ( -0.772 -4.187 6.048) 7.397 7.495 ( -1.139 -3.340 -4.609) 5.805 8.695 ( 0.750 -2.759 5.989) 6.636 8.921 ( 2.214 -4.620 -6.634) 8.382 8.974 ( -3.760 -2.868 2.629) 5.411 9.148 ( 2.309 0.055 -3.101) 3.866 9.317 ( 0.834 0.022 7.334) 7.381 9.435 ( -2.708 0.446 -0.481) 2.786 9.624 ( -4.355 -3.205 4.337) 6.932 9.730 ( 3.140 0.302 1.931) 3.699 10.037 ( -9.104 -5.920 4.948) 11.934 10.577 ( 10.608 -6.326 -8.684) 15.099 10.825 ( -5.952 2.438 -0.436) 6.446 10.945 ( 2.754 2.501 0.244) 3.728 11.346 ( 3.606 1.474 2.377) 4.564 11.384 ( -6.734 1.556 -7.912) 10.505 11.479 ( 0.847 3.098 2.984) 4.384 11.634 ( 2.131 2.703 2.170) 4.069 11.802 ( 0.505 -3.045 -4.924) 5.812 11.868 ( 4.395 0.489 -4.966) 6.650 11.957 ( -5.195 -0.064 6.262) 8.137 12.197 ( 4.623 0.732 -2.336) 5.231 12.257 ( 2.022 5.136 -0.305) 5.528 12.288 ( 0.349 9.841 -6.454) 11.773 12.837 ( -3.654 -11.148 5.159) 12.816 12.985 ( 2.051 -12.031 -0.742) 12.227 14.608 ( 0.366 -2.769 1.714) 3.277 14.662 ( -0.419 0.643 -0.625) 0.990 14.883 ( -1.302 -1.992 -1.379) 2.751 14.949 ( 4.022 0.988 -2.244) 4.711 15.253 ( -2.556 3.028 4.712) 6.157 15.358 ( -1.103 2.935 -1.397) 3.433 15.450 ( -0.576 1.095 -1.633) 2.048 15.486 ( -0.359 -0.047 -2.653) 2.677 15.762 ( -3.342 -1.829 0.215) 3.816 15.825 ( 6.873 0.308 2.751) 7.409 16.254 ( -5.141 0.531 9.493) 10.809 16.516 ( 1.104 -1.305 -4.287) 4.616 16.926 ( -6.645 8.378 2.853) 11.067 17.122 ( 2.759 7.587 -1.832) 8.279 17.472 ( 1.907 0.371 1.960) 2.759 17.630 ( 2.782 -0.741 -4.639) 5.460 25.713 ( -0.587 1.365 1.633) 2.208 25.716 ( 0.254 -0.495 1.750) 1.836 25.743 ( -0.969 -0.570 2.594) 2.827 25.776 ( -0.657 -2.376 0.410) 2.498 25.831 ( -1.159 -0.393 1.182) 1.701 26.084 ( 3.463 -0.736 -10.040) 10.646 26.427 ( 0.842 -0.294 2.561) 2.711 26.510 ( -3.022 -0.610 -5.291) 6.124 26.813 ( 2.370 -1.368 10.887) 11.225 27.038 ( -3.063 -0.685 -7.003) 7.674 28.055 ( -3.403 -1.771 7.303) 8.249 28.305 ( 1.235 -3.333 -2.874) 4.571 28.594 ( 3.065 -7.245 -0.377) 7.876 28.710 ( 7.594 -10.809 -1.756) 13.326 29.232 ( -4.818 9.774 5.541) 12.225 29.456 ( -1.173 18.119 -6.715) 19.359 ======================= Grid point 201 (100/140) ======================= q-point: (-0.11 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.692 ( -2.256 7.956 10.081) 13.039 1.978 ( -3.548 3.646 2.798) 5.807 2.049 ( 1.223 0.269 1.678) 2.094 2.360 ( 1.373 -2.516 -6.500) 7.104 2.479 ( 4.838 5.879 -2.673) 8.069 2.642 ( 5.042 0.009 -2.403) 5.586 2.756 ( 1.114 2.312 6.038) 6.561 2.838 ( -0.051 -2.479 3.509) 4.296 3.028 ( -1.290 0.031 -0.363) 1.341 3.142 ( -0.660 2.588 -2.474) 3.641 3.201 ( -3.854 -1.915 -5.922) 7.320 3.254 ( 0.982 0.118 -2.441) 2.634 3.491 ( -5.798 -0.295 3.484) 6.771 3.530 ( -7.470 5.298 0.289) 9.163 3.639 ( -0.151 -2.168 2.094) 3.018 3.812 ( 6.611 2.769 4.972) 8.723 4.001 ( -3.225 1.614 2.340) 4.299 4.142 ( 0.925 -1.694 4.347) 4.756 4.360 ( 4.166 2.991 -10.048) 11.281 4.460 ( 6.146 -2.657 -8.441) 10.775 4.507 ( 0.274 -0.880 8.784) 8.832 4.770 ( -1.239 -1.998 4.626) 5.188 4.863 ( 2.580 -1.010 -3.542) 4.497 4.997 ( -4.212 -2.197 -9.564) 10.679 5.340 ( 2.654 6.988 6.392) 9.835 5.485 ( 2.080 0.793 -8.333) 8.626 5.713 ( -0.002 -1.782 5.745) 6.015 5.823 ( -1.253 -2.591 -3.412) 4.464 5.899 ( -4.003 4.819 -1.002) 6.344 5.954 ( 4.321 6.897 0.366) 8.147 6.260 ( -2.050 0.212 3.782) 4.307 6.344 ( 1.535 1.243 -1.623) 2.557 6.583 ( -9.612 -4.870 4.482) 11.670 6.708 ( 1.044 1.474 -1.085) 2.107 6.771 ( -0.082 4.166 -1.810) 4.543 6.951 ( 9.221 2.099 2.002) 9.667 7.065 ( -4.235 -1.880 0.534) 4.664 7.197 ( 2.475 0.996 -2.608) 3.731 7.440 ( -2.782 -4.674 3.445) 6.439 7.566 ( 1.146 -6.407 -0.738) 6.550 8.777 ( 0.336 -2.894 5.500) 6.224 8.893 ( -6.519 4.102 -2.103) 7.984 9.024 ( 2.035 -4.793 -6.102) 8.022 9.106 ( -0.384 5.104 -0.915) 5.199 9.271 ( -5.589 3.049 -0.323) 6.375 9.395 ( 3.452 5.419 2.488) 6.890 9.624 ( -7.082 -0.664 2.066) 7.407 9.778 ( 4.149 0.641 3.595) 5.527 10.101 ( -7.697 -5.566 8.373) 12.662 10.677 ( -3.061 -1.975 0.481) 3.675 10.793 ( 10.002 -2.476 -8.273) 13.214 10.931 ( 4.578 4.577 4.840) 8.083 11.199 ( -5.039 6.555 -8.955) 12.188 11.404 ( 3.946 -1.830 -1.304) 4.541 11.454 ( -5.114 -0.596 0.950) 5.236 11.675 ( 6.504 -1.035 4.661) 8.068 11.787 ( 1.109 1.598 -2.420) 3.105 11.840 ( 2.531 4.725 0.335) 5.371 11.991 ( -0.799 -3.337 3.878) 5.178 12.121 ( 2.885 6.007 0.068) 6.664 12.162 ( -1.552 0.250 -7.420) 7.584 12.318 ( 5.732 -5.138 -4.014) 8.681 13.000 ( -8.397 -10.661 3.914) 14.124 13.203 ( -1.423 -12.701 -0.790) 12.805 14.631 ( -0.000 1.110 1.753) 2.075 14.683 ( 2.168 -2.111 0.283) 3.039 14.921 ( -1.934 -3.516 -0.959) 4.126 14.957 ( -0.841 -1.565 -0.810) 1.953 15.186 ( 0.641 6.813 4.780) 8.347 15.271 ( 1.032 2.739 -2.313) 3.730 15.428 ( -0.537 0.785 -2.986) 3.134 15.492 ( 2.501 0.173 -1.439) 2.891 15.756 ( -5.223 -1.455 0.750) 5.474 15.942 ( 3.400 -6.808 1.597) 7.776 16.236 ( -6.902 0.851 7.999) 10.600 16.526 ( 2.979 -0.643 -3.782) 4.857 16.764 ( -4.329 7.420 3.517) 9.282 17.060 ( 4.901 2.328 -1.264) 5.571 17.463 ( -1.148 0.839 -1.506) 2.071 17.645 ( 4.287 0.043 -3.444) 5.499 25.681 ( 0.050 2.563 0.798) 2.685 25.702 ( 0.601 1.654 -0.323) 1.789 25.783 ( -1.629 -1.430 5.594) 5.999 25.818 ( -0.820 -2.404 -0.722) 2.640 25.838 ( -2.307 -1.743 2.027) 3.531 26.097 ( 5.739 -1.824 -7.397) 9.538 26.424 ( -1.597 1.821 0.446) 2.463 26.469 ( -0.520 1.135 -1.564) 2.002 26.923 ( 2.073 -2.279 10.197) 10.652 27.011 ( -1.277 -2.722 -5.456) 6.229 28.055 ( -6.718 0.645 5.397) 8.641 28.309 ( -2.375 -0.129 -5.695) 6.172 28.659 ( -3.653 -2.747 -5.210) 6.930 28.954 ( 2.441 0.605 -5.968) 6.476 29.097 ( 7.019 -1.293 5.771) 9.178 29.185 ( 3.284 9.746 2.034) 10.484 ======================= Grid point 206 (101/140) ======================= q-point: ( 0.44 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.047 ( 7.431 0.000 -3.532) 8.228 1.224 ( 1.177 0.000 -7.392) 7.485 1.642 ( 11.782 0.000 -7.169) 13.792 1.844 ( -8.290 -0.000 0.410) 8.300 2.142 ( -6.666 -0.000 -5.457) 8.615 2.325 ( -6.405 -0.000 1.446) 6.567 2.439 ( 0.554 0.000 -6.785) 6.808 2.450 ( -0.008 -0.000 1.819) 1.819 2.613 ( 3.807 0.000 5.617) 6.785 3.063 ( 4.063 0.000 -1.656) 4.387 3.097 ( -5.925 -0.000 -0.456) 5.943 3.184 ( -3.082 -0.000 1.356) 3.367 3.290 ( 3.001 0.000 10.200) 10.632 3.550 ( 7.629 0.000 -5.482) 9.394 3.706 ( -12.697 -0.000 -2.131) 12.875 3.801 ( 4.333 0.000 -4.921) 6.556 3.937 ( -4.059 -0.000 2.233) 4.632 4.116 ( 1.250 0.000 -7.573) 7.676 4.236 ( 1.317 0.000 11.031) 11.110 4.328 ( -2.300 -0.000 1.955) 3.019 4.579 ( 14.061 0.000 -10.152) 17.343 4.687 ( -5.635 -0.000 -1.182) 5.757 4.883 ( -5.188 -0.000 3.948) 6.520 5.036 ( -0.933 -0.000 -3.051) 3.191 5.294 ( 1.392 0.000 3.563) 3.826 5.532 ( -1.302 -0.000 2.195) 2.552 5.584 ( 3.422 0.000 0.942) 3.549 5.878 ( 1.557 0.000 -11.440) 11.545 6.090 ( 3.264 0.000 5.566) 6.452 6.208 ( 4.684 0.000 13.023) 13.839 6.493 ( -4.239 -0.000 -7.437) 8.560 6.504 ( 1.917 0.000 -2.028) 2.791 6.581 ( -1.639 -0.000 2.240) 2.776 6.646 ( -2.766 -0.000 -3.561) 4.509 6.975 ( 2.393 0.000 3.334) 4.104 7.047 ( -7.453 -0.000 6.664) 9.998 7.142 ( 1.562 0.000 9.648) 9.773 7.171 ( 0.415 0.000 -1.384) 1.444 7.268 ( -3.095 -0.000 -1.421) 3.406 7.642 ( 1.631 0.000 -6.852) 7.043 8.273 ( 5.081 0.000 0.980) 5.174 8.605 ( -8.944 -0.000 -4.715) 10.110 8.698 ( -2.231 -0.000 10.773) 11.001 8.887 ( -1.805 -0.000 15.834) 15.937 9.115 ( -4.066 -0.000 7.912) 8.896 9.300 ( 2.462 0.000 -2.052) 3.205 9.380 ( 8.068 0.000 -8.391) 11.640 9.784 ( 1.029 0.000 -3.821) 3.957 9.966 ( -7.157 -0.000 -7.673) 10.492 10.201 ( -3.044 -0.000 -20.760) 20.982 10.809 ( -2.601 -0.000 2.137) 3.367 10.859 ( 7.706 0.000 -2.872) 8.224 11.362 ( 2.380 0.000 -1.902) 3.047 11.393 ( 5.950 0.000 10.324) 11.916 11.532 ( 6.931 0.000 -2.106) 7.244 11.576 ( -11.031 -0.000 -1.003) 11.076 11.793 ( 1.826 0.000 -1.252) 2.214 11.967 ( -3.922 -0.000 -8.111) 9.009 12.063 ( -5.305 -0.000 2.101) 5.706 12.133 ( -1.102 -0.000 5.216) 5.332 12.145 ( -4.703 -0.000 -9.987) 11.038 12.416 ( -3.787 -0.000 -1.948) 4.259 12.899 ( 9.542 0.000 7.240) 11.977 13.298 ( -5.105 -0.000 -3.610) 6.252 14.712 ( 3.446 0.000 0.313) 3.460 14.715 ( -5.554 -0.000 2.336) 6.025 14.879 ( -1.052 -0.000 7.535) 7.608 15.056 ( 0.572 0.000 0.994) 1.147 15.295 ( -5.557 -0.000 -6.679) 8.688 15.311 ( 6.076 0.000 -10.300) 11.958 15.591 ( 1.947 0.000 6.027) 6.334 15.667 ( 3.634 0.000 0.650) 3.692 15.875 ( 5.970 0.000 -0.746) 6.017 15.962 ( -4.855 -0.000 3.518) 5.995 16.247 ( 1.980 0.000 1.081) 2.256 16.293 ( -4.799 -0.000 2.877) 5.596 17.277 ( 5.701 0.000 5.042) 7.611 17.497 ( 7.612 0.000 -1.959) 7.860 17.527 ( -11.787 -0.000 9.212) 14.960 17.644 ( 5.304 0.000 -2.418) 5.830 25.603 ( -0.184 -0.000 -0.750) 0.772 25.611 ( 1.691 0.000 -1.902) 2.545 25.709 ( -1.844 -0.000 2.200) 2.871 25.773 ( -2.294 -0.000 0.606) 2.372 25.880 ( -1.881 -0.000 -0.630) 1.984 26.132 ( 0.532 0.000 -4.312) 4.344 26.412 ( -0.704 -0.000 -0.002) 0.704 26.422 ( -2.271 -0.000 -1.725) 2.852 26.812 ( -2.119 -0.000 1.004) 2.345 27.165 ( -4.780 -0.000 -15.245) 15.976 27.732 ( -4.992 -0.000 13.346) 14.249 27.902 ( 8.794 0.000 3.754) 9.561 28.218 ( -0.749 -0.000 2.384) 2.498 28.319 ( 0.604 0.000 -2.143) 2.227 29.552 ( -1.136 -0.000 20.437) 20.468 30.535 ( 12.425 0.000 -18.741) 22.486 ======================= Grid point 207 (102/140) ======================= q-point: (-0.44 -0.56 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.143 ( 2.896 -13.791 0.960) 14.124 1.456 ( -2.235 -19.368 -11.573) 22.672 1.762 ( 10.403 -5.858 2.306) 12.160 1.954 ( -0.117 -15.778 4.389) 16.378 2.144 ( -8.896 -9.268 -7.430) 14.841 2.194 ( -16.079 -2.228 -2.245) 16.387 2.439 ( 3.725 2.010 -4.688) 6.316 2.467 ( -0.566 -3.029 -0.780) 3.179 2.760 ( 4.289 -6.480 8.853) 11.780 2.992 ( -2.699 3.928 -1.936) 5.145 3.135 ( 0.115 2.077 -2.268) 3.077 3.143 ( 2.080 -3.476 -3.225) 5.178 3.309 ( 0.676 2.258 10.329) 10.594 3.542 ( 5.958 5.846 -3.029) 8.880 3.682 ( -11.857 -8.540 0.806) 14.634 3.853 ( 0.944 -4.010 -1.598) 4.418 3.973 ( 0.934 -5.824 -0.889) 5.965 4.145 ( -2.163 -3.790 -3.118) 5.363 4.196 ( 0.458 5.113 2.388) 5.662 4.351 ( 2.606 -0.314 -0.510) 2.674 4.639 ( 10.968 1.230 -3.472) 11.570 4.660 ( -4.869 -2.499 -4.607) 7.154 4.859 ( -1.111 0.837 3.526) 3.790 4.998 ( -2.524 2.153 -3.019) 4.485 5.324 ( 0.885 -0.971 6.344) 6.479 5.518 ( -1.901 0.872 -0.151) 2.097 5.593 ( 3.289 2.885 1.227) 4.544 5.834 ( -0.376 -0.781 -11.936) 11.967 6.118 ( 4.220 2.698 6.942) 8.560 6.289 ( 1.759 1.880 7.920) 8.328 6.394 ( -3.565 1.761 -2.919) 4.933 6.500 ( 4.034 5.184 3.046) 7.241 6.533 ( 1.362 -1.002 -3.952) 4.298 6.626 ( -6.391 -0.267 -1.027) 6.478 6.977 ( -6.049 0.400 4.903) 7.797 7.043 ( 1.965 3.930 5.996) 7.433 7.100 ( -3.778 3.018 2.302) 5.356 7.208 ( 5.856 -1.568 4.553) 7.581 7.333 ( 0.869 -4.669 -3.100) 5.671 7.573 ( -0.635 3.845 -7.431) 8.390 8.406 ( 7.000 -7.427 2.647) 10.544 8.559 ( -7.260 -5.810 -3.912) 10.088 8.778 ( -2.104 -4.519 9.342) 10.589 8.971 ( -0.553 -2.508 11.664) 11.943 9.148 ( -6.158 -4.151 8.308) 11.144 9.225 ( 4.983 4.076 1.297) 6.567 9.540 ( 5.720 -8.535 -6.575) 12.198 9.725 ( -1.585 4.368 -3.150) 5.614 9.893 ( -5.050 -1.651 -6.492) 8.389 10.173 ( 2.856 -8.829 -20.446) 22.453 10.798 ( -1.905 -0.759 2.123) 2.952 10.931 ( 2.366 -3.804 -3.305) 5.567 11.375 ( -0.665 0.381 -0.427) 0.878 11.433 ( -4.995 -2.141 -3.233) 6.323 11.506 ( 2.568 2.412 5.946) 6.911 11.620 ( 3.976 -2.976 5.752) 7.600 11.794 ( 5.044 2.391 -0.767) 5.635 11.868 ( -7.187 0.399 -10.378) 12.630 12.028 ( -8.413 -2.278 -2.701) 9.125 12.101 ( 2.252 -1.022 -4.216) 4.888 12.191 ( 1.085 -2.130 6.579) 7.000 12.415 ( -0.126 -2.497 -2.874) 3.809 12.939 ( 7.859 6.938 6.296) 12.229 13.168 ( -5.397 7.985 -4.932) 10.827 14.652 ( -5.136 3.581 2.813) 6.864 14.731 ( 3.624 1.604 1.653) 4.294 14.921 ( 2.609 -0.709 4.026) 4.849 15.084 ( -0.807 -2.065 1.016) 2.439 15.148 ( -2.451 6.453 -5.752) 8.985 15.342 ( 3.095 -2.524 -8.045) 8.982 15.571 ( 0.552 4.516 3.996) 6.056 15.706 ( 2.113 0.610 -1.369) 2.590 15.849 ( -1.322 5.186 2.702) 5.996 15.939 ( 1.535 1.317 0.395) 2.061 16.236 ( -0.694 0.521 4.801) 4.878 16.355 ( -2.412 -5.926 -0.317) 6.406 17.330 ( -1.493 2.017 5.260) 5.829 17.431 ( -4.913 3.155 6.420) 8.678 17.522 ( 1.659 0.661 -1.735) 2.490 17.661 ( 8.786 4.446 -1.885) 10.026 25.607 ( -0.865 -1.420 -0.961) 1.920 25.627 ( 1.304 -1.579 -1.420) 2.492 25.716 ( -1.288 -0.721 3.010) 3.353 25.764 ( -2.068 -0.644 0.356) 2.195 25.862 ( -1.297 0.710 1.036) 1.806 26.109 ( 1.232 0.158 -6.813) 6.925 26.386 ( -1.177 0.402 -0.235) 1.266 26.433 ( -1.777 -2.417 -1.531) 3.368 26.786 ( -1.238 1.637 3.371) 3.947 27.093 ( -3.151 -1.642 -11.602) 12.134 27.804 ( -3.269 -5.231 11.115) 12.712 28.000 ( 7.309 -2.711 2.634) 8.229 28.262 ( 0.221 -4.047 1.563) 4.344 28.333 ( 0.786 -2.314 -2.213) 3.297 29.592 ( -4.231 4.375 19.416) 20.348 30.430 ( 9.675 11.793 -19.246) 24.558 ======================= Grid point 208 (103/140) ======================= q-point: (-0.33 -0.56 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.475 ( -1.311 -19.419 4.450) 19.965 1.642 ( -4.261 -15.559 -7.407) 17.751 1.985 ( -1.874 -8.136 1.582) 8.498 2.097 ( -16.810 -7.546 -0.764) 18.442 2.167 ( 1.695 -2.396 -3.288) 4.408 2.330 ( 5.930 -15.752 5.450) 17.692 2.472 ( -0.421 -6.104 -1.456) 6.290 2.570 ( 0.595 -12.312 -5.547) 13.517 2.880 ( 0.544 1.055 0.543) 1.305 2.957 ( -0.613 -4.866 1.068) 5.020 3.084 ( 1.313 -0.089 1.772) 2.207 3.264 ( 9.192 -3.395 -2.837) 10.202 3.361 ( 0.317 -3.977 4.070) 5.699 3.450 ( 1.651 5.575 -1.246) 5.946 3.766 ( -11.213 -9.700 3.905) 15.332 3.907 ( 1.345 0.373 5.077) 5.265 4.040 ( -4.626 6.646 8.431) 11.690 4.100 ( 2.710 -7.475 -7.809) 11.144 4.193 ( 0.880 1.990 -7.369) 7.683 4.394 ( 6.398 -4.621 -7.464) 10.863 4.601 ( -6.550 1.141 -3.885) 7.700 4.664 ( 0.677 0.987 2.295) 2.589 4.895 ( -1.028 2.036 -0.590) 2.355 4.928 ( 4.846 -1.819 -3.166) 6.068 5.408 ( 3.486 -1.683 7.628) 8.554 5.493 ( -1.623 -1.092 -1.047) 2.219 5.559 ( 2.945 4.313 2.978) 6.012 5.779 ( -1.203 -0.533 -11.586) 11.661 6.151 ( 3.064 1.430 6.655) 7.464 6.211 ( -5.699 4.100 -1.297) 7.140 6.381 ( 0.327 3.639 3.551) 5.095 6.418 ( -1.191 2.370 -1.767) 3.187 6.544 ( -6.157 2.101 0.566) 6.530 6.640 ( 7.820 -3.172 1.510) 8.573 6.966 ( -3.674 1.091 6.980) 7.963 6.969 ( -0.753 3.578 7.624) 8.455 7.072 ( 1.024 1.682 -1.452) 2.447 7.306 ( 3.808 -0.556 7.470) 8.403 7.352 ( 2.695 0.164 -8.347) 8.773 7.462 ( -2.865 2.759 -6.979) 8.033 8.577 ( 2.445 -5.910 3.569) 7.324 8.658 ( 0.736 -10.055 -2.585) 10.408 8.882 ( -0.874 -3.931 6.633) 7.760 9.039 ( -1.679 -3.491 -0.912) 3.980 9.238 ( -0.360 -3.893 10.828) 11.512 9.296 ( 1.211 -5.701 5.766) 8.198 9.584 ( -7.138 1.135 -4.163) 8.341 9.674 ( 1.719 -2.433 2.064) 3.624 9.875 ( -3.332 -3.188 -5.332) 7.050 10.320 ( 12.734 -10.696 -16.384) 23.345 10.820 ( -3.864 -2.472 1.760) 4.913 10.965 ( -0.233 -1.657 -4.581) 4.877 11.308 ( -10.487 -0.314 -0.768) 10.519 11.439 ( 1.776 -0.229 -1.912) 2.620 11.556 ( 3.271 -1.335 5.373) 6.430 11.704 ( -0.586 -0.957 1.286) 1.707 11.772 ( -0.554 0.251 -6.565) 6.593 11.798 ( 6.981 2.724 0.588) 7.517 11.982 ( -9.329 -1.593 -1.125) 9.530 12.149 ( 6.444 -2.133 -2.319) 7.174 12.288 ( 1.072 -4.101 6.895) 8.094 12.460 ( 0.922 -4.449 -4.740) 6.566 12.859 ( 2.592 11.488 3.496) 12.285 12.938 ( -0.847 10.387 -4.064) 11.186 14.568 ( -4.916 2.688 3.078) 6.393 14.730 ( 2.927 2.627 1.720) 4.293 14.967 ( 4.474 -0.621 -1.892) 4.897 14.980 ( 1.854 7.432 -4.197) 8.735 15.159 ( -4.049 -5.259 4.242) 7.878 15.359 ( 2.100 -0.971 -5.075) 5.577 15.522 ( -0.691 2.804 1.908) 3.461 15.627 ( -2.291 6.004 -4.141) 7.645 15.778 ( -3.693 2.496 3.177) 5.474 15.939 ( 7.276 3.335 0.187) 8.006 16.259 ( -2.202 -0.387 7.790) 8.105 16.417 ( -1.602 -4.321 -3.006) 5.503 17.198 ( -11.252 7.241 6.048) 14.684 17.404 ( -3.840 4.438 4.551) 7.427 17.539 ( 10.837 1.516 -1.992) 11.122 17.612 ( 4.191 4.574 -4.025) 7.395 25.631 ( -1.301 -2.780 -0.101) 3.071 25.667 ( 1.077 -2.582 -0.593) 2.860 25.734 ( -1.536 -0.360 4.091) 4.385 25.762 ( -1.663 -0.395 0.347) 1.745 25.848 ( -0.509 0.847 1.464) 1.767 26.083 ( 3.315 0.243 -9.216) 9.797 26.392 ( 0.328 -1.054 2.145) 2.412 26.447 ( -2.273 -2.357 -3.064) 4.485 26.795 ( 0.196 -0.058 8.002) 8.004 27.037 ( -2.626 -0.250 -9.135) 9.508 27.934 ( -2.142 -5.985 7.868) 10.115 28.129 ( 4.751 -5.625 0.530) 7.382 28.371 ( 2.981 -7.595 0.433) 8.171 28.389 ( 1.001 -4.979 -2.231) 5.547 29.534 ( -5.696 8.056 15.606) 18.463 30.122 ( 3.562 19.632 -17.350) 26.441 ======================= Grid point 209 (104/140) ======================= q-point: (-0.22 -0.56 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.757 ( -2.190 -13.468 8.103) 15.870 1.844 ( -5.385 -12.008 1.586) 13.255 1.905 ( -10.980 2.373 -1.483) 11.331 2.169 ( -6.088 -10.858 0.866) 12.478 2.341 ( 5.959 -9.337 -5.654) 12.436 2.516 ( 5.847 -3.820 -3.139) 7.657 2.652 ( -0.139 -11.807 4.246) 12.548 2.744 ( 1.461 -7.201 -6.185) 9.604 2.896 ( 1.419 -3.598 5.642) 6.841 3.048 ( -0.957 -6.961 -4.756) 8.485 3.143 ( 0.460 -1.812 3.386) 3.868 3.285 ( 3.996 3.785 -2.242) 5.943 3.421 ( 0.850 -0.154 1.649) 1.862 3.515 ( 4.298 -9.344 -0.630) 10.305 3.796 ( -6.525 4.533 4.336) 9.051 3.899 ( -5.966 -0.943 6.590) 8.939 3.951 ( 3.236 5.347 1.262) 6.376 4.119 ( 1.227 0.086 -1.280) 1.775 4.237 ( 4.671 -7.642 -5.511) 10.516 4.469 ( 8.693 0.156 -11.605) 14.501 4.548 ( -8.939 -3.241 4.752) 10.630 4.632 ( -6.086 0.939 2.814) 6.770 4.831 ( -3.642 -0.692 -5.182) 6.371 4.994 ( 6.862 0.984 -2.595) 7.402 5.469 ( 0.341 -1.296 -1.332) 1.890 5.506 ( 6.222 1.926 2.066) 6.833 5.601 ( 2.991 -2.979 7.489) 8.597 5.736 ( -0.513 -1.792 -8.204) 8.413 6.050 ( -8.859 4.961 -1.670) 10.290 6.194 ( 2.090 2.849 3.683) 5.104 6.279 ( -4.096 3.566 -0.842) 5.496 6.418 ( 1.252 0.189 0.513) 1.366 6.460 ( -7.387 1.051 1.560) 7.622 6.716 ( 2.939 -0.327 -0.813) 3.067 6.930 ( 2.388 4.766 5.275) 7.500 7.021 ( -3.449 -0.565 2.293) 4.180 7.066 ( 9.195 0.554 5.497) 10.727 7.280 ( -0.189 3.182 -5.053) 5.974 7.362 ( 1.226 1.077 5.650) 5.881 7.407 ( 0.029 -2.130 -6.509) 6.848 8.695 ( 2.931 -3.450 4.557) 6.424 8.814 ( 3.867 -7.179 -3.097) 8.723 8.932 ( -3.092 -0.904 2.796) 4.266 9.088 ( -0.484 -4.820 -2.947) 5.670 9.303 ( -5.380 -1.282 -0.480) 5.551 9.412 ( 0.244 -3.179 2.375) 3.976 9.529 ( -6.920 -4.460 3.805) 9.069 9.779 ( 4.938 -2.734 9.627) 11.160 9.888 ( -4.924 -4.631 -2.902) 7.357 10.509 ( 12.546 -7.063 -9.770) 17.399 10.791 ( -6.552 0.330 -3.738) 7.551 10.982 ( 2.303 -1.185 1.619) 3.055 11.243 ( -10.645 -2.076 -0.930) 10.886 11.425 ( -0.259 2.825 -2.919) 4.070 11.600 ( 5.152 2.956 5.771) 8.282 11.689 ( 0.473 0.094 -4.312) 4.339 11.725 ( -1.447 0.855 -1.844) 2.495 11.856 ( 3.017 -3.285 -4.602) 6.409 11.945 ( -3.192 0.047 3.753) 4.927 12.225 ( 6.932 -0.775 -0.290) 6.981 12.359 ( -0.155 1.619 4.129) 4.438 12.466 ( 4.918 8.220 -4.033) 10.393 12.690 ( -5.641 -1.210 -1.625) 5.994 12.884 ( 5.698 -0.829 1.251) 5.893 14.546 ( -2.652 -2.532 2.505) 4.441 14.701 ( 1.329 3.034 -0.598) 3.365 14.892 ( 0.484 3.204 0.454) 3.272 14.996 ( 6.736 0.714 -4.437) 8.098 15.233 ( -3.193 -3.882 4.279) 6.601 15.367 ( -0.288 -0.812 -0.524) 1.008 15.469 ( -4.214 3.217 -1.592) 5.535 15.493 ( -0.745 4.051 -1.594) 4.417 15.733 ( -1.917 0.767 -0.837) 2.228 15.936 ( 7.366 4.083 0.805) 8.460 16.278 ( -3.850 0.675 9.505) 10.277 16.452 ( -0.480 -3.320 -4.726) 5.796 17.023 ( -9.045 7.209 5.243) 12.699 17.266 ( -3.202 8.961 1.875) 9.699 17.529 ( 4.591 4.532 -3.490) 7.335 17.617 ( 4.751 -1.799 -3.012) 5.906 25.672 ( -1.673 -3.319 0.094) 3.718 25.719 ( 0.972 -2.685 -0.190) 2.862 25.741 ( -2.809 0.056 5.141) 5.859 25.751 ( -1.179 0.521 0.432) 1.360 25.839 ( 0.281 0.909 0.936) 1.335 26.071 ( 5.936 0.074 -8.296) 10.201 26.428 ( -1.318 -1.387 0.426) 1.960 26.456 ( 0.157 -1.633 0.008) 1.640 26.863 ( 1.974 -1.429 10.697) 10.971 26.978 ( -1.616 0.249 -7.776) 7.946 28.020 ( -4.033 -3.121 5.306) 7.359 28.233 ( 1.597 -4.286 -3.425) 5.714 28.483 ( 1.032 -6.521 -3.714) 7.575 28.579 ( 8.059 -11.702 0.115) 14.209 29.398 ( -6.058 10.275 11.208) 16.367 29.716 ( -2.125 19.498 -11.617) 22.796 ======================= Grid point 210 (105/140) ======================= q-point: (-0.11 -0.56 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.797 ( -5.411 2.646 6.082) 8.560 1.935 ( -7.574 -5.930 4.099) 10.456 2.015 ( 2.008 -8.318 7.882) 11.634 2.297 ( 1.710 -4.969 -1.260) 5.404 2.457 ( 2.988 -6.701 -12.088) 14.140 2.608 ( 2.876 -2.989 1.289) 4.343 2.785 ( -0.786 -3.941 -2.751) 4.870 2.823 ( 2.267 -3.786 3.312) 5.517 3.007 ( -0.266 -4.027 1.553) 4.325 3.093 ( -2.012 0.825 -10.871) 11.087 3.146 ( -2.010 0.003 -2.465) 3.181 3.254 ( 1.768 -0.484 3.930) 4.336 3.436 ( -0.941 -1.527 1.047) 2.077 3.594 ( -4.955 6.823 1.867) 8.637 3.668 ( 1.098 2.092 0.489) 2.413 3.889 ( -5.048 -1.328 5.701) 7.730 3.998 ( 7.961 -0.999 2.894) 8.529 4.171 ( 4.684 -0.908 5.775) 7.491 4.359 ( 2.356 -5.807 -5.082) 8.068 4.426 ( 4.993 2.391 -10.887) 12.214 4.538 ( -4.002 1.294 7.195) 8.334 4.673 ( -4.540 -7.925 6.961) 11.484 4.805 ( -3.427 -2.738 -9.207) 10.199 4.983 ( 4.668 3.132 -3.048) 6.395 5.456 ( 0.747 -0.298 -7.796) 7.838 5.503 ( 2.891 6.193 2.337) 7.223 5.680 ( 0.873 -2.959 0.493) 3.124 5.793 ( 2.940 -2.844 4.224) 5.880 5.911 ( -6.410 2.803 -1.632) 7.184 6.107 ( 1.341 6.889 -0.612) 7.045 6.231 ( -6.417 -0.637 -0.610) 6.477 6.398 ( 4.863 2.761 -1.463) 5.780 6.459 ( -8.518 -3.861 6.093) 11.162 6.723 ( 2.587 0.469 -1.900) 3.244 6.861 ( 1.073 6.706 2.297) 7.169 6.979 ( -5.594 -0.125 -5.126) 7.588 7.140 ( 7.679 5.234 7.935) 12.220 7.225 ( 2.802 0.766 -2.102) 3.586 7.414 ( 2.649 -0.941 5.738) 6.390 7.453 ( 0.084 -6.586 -2.256) 6.962 8.775 ( 0.975 -1.161 5.171) 5.389 8.889 ( -4.070 1.579 1.352) 4.571 8.929 ( 3.057 -4.483 -7.088) 8.926 9.131 ( -1.161 -0.697 -1.705) 2.178 9.231 ( -6.844 -0.326 -3.902) 7.885 9.462 ( -1.008 -1.941 3.991) 4.551 9.579 ( -3.478 -1.216 1.358) 3.927 9.854 ( 6.048 2.203 -0.597) 6.464 9.970 ( -5.992 -7.917 11.332) 15.066 10.614 ( -2.999 -2.901 -0.248) 4.180 10.775 ( 9.606 -3.490 -8.876) 13.536 11.022 ( 0.932 1.015 4.680) 4.879 11.187 ( -6.143 -0.525 -9.132) 11.018 11.334 ( -3.932 2.328 3.077) 5.509 11.545 ( 0.577 7.176 -0.250) 7.203 11.705 ( 2.140 -0.482 0.887) 2.366 11.766 ( 1.537 -5.549 -0.281) 5.765 11.880 ( -3.889 -4.111 -2.694) 6.267 11.971 ( 6.750 1.414 3.575) 7.768 12.213 ( -0.905 6.287 -3.611) 7.307 12.288 ( 2.272 10.331 1.938) 10.753 12.329 ( 10.664 3.607 -4.332) 12.063 12.774 ( -6.615 -10.124 -0.047) 12.094 13.012 ( 0.662 -8.502 1.515) 8.662 14.634 ( 1.561 -5.757 1.726) 6.209 14.659 ( -0.343 0.962 -0.781) 1.286 14.859 ( -0.740 1.576 1.027) 2.021 15.000 ( 4.425 2.386 -2.227) 5.498 15.269 ( -0.262 -0.772 1.919) 2.085 15.323 ( -2.682 5.187 2.091) 6.203 15.413 ( -2.181 -0.381 -0.805) 2.356 15.466 ( 0.667 -1.895 -2.437) 3.159 15.713 ( -1.417 -0.545 -2.625) 3.032 15.932 ( 3.635 1.822 1.690) 4.403 16.261 ( -5.545 2.477 9.250) 11.065 16.482 ( 0.875 -3.033 -5.068) 5.971 16.879 ( -4.384 6.447 4.747) 9.128 17.133 ( -0.120 4.817 0.086) 4.819 17.469 ( -0.053 2.503 -3.997) 4.716 17.659 ( 4.193 -0.584 -2.295) 4.816 25.704 ( -1.109 -1.231 0.223) 1.672 25.722 ( -0.837 1.241 -0.135) 1.503 25.751 ( -2.299 -2.052 1.263) 3.331 25.771 ( -0.642 -1.936 2.612) 3.314 25.829 ( 0.004 0.987 0.687) 1.203 26.097 ( 7.320 -0.799 -4.750) 8.762 26.418 ( -2.190 -0.046 -1.074) 2.439 26.489 ( 0.933 0.143 3.091) 3.232 26.924 ( -1.998 -1.082 -8.771) 9.060 26.979 ( 4.737 -1.619 12.567) 13.527 28.027 ( -6.386 -0.499 2.093) 6.739 28.258 ( -1.703 -0.898 -4.172) 4.594 28.561 ( 0.517 -4.229 -6.273) 7.583 28.855 ( 9.091 -12.397 -3.005) 15.664 29.223 ( -4.583 9.917 6.716) 12.824 29.390 ( -1.350 12.391 -1.401) 12.543 ======================= Grid point 216 (106/140) ======================= q-point: (-0.44 -0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.119 ( 3.646 0.000 -2.419) 4.375 1.147 ( -3.575 -0.000 -7.031) 7.888 1.781 ( -4.446 -0.000 4.764) 6.516 1.874 ( 13.689 0.000 9.170) 16.477 1.933 ( -21.580 -0.000 -10.766) 24.116 1.980 ( -3.242 -0.000 -7.050) 7.760 2.439 ( -2.720 -0.000 0.467) 2.760 2.483 ( -0.645 -0.000 -1.045) 1.228 2.782 ( 0.268 0.000 10.583) 10.586 3.019 ( -3.919 -0.000 0.864) 4.013 3.031 ( -4.911 -0.000 -9.075) 10.319 3.180 ( 8.261 0.000 -1.085) 8.332 3.409 ( 0.966 0.000 10.334) 10.379 3.493 ( -7.436 -0.000 -1.708) 7.630 3.699 ( 10.226 0.000 0.974) 10.272 3.758 ( -0.459 -0.000 -9.110) 9.122 3.935 ( 0.656 0.000 2.145) 2.244 4.045 ( -1.712 -0.000 -4.957) 5.244 4.312 ( -1.483 -0.000 0.802) 1.685 4.336 ( -0.537 -0.000 6.381) 6.403 4.572 ( -2.806 -0.000 -6.172) 6.780 4.751 ( 15.948 0.000 -4.100) 16.467 4.872 ( -3.729 -0.000 5.981) 7.048 4.995 ( -1.671 -0.000 -0.969) 1.932 5.347 ( -0.238 -0.000 6.837) 6.841 5.500 ( -2.395 -0.000 -1.588) 2.873 5.658 ( 4.071 0.000 0.462) 4.097 5.763 ( -1.456 -0.000 -11.205) 11.299 6.202 ( 2.968 0.000 4.843) 5.680 6.304 ( -6.347 -0.000 -3.634) 7.314 6.386 ( -1.241 -0.000 6.138) 6.262 6.531 ( 2.359 0.000 -4.386) 4.981 6.554 ( -2.108 -0.000 1.594) 2.643 6.592 ( 0.805 0.000 0.612) 1.011 6.948 ( -7.646 -0.000 5.934) 9.679 7.083 ( -7.161 -0.000 -0.773) 7.203 7.163 ( 10.643 0.000 4.886) 11.712 7.281 ( 6.063 0.000 -4.002) 7.265 7.295 ( 2.778 0.000 10.551) 10.911 7.562 ( -1.327 -0.000 -9.977) 10.065 8.419 ( -7.321 -0.000 -5.716) 9.288 8.426 ( 10.685 0.000 3.946) 11.390 8.777 ( -1.688 -0.000 11.656) 11.778 8.989 ( -1.299 -0.000 5.795) 5.939 9.107 ( -5.651 -0.000 10.375) 11.814 9.302 ( -0.066 -0.000 -2.146) 2.147 9.495 ( 11.441 0.000 -0.688) 11.462 9.733 ( -0.900 -0.000 -7.808) 7.860 9.809 ( -5.064 -0.000 -4.184) 6.569 10.011 ( 3.475 0.000 -16.574) 16.935 10.758 ( -6.667 -0.000 1.520) 6.838 10.911 ( 2.392 0.000 -2.517) 3.472 11.311 ( -11.668 -0.000 -3.636) 12.222 11.411 ( 4.160 0.000 1.943) 4.591 11.595 ( -1.751 -0.000 9.612) 9.770 11.621 ( 2.611 0.000 1.194) 2.871 11.751 ( -6.047 -0.000 -9.563) 11.315 11.878 ( 9.898 0.000 0.002) 9.898 11.929 ( -7.578 -0.000 -3.557) 8.371 12.092 ( 4.267 0.000 -4.170) 5.966 12.230 ( 2.893 0.000 8.016) 8.522 12.393 ( 2.067 0.000 -3.604) 4.155 13.081 ( 5.241 0.000 6.355) 8.237 13.169 ( -4.990 -0.000 -6.117) 7.894 14.664 ( -3.182 -0.000 1.376) 3.467 14.791 ( 5.155 0.000 1.674) 5.420 14.965 ( 1.987 0.000 7.980) 8.224 15.022 ( -6.853 -0.000 1.553) 7.027 15.205 ( 4.147 0.000 -8.687) 9.626 15.282 ( 2.054 0.000 -8.020) 8.279 15.656 ( -0.206 -0.000 3.646) 3.652 15.712 ( 2.067 0.000 -0.124) 2.070 15.889 ( -6.522 -0.000 0.696) 6.559 15.967 ( 5.943 0.000 0.345) 5.953 16.233 ( -6.308 -0.000 2.485) 6.779 16.299 ( 2.808 0.000 1.755) 3.311 17.354 ( -9.450 -0.000 5.861) 11.120 17.447 ( -1.339 -0.000 5.805) 5.957 17.488 ( -1.161 -0.000 -4.774) 4.913 17.809 ( 14.900 0.000 -0.949) 14.930 25.579 ( -1.587 -0.000 -0.914) 1.832 25.614 ( 0.943 0.000 -1.563) 1.826 25.722 ( -0.169 -0.000 4.096) 4.099 25.745 ( -1.466 -0.000 0.030) 1.467 25.869 ( -1.215 -0.000 3.254) 3.473 26.081 ( 0.504 0.000 -7.441) 7.458 26.381 ( -1.392 -0.000 0.513) 1.483 26.400 ( -0.319 -0.000 -0.464) 0.564 26.795 ( -2.820 -0.000 3.245) 4.299 27.016 ( -0.345 -0.000 -9.271) 9.277 27.770 ( -5.161 -0.000 9.841) 11.113 28.040 ( 7.270 0.000 -1.439) 7.411 28.241 ( 0.541 0.000 2.480) 2.538 28.310 ( 1.163 0.000 -2.222) 2.508 29.688 ( -7.111 -0.000 21.257) 22.415 30.511 ( 10.281 0.000 -22.793) 25.004 ======================= Grid point 217 (107/140) ======================= q-point: (-0.33 -0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.181 ( -4.540 -14.486 1.894) 15.298 1.290 ( -1.772 -16.154 -8.289) 18.243 1.698 ( -23.727 -8.929 -12.281) 28.170 1.938 ( 0.272 -4.507 11.497) 12.351 2.068 ( 0.187 -13.578 -0.865) 13.607 2.145 ( 8.472 -13.498 7.602) 17.656 2.370 ( -7.240 1.665 0.516) 7.447 2.464 ( -0.321 -1.133 -2.175) 2.473 2.829 ( -7.490 -3.743 6.286) 10.470 2.943 ( -0.790 0.982 -5.119) 5.272 3.039 ( -0.759 -4.571 -1.307) 4.814 3.289 ( 11.955 -2.998 -2.768) 12.632 3.416 ( 3.928 3.302 5.297) 7.375 3.490 ( -4.471 -0.021 -0.506) 4.500 3.620 ( 0.089 2.324 -0.508) 2.380 3.873 ( 1.542 -5.903 3.888) 7.234 3.988 ( 1.185 -3.968 -0.350) 4.156 4.099 ( 1.913 -7.907 -4.881) 9.487 4.210 ( -1.530 7.757 3.184) 8.524 4.366 ( -1.557 -0.025 -1.513) 2.172 4.530 ( -0.105 0.196 -8.088) 8.091 4.783 ( 2.555 5.833 4.102) 7.575 4.916 ( 3.406 -1.610 -0.375) 3.786 4.937 ( 1.588 2.664 -1.289) 3.359 5.421 ( 1.174 -3.689 9.445) 10.208 5.470 ( -1.184 0.509 -2.302) 2.638 5.660 ( 3.144 2.859 -0.361) 4.265 5.701 ( -2.159 -0.756 -10.241) 10.494 6.199 ( -7.193 3.295 -3.349) 8.591 6.226 ( 1.313 1.316 3.495) 3.959 6.396 ( -4.807 -0.184 2.227) 5.301 6.454 ( -2.081 4.314 -2.584) 5.443 6.540 ( -2.038 1.506 -0.177) 2.541 6.675 ( 7.163 -2.973 4.119) 8.782 6.944 ( -5.460 -2.473 8.078) 10.059 7.007 ( -4.459 1.742 -0.257) 4.794 7.190 ( 7.478 6.498 2.312) 10.173 7.350 ( 5.500 -0.524 -2.831) 6.208 7.363 ( 4.631 -1.184 6.326) 7.928 7.469 ( -1.346 3.199 -8.604) 9.277 8.422 ( -3.587 -8.556 -4.233) 10.197 8.585 ( 10.020 -5.668 3.847) 12.138 8.851 ( -1.069 -3.190 9.696) 10.263 8.985 ( -2.616 -0.205 -1.811) 3.189 9.171 ( -3.504 -5.348 10.164) 12.008 9.283 ( -0.868 -0.627 -0.113) 1.076 9.545 ( -0.664 2.525 -3.249) 4.168 9.703 ( 2.393 1.129 5.066) 5.716 9.778 ( -0.735 -3.515 -7.406) 8.231 10.128 ( 12.727 -14.417 -13.431) 23.456 10.726 ( -8.814 -2.480 0.774) 9.189 10.923 ( 0.092 -1.531 -2.213) 2.692 11.217 ( -9.692 -0.204 -1.051) 9.751 11.458 ( 3.228 0.714 1.730) 3.731 11.555 ( -5.876 -0.711 1.830) 6.196 11.657 ( -3.533 -2.609 -0.851) 4.473 11.738 ( 2.587 -1.916 -1.017) 3.377 11.869 ( -6.986 -0.730 -2.008) 7.305 11.925 ( 7.799 3.301 1.161) 8.548 12.154 ( 8.066 -3.634 -1.270) 8.938 12.306 ( 4.643 -0.721 7.645) 8.973 12.397 ( 2.092 -1.411 -5.539) 6.087 13.031 ( -2.928 8.400 -6.379) 10.947 13.090 ( 2.918 5.988 5.383) 8.565 14.612 ( -3.225 4.021 2.455) 5.709 14.817 ( 4.053 2.597 2.991) 5.667 14.965 ( -1.058 0.055 -1.669) 1.977 15.062 ( -3.172 -2.969 4.115) 5.984 15.129 ( 6.412 5.691 -3.534) 9.273 15.309 ( 2.619 -3.340 -7.485) 8.605 15.601 ( -1.562 5.514 3.394) 6.661 15.684 ( -1.288 4.896 -4.428) 6.725 15.806 ( -4.327 2.968 1.811) 5.551 16.020 ( 5.737 0.128 0.085) 5.740 16.229 ( -6.168 -3.412 3.816) 8.015 16.352 ( 2.315 -2.190 0.969) 3.330 17.232 ( -13.924 5.007 5.583) 15.815 17.436 ( -3.619 1.675 1.209) 4.167 17.521 ( 3.497 -3.449 -1.784) 5.226 17.835 ( 13.410 9.275 -2.945) 16.568 25.577 ( -1.885 -1.760 -0.252) 2.591 25.630 ( 0.664 -1.915 -1.188) 2.349 25.743 ( -0.847 -0.637 0.217) 1.082 25.748 ( 0.156 -0.032 5.527) 5.529 25.869 ( -1.045 1.158 3.693) 4.009 26.062 ( 2.683 -1.068 -7.639) 8.167 26.385 ( -0.732 -0.663 1.332) 1.658 26.404 ( 0.223 -0.866 0.088) 0.899 26.807 ( -2.301 -1.673 6.245) 6.862 26.981 ( 0.153 -0.401 -7.030) 7.043 27.829 ( -4.657 -6.300 6.349) 10.084 28.099 ( 5.629 -2.452 -3.131) 6.892 28.286 ( 0.855 -3.493 1.131) 3.770 28.335 ( 2.302 -2.954 -1.877) 4.189 29.683 ( -8.411 5.360 19.467) 21.874 30.343 ( 5.482 13.807 -24.219) 28.412 ======================= Grid point 218 (108/140) ======================= q-point: (-0.22 -0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.430 ( -9.504 -19.850 -1.280) 22.045 1.567 ( -3.896 -17.433 4.219) 18.355 1.762 ( -9.665 -20.211 -6.906) 23.443 1.938 ( -11.229 2.177 12.335) 16.823 2.305 ( 6.386 -5.371 2.403) 8.683 2.370 ( -8.146 -12.233 -0.998) 14.731 2.503 ( 6.928 -13.083 3.010) 15.108 2.534 ( 3.191 -9.192 -4.126) 10.569 2.865 ( -2.967 -4.710 -2.209) 5.989 2.935 ( 0.492 -2.017 0.167) 2.083 3.136 ( -0.506 -4.148 1.688) 4.506 3.343 ( 5.884 -0.906 -7.822) 9.830 3.428 ( 5.059 3.962 3.044) 7.111 3.485 ( 3.190 -2.836 0.203) 4.273 3.647 ( -7.292 -5.884 5.049) 10.644 3.999 ( 2.611 -3.809 6.604) 8.058 4.033 ( -1.660 4.455 -1.163) 4.895 4.099 ( 0.373 0.639 5.197) 5.249 4.195 ( 5.369 0.006 -3.321) 6.313 4.374 ( -2.493 -8.084 -4.117) 9.409 4.484 ( 3.611 1.099 -10.030) 10.717 4.690 ( -4.583 6.468 6.011) 9.948 4.813 ( -4.655 4.721 -1.679) 6.839 5.039 ( 8.643 -1.687 -2.140) 9.062 5.442 ( 0.369 0.225 -2.403) 2.442 5.559 ( 3.452 -3.515 5.860) 7.656 5.627 ( 1.422 -0.234 -4.862) 5.071 5.681 ( 1.402 -0.990 -0.202) 1.728 6.046 ( -8.867 5.106 -3.530) 10.824 6.218 ( -2.092 1.162 0.725) 2.500 6.311 ( -4.882 4.543 -2.847) 7.251 6.386 ( -5.450 0.014 2.545) 6.015 6.503 ( 1.964 2.767 -0.528) 3.434 6.743 ( 1.459 0.386 1.895) 2.423 6.950 ( -5.723 0.051 2.150) 6.114 7.082 ( 4.621 -7.181 4.741) 9.767 7.128 ( 5.375 7.273 2.521) 9.388 7.336 ( 3.697 3.249 -0.593) 4.957 7.381 ( 1.342 3.048 -4.540) 5.631 7.439 ( 4.913 0.545 2.840) 5.701 8.581 ( 1.594 -11.879 -2.053) 12.160 8.771 ( 7.972 -5.604 3.255) 10.274 8.905 ( -4.006 -0.202 1.324) 4.224 8.993 ( -1.224 -4.692 1.202) 4.996 9.227 ( -4.528 -0.309 -5.970) 7.499 9.340 ( -1.096 -7.014 4.762) 8.548 9.456 ( -5.647 1.430 0.935) 5.900 9.744 ( -4.694 -3.283 5.266) 7.781 9.860 ( 9.362 -3.043 3.706) 10.519 10.429 ( 16.695 -10.897 -10.848) 22.697 10.696 ( -8.152 -2.637 -3.023) 9.085 10.948 ( -1.882 -3.165 0.391) 3.703 11.159 ( -7.204 -0.172 1.384) 7.338 11.424 ( -4.031 0.521 -2.664) 4.860 11.597 ( 0.559 -3.443 -0.176) 3.493 11.680 ( -0.796 -2.029 1.769) 2.807 11.767 ( -2.567 -1.687 -2.990) 4.287 11.795 ( -0.968 4.757 -2.939) 5.675 11.955 ( 3.817 -1.089 6.098) 7.276 12.273 ( 6.778 -0.955 1.187) 6.947 12.369 ( 0.453 -1.929 1.655) 2.582 12.460 ( 5.679 -5.102 -0.715) 7.668 12.802 ( 1.394 13.244 -6.992) 15.041 13.021 ( 3.985 7.563 5.528) 10.180 14.539 ( -2.631 2.464 3.844) 5.270 14.783 ( 1.936 5.553 0.070) 5.881 14.956 ( 2.381 1.190 -1.348) 2.983 15.017 ( 1.106 0.898 -3.966) 4.214 15.182 ( 1.071 -2.356 6.246) 6.762 15.336 ( 1.955 -1.442 -5.582) 6.088 15.507 ( -4.184 5.054 1.692) 6.776 15.548 ( -2.613 4.943 -2.262) 6.031 15.741 ( -1.777 2.433 -1.409) 3.326 16.042 ( 4.959 2.067 -0.328) 5.382 16.271 ( -4.589 -3.629 4.682) 7.493 16.398 ( 2.205 -0.800 0.012) 2.345 17.066 ( -12.547 5.184 4.852) 14.417 17.357 ( -6.349 4.888 3.084) 8.586 17.580 ( 1.686 -1.181 -2.938) 3.587 17.712 ( 9.544 10.450 -6.450) 15.553 25.603 ( -1.963 -3.031 0.128) 3.614 25.670 ( 0.237 -2.820 -1.141) 3.051 25.745 ( -1.634 0.347 1.754) 2.422 25.766 ( -1.070 0.686 5.615) 5.757 25.860 ( 0.447 0.570 0.848) 1.115 26.083 ( 6.674 -0.786 -5.890) 8.936 26.390 ( -1.201 -0.837 -0.022) 1.464 26.448 ( 1.576 -2.024 3.218) 4.115 26.855 ( -2.761 -2.386 1.102) 3.811 26.984 ( 4.866 -0.137 3.378) 5.925 27.928 ( -4.443 -6.097 1.670) 7.726 28.167 ( 3.076 -3.491 -4.318) 6.348 28.369 ( 1.513 -5.697 -3.011) 6.618 28.455 ( 5.081 -9.044 0.132) 10.374 29.576 ( -8.557 9.461 15.493) 20.069 29.945 ( -3.799 19.399 -19.815) 27.989 ======================= Grid point 219 (109/140) ======================= q-point: (-0.11 -0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.657 ( -9.092 -15.195 0.885) 17.730 1.766 ( -12.915 -7.778 11.764) 19.122 1.944 ( 2.672 -9.102 11.502) 14.909 2.103 ( -0.505 -17.927 -0.302) 17.936 2.338 ( -0.351 -2.936 -7.601) 8.156 2.566 ( 1.524 -9.798 -0.618) 9.935 2.619 ( -2.916 -4.015 -2.565) 5.586 2.760 ( 5.994 -8.984 -4.665) 11.764 2.920 ( 0.339 -4.213 -3.185) 5.292 3.028 ( 0.126 -6.584 4.256) 7.841 3.129 ( -0.367 1.583 -1.118) 1.972 3.360 ( 0.074 7.199 -1.121) 7.286 3.432 ( 4.861 -2.916 -0.555) 5.695 3.562 ( 2.257 -3.403 -0.818) 4.164 3.718 ( -5.682 -4.358 2.737) 7.666 3.864 ( -2.986 7.632 1.993) 8.435 4.118 ( 9.879 0.923 7.011) 12.150 4.179 ( -0.319 -7.268 1.720) 7.475 4.231 ( 1.539 -1.868 3.013) 3.864 4.456 ( 3.550 1.071 -7.555) 8.416 4.529 ( 0.765 -9.472 0.248) 9.506 4.583 ( -2.938 2.894 2.013) 4.589 4.693 ( -8.433 1.591 -3.036) 9.103 5.067 ( 5.912 2.851 -2.974) 7.205 5.435 ( 2.195 0.371 -4.230) 4.780 5.555 ( -3.559 0.975 -5.562) 6.675 5.691 ( 6.963 -0.715 3.140) 7.672 5.782 ( 3.182 -5.246 5.759) 8.416 5.883 ( -8.515 3.148 -3.182) 9.620 6.165 ( -6.077 1.339 -2.347) 6.651 6.190 ( -1.027 3.632 -3.099) 4.884 6.381 ( -5.916 -2.046 4.503) 7.711 6.476 ( 4.169 2.680 -0.729) 5.009 6.747 ( 0.556 0.287 0.753) 0.979 6.896 ( -7.150 -0.161 -3.806) 8.102 7.040 ( 4.057 9.945 2.827) 11.107 7.215 ( 3.921 -2.393 -0.705) 4.647 7.328 ( 0.149 3.070 0.459) 3.108 7.360 ( 4.760 -0.485 3.279) 5.800 7.476 ( 6.578 0.235 3.467) 7.439 8.761 ( 1.125 -5.230 1.456) 5.544 8.859 ( -1.964 -1.357 -2.513) 3.466 8.908 ( 4.445 -1.994 2.382) 5.422 9.075 ( -0.553 -3.298 -0.383) 3.366 9.143 ( -3.826 -0.806 -7.202) 8.195 9.397 ( -3.649 -2.867 0.543) 4.672 9.514 ( -1.444 -6.075 4.696) 7.813 9.792 ( -4.277 -5.261 -0.747) 6.821 10.006 ( 7.294 -0.375 12.631) 14.590 10.542 ( -3.518 -1.923 -0.699) 4.070 10.739 ( 11.167 -5.237 -9.420) 15.520 11.004 ( -4.142 -5.012 3.006) 7.163 11.095 ( -7.198 2.164 -2.001) 7.779 11.376 ( -2.025 0.915 -0.415) 2.261 11.644 ( -2.728 0.252 -1.830) 3.295 11.660 ( -0.693 1.397 -4.336) 4.608 11.734 ( -2.140 1.103 0.974) 2.597 11.763 ( 0.640 -4.337 0.941) 4.483 12.045 ( 5.584 -0.741 3.514) 6.640 12.265 ( -1.209 3.131 -1.788) 3.803 12.395 ( 3.458 2.485 -0.624) 4.303 12.543 ( -5.764 1.913 -8.507) 10.453 12.642 ( 15.143 4.594 5.066) 16.616 12.993 ( 4.262 2.122 5.328) 7.145 14.560 ( 0.712 -3.848 3.514) 5.259 14.690 ( -0.731 4.325 -1.775) 4.731 14.935 ( 0.946 3.999 3.827) 5.616 15.038 ( 5.394 -1.109 -5.332) 7.666 15.234 ( -1.787 -2.113 1.564) 3.178 15.337 ( -3.059 -0.982 -0.542) 3.258 15.412 ( -2.044 3.057 3.181) 4.862 15.469 ( 0.283 2.581 -3.014) 3.979 15.692 ( -0.490 0.765 -3.490) 3.607 16.025 ( 2.680 3.812 0.810) 4.730 16.304 ( -3.549 0.278 7.080) 7.925 16.419 ( 1.927 -1.414 -3.341) 4.108 16.930 ( -8.971 3.337 4.208) 10.456 17.215 ( -6.164 6.661 3.162) 9.610 17.514 ( 1.590 4.894 -7.299) 8.930 17.672 ( 4.431 0.176 -3.245) 5.495 25.645 ( -1.714 -3.456 0.047) 3.858 25.706 ( -0.673 -1.841 -0.818) 2.124 25.724 ( -3.121 0.402 2.124) 3.797 25.775 ( -0.102 0.262 3.319) 3.331 25.858 ( 1.189 1.103 0.140) 1.628 26.125 ( 6.958 -0.516 -3.686) 7.891 26.402 ( 0.138 -0.629 1.769) 1.883 26.503 ( 0.497 -1.136 3.084) 3.324 26.842 ( -2.631 -1.501 -7.776) 8.345 27.085 ( 8.518 0.618 13.215) 15.735 27.957 ( -5.171 -2.261 -2.843) 6.319 28.215 ( 1.009 -2.217 -2.428) 3.439 28.462 ( 2.257 -5.424 -5.487) 8.038 28.688 ( 6.520 -12.978 -1.946) 14.653 29.395 ( -8.297 11.646 8.960) 16.874 29.546 ( -6.784 12.598 -7.933) 16.360 ======================= Grid point 226 (110/140) ======================= q-point: (-0.33 -0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.952 ( -12.644 -0.000 -5.843) 13.928 1.125 ( 1.496 0.000 -1.261) 1.957 1.349 ( -28.708 -0.000 -11.913) 31.082 1.929 ( 2.481 0.000 -1.641) 2.974 1.952 ( 2.434 0.000 12.832) 13.061 2.143 ( 3.742 0.000 9.118) 9.856 2.334 ( -19.790 -0.000 4.090) 20.208 2.438 ( 5.922 0.000 1.040) 6.013 2.751 ( -11.780 -0.000 8.943) 14.791 2.867 ( -3.307 -0.000 -10.479) 10.989 3.011 ( 0.713 0.000 0.340) 0.790 3.299 ( 7.421 0.000 -1.666) 7.606 3.524 ( 3.790 0.000 4.944) 6.230 3.531 ( 7.703 0.000 2.775) 8.188 3.654 ( 0.634 0.000 -10.150) 10.170 3.837 ( 3.003 0.000 6.459) 7.123 3.983 ( 4.795 0.000 -1.453) 5.011 3.992 ( -0.591 -0.000 -0.065) 0.594 4.297 ( -5.887 -0.000 -2.949) 6.584 4.310 ( 0.321 0.000 1.024) 1.074 4.526 ( 4.037 0.000 -6.419) 7.584 4.867 ( -4.848 -0.000 6.550) 8.149 4.909 ( 4.406 0.000 -4.741) 6.472 5.003 ( 7.612 0.000 0.389) 7.622 5.426 ( -1.635 -0.000 11.315) 11.433 5.460 ( 0.743 0.000 -2.880) 2.974 5.613 ( -4.965 -0.000 -9.387) 10.619 5.703 ( 2.770 0.000 -1.970) 3.399 6.151 ( -7.143 -0.000 -3.995) 8.184 6.271 ( 0.940 0.000 4.253) 4.356 6.375 ( -4.151 -0.000 2.898) 5.063 6.438 ( -3.882 -0.000 -7.108) 8.099 6.587 ( -0.532 -0.000 6.301) 6.324 6.682 ( 4.916 0.000 1.053) 5.028 6.903 ( -6.527 -0.000 7.009) 9.578 6.995 ( -3.254 -0.000 -0.318) 3.269 7.329 ( 3.767 0.000 -5.808) 6.922 7.360 ( 5.000 0.000 2.163) 5.448 7.426 ( 6.459 0.000 8.135) 10.387 7.451 ( 2.990 0.000 -9.390) 9.855 8.296 ( -1.584 -0.000 -4.186) 4.475 8.637 ( 10.040 0.000 3.737) 10.713 8.863 ( -1.634 -0.000 10.122) 10.253 8.953 ( -3.228 -0.000 -5.015) 5.964 9.148 ( -1.442 -0.000 8.003) 8.131 9.249 ( -2.072 -0.000 -4.417) 4.879 9.628 ( 1.774 0.000 -11.885) 12.016 9.652 ( 1.272 0.000 1.678) 2.105 9.796 ( 6.416 0.000 10.919) 12.665 10.005 ( 8.740 0.000 -5.226) 10.184 10.634 ( -10.106 -0.000 0.617) 10.125 10.896 ( -1.080 -0.000 -1.885) 2.173 11.149 ( -7.442 -0.000 1.221) 7.541 11.469 ( -10.266 -0.000 -1.679) 10.402 11.526 ( 4.476 0.000 0.331) 4.488 11.570 ( -7.046 -0.000 1.793) 7.271 11.751 ( 2.977 0.000 1.032) 3.151 11.829 ( -3.799 -0.000 3.137) 4.927 12.024 ( 6.918 0.000 -0.891) 6.975 12.163 ( 7.039 0.000 0.005) 7.039 12.369 ( 1.194 0.000 -7.506) 7.600 12.396 ( 8.420 0.000 7.907) 11.551 13.053 ( 0.700 0.000 -8.344) 8.373 13.184 ( -0.480 -0.000 7.743) 7.758 14.648 ( -0.136 -0.000 0.853) 0.864 14.881 ( 3.140 0.000 2.194) 3.830 14.920 ( -7.891 -0.000 2.669) 8.330 15.068 ( 1.868 0.000 3.640) 4.091 15.226 ( 10.412 0.000 -10.856) 15.042 15.243 ( 0.679 0.000 -0.809) 1.056 15.643 ( -3.388 -0.000 -1.021) 3.538 15.721 ( 0.548 0.000 -3.477) 3.520 15.812 ( -2.463 -0.000 0.234) 2.474 16.051 ( 3.325 0.000 1.293) 3.567 16.148 ( -8.176 -0.000 3.327) 8.827 16.365 ( 3.623 0.000 1.571) 3.949 17.187 ( -16.210 -0.000 5.544) 17.132 17.423 ( 0.773 0.000 -6.690) 6.734 17.511 ( 0.593 0.000 3.533) 3.582 18.013 ( 14.191 0.000 -6.570) 15.638 25.547 ( -2.046 -0.000 0.232) 2.059 25.610 ( 0.172 0.000 -0.895) 0.912 25.735 ( 0.032 0.000 0.314) 0.315 25.785 ( 2.479 0.000 4.413) 5.062 25.915 ( 0.028 0.000 9.597) 9.597 26.019 ( 0.881 0.000 -6.783) 6.840 26.389 ( 0.154 0.000 2.234) 2.239 26.401 ( 0.649 0.000 0.758) 0.998 26.800 ( -2.671 -0.000 8.450) 8.862 26.947 ( 0.433 0.000 -5.780) 5.797 27.757 ( -5.950 -0.000 5.028) 7.790 28.098 ( 5.308 0.000 -5.887) 7.927 28.275 ( 0.974 0.000 1.632) 1.900 28.313 ( 2.107 0.000 -2.389) 3.186 29.753 ( -10.422 -0.000 19.787) 22.364 30.376 ( 4.668 0.000 -31.940) 32.279 ======================= Grid point 227 (111/140) ======================= q-point: (-0.22 -0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.008 ( -12.064 -18.758 0.524) 22.309 1.230 ( -20.631 -15.646 -0.929) 25.909 1.318 ( 1.508 -19.596 0.802) 19.670 1.962 ( -18.911 3.805 14.270) 23.995 2.080 ( 1.590 -13.567 -1.072) 13.702 2.259 ( -0.191 -9.633 -0.732) 9.663 2.279 ( -2.286 -7.051 5.968) 9.516 2.542 ( 7.933 -1.541 5.232) 9.627 2.719 ( -7.968 -4.109 0.498) 8.979 2.882 ( -0.897 -7.317 -4.554) 8.666 3.027 ( -0.656 -2.223 0.537) 2.379 3.387 ( 0.455 -5.428 0.767) 5.500 3.447 ( 3.718 9.669 -5.915) 11.928 3.556 ( 4.808 2.956 2.442) 6.150 3.639 ( 4.009 0.304 0.559) 4.059 3.988 ( 5.073 -6.313 8.551) 11.777 3.995 ( -0.921 -2.373 2.749) 3.747 4.111 ( 5.680 -8.812 -6.309) 12.236 4.186 ( -2.969 4.916 -3.290) 6.619 4.314 ( 0.640 1.139 -0.382) 1.361 4.499 ( 3.420 2.627 -6.776) 8.032 4.795 ( -3.093 6.296 2.897) 7.590 4.868 ( -4.754 4.491 0.304) 6.547 5.075 ( 10.432 -0.607 -1.202) 10.519 5.447 ( 1.808 0.103 -3.721) 4.138 5.518 ( -2.821 -3.494 3.230) 5.531 5.547 ( -3.558 -3.386 -1.372) 5.100 5.707 ( 3.047 0.257 -2.162) 3.745 6.052 ( -6.248 3.848 -2.869) 7.879 6.253 ( -1.742 3.611 1.136) 4.167 6.321 ( -5.424 3.688 -2.766) 7.119 6.373 ( -2.269 1.146 1.339) 2.873 6.561 ( 0.542 2.710 2.679) 3.849 6.746 ( -3.001 -0.840 3.291) 4.532 6.942 ( -4.178 2.059 0.893) 4.743 6.978 ( 0.769 -8.233 2.219) 8.561 7.270 ( 4.847 3.391 -0.818) 5.971 7.401 ( 0.255 1.237 -2.738) 3.015 7.464 ( 7.969 -0.443 -3.525) 8.725 7.484 ( 7.156 3.220 4.982) 9.294 8.384 ( 2.977 -10.966 -1.698) 11.489 8.742 ( 4.885 -3.611 0.603) 6.104 8.882 ( -4.090 0.538 -3.698) 5.540 8.924 ( -2.243 -3.606 5.443) 6.904 9.187 ( -0.816 1.154 -3.949) 4.194 9.244 ( -0.290 -5.382 3.356) 6.349 9.495 ( -0.974 6.010 -1.126) 6.192 9.701 ( -1.113 -1.309 -2.450) 2.992 9.930 ( 9.417 -1.430 14.866) 17.656 10.277 ( 18.690 -17.870 -6.634) 26.696 10.575 ( -9.965 -1.847 0.068) 10.134 10.887 ( -2.759 -1.335 -0.747) 3.155 11.117 ( -5.377 -0.564 3.224) 6.295 11.366 ( -8.862 1.383 -3.500) 9.628 11.499 ( -8.745 -4.852 -5.505) 11.415 11.649 ( 4.350 -1.620 9.723) 10.774 11.771 ( 1.806 0.628 0.810) 2.077 11.822 ( -1.797 0.329 2.190) 2.852 12.028 ( 4.254 2.673 3.012) 5.858 12.278 ( 7.219 -5.334 1.051) 9.037 12.328 ( -0.460 0.536 -8.215) 8.245 12.489 ( 4.477 0.068 5.302) 6.939 12.982 ( 9.320 7.412 -6.833) 13.729 13.176 ( -0.424 4.245 8.725) 9.712 14.610 ( -0.268 4.497 3.175) 5.511 14.888 ( -0.959 3.085 3.991) 5.134 14.916 ( 0.588 -3.698 -3.691) 5.258 15.029 ( -1.817 3.395 -2.052) 4.363 15.250 ( 3.815 2.232 6.524) 7.880 15.298 ( 8.301 -2.920 -8.966) 12.563 15.570 ( -5.085 3.076 -0.984) 6.024 15.607 ( -2.578 8.594 -2.839) 9.410 15.774 ( -0.205 3.281 -1.315) 3.541 16.072 ( 0.309 -0.377 -0.833) 0.965 16.162 ( -4.975 -5.296 2.890) 7.819 16.423 ( 4.480 -1.493 2.082) 5.160 17.056 ( -14.795 3.426 4.153) 15.744 17.382 ( -1.663 2.292 -1.866) 3.392 17.547 ( -0.264 -2.224 0.229) 2.251 17.940 ( 6.837 12.433 -12.046) 18.612 25.549 ( -1.981 -1.796 0.659) 2.755 25.625 ( 0.050 -1.970 -0.768) 2.115 25.745 ( 0.348 -0.383 0.828) 0.977 25.817 ( 1.576 1.276 4.458) 4.898 25.888 ( -1.557 3.726 3.589) 5.403 26.078 ( 5.731 -3.538 -2.229) 7.095 26.393 ( 0.848 0.346 2.615) 2.771 26.438 ( 1.046 -1.955 2.377) 3.251 26.813 ( -2.898 1.075 2.213) 3.802 27.021 ( 8.189 -6.490 8.892) 13.721 27.782 ( -5.776 -6.033 0.468) 8.365 28.122 ( 4.286 -1.965 -6.671) 8.169 28.305 ( 1.322 -2.320 -0.287) 2.685 28.364 ( 3.008 -5.187 -1.363) 6.149 29.710 ( -11.407 5.752 17.100) 21.345 30.076 ( -6.481 14.744 -32.652) 36.408 ======================= Grid point 228 (112/140) ======================= q-point: (-0.11 -0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.306 ( -7.765 -20.621 12.066) 25.121 1.493 ( -10.389 -22.622 6.969) 25.851 1.706 ( 0.445 -19.796 2.403) 19.946 1.875 ( -16.408 -8.382 15.194) 23.882 2.231 ( -1.831 -5.513 -5.278) 7.849 2.378 ( 3.466 -8.596 -4.571) 10.334 2.556 ( 2.790 -15.524 -3.673) 16.195 2.599 ( 0.016 -1.559 3.901) 4.201 2.818 ( 0.707 -8.359 0.534) 8.406 2.976 ( 3.223 -3.044 0.950) 4.534 3.104 ( -3.112 -6.903 0.039) 7.572 3.317 ( -0.458 1.084 -3.906) 4.079 3.497 ( -2.737 -6.684 2.171) 7.542 3.524 ( 4.358 5.085 -1.917) 6.966 3.671 ( 3.051 0.709 3.905) 5.006 3.979 ( -0.846 5.990 -2.693) 6.622 4.081 ( -3.053 -0.710 2.717) 4.148 4.194 ( 6.376 -5.005 8.562) 11.790 4.286 ( 8.211 -5.550 -5.863) 11.515 4.327 ( 1.807 -5.006 -0.384) 5.336 4.452 ( 0.671 0.749 -4.998) 5.099 4.670 ( -1.630 6.841 1.796) 7.259 4.715 ( -7.022 7.570 0.683) 10.348 5.132 ( 6.610 1.239 -3.101) 7.406 5.447 ( 1.807 -0.860 -5.545) 5.895 5.487 ( -3.909 -0.402 -2.269) 4.537 5.686 ( -0.577 -8.867 3.515) 9.556 5.738 ( 4.955 -1.319 -0.873) 5.202 5.898 ( -5.820 6.763 -2.266) 9.206 6.168 ( -3.353 4.502 0.121) 5.615 6.204 ( -2.399 2.096 -5.260) 6.150 6.351 ( -3.274 0.749 3.566) 4.898 6.543 ( 1.825 1.918 1.122) 2.875 6.719 ( -7.820 0.039 2.221) 8.129 6.855 ( -2.344 1.817 -3.122) 4.306 7.136 ( 0.153 -5.392 -0.348) 5.405 7.267 ( 5.003 3.785 2.636) 6.805 7.338 ( 4.885 5.902 -4.696) 8.985 7.490 ( 4.823 2.365 4.551) 7.041 7.534 ( 6.952 -0.529 1.179) 7.071 8.628 ( 4.475 -12.453 0.800) 13.257 8.796 ( -4.765 -2.722 -2.417) 5.996 8.874 ( 1.796 -4.057 -3.287) 5.521 9.014 ( -0.626 -5.304 2.516) 5.904 9.117 ( 0.629 2.614 -3.949) 4.778 9.363 ( 1.730 -2.795 -1.415) 3.579 9.434 ( -2.669 -1.534 7.430) 8.042 9.707 ( -1.090 -1.771 0.377) 2.114 10.104 ( 7.268 -2.145 13.594) 15.564 10.493 ( -4.633 -0.461 0.395) 4.673 10.673 ( 16.656 -10.384 -9.532) 21.819 10.897 ( -4.749 -3.713 1.180) 6.143 11.074 ( -8.347 2.379 0.213) 8.682 11.299 ( -5.550 -3.724 -2.778) 7.238 11.512 ( -7.239 -5.921 -2.620) 9.712 11.701 ( 2.940 2.755 2.049) 4.520 11.769 ( 0.825 1.646 2.550) 3.145 11.789 ( -0.164 2.894 0.061) 2.900 12.080 ( 3.151 -1.050 6.927) 7.682 12.266 ( -1.970 0.970 -7.595) 7.906 12.419 ( 6.546 -3.523 0.735) 7.470 12.469 ( -4.741 2.501 -4.703) 7.131 12.941 ( 17.740 8.394 3.020) 19.857 13.149 ( 5.333 6.105 8.056) 11.428 14.574 ( 1.722 1.779 4.765) 5.370 14.783 ( -0.823 8.113 -1.428) 8.279 14.968 ( -1.709 -2.064 -2.789) 3.868 15.016 ( 3.923 -3.042 1.794) 5.279 15.226 ( -1.078 3.254 -0.258) 3.437 15.328 ( 0.506 2.143 -2.433) 3.282 15.467 ( -2.313 3.832 1.064) 4.600 15.495 ( -0.913 1.507 -0.444) 1.817 15.704 ( 0.805 2.945 -3.641) 4.752 16.071 ( -1.163 0.307 0.708) 1.396 16.239 ( -1.309 -5.639 0.026) 5.789 16.470 ( 4.602 2.197 2.372) 5.624 16.911 ( -12.233 2.692 2.814) 12.838 17.285 ( -8.451 6.158 5.092) 11.631 17.542 ( -1.905 1.654 -5.812) 6.336 17.722 ( 3.092 6.098 -10.848) 12.822 25.579 ( -1.648 -2.966 0.795) 3.485 25.660 ( -0.192 -2.461 -0.875) 2.618 25.743 ( -1.417 1.978 3.151) 3.981 25.800 ( -0.874 1.623 4.332) 4.708 25.874 ( 0.970 -0.121 -0.441) 1.073 26.139 ( 4.782 -1.069 -4.016) 6.336 26.426 ( 3.230 -0.152 4.472) 5.519 26.489 ( -0.081 -2.044 2.274) 3.059 26.768 ( -3.229 -0.087 -5.159) 6.087 27.263 ( 15.744 0.761 17.205) 23.333 27.842 ( -2.711 -5.884 -5.008) 8.188 28.169 ( 3.716 -3.458 -4.627) 6.868 28.374 ( 2.589 -4.622 -2.203) 5.737 28.519 ( 3.983 -10.714 -1.741) 11.562 29.545 ( -13.296 11.223 3.370) 17.722 29.614 ( -13.969 10.895 -11.345) 21.037 ======================= Grid point 236 (113/140) ======================= q-point: (-0.22 -0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.720 ( -13.502 -0.000 4.903) 14.365 0.922 ( -19.650 -0.000 13.476) 23.827 1.175 ( 4.031 0.000 2.461) 4.723 1.868 ( -34.210 -0.000 18.066) 38.687 1.975 ( 3.182 0.000 -0.700) 3.258 2.168 ( 1.328 0.000 -3.940) 4.157 2.228 ( 1.395 0.000 6.844) 6.985 2.636 ( 7.744 0.000 10.003) 12.651 2.656 ( -8.309 -0.000 2.571) 8.698 2.725 ( -2.149 -0.000 -10.184) 10.408 3.030 ( 0.524 0.000 1.967) 2.035 3.354 ( 0.188 0.000 0.363) 0.409 3.537 ( 0.533 0.000 -10.841) 10.854 3.598 ( 4.333 0.000 -3.922) 5.844 3.690 ( 2.439 0.000 5.560) 6.072 3.927 ( 0.579 0.000 6.593) 6.618 4.054 ( 7.030 0.000 -2.043) 7.321 4.070 ( 6.930 0.000 5.291) 8.719 4.170 ( -2.005 -0.000 -7.714) 7.971 4.337 ( 2.783 0.000 -1.424) 3.126 4.529 ( 3.424 0.000 -4.899) 5.977 4.849 ( -5.841 -0.000 6.105) 8.449 4.861 ( -1.960 -0.000 -4.642) 5.039 5.151 ( 9.450 0.000 -1.503) 9.569 5.399 ( -2.685 -0.000 -11.697) 12.001 5.482 ( -5.252 -0.000 9.165) 10.563 5.501 ( -1.671 -0.000 1.769) 2.434 5.709 ( 2.523 0.000 -4.861) 5.477 6.036 ( -4.190 -0.000 -0.847) 4.274 6.246 ( -3.131 -0.000 -5.482) 6.313 6.339 ( -5.094 -0.000 4.092) 6.534 6.396 ( -0.323 -0.000 1.866) 1.893 6.642 ( -0.600 -0.000 6.980) 7.006 6.715 ( 1.361 0.000 0.844) 1.602 6.871 ( -6.026 -0.000 6.060) 8.546 6.944 ( -2.779 -0.000 -2.538) 3.764 7.350 ( -5.215 -0.000 -0.005) 5.215 7.359 ( 10.128 0.000 0.734) 10.154 7.470 ( 5.904 0.000 -8.078) 10.006 7.637 ( 10.668 0.000 4.176) 11.457 8.306 ( 5.698 0.000 -0.138) 5.700 8.747 ( 1.779 0.000 -1.429) 2.282 8.797 ( -7.540 -0.000 -8.618) 11.451 8.901 ( -3.472 -0.000 5.274) 6.314 9.200 ( 2.056 0.000 -4.158) 4.639 9.204 ( 0.336 0.000 3.312) 3.329 9.597 ( 7.215 0.000 -7.668) 10.529 9.638 ( -2.093 -0.000 2.991) 3.650 10.141 ( 9.702 0.000 1.484) 9.814 10.157 ( 17.187 0.000 18.547) 25.286 10.493 ( -8.119 -0.000 1.557) 8.267 10.856 ( -1.574 -0.000 -1.316) 2.052 11.095 ( -4.186 -0.000 5.302) 6.755 11.307 ( -11.783 -0.000 -8.813) 14.714 11.342 ( -7.204 -0.000 3.424) 7.976 11.734 ( 5.395 0.000 10.361) 11.681 11.797 ( 2.990 0.000 -0.246) 3.000 11.817 ( -3.880 -0.000 4.767) 6.146 12.115 ( 5.572 0.000 5.723) 7.988 12.254 ( 1.488 0.000 -7.829) 7.969 12.313 ( 5.169 0.000 -1.281) 5.326 12.524 ( -1.728 -0.000 1.394) 2.220 13.135 ( 20.933 0.000 -3.769) 21.270 13.233 ( -4.853 -0.000 11.646) 12.616 14.682 ( 3.236 0.000 1.272) 3.477 14.837 ( -4.535 -0.000 0.547) 4.568 14.918 ( -1.690 -0.000 2.824) 3.291 15.048 ( -2.523 -0.000 -3.172) 4.053 15.303 ( 11.517 0.000 -9.658) 15.031 15.341 ( 4.695 0.000 9.069) 10.212 15.519 ( -9.119 -0.000 -5.167) 10.481 15.683 ( 2.004 0.000 -5.684) 6.027 15.820 ( 3.252 0.000 -1.555) 3.604 16.026 ( -6.479 -0.000 -0.655) 6.512 16.115 ( -1.016 -0.000 4.830) 4.936 16.442 ( 5.220 0.000 0.584) 5.253 16.984 ( -16.109 -0.000 4.339) 16.683 17.397 ( 4.669 0.000 -7.110) 8.506 17.517 ( -3.810 -0.000 3.057) 4.885 18.007 ( -1.662 -0.000 -22.589) 22.651 25.523 ( -1.776 -0.000 1.209) 2.149 25.605 ( -0.075 -0.000 -0.391) 0.398 25.750 ( 0.809 0.000 1.082) 1.351 25.845 ( 1.901 0.000 0.328) 1.929 25.988 ( 2.094 0.000 -3.793) 4.333 26.055 ( 3.292 0.000 8.275) 8.906 26.413 ( 0.048 0.000 1.661) 1.662 26.434 ( 0.851 0.000 1.517) 1.739 26.915 ( 1.202 0.000 -3.115) 3.339 27.017 ( 14.735 0.000 31.286) 34.583 27.686 ( -6.250 -0.000 0.111) 6.251 28.108 ( 5.129 0.000 -7.471) 9.062 28.297 ( 0.491 0.000 0.495) 0.698 28.329 ( 2.933 0.000 -2.472) 3.836 29.744 ( -13.776 -0.000 15.920) 21.053 29.937 ( -16.881 -0.000 -44.285) 47.394 ======================= Grid point 237 (114/140) ======================= q-point: (-0.11 -0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.966 ( -4.424 -28.284 9.910) 30.295 1.070 ( -6.110 -14.640 25.861) 30.339 1.411 ( 4.137 -19.776 6.145) 21.118 1.684 ( -33.971 -1.130 23.520) 41.334 2.086 ( 4.505 -8.536 -8.863) 13.104 2.252 ( 2.606 -9.831 -1.339) 10.259 2.336 ( 1.542 -7.271 -4.300) 8.587 2.563 ( -5.770 -0.989 2.041) 6.199 2.746 ( 2.911 -3.547 5.985) 7.542 2.821 ( -2.270 -12.190 -1.705) 12.516 3.043 ( 0.385 0.189 3.162) 3.191 3.347 ( -5.971 1.116 1.319) 6.216 3.435 ( 3.155 2.360 -8.264) 9.155 3.587 ( 2.688 1.842 -6.859) 7.593 3.730 ( 1.751 0.159 6.963) 7.182 4.010 ( -1.215 -3.068 2.710) 4.270 4.066 ( -0.554 2.517 -7.642) 8.065 4.154 ( 6.579 -4.733 0.175) 8.107 4.210 ( 7.424 -3.729 4.823) 9.607 4.354 ( 4.908 -0.827 -3.288) 5.965 4.491 ( 2.626 4.239 -3.297) 5.978 4.770 ( -0.440 5.223 -2.717) 5.904 4.786 ( -8.745 5.200 5.225) 11.437 5.199 ( 8.041 1.769 -3.532) 8.958 5.347 ( -2.510 -3.057 -7.608) 8.574 5.490 ( -1.687 0.104 1.457) 2.232 5.537 ( -5.091 -6.521 1.628) 8.432 5.722 ( 3.585 -2.486 -5.121) 6.727 5.968 ( -3.058 5.162 0.404) 6.013 6.185 ( -2.219 1.442 -5.707) 6.291 6.251 ( -4.762 6.512 4.052) 9.028 6.374 ( -2.072 0.834 0.960) 2.432 6.579 ( -1.171 4.378 4.542) 6.416 6.723 ( -3.795 2.906 6.659) 8.196 6.869 ( -2.248 3.332 -2.862) 4.934 7.007 ( 1.453 -9.884 -0.730) 10.017 7.290 ( -3.325 0.884 -2.701) 4.374 7.459 ( 4.975 0.412 -7.726) 9.199 7.535 ( 11.255 -3.158 5.472) 12.907 7.655 ( 7.714 6.740 3.649) 10.875 8.474 ( 6.691 -10.894 1.827) 12.914 8.696 ( -5.354 -1.899 -4.209) 7.070 8.782 ( -1.059 -4.071 -6.093) 7.403 8.922 ( -2.925 -4.094 0.766) 5.090 9.171 ( 0.955 2.935 -0.190) 3.092 9.268 ( -1.069 -5.847 0.441) 5.960 9.528 ( 3.796 6.144 3.591) 8.066 9.703 ( 3.288 -1.238 -0.113) 3.515 10.194 ( 5.412 0.043 11.043) 12.298 10.458 ( -3.368 -0.528 2.885) 4.466 10.548 ( 16.437 -15.184 -4.225) 22.773 10.839 ( -2.480 -0.124 0.220) 2.493 11.067 ( -5.799 3.414 2.388) 7.141 11.199 ( -3.629 -1.766 -2.515) 4.756 11.366 ( -6.129 -4.919 3.510) 8.607 11.762 ( -0.470 1.483 -0.235) 1.573 11.815 ( -0.229 0.946 2.867) 3.028 11.831 ( 3.548 1.283 3.989) 5.490 12.154 ( 0.472 2.937 6.112) 6.797 12.223 ( 3.258 -0.102 -6.503) 7.274 12.421 ( 8.774 -4.242 2.053) 9.960 12.459 ( -6.091 3.101 -4.956) 8.442 13.189 ( 4.728 5.676 9.654) 12.157 13.329 ( 20.012 1.494 4.262) 20.515 14.667 ( 2.845 3.940 3.805) 6.172 14.860 ( -2.185 -1.984 -0.997) 3.115 14.905 ( -0.822 1.019 -1.579) 2.051 14.999 ( 0.012 -0.110 0.046) 0.119 15.289 ( 1.556 4.098 -5.243) 6.834 15.363 ( -7.147 2.790 -0.279) 7.677 15.475 ( 3.321 -0.962 -1.571) 3.797 15.575 ( 0.760 8.832 0.781) 8.899 15.768 ( 2.478 4.991 -3.287) 6.470 16.023 ( -3.475 -3.578 0.172) 4.991 16.159 ( 1.249 -3.177 1.429) 3.701 16.526 ( 7.168 -2.389 1.020) 7.624 16.863 ( -14.432 2.140 2.713) 14.840 17.351 ( -4.452 6.063 2.343) 7.879 17.497 ( -5.413 -0.012 -4.100) 6.790 17.740 ( -9.810 4.918 -20.721) 23.447 25.533 ( -1.299 -1.718 1.559) 2.659 25.619 ( -0.103 -1.748 -0.484) 1.817 25.766 ( 0.698 -0.268 1.471) 1.650 25.864 ( 1.172 -0.833 -0.458) 1.509 25.898 ( -0.968 7.321 4.646) 8.725 26.127 ( 2.364 -1.543 -2.800) 3.976 26.444 ( 0.260 -1.385 0.004) 1.409 26.461 ( 0.640 -3.254 1.341) 3.578 26.800 ( 0.029 7.743 2.117) 8.028 27.535 ( 31.841 -2.124 27.867) 42.367 27.666 ( -2.017 -9.451 -5.187) 10.968 28.128 ( 5.550 -1.886 -6.538) 8.781 28.327 ( 1.656 -3.036 0.437) 3.486 28.393 ( 3.247 -6.106 -2.036) 7.209 29.457 ( -30.748 6.693 -31.874) 44.790 29.654 ( -15.322 5.398 11.654) 19.993 ======================= Grid point 246 (115/140) ======================= q-point: (-0.11 -0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.725 ( -1.701 -0.000 21.217) 21.285 1.107 ( 0.611 0.000 36.605) 36.610 1.286 ( 5.204 0.000 8.019) 9.560 1.548 ( -29.879 -0.000 30.030) 42.363 1.978 ( 3.199 0.000 -7.864) 8.490 2.174 ( 4.661 0.000 -6.060) 7.645 2.267 ( 1.302 0.000 -6.302) 6.435 2.550 ( -9.293 -0.000 5.336) 10.716 2.609 ( -0.530 -0.000 -7.444) 7.463 2.802 ( 0.213 0.000 10.450) 10.452 3.070 ( -0.256 -0.000 5.701) 5.707 3.299 ( -6.990 -0.000 -1.807) 7.220 3.430 ( 1.564 0.000 -13.164) 13.256 3.578 ( 2.459 0.000 -9.878) 10.180 3.773 ( -0.182 -0.000 9.074) 9.076 3.981 ( 0.010 0.000 3.142) 3.142 4.066 ( -0.809 -0.000 -7.316) 7.360 4.173 ( 9.934 0.000 -0.344) 9.940 4.276 ( 7.957 0.000 6.679) 10.389 4.347 ( 3.802 0.000 -7.150) 8.098 4.552 ( 3.962 0.000 -1.143) 4.124 4.770 ( -4.997 -0.000 -3.620) 6.171 4.801 ( -7.427 -0.000 5.849) 9.454 5.249 ( 6.298 0.000 -3.137) 7.035 5.287 ( 1.816 0.000 -6.089) 6.354 5.432 ( -6.877 -0.000 1.684) 7.081 5.470 ( -4.852 -0.000 -1.108) 4.976 5.687 ( 2.252 0.000 -7.373) 7.709 6.004 ( -1.399 -0.000 2.508) 2.872 6.158 ( -1.863 -0.000 -4.670) 5.028 6.303 ( -5.273 -0.000 5.298) 7.475 6.333 ( -3.440 -0.000 -0.140) 3.443 6.690 ( -2.239 -0.000 6.173) 6.566 6.840 ( -5.380 -0.000 5.944) 8.017 6.860 ( 11.935 0.000 2.038) 12.107 6.875 ( -1.138 -0.000 -3.857) 4.021 7.235 ( -6.383 -0.000 -3.141) 7.114 7.418 ( -0.447 -0.000 -10.137) 10.146 7.654 ( 17.380 0.000 7.617) 18.976 7.810 ( 6.447 0.000 3.466) 7.320 8.430 ( 5.687 0.000 1.445) 5.867 8.613 ( -4.750 -0.000 -3.741) 6.047 8.703 ( -1.414 -0.000 -5.085) 5.278 8.854 ( -4.505 -0.000 -2.106) 4.973 9.199 ( -0.285 -0.000 -0.607) 0.670 9.201 ( -1.845 -0.000 0.662) 1.960 9.676 ( 1.329 0.000 4.467) 4.660 9.694 ( 10.611 0.000 -3.183) 11.078 10.268 ( 3.577 0.000 1.675) 3.950 10.463 ( -0.714 -0.000 4.163) 4.224 10.467 ( 1.516 0.000 5.122) 5.342 10.825 ( -1.855 -0.000 -2.431) 3.058 11.110 ( -2.465 -0.000 7.548) 7.940 11.181 ( 10.726 0.000 -5.141) 11.895 11.311 ( -4.263 -0.000 8.058) 9.116 11.744 ( -4.177 -0.000 -1.523) 4.446 11.849 ( 3.429 0.000 0.576) 3.477 11.894 ( 2.852 0.000 5.133) 5.872 12.124 ( -2.620 -0.000 -10.507) 10.828 12.343 ( 7.148 0.000 9.924) 12.230 12.413 ( -5.216 -0.000 -4.453) 6.859 12.447 ( 8.904 0.000 1.424) 9.018 13.273 ( -7.231 -0.000 15.881) 17.450 13.574 ( 33.831 0.000 -1.750) 33.876 14.756 ( 3.717 0.000 0.481) 3.748 14.789 ( -1.698 -0.000 -0.414) 1.748 14.899 ( -2.509 -0.000 0.772) 2.625 14.992 ( -0.857 -0.000 -1.441) 1.676 15.236 ( -17.440 -0.000 -5.006) 18.145 15.355 ( 5.165 0.000 -7.068) 8.755 15.511 ( 0.053 0.000 10.333) 10.333 15.691 ( 5.492 0.000 -5.238) 7.589 15.867 ( 6.710 0.000 -5.011) 8.375 15.936 ( -0.706 -0.000 -5.195) 5.243 16.185 ( 5.869 0.000 6.880) 9.043 16.538 ( 5.817 0.000 0.442) 5.834 16.790 ( -12.045 -0.000 2.554) 12.313 17.413 ( -8.915 -0.000 -13.167) 15.901 17.452 ( -23.558 -0.000 -13.449) 27.126 17.460 ( -7.063 -0.000 2.927) 7.645 25.520 ( -0.644 -0.000 2.193) 2.285 25.601 ( 0.070 0.000 -0.258) 0.267 25.773 ( 0.599 0.000 0.974) 1.144 25.852 ( -0.393 -0.000 -1.471) 1.523 26.014 ( 3.871 0.000 -0.461) 3.898 26.102 ( -1.955 -0.000 0.947) 2.172 26.412 ( -1.416 -0.000 0.217) 1.432 26.426 ( -1.236 -0.000 -1.122) 1.669 26.932 ( 3.240 0.000 0.216) 3.247 27.518 ( -4.508 -0.000 -6.240) 7.698 28.008 ( 53.842 0.000 31.929) 62.597 28.133 ( 7.130 0.000 -6.067) 9.362 28.302 ( 0.439 0.000 0.381) 0.581 28.353 ( 3.236 0.000 -2.370) 4.011 29.041 ( -44.646 -0.000 -24.255) 50.809 29.623 ( -18.399 -0.000 9.487) 20.701 ======================= Grid point 247 (116/140) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 70 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.389 ( -4.734 -0.000 -11.159) 12.121 1.389 ( 4.734 0.000 11.159) 12.121 1.691 ( 20.438 0.000 -19.597) 28.315 1.691 ( -20.438 -0.000 19.597) 28.315 1.921 ( -9.269 -0.000 -3.489) 9.904 1.921 ( 9.269 0.000 3.489) 9.904 2.488 ( 4.616 0.000 -13.314) 14.092 2.488 ( -4.616 -0.000 13.314) 14.092 2.815 ( -11.991 -0.000 -17.876) 21.525 2.815 ( 11.991 0.000 17.876) 21.525 3.085 ( 5.455 0.000 -12.712) 13.833 3.085 ( -5.455 -0.000 12.712) 13.833 3.319 ( -0.410 -0.000 -8.896) 8.905 3.319 ( 0.410 0.000 8.896) 8.905 3.866 ( 0.607 0.000 -3.151) 3.209 3.866 ( -0.607 -0.000 3.151) 3.209 4.116 ( 4.277 0.000 -10.202) 11.062 4.116 ( -4.277 -0.000 10.202) 11.062 4.360 ( -3.761 -0.000 -0.741) 3.833 4.360 ( 3.761 0.000 0.741) 3.833 4.728 ( -2.784 -0.000 0.254) 2.796 4.728 ( 2.784 0.000 -0.254) 2.796 4.944 ( -2.454 -0.000 -12.495) 12.734 4.944 ( 2.454 0.000 12.495) 12.734 5.361 ( -2.475 -0.000 0.545) 2.535 5.361 ( 2.475 0.000 -0.545) 2.535 5.449 ( -2.989 -0.000 -7.183) 7.780 5.449 ( 2.989 0.000 7.183) 7.780 6.084 ( 3.034 0.000 -3.301) 4.483 6.084 ( -3.034 -0.000 3.301) 4.483 6.346 ( 4.387 0.000 -1.831) 4.754 6.346 ( -4.387 -0.000 1.831) 4.754 6.764 ( 1.265 0.000 -2.899) 3.163 6.764 ( -1.265 -0.000 2.899) 3.163 6.947 ( 10.376 0.000 -7.316) 12.696 6.947 ( -10.376 -0.000 7.316) 12.696 7.151 ( -1.449 -0.000 -3.565) 3.849 7.151 ( 1.449 0.000 3.565) 3.849 7.922 ( -2.546 -0.000 0.598) 2.616 7.922 ( 2.546 0.000 -0.598) 2.616 8.538 ( -0.881 -0.000 -5.005) 5.082 8.538 ( 0.881 0.000 5.005) 5.082 8.629 ( -3.082 -0.000 -3.996) 5.047 8.629 ( 3.082 0.000 3.996) 5.047 9.210 ( 3.962 0.000 -1.986) 4.432 9.210 ( -3.962 -0.000 1.986) 4.432 9.762 ( 5.416 0.000 -2.557) 5.990 9.762 ( -5.416 -0.000 2.557) 5.990 10.382 ( -9.327 -0.000 0.620) 9.348 10.382 ( 9.327 0.000 -0.620) 9.348 10.675 ( -3.069 -0.000 -4.858) 5.746 10.675 ( 3.069 0.000 4.858) 5.746 11.226 ( 9.863 0.000 -5.034) 11.073 11.226 ( -9.863 -0.000 5.034) 11.073 11.554 ( -1.211 -0.000 -8.269) 8.357 11.554 ( 1.211 0.000 8.269) 8.357 11.940 ( 2.327 0.000 -2.721) 3.580 11.940 ( -2.327 -0.000 2.721) 3.580 12.035 ( -6.246 -0.000 -5.679) 8.442 12.035 ( 6.246 0.000 5.679) 8.442 12.574 ( 6.339 0.000 -2.474) 6.805 12.574 ( -6.339 -0.000 2.474) 6.805 13.613 ( 9.037 0.000 -14.435) 17.030 13.613 ( -9.037 -0.000 14.435) 17.030 14.754 ( 0.187 0.000 -0.240) 0.304 14.754 ( -0.187 -0.000 0.240) 0.304 14.896 ( -0.921 -0.000 -0.862) 1.261 14.896 ( 0.921 0.000 0.862) 1.261 15.217 ( -0.284 -0.000 -5.240) 5.247 15.217 ( 0.284 0.000 5.240) 5.247 15.654 ( 12.069 0.000 -6.976) 13.941 15.654 ( -12.069 -0.000 6.976) 13.941 15.811 ( -0.145 -0.000 -0.606) 0.623 15.811 ( 0.145 0.000 0.606) 0.623 16.508 ( -13.881 -0.000 -0.855) 13.908 16.508 ( 13.881 0.000 0.855) 13.908 16.806 ( -18.583 -0.000 1.453) 18.640 16.806 ( 18.583 0.000 -1.453) 18.640 17.427 ( 8.403 0.000 -3.376) 9.055 17.427 ( -8.403 -0.000 3.376) 9.055 25.584 ( -0.049 -0.000 -1.515) 1.516 25.584 ( 0.049 0.000 1.515) 1.516 25.792 ( -1.509 -0.000 -0.285) 1.536 25.792 ( 1.509 0.000 0.285) 1.536 26.096 ( -3.702 -0.000 0.501) 3.736 26.096 ( 3.702 0.000 -0.501) 3.736 26.383 ( 0.963 0.000 -0.642) 1.157 26.383 ( -0.963 -0.000 0.642) 1.157 27.141 ( -7.778 -0.000 -8.140) 11.259 27.141 ( 7.778 0.000 8.140) 11.259 28.167 ( -15.451 -0.000 2.412) 15.638 28.167 ( 15.451 0.000 -2.412) 15.638 28.340 ( 5.370 0.000 -2.575) 5.955 28.340 ( -5.370 -0.000 2.575) 5.955 29.346 ( -35.685 -0.000 -1.605) 35.721 29.346 ( 35.685 0.000 1.605) 35.721 ======================= Grid point 249 (117/140) ======================= q-point: ( 0.11 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.364 ( -3.583 -10.076 -14.626) 18.118 1.506 ( 3.090 -6.177 3.261) 7.638 1.754 ( -8.357 -9.304 14.247) 18.957 1.856 ( 13.809 -10.662 -18.038) 25.095 1.936 ( -2.484 -7.813 4.612) 9.407 2.098 ( 7.648 -9.160 4.386) 12.714 2.442 ( -5.651 -7.197 -22.553) 24.338 2.592 ( -5.103 -11.253 6.903) 14.154 2.773 ( -1.687 -8.181 -8.075) 11.618 3.022 ( 4.426 -2.098 0.795) 4.962 3.103 ( 4.709 -0.993 2.143) 5.269 3.135 ( 3.582 -4.235 11.817) 13.054 3.257 ( -0.837 0.539 -6.414) 6.491 3.349 ( 0.468 0.994 7.706) 7.784 3.847 ( -4.155 0.852 2.226) 4.790 3.887 ( 0.824 -1.082 3.456) 3.714 4.081 ( 0.924 2.296 -7.276) 7.686 4.135 ( 0.752 0.336 3.958) 4.043 4.293 ( -7.097 2.142 0.948) 7.474 4.370 ( 0.600 -0.525 2.363) 2.494 4.654 ( -2.109 4.619 -5.208) 7.273 4.740 ( 5.503 1.732 -1.932) 6.084 4.893 ( -3.477 -1.790 -8.553) 9.405 5.033 ( -0.531 -1.417 9.703) 9.821 5.329 ( -2.715 1.482 2.925) 4.257 5.390 ( 6.257 1.279 1.308) 6.519 5.449 ( -1.533 -6.421 -4.902) 8.223 5.555 ( 2.755 -5.335 6.110) 8.567 6.035 ( 0.574 5.822 -2.891) 6.525 6.052 ( 1.001 3.653 1.284) 3.999 6.321 ( -0.109 0.854 -2.148) 2.314 6.358 ( 2.197 1.007 -0.144) 2.421 6.702 ( -3.456 4.771 -0.172) 5.894 6.749 ( 1.999 3.285 0.969) 3.965 6.920 ( -2.762 -1.477 3.811) 4.933 6.931 ( 2.976 4.594 -6.031) 8.144 7.159 ( 1.456 -0.965 -0.011) 1.747 7.198 ( 1.709 -0.985 6.235) 6.539 7.829 ( -6.883 6.870 -0.008) 9.725 7.847 ( -3.485 4.598 -2.148) 6.157 8.557 ( 0.093 -4.453 -2.382) 5.051 8.603 ( 0.526 -6.564 1.816) 6.830 8.693 ( -1.406 -8.397 -1.443) 8.635 8.742 ( 1.130 -7.197 6.295) 9.628 9.221 ( -2.917 -2.514 2.372) 4.522 9.253 ( 3.608 -2.236 -4.028) 5.852 9.710 ( -6.398 0.468 -0.682) 6.451 9.762 ( 0.127 1.339 -0.698) 1.515 10.346 ( -7.475 -2.039 2.350) 8.097 10.490 ( 13.227 -2.582 -3.137) 13.837 10.645 ( -1.837 -2.194 -4.993) 5.755 10.735 ( 3.522 -1.793 4.000) 5.624 11.131 ( -12.676 2.848 1.816) 13.119 11.255 ( 7.206 0.506 -5.134) 8.862 11.527 ( -0.042 -1.768 -7.978) 8.171 11.612 ( 1.116 -0.646 7.202) 7.316 11.909 ( -1.719 2.514 -5.011) 5.864 11.942 ( -1.244 0.062 1.662) 2.077 11.967 ( 0.838 1.633 -0.024) 1.836 12.087 ( 7.650 4.048 7.362) 11.363 12.489 ( -6.460 4.313 -1.679) 7.947 12.558 ( 1.537 3.666 -1.631) 4.297 13.538 ( -11.815 3.568 1.690) 12.457 13.580 ( -3.392 2.272 -2.386) 4.729 14.755 ( 0.183 -0.134 -0.212) 0.310 14.784 ( 4.402 -0.764 -0.724) 4.526 14.896 ( -4.911 -1.289 0.911) 5.158 14.982 ( 2.966 -5.418 2.837) 6.797 15.128 ( 2.532 5.662 -3.561) 7.152 15.194 ( 4.248 6.122 2.795) 7.959 15.499 ( -7.965 7.364 2.336) 11.096 15.596 ( 5.679 7.989 0.060) 9.802 15.857 ( -6.371 -4.805 -1.734) 8.167 15.932 ( 2.548 -7.361 1.097) 7.866 16.363 ( -12.276 2.158 -4.206) 13.155 16.608 ( 5.515 -2.416 3.465) 6.947 16.702 ( -4.205 3.660 0.717) 5.620 16.967 ( 21.668 0.852 2.512) 21.830 17.398 ( -6.564 -1.904 1.591) 7.018 17.492 ( 7.094 -1.825 -1.815) 7.547 25.583 ( -0.002 -0.995 -1.813) 2.068 25.600 ( 0.295 -1.110 0.967) 1.502 25.794 ( -1.411 -1.411 0.118) 1.999 25.818 ( 0.973 -1.266 1.160) 1.973 26.048 ( -3.826 2.202 -1.996) 4.845 26.109 ( 3.189 0.871 -1.109) 3.487 26.377 ( 0.897 0.050 0.580) 1.070 26.390 ( 0.857 0.300 2.843) 2.984 27.024 ( -7.226 2.442 -8.553) 11.460 27.246 ( 9.038 0.776 10.653) 13.992 28.096 ( -13.376 -3.096 4.484) 14.443 28.224 ( 1.996 2.199 0.218) 2.978 28.378 ( -1.632 -7.078 -1.806) 7.485 28.484 ( 6.319 -9.552 4.810) 12.422 29.023 ( -26.740 3.448 -8.913) 28.396 29.540 ( 31.000 7.179 -3.335) 31.995 ======================= Grid point 250 (118/140) ======================= q-point: ( 0.22 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.546 ( 0.575 -16.164 -1.600) 16.253 1.663 ( 6.581 -8.499 -4.640) 11.708 1.944 ( -1.120 -9.082 10.277) 13.761 2.003 ( -1.213 -12.559 -13.376) 18.388 2.142 ( 6.688 -8.630 3.112) 11.353 2.311 ( -0.034 -13.179 -11.315) 17.370 2.498 ( 1.937 -11.483 -11.939) 16.678 2.787 ( -6.236 -11.769 1.222) 13.375 2.917 ( -0.084 -7.949 2.919) 8.469 2.995 ( -2.076 -0.562 -10.258) 10.481 3.113 ( -2.226 0.669 6.150) 6.574 3.202 ( -1.027 -2.505 -1.572) 3.130 3.346 ( -2.204 -2.090 9.687) 10.152 3.483 ( 13.698 -9.008 2.759) 16.625 3.786 ( -6.598 3.030 4.054) 8.316 3.924 ( 2.366 5.585 0.501) 6.086 4.013 ( -1.558 -2.977 1.786) 3.805 4.145 ( 4.289 1.278 -1.637) 4.766 4.242 ( -4.998 -1.211 4.295) 6.700 4.439 ( 0.679 -3.762 3.633) 5.274 4.537 ( -2.064 1.983 -7.645) 8.163 4.715 ( 4.990 4.824 -3.532) 7.788 4.839 ( -3.871 0.173 -8.220) 9.087 5.051 ( -3.614 0.375 4.511) 5.792 5.324 ( -1.095 -0.492 4.347) 4.510 5.410 ( 6.687 3.026 1.083) 7.419 5.595 ( 0.938 -10.712 1.065) 10.805 5.698 ( -1.249 -6.980 5.423) 8.927 5.897 ( -0.130 7.742 -4.171) 8.795 6.007 ( 3.031 4.308 3.112) 6.118 6.276 ( 1.125 2.722 -5.363) 6.118 6.361 ( 0.150 0.329 1.780) 1.817 6.609 ( -3.095 1.557 -1.454) 3.757 6.690 ( 3.115 4.906 -3.438) 6.752 6.840 ( -2.078 2.952 -0.476) 3.641 6.988 ( 5.030 -1.152 5.615) 7.626 7.158 ( -0.325 2.170 2.641) 3.433 7.262 ( 2.667 -0.149 6.287) 6.831 7.637 ( -8.421 6.819 -1.098) 10.891 7.744 ( -2.712 4.013 -2.466) 5.435 8.645 ( -0.118 -6.058 0.177) 6.062 8.772 ( -1.830 -12.133 0.144) 12.271 8.807 ( -0.787 -7.203 -0.325) 7.253 8.906 ( -1.975 -7.199 5.527) 9.288 9.233 ( -1.490 0.304 -2.491) 2.918 9.283 ( 0.464 -1.981 1.192) 2.359 9.650 ( -3.671 1.472 -4.842) 6.252 9.744 ( -2.172 -1.719 0.577) 2.830 10.344 ( -7.302 -2.039 4.604) 8.870 10.565 ( 5.155 -0.892 -7.261) 8.950 10.719 ( 9.265 -4.561 -2.916) 10.730 10.838 ( 5.253 -4.563 2.543) 7.408 10.977 ( -12.811 3.072 -1.090) 13.219 11.292 ( 5.323 -2.117 -3.631) 6.783 11.512 ( 0.374 0.273 -5.769) 5.788 11.656 ( 0.902 -0.809 3.652) 3.848 11.810 ( -4.240 3.370 -1.190) 5.545 11.947 ( 2.612 -0.883 -4.820) 5.553 11.988 ( 3.294 0.294 6.148) 6.981 12.097 ( 8.102 6.345 8.499) 13.347 12.323 ( -3.981 7.478 -6.272) 10.541 12.495 ( -1.471 3.641 1.902) 4.364 13.350 ( -17.184 5.895 0.306) 18.169 13.451 ( -4.740 6.813 -5.851) 10.155 14.734 ( 0.569 6.969 -3.187) 7.684 14.754 ( 0.648 1.596 -0.478) 1.787 14.900 ( -6.294 -4.549 3.107) 8.364 15.052 ( -0.452 -3.661 2.818) 4.642 15.093 ( 2.296 5.766 2.514) 6.696 15.228 ( 13.149 -1.811 -0.009) 13.273 15.368 ( -3.748 2.999 -0.619) 4.840 15.525 ( 3.048 4.933 2.364) 6.263 15.816 ( -10.462 0.047 -2.802) 10.831 16.041 ( 2.350 -2.655 -0.333) 3.561 16.272 ( -5.458 -1.673 -1.797) 5.984 16.596 ( -3.960 4.382 -0.996) 5.989 16.708 ( 7.383 -0.367 5.522) 9.227 17.099 ( 17.155 3.973 4.025) 18.064 17.394 ( -4.802 -2.264 -0.252) 5.315 17.567 ( 4.710 -2.006 -0.051) 5.119 25.602 ( 0.401 -2.032 -1.454) 2.531 25.633 ( 0.616 -1.906 0.677) 2.114 25.806 ( -1.177 -1.004 -0.499) 1.626 25.847 ( -0.150 -0.772 1.669) 1.845 25.944 ( -2.907 4.302 -5.369) 7.469 26.115 ( 2.210 0.413 -0.115) 2.251 26.406 ( 1.866 -0.049 3.827) 4.258 26.428 ( 1.113 -2.311 4.395) 5.089 26.882 ( -5.653 2.629 -9.754) 11.576 27.327 ( 9.214 4.989 10.645) 14.937 28.087 ( -13.605 -3.087 5.064) 14.841 28.152 ( -6.981 -0.160 -5.242) 8.732 28.516 ( -2.511 -11.478 -1.060) 11.797 28.575 ( -17.185 -3.704 -2.645) 17.777 28.947 ( 11.950 -4.871 2.278) 13.104 29.564 ( 23.478 12.302 -4.526) 26.889 ======================= Grid point 251 (119/140) ======================= q-point: ( 0.33 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.748 ( 4.331 -5.315 -0.550) 6.878 1.910 ( 5.422 -16.018 -1.386) 16.968 2.098 ( -5.920 -6.788 10.206) 13.612 2.128 ( 6.692 -6.997 -11.080) 14.714 2.347 ( 2.916 -9.594 0.593) 10.045 2.428 ( -2.432 -11.113 -17.682) 21.026 2.661 ( 5.650 -6.276 -1.490) 8.575 2.777 ( -6.317 2.068 -5.649) 8.723 2.940 ( -4.614 -0.655 0.483) 4.686 3.055 ( -0.782 -4.172 2.124) 4.746 3.142 ( 1.121 1.328 4.827) 5.131 3.248 ( -4.599 -7.443 -1.884) 8.950 3.448 ( -2.276 -7.706 5.674) 9.837 3.616 ( 2.747 5.071 0.953) 5.846 3.689 ( -7.060 4.741 1.444) 8.626 3.886 ( 8.261 -3.062 -1.641) 8.962 4.078 ( -6.529 -0.396 7.711) 10.111 4.199 ( 4.999 -4.140 2.507) 6.958 4.288 ( 4.314 -2.183 1.662) 5.113 4.450 ( 0.954 0.819 -1.649) 2.074 4.553 ( 1.892 -3.869 -5.407) 6.913 4.645 ( -1.401 2.022 -3.537) 4.308 4.768 ( 1.336 0.303 -9.020) 9.124 5.028 ( -6.568 0.816 4.520) 8.015 5.360 ( 3.404 0.711 2.821) 4.478 5.399 ( 0.394 1.322 1.589) 2.104 5.746 ( 0.977 -0.256 -1.055) 1.460 5.795 ( 0.723 -0.641 0.620) 1.148 5.812 ( -3.264 -7.702 3.704) 9.149 6.011 ( 4.693 0.551 3.381) 5.810 6.213 ( -2.188 1.643 -3.900) 4.764 6.360 ( 2.717 0.834 -0.012) 2.842 6.564 ( -5.384 0.576 -1.842) 5.719 6.667 ( 7.096 -0.193 -1.445) 7.244 6.803 ( -3.239 0.395 2.720) 4.248 6.999 ( 0.206 6.179 3.530) 7.119 7.167 ( 2.703 -0.960 4.726) 5.528 7.289 ( 1.285 1.501 3.426) 3.955 7.504 ( -4.149 2.806 -0.409) 5.026 7.642 ( -1.314 4.205 -2.868) 5.257 8.737 ( -0.702 -4.732 1.010) 4.889 8.891 ( -0.639 -4.753 0.199) 4.800 8.919 ( -7.432 -2.023 -1.686) 7.885 8.983 ( 1.361 -5.598 3.497) 6.739 9.186 ( -2.486 0.690 -2.930) 3.904 9.382 ( -0.575 -7.880 3.591) 8.679 9.563 ( -2.635 2.187 -3.848) 5.151 9.782 ( 0.342 -2.561 -1.230) 2.862 10.328 ( -6.042 0.496 3.630) 7.067 10.579 ( 2.064 -1.729 -5.972) 6.551 10.826 ( 4.051 -2.790 -5.363) 7.277 10.848 ( -3.008 2.952 0.023) 4.214 10.988 ( 7.019 -5.606 0.794) 9.018 11.379 ( 4.154 -4.847 -0.888) 6.445 11.478 ( 0.077 1.721 0.675) 1.850 11.678 ( 0.823 0.722 -1.661) 1.990 11.748 ( -4.804 -0.755 -0.360) 4.876 11.937 ( 0.003 -0.306 -8.004) 8.010 12.065 ( 2.450 -2.037 7.382) 8.040 12.095 ( 8.548 5.958 9.453) 14.068 12.181 ( 2.229 4.125 -2.481) 5.305 12.424 ( -1.069 5.226 1.745) 5.612 13.085 ( -16.596 8.994 -3.206) 19.147 13.255 ( -5.286 7.205 -6.078) 10.807 14.627 ( 0.188 3.176 -1.166) 3.389 14.737 ( -1.087 -0.680 -2.323) 2.653 14.935 ( -0.850 -0.859 1.508) 1.932 15.000 ( -2.634 5.266 3.585) 6.893 15.187 ( 3.506 -6.812 3.760) 8.534 15.278 ( 0.754 0.321 -2.250) 2.394 15.351 ( 5.108 1.527 0.429) 5.349 15.512 ( 2.162 0.811 1.106) 2.560 15.706 ( -7.212 1.795 -3.682) 8.294 16.046 ( -0.630 2.668 0.339) 2.763 16.290 ( -3.987 -3.629 3.180) 6.259 16.495 ( 1.175 4.651 -3.928) 6.200 16.803 ( 5.175 -1.998 5.095) 7.532 17.134 ( 9.850 5.377 1.613) 11.337 17.393 ( -3.773 -1.320 0.416) 4.019 17.624 ( 2.693 -1.305 0.337) 3.012 25.641 ( 0.784 -2.613 -0.844) 2.856 25.677 ( 0.632 -2.261 0.649) 2.436 25.789 ( -0.685 1.604 -3.154) 3.604 25.841 ( -1.587 2.425 -2.740) 3.989 25.855 ( -0.988 0.317 1.328) 1.686 26.128 ( 1.485 -0.025 0.727) 1.654 26.442 ( 2.513 0.309 4.717) 5.353 26.498 ( -1.044 -2.516 4.078) 4.904 26.771 ( -2.652 0.990 -9.258) 9.681 27.323 ( 5.815 7.078 7.567) 11.882 27.968 ( -14.304 -0.687 -6.269) 15.632 28.180 ( -4.825 -5.275 4.206) 8.295 28.490 ( -6.258 -1.061 -5.525) 8.415 28.704 ( -3.508 -12.913 0.755) 13.402 29.147 ( 9.640 -3.146 5.730) 11.647 29.478 ( 15.633 12.603 -3.505) 20.385 ======================= Grid point 252 (120/140) ======================= q-point: ( 0.44 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.826 ( 2.014 -1.857 -1.311) 3.036 2.123 ( -1.289 -5.268 5.364) 7.628 2.195 ( 5.685 -0.952 -8.475) 10.250 2.249 ( 0.503 -8.290 6.513) 10.554 2.415 ( -3.362 0.086 -6.393) 7.223 2.490 ( 1.811 -2.207 -4.004) 4.917 2.696 ( -0.465 -1.232 -2.467) 2.797 2.786 ( -1.307 -4.726 0.846) 4.976 2.935 ( -0.373 -1.115 0.853) 1.453 3.037 ( -0.474 4.732 -0.521) 4.784 3.130 ( 0.254 1.058 1.463) 1.823 3.360 ( -4.249 -9.357 -2.084) 10.486 3.480 ( 0.900 7.245 3.023) 7.902 3.586 ( -1.503 -4.319 -0.969) 4.674 3.597 ( -1.626 3.403 4.243) 5.677 3.948 ( 1.878 0.013 -2.704) 3.292 4.094 ( -2.490 -1.901 4.922) 5.835 4.273 ( 2.414 -0.313 -1.138) 2.687 4.338 ( 3.808 1.563 0.919) 4.217 4.454 ( 1.506 0.079 0.547) 1.604 4.585 ( -4.967 -1.710 -0.598) 5.287 4.625 ( 2.958 -2.287 -2.617) 4.563 4.809 ( 8.272 -5.517 -9.018) 13.424 4.947 ( -9.500 4.717 5.922) 12.148 5.346 ( 1.419 2.235 0.841) 2.778 5.414 ( -0.183 -0.845 0.313) 0.920 5.745 ( 2.781 -0.389 0.528) 2.857 5.805 ( -3.133 -0.345 0.288) 3.165 5.923 ( 0.141 -3.384 1.605) 3.748 6.067 ( 3.618 -1.178 1.407) 4.057 6.147 ( -4.008 1.355 -1.874) 4.627 6.407 ( 7.641 -1.401 0.546) 7.788 6.496 ( -7.531 0.782 -1.442) 7.707 6.739 ( 5.759 -0.542 1.710) 6.031 6.793 ( -2.961 -1.850 -0.044) 3.492 6.889 ( -2.183 5.562 1.251) 6.105 7.211 ( 1.342 0.251 0.703) 1.536 7.315 ( 0.173 -2.688 6.325) 6.875 7.419 ( -0.313 4.677 -5.858) 7.503 7.593 ( -0.276 0.423 0.679) 0.847 8.802 ( -0.085 -2.726 0.487) 2.770 8.847 ( -2.634 1.874 -1.220) 3.456 8.929 ( 1.429 1.079 1.585) 2.392 9.056 ( -3.266 -2.577 -0.803) 4.236 9.175 ( -0.473 -1.365 -0.118) 1.449 9.475 ( -2.842 -2.641 -2.470) 4.599 9.564 ( 1.534 -2.871 3.133) 4.518 9.797 ( 0.909 0.367 -1.569) 1.850 10.284 ( -2.623 1.172 1.046) 3.057 10.592 ( 0.390 -0.889 -2.059) 2.276 10.800 ( -4.433 -1.748 -1.528) 5.005 10.853 ( 5.259 2.156 -0.878) 5.751 11.115 ( 4.520 -2.988 -0.857) 5.486 11.470 ( 1.757 -2.410 1.444) 3.313 11.484 ( 0.556 0.031 5.304) 5.333 11.644 ( 0.712 1.080 -5.751) 5.894 11.685 ( -5.351 1.930 -2.278) 6.128 11.957 ( 0.398 -4.354 -1.549) 4.639 12.091 ( 2.724 1.752 2.090) 3.855 12.144 ( -1.611 -3.809 0.095) 4.137 12.214 ( 8.983 3.477 7.813) 12.402 12.327 ( -0.350 3.800 -0.531) 3.852 12.816 ( -9.705 6.092 -3.902) 12.105 13.112 ( -2.652 2.843 -2.482) 4.613 14.610 ( 0.939 0.072 -0.200) 0.963 14.759 ( -2.148 -5.393 -2.428) 6.292 14.860 ( 1.231 8.311 1.367) 8.512 14.979 ( -1.552 -0.851 2.022) 2.688 15.263 ( 0.305 -0.078 -0.406) 0.514 15.354 ( 2.901 -0.781 -1.428) 3.326 15.359 ( 1.266 -5.315 4.770) 7.253 15.482 ( -1.059 3.640 -2.629) 4.613 15.644 ( -1.201 0.247 -1.374) 1.841 15.979 ( -1.263 3.027 0.616) 3.337 16.348 ( -3.934 -3.986 5.753) 8.029 16.420 ( 3.214 3.790 -5.821) 7.654 16.885 ( 2.612 -1.305 2.095) 3.593 17.117 ( 3.013 2.318 0.166) 3.805 17.383 ( -1.748 -0.062 0.307) 1.775 17.654 ( 0.893 -0.442 0.145) 1.007 25.686 ( 0.429 -2.275 -0.094) 2.317 25.715 ( -0.021 -1.082 0.800) 1.346 25.733 ( 0.212 1.983 -2.745) 3.393 25.808 ( -0.263 0.477 -0.552) 0.775 25.840 ( -0.928 0.751 0.724) 1.396 26.141 ( 0.588 -0.060 0.464) 0.751 26.476 ( 2.574 0.506 2.928) 3.931 26.521 ( -2.937 -1.038 0.794) 3.214 26.722 ( -0.075 0.019 -4.024) 4.024 27.288 ( 1.736 2.973 2.824) 4.453 27.881 ( -5.226 -0.687 -2.978) 6.054 28.241 ( -1.750 -2.400 2.620) 3.961 28.452 ( -1.208 -0.117 -2.616) 2.884 28.875 ( -2.940 -8.548 0.966) 9.091 29.204 ( 4.905 4.135 0.392) 6.427 29.408 ( 5.166 3.474 -0.049) 6.226 ======================= Grid point 258 (121/140) ======================= q-point: ( 0.11 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.128 ( -5.866 -0.000 -19.823) 20.672 1.422 ( -2.364 -0.000 -6.690) 7.096 1.694 ( -4.837 -0.000 19.325) 19.922 1.724 ( 2.925 0.000 -23.455) 23.637 1.960 ( 14.629 0.000 3.011) 14.936 2.114 ( 8.566 0.000 3.205) 9.146 2.233 ( -0.873 -0.000 -22.595) 22.611 2.454 ( -8.379 -0.000 8.270) 11.773 2.701 ( 6.588 0.000 -6.848) 9.503 3.001 ( 0.376 0.000 -9.333) 9.340 3.146 ( -4.485 -0.000 15.822) 16.446 3.210 ( -1.986 -0.000 -8.631) 8.857 3.243 ( 16.440 0.000 10.282) 19.391 3.382 ( -2.162 -0.000 5.848) 6.235 3.831 ( -4.174 -0.000 0.822) 4.254 3.898 ( -2.389 -0.000 8.958) 9.271 4.087 ( 4.325 0.000 -8.918) 9.911 4.139 ( -3.427 -0.000 5.292) 6.304 4.254 ( -7.429 -0.000 1.338) 7.549 4.366 ( -2.048 -0.000 -0.915) 2.243 4.641 ( -7.577 -0.000 -11.626) 13.877 4.729 ( 2.275 0.000 0.358) 2.303 4.904 ( 7.963 0.000 -3.941) 8.884 5.058 ( -2.737 -0.000 10.947) 11.284 5.301 ( -4.573 -0.000 -3.622) 5.833 5.391 ( 2.850 0.000 6.544) 7.137 5.472 ( 6.473 0.000 -0.116) 6.474 5.560 ( 3.441 0.000 3.985) 5.265 6.083 ( 1.647 0.000 -5.371) 5.618 6.095 ( 1.516 0.000 2.054) 2.553 6.319 ( -0.202 -0.000 1.545) 1.558 6.395 ( 5.088 0.000 -4.092) 6.529 6.769 ( 1.897 0.000 -2.201) 2.905 6.784 ( -2.929 -0.000 5.603) 6.322 6.843 ( -7.260 -0.000 2.838) 7.795 6.974 ( 3.765 0.000 -7.788) 8.650 7.188 ( 7.383 0.000 1.208) 7.481 7.234 ( 0.154 0.000 8.386) 8.387 7.766 ( -15.393 -0.000 -3.664) 15.824 7.862 ( -7.373 -0.000 -1.629) 7.550 8.471 ( -5.393 -0.000 -2.909) 6.127 8.579 ( 1.227 0.000 -0.384) 1.286 8.602 ( 1.392 0.000 4.842) 5.038 8.760 ( 6.479 0.000 7.002) 9.540 9.197 ( 1.084 0.000 0.934) 1.431 9.225 ( -0.560 -0.000 -2.928) 2.982 9.645 ( -11.215 -0.000 2.017) 11.394 9.762 ( -0.007 -0.000 -4.053) 4.053 10.298 ( -2.990 -0.000 -0.549) 3.040 10.540 ( 9.418 0.000 -3.107) 9.918 10.583 ( -0.840 -0.000 -6.614) 6.667 10.764 ( 2.641 0.000 3.797) 4.625 11.082 ( -10.743 -0.000 3.379) 11.262 11.268 ( 4.844 0.000 -8.489) 9.774 11.470 ( 0.616 0.000 -7.717) 7.741 11.660 ( 2.311 0.000 7.320) 7.677 11.890 ( -3.522 -0.000 -4.266) 5.532 11.938 ( 0.265 0.000 -0.142) 0.300 11.999 ( 2.652 0.000 2.010) 3.327 12.228 ( 8.968 0.000 8.673) 12.476 12.458 ( -9.401 -0.000 0.625) 9.421 12.568 ( -1.079 -0.000 -8.211) 8.281 13.457 ( -26.508 -0.000 9.522) 28.166 13.533 ( -0.957 -0.000 -10.360) 10.404 14.756 ( -1.744 -0.000 0.179) 1.753 14.782 ( 2.669 0.000 0.121) 2.672 14.916 ( 4.388 0.000 -1.206) 4.551 14.958 ( 2.740 0.000 2.152) 3.484 15.223 ( 9.743 0.000 -2.757) 10.125 15.246 ( -4.178 -0.000 4.143) 5.884 15.553 ( -9.277 -0.000 8.019) 12.262 15.707 ( -0.508 -0.000 -9.790) 9.803 15.801 ( -2.631 -0.000 2.414) 3.570 15.822 ( 3.950 0.000 5.001) 6.373 16.291 ( -7.873 -0.000 -4.150) 8.900 16.514 ( -9.870 -0.000 3.085) 10.341 16.834 ( 16.063 0.000 -2.385) 16.239 17.169 ( 16.241 0.000 9.725) 18.930 17.358 ( -0.007 -0.000 2.429) 2.429 17.519 ( 7.208 0.000 -3.092) 7.843 25.566 ( 0.428 0.000 -2.343) 2.382 25.594 ( 0.058 0.000 0.578) 0.581 25.773 ( -1.408 -0.000 0.860) 1.650 25.820 ( 0.663 0.000 1.595) 1.728 26.031 ( -3.785 -0.000 -1.552) 4.091 26.131 ( 2.325 0.000 -1.903) 3.004 26.396 ( 1.084 0.000 1.913) 2.199 26.404 ( 1.330 0.000 0.735) 1.520 26.975 ( -5.604 -0.000 -4.403) 7.127 27.356 ( 8.130 0.000 9.556) 12.546 27.992 ( -13.199 -0.000 8.823) 15.877 28.282 ( -1.857 -0.000 -1.866) 2.633 28.304 ( -3.388 -0.000 2.559) 4.246 28.365 ( -16.147 -0.000 -4.455) 16.750 28.891 ( 4.371 0.000 -3.948) 5.890 29.804 ( 28.332 0.000 -9.496) 29.881 ======================= Grid point 259 (122/140) ======================= q-point: ( 0.22 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.169 ( -2.307 -19.226 -12.738) 23.178 1.528 ( 1.534 -14.027 -7.072) 15.784 1.660 ( -4.760 -10.819 -23.538) 26.339 1.843 ( -0.135 -8.028 11.687) 14.180 2.127 ( 15.348 -2.016 -18.459) 24.090 2.140 ( 4.111 -1.788 11.070) 11.943 2.299 ( 5.663 -11.562 -6.743) 14.534 2.552 ( -3.359 -10.635 6.063) 12.694 2.790 ( 5.558 -7.414 -3.066) 9.760 2.940 ( -3.239 0.370 -9.615) 10.153 3.129 ( -3.220 1.378 -2.843) 4.511 3.191 ( -2.346 1.264 10.100) 10.445 3.378 ( -4.719 0.470 11.473) 12.414 3.456 ( 14.569 -6.089 -1.666) 15.878 3.784 ( -6.926 1.381 1.517) 7.223 3.952 ( -0.287 -3.248 8.247) 8.869 4.033 ( 0.716 4.176 -4.258) 6.007 4.161 ( -1.486 -1.716 -0.491) 2.323 4.225 ( -3.600 -0.165 6.326) 7.280 4.350 ( -1.815 -2.967 -4.493) 5.682 4.512 ( -7.048 1.867 -7.272) 10.298 4.737 ( 0.207 1.312 -0.371) 1.379 4.903 ( 8.110 4.658 -5.252) 10.726 5.067 ( -4.300 1.680 6.953) 8.346 5.294 ( -2.142 -3.313 -0.580) 3.987 5.489 ( 3.112 -3.429 6.245) 7.774 5.506 ( 5.397 0.210 1.935) 5.738 5.634 ( 2.858 -3.453 2.331) 5.053 6.008 ( 0.296 6.415 -3.076) 7.120 6.099 ( 2.159 2.311 2.095) 3.794 6.339 ( 4.979 4.407 -3.976) 7.747 6.365 ( 0.315 0.413 0.800) 0.954 6.639 ( -3.591 5.197 -0.751) 6.361 6.795 ( 2.307 3.835 2.905) 5.335 6.875 ( 0.071 2.559 -7.600) 8.019 6.963 ( 1.437 -5.222 3.870) 6.657 7.217 ( 1.253 2.423 4.858) 5.571 7.298 ( 1.850 -1.217 6.630) 6.990 7.646 ( -12.922 -0.865 -4.104) 13.586 7.716 ( -8.599 5.203 -2.777) 10.427 8.511 ( -7.460 -10.963 -2.155) 13.435 8.622 ( 3.619 -2.336 3.799) 5.744 8.684 ( 0.083 -5.131 2.956) 5.923 8.868 ( 6.100 -2.929 5.879) 8.964 9.197 ( -4.268 -0.745 -1.955) 4.753 9.250 ( 0.438 -2.893 1.416) 3.251 9.586 ( -6.657 -2.036 -1.980) 7.238 9.725 ( -1.532 1.587 -2.631) 3.433 10.276 ( -5.557 -1.433 0.353) 5.750 10.553 ( 3.779 -0.106 -6.904) 7.872 10.619 ( -1.537 -6.631 -8.428) 10.833 10.817 ( 2.278 -2.790 2.614) 4.451 11.016 ( 1.019 4.257 5.308) 6.880 11.268 ( 3.574 -1.319 -7.653) 8.549 11.468 ( 1.629 -2.348 -6.184) 6.812 11.696 ( 0.946 1.458 6.044) 6.288 11.826 ( -3.083 2.383 -2.215) 4.482 11.937 ( 1.805 0.107 -3.809) 4.216 12.038 ( 2.466 -0.226 5.749) 6.259 12.302 ( 7.869 4.152 7.252) 11.479 12.360 ( -5.128 3.837 -2.911) 7.035 12.492 ( -4.277 0.542 -6.246) 7.589 13.251 ( -26.807 2.292 2.743) 27.044 13.457 ( -4.057 2.707 -7.456) 8.910 14.735 ( -2.264 0.127 -2.576) 3.432 14.825 ( -0.376 -2.703 2.600) 3.770 14.886 ( 2.655 7.812 -0.594) 8.272 14.998 ( 0.371 -2.671 0.857) 2.829 15.194 ( -1.050 1.838 3.400) 4.005 15.330 ( 12.233 -0.448 1.039) 12.285 15.421 ( -5.003 8.354 3.777) 10.444 15.652 ( 0.322 3.784 -3.606) 5.237 15.719 ( -5.830 1.143 1.037) 6.031 15.983 ( 2.481 -6.164 1.933) 6.919 16.213 ( -2.991 0.464 -2.808) 4.129 16.514 ( -7.554 -4.206 2.440) 8.983 16.895 ( 14.738 5.389 -0.695) 15.708 17.285 ( -0.980 -2.802 9.268) 9.732 17.401 ( 14.109 6.186 3.957) 15.906 17.569 ( 4.712 -1.510 -1.414) 5.146 25.570 ( 0.924 -1.252 -2.098) 2.612 25.610 ( 0.215 -1.456 0.423) 1.531 25.777 ( -1.384 -1.087 0.580) 1.853 25.839 ( -0.354 -0.883 1.732) 1.976 25.967 ( -2.977 3.169 -3.203) 5.400 26.126 ( 1.180 0.611 -1.994) 2.396 26.417 ( 1.609 -1.057 2.043) 2.807 26.440 ( 1.188 -1.346 3.071) 3.557 26.867 ( -4.140 4.808 -5.310) 8.273 27.494 ( 8.997 -1.437 10.668) 14.029 27.942 ( -20.448 0.851 -0.970) 20.489 28.026 ( -17.635 -0.746 -6.214) 18.713 28.356 ( -1.509 -5.532 -2.136) 6.119 28.362 ( -7.121 -6.319 0.386) 9.528 29.053 ( 20.740 -1.371 11.287) 23.653 29.881 ( 22.932 7.983 -11.618) 26.918 ======================= Grid point 260 (123/140) ======================= q-point: ( 0.33 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.542 ( 1.424 -26.563 -2.254) 26.697 1.658 ( 4.260 -10.134 -16.938) 20.193 1.853 ( -1.797 -17.115 -9.658) 19.734 2.027 ( -1.512 -9.528 6.805) 11.806 2.183 ( 5.518 -1.414 -0.333) 5.706 2.289 ( 11.561 -7.940 -7.014) 15.682 2.533 ( 1.124 -12.720 -2.472) 13.006 2.706 ( 0.019 -4.525 -2.937) 5.394 2.859 ( -5.031 -2.435 -5.254) 7.672 2.963 ( -0.557 -7.268 3.710) 8.179 3.121 ( 0.146 -4.061 -2.823) 4.948 3.178 ( -4.182 0.252 7.960) 8.996 3.393 ( -3.214 0.024 9.523) 10.051 3.630 ( 4.782 -3.765 -5.262) 8.046 3.702 ( -5.126 1.353 0.607) 5.337 3.946 ( 3.376 4.340 -0.847) 5.563 4.076 ( -0.454 -2.953 8.785) 9.279 4.150 ( -3.525 -2.367 3.211) 5.323 4.275 ( 3.616 -2.707 0.979) 4.622 4.383 ( -4.652 -5.640 -7.694) 10.614 4.446 ( -2.120 -2.721 -3.942) 5.238 4.680 ( -0.239 3.833 -3.236) 5.021 4.833 ( 7.687 7.060 -6.282) 12.182 5.026 ( -5.140 1.897 5.559) 7.805 5.358 ( 1.154 -3.592 2.798) 4.697 5.482 ( 0.871 3.457 0.423) 3.590 5.661 ( -1.400 -8.179 5.690) 10.061 5.726 ( 4.236 -3.615 0.970) 5.653 5.881 ( 1.998 7.511 -0.548) 7.792 6.091 ( 3.437 2.548 3.795) 5.718 6.223 ( -1.770 4.507 -4.049) 6.312 6.397 ( 4.270 0.677 -0.599) 4.365 6.559 ( -2.875 2.791 -0.330) 4.020 6.754 ( 7.903 4.001 -0.817) 8.895 6.798 ( -2.912 1.529 1.064) 3.457 7.088 ( 0.501 -2.209 4.776) 5.286 7.193 ( -2.272 1.941 6.743) 7.375 7.312 ( -3.633 2.063 0.551) 4.214 7.522 ( -2.513 3.018 -0.410) 3.949 7.624 ( -7.075 -0.640 -5.488) 8.977 8.643 ( -6.994 -10.961 -0.575) 13.015 8.732 ( 2.566 -5.102 5.041) 7.618 8.797 ( -0.030 -6.895 2.078) 7.201 8.984 ( 3.033 -2.134 4.465) 5.804 9.147 ( -4.566 -0.200 -4.539) 6.441 9.303 ( -1.781 -2.867 4.286) 5.456 9.571 ( 1.161 0.685 -6.017) 6.167 9.703 ( -2.481 -3.556 -0.237) 4.342 10.265 ( -8.085 -2.723 0.961) 8.585 10.550 ( 1.607 -0.258 -7.401) 7.577 10.634 ( -7.744 -5.892 -7.564) 12.325 10.930 ( 5.597 -5.710 -0.381) 8.005 11.036 ( 12.646 3.698 4.216) 13.834 11.312 ( 3.502 -4.735 -3.603) 6.904 11.497 ( 2.318 -1.275 -1.389) 2.988 11.687 ( -1.583 1.628 2.259) 3.203 11.749 ( -2.783 3.426 0.496) 4.442 11.913 ( 1.183 1.260 -7.452) 7.650 12.090 ( -0.251 0.051 7.321) 7.326 12.231 ( 1.399 1.826 -5.901) 6.334 12.331 ( 8.855 6.970 8.733) 14.257 12.443 ( -4.245 -0.261 -1.494) 4.508 13.014 ( -23.004 3.129 -2.852) 23.391 13.295 ( -6.674 7.298 -6.531) 11.851 14.677 ( -1.323 2.667 -5.067) 5.877 14.747 ( -1.978 6.405 1.769) 6.933 14.887 ( -1.725 -3.381 3.871) 5.421 15.067 ( 0.184 -1.617 -0.571) 1.725 15.163 ( 2.354 1.912 3.852) 4.902 15.297 ( -1.465 3.320 0.257) 3.638 15.436 ( 8.426 0.221 0.397) 8.438 15.574 ( 1.413 4.252 -2.176) 4.981 15.663 ( -3.553 1.095 -0.209) 3.724 16.049 ( -1.987 -0.771 1.534) 2.626 16.224 ( -1.106 -3.159 1.592) 3.706 16.513 ( -3.169 -0.046 -1.228) 3.399 16.917 ( 12.191 4.004 2.280) 13.033 17.340 ( -0.599 0.563 -0.827) 1.166 17.377 ( 7.797 8.152 9.745) 14.907 17.617 ( 1.842 -1.556 -0.357) 2.437 25.602 ( 1.345 -2.361 -1.411) 3.062 25.646 ( 0.291 -2.197 0.547) 2.283 25.782 ( -1.278 -0.421 -0.728) 1.530 25.852 ( -1.525 -0.268 1.200) 1.959 25.871 ( -0.545 3.655 -3.094) 4.820 26.121 ( -0.049 -0.544 -1.555) 1.648 26.459 ( -0.716 -1.641 0.932) 2.019 26.490 ( 1.207 -1.191 4.303) 4.625 26.746 ( -1.354 2.920 -5.087) 6.020 27.511 ( -1.648 9.264 -0.973) 9.460 27.768 ( -12.027 -7.344 -3.427) 14.503 28.058 ( -5.559 -6.655 6.225) 10.675 28.383 ( -3.963 -3.764 -2.831) 6.155 28.486 ( -2.759 -10.314 1.312) 10.757 29.261 ( 13.693 1.029 13.480) 19.243 29.796 ( 16.910 13.314 -11.144) 24.236 ======================= Grid point 261 (124/140) ======================= q-point: ( 0.44 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.779 ( 5.879 -7.469 -9.119) 13.173 1.960 ( 4.829 -15.344 -3.507) 16.464 2.026 ( -5.904 -15.411 -0.430) 16.509 2.184 ( 0.529 -5.941 0.125) 5.966 2.240 ( 0.927 -3.430 -3.998) 5.349 2.498 ( 10.221 -7.458 -0.431) 12.660 2.647 ( -5.204 -2.068 -1.498) 5.797 2.701 ( -0.153 -3.875 -2.397) 4.560 2.883 ( -2.849 -3.702 1.305) 4.851 3.070 ( -0.729 -1.585 2.558) 3.096 3.132 ( -3.077 -5.092 -3.515) 6.910 3.254 ( 2.366 0.969 7.554) 7.975 3.445 ( -4.410 -7.206 1.807) 8.639 3.552 ( -6.472 2.448 -0.347) 6.928 3.697 ( 2.907 3.852 3.512) 5.968 3.956 ( 5.294 -0.094 -4.796) 7.144 4.077 ( -3.802 0.314 8.474) 9.293 4.239 ( -2.454 -3.508 0.646) 4.330 4.349 ( 1.715 -4.096 -10.603) 11.495 4.417 ( -4.722 0.938 -2.993) 5.668 4.468 ( -0.481 -9.389 1.067) 9.461 4.639 ( 6.399 1.119 -2.269) 6.881 4.776 ( 7.859 1.027 -8.475) 11.604 4.969 ( -6.564 3.246 6.061) 9.506 5.387 ( -2.632 2.556 0.688) 3.733 5.458 ( 3.093 0.618 4.493) 5.490 5.730 ( -5.314 -3.180 -0.723) 6.235 5.818 ( 5.599 3.230 2.346) 6.877 5.858 ( 2.959 -5.876 0.200) 6.582 6.104 ( 3.373 1.698 2.983) 4.812 6.151 ( -0.023 1.719 0.132) 1.725 6.424 ( 2.423 -0.862 -0.194) 2.579 6.481 ( -1.487 2.421 -1.165) 3.071 6.750 ( -4.101 1.017 0.451) 4.249 6.810 ( 8.021 0.119 3.826) 8.887 7.012 ( -3.984 8.906 5.477) 11.189 7.221 ( -3.100 1.738 0.380) 3.574 7.261 ( -3.092 -5.276 2.262) 6.520 7.477 ( 0.622 4.609 -4.473) 6.452 7.555 ( -4.629 -1.562 -4.076) 6.363 8.732 ( -6.417 -5.360 3.385) 9.021 8.849 ( 3.434 -2.268 1.040) 4.244 8.921 ( 1.734 -5.259 0.781) 5.592 9.011 ( -0.008 -0.488 3.148) 3.185 9.115 ( -2.938 -1.607 -2.773) 4.348 9.384 ( 0.549 -5.390 2.012) 5.779 9.560 ( 2.528 -0.762 0.029) 2.641 9.770 ( 0.036 -3.951 -0.878) 4.047 10.240 ( -6.297 -1.833 -2.995) 7.210 10.520 ( -7.562 -3.360 -3.618) 9.031 10.667 ( 1.223 -3.885 -3.706) 5.506 11.033 ( 8.756 2.146 0.143) 9.016 11.090 ( 7.034 -0.852 -1.261) 7.197 11.430 ( 4.904 -5.219 -2.835) 7.702 11.541 ( 3.321 0.367 6.801) 7.578 11.634 ( -3.744 1.394 -2.173) 4.547 11.681 ( -2.734 2.604 1.898) 4.226 11.871 ( -0.216 -1.608 -6.124) 6.335 12.083 ( -2.326 0.395 0.376) 2.389 12.241 ( 5.155 3.680 0.452) 6.350 12.326 ( 2.413 3.111 6.077) 7.241 12.414 ( 2.743 2.701 3.151) 4.975 12.771 ( -16.185 3.758 -6.322) 17.778 13.099 ( -7.507 4.110 -4.866) 9.845 14.628 ( 1.141 0.370 -1.289) 1.761 14.670 ( -2.807 0.779 -1.841) 3.446 14.936 ( -5.013 -2.377 4.646) 7.236 14.995 ( 0.408 5.980 -1.561) 6.194 15.257 ( 3.261 -1.361 -2.432) 4.290 15.276 ( 0.263 -4.634 5.510) 7.204 15.447 ( 5.301 3.758 -1.264) 6.619 15.508 ( 0.062 2.965 -4.067) 5.033 15.643 ( 0.910 0.525 1.199) 1.594 16.008 ( -5.653 2.687 2.125) 6.610 16.288 ( -1.797 -3.578 5.431) 6.747 16.469 ( 1.654 2.352 -4.880) 5.664 16.963 ( 10.026 2.954 1.161) 10.517 17.238 ( 2.255 8.958 0.446) 9.248 17.384 ( -1.024 0.529 5.387) 5.509 17.643 ( -0.153 -1.049 -0.672) 1.255 25.649 ( 1.169 -2.608 -0.531) 2.907 25.690 ( 0.332 -2.286 0.733) 2.424 25.757 ( -0.014 1.557 -1.888) 2.447 25.814 ( -0.108 1.175 -0.858) 1.459 25.850 ( -1.193 0.620 1.199) 1.801 26.121 ( -1.446 -1.014 -2.275) 2.880 26.454 ( -3.446 -0.649 -2.351) 4.222 26.535 ( 1.831 -0.655 2.210) 2.944 26.715 ( 1.009 0.062 1.194) 1.565 27.317 ( -7.874 4.041 -8.198) 12.064 27.844 ( 2.674 -3.039 5.847) 7.111 28.171 ( -1.840 -6.154 4.316) 7.738 28.403 ( -2.174 -2.835 -0.964) 3.700 28.656 ( -4.411 -12.126 1.316) 12.970 29.343 ( 6.328 4.826 8.148) 11.390 29.616 ( 10.437 14.190 -8.980) 19.772 ======================= Grid point 262 (125/140) ======================= q-point: ( 0.56 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.854 ( 4.363 0.343 -2.396) 4.989 2.098 ( -0.303 -6.445 -4.175) 7.685 2.177 ( -7.315 -0.951 -1.345) 7.499 2.232 ( -1.358 -2.419 -4.983) 5.703 2.334 ( 2.750 -9.133 1.095) 9.600 2.583 ( 1.721 2.053 5.662) 6.264 2.697 ( 0.806 -4.019 0.494) 4.129 2.804 ( 2.238 -7.173 5.123) 9.094 2.924 ( -2.966 -0.828 1.278) 3.334 3.036 ( 0.651 3.084 1.033) 3.317 3.148 ( 0.863 2.651 -0.232) 2.798 3.308 ( -1.337 -7.050 -0.956) 7.239 3.482 ( 0.658 -2.909 -3.650) 4.714 3.573 ( 0.802 -0.266 3.899) 3.989 3.654 ( 2.137 4.478 1.591) 5.211 3.948 ( -1.730 0.768 1.380) 2.343 4.097 ( 0.891 -0.875 -3.284) 3.514 4.230 ( -5.349 -0.808 1.346) 5.575 4.312 ( -2.977 1.171 -4.992) 5.929 4.369 ( -5.605 -3.327 -6.196) 8.993 4.611 ( 3.196 -1.495 2.686) 4.434 4.675 ( 4.558 0.357 0.478) 4.596 4.849 ( 3.497 -4.727 -7.604) 9.612 4.891 ( -0.997 1.547 4.287) 4.665 5.333 ( -2.434 1.693 3.572) 4.642 5.476 ( 2.210 2.567 3.711) 5.025 5.715 ( -4.197 -1.077 -2.575) 5.041 5.844 ( 5.469 0.778 0.945) 5.604 5.931 ( 0.089 -1.959 -3.577) 4.079 6.077 ( -0.950 3.578 2.084) 4.248 6.187 ( 6.664 -0.276 3.176) 7.387 6.374 ( -6.404 1.863 0.421) 6.683 6.535 ( 7.878 -2.863 -0.718) 8.412 6.699 ( -4.837 0.568 -0.324) 4.882 6.863 ( -3.715 5.038 2.180) 6.628 6.888 ( 5.891 1.486 4.345) 7.469 7.171 ( -5.997 -0.444 -0.230) 6.017 7.330 ( -1.264 3.013 -6.976) 7.703 7.372 ( -0.591 -2.960 3.096) 4.324 7.544 ( -2.518 -2.139 -5.003) 5.995 8.778 ( -5.751 -3.326 6.973) 9.631 8.875 ( 2.519 -0.484 -3.927) 4.690 8.934 ( 4.977 2.993 -2.605) 6.364 9.097 ( 3.043 -2.183 2.753) 4.648 9.150 ( 0.070 -3.893 2.497) 4.625 9.485 ( 2.152 -3.834 1.775) 4.742 9.601 ( 2.007 0.496 -0.143) 2.072 9.791 ( -1.971 0.234 1.674) 2.596 10.235 ( 0.744 -3.940 -6.713) 7.819 10.521 ( -11.074 -5.369 2.714) 12.602 10.726 ( 4.238 -2.042 -2.979) 5.568 11.026 ( 9.443 6.678 4.392) 12.371 11.111 ( -3.300 0.541 -2.424) 4.130 11.460 ( 2.066 0.898 -8.211) 8.515 11.530 ( 1.757 4.772 1.343) 5.259 11.631 ( -3.558 -2.006 5.569) 6.907 11.707 ( 4.403 -2.604 6.774) 8.488 11.906 ( -3.158 -5.666 -5.868) 8.747 12.061 ( -3.392 -1.603 -4.308) 5.713 12.163 ( 1.905 8.680 1.721) 9.052 12.281 ( -5.464 -0.020 -0.070) 5.465 12.316 ( -0.638 12.814 -0.306) 12.833 12.751 ( 3.854 -9.507 1.965) 10.445 13.046 ( -3.404 -4.721 -1.382) 5.982 14.617 ( -1.114 1.231 1.530) 2.258 14.701 ( -0.599 -6.427 -3.344) 7.270 14.876 ( -0.693 4.756 0.408) 4.824 14.963 ( -2.332 -1.062 0.726) 2.664 15.261 ( 0.782 0.744 0.433) 1.162 15.405 ( -0.816 -2.175 1.458) 2.743 15.409 ( 4.396 4.510 -3.227) 7.077 15.437 ( 1.059 0.073 -1.638) 1.952 15.660 ( 2.062 -0.231 2.385) 3.161 15.937 ( -5.175 0.149 1.286) 5.335 16.362 ( -2.333 -3.277 6.821) 7.919 16.420 ( 4.325 3.024 -6.225) 8.161 16.950 ( 5.172 5.757 -2.040) 8.004 17.117 ( -2.944 5.175 0.572) 5.981 17.403 ( 1.740 -0.174 3.464) 3.880 17.642 ( -1.860 -0.266 -1.009) 2.132 25.698 ( 0.732 -1.988 0.973) 2.331 25.724 ( -0.011 1.681 0.117) 1.685 25.729 ( 0.901 -0.989 0.650) 1.487 25.802 ( -0.375 -0.084 0.022) 0.384 25.840 ( 0.387 0.152 0.413) 0.586 26.105 ( -3.108 -1.092 -4.101) 5.260 26.430 ( -1.937 -0.593 -2.198) 2.989 26.552 ( 1.334 0.372 -2.178) 2.582 26.750 ( 1.299 -0.490 7.462) 7.591 27.194 ( -6.468 -0.604 -8.786) 10.927 27.956 ( 7.961 -1.501 7.647) 11.140 28.247 ( 1.058 -1.963 -1.149) 2.509 28.448 ( 0.079 -3.035 4.107) 5.107 28.816 ( -6.053 -10.581 1.005) 12.232 29.272 ( 3.027 10.226 0.951) 10.707 29.433 ( 1.722 8.793 -5.001) 10.261 ======================= Grid point 263 (126/140) ======================= q-point: (-0.33 0.11 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.819 ( 1.856 5.128 -1.542) 5.668 2.025 ( -7.211 7.457 -4.336) 11.243 2.166 ( -5.672 -1.735 6.125) 8.526 2.199 ( 1.680 3.166 -5.734) 6.762 2.444 ( 3.049 1.557 0.706) 3.496 2.591 ( -3.035 1.184 5.820) 6.670 2.736 ( -0.110 1.310 6.108) 6.248 2.857 ( 1.452 3.871 4.241) 5.923 2.955 ( 7.045 -1.995 1.938) 7.574 3.059 ( 0.500 -2.645 3.125) 4.125 3.120 ( 0.880 0.898 -1.694) 2.109 3.405 ( -2.114 -3.381 -9.215) 10.041 3.475 ( 5.955 6.112 4.289) 9.551 3.570 ( 3.748 -0.719 -2.935) 4.814 3.647 ( 1.212 -1.921 0.592) 2.348 3.887 ( -9.939 3.094 -1.001) 10.457 4.104 ( 6.158 -0.171 -4.583) 7.679 4.209 ( -4.411 2.705 0.149) 5.177 4.251 ( -3.488 -0.677 -0.962) 3.681 4.364 ( -5.359 -4.611 -4.416) 8.335 4.619 ( -2.846 3.227 6.798) 8.046 4.680 ( 3.369 1.764 -1.042) 3.943 4.826 ( 0.177 1.208 7.520) 7.619 4.990 ( 4.428 -5.314 -9.040) 11.383 5.326 ( -1.761 0.574 6.017) 6.295 5.440 ( 1.683 4.234 -2.096) 5.015 5.714 ( -0.771 -2.645 1.565) 3.168 5.856 ( 3.450 3.056 0.147) 4.611 5.900 ( -0.507 2.036 -5.646) 6.023 5.987 ( -3.973 5.171 -1.490) 6.689 6.240 ( 2.418 0.624 4.505) 5.151 6.337 ( 0.048 -0.381 -0.516) 0.643 6.620 ( 3.643 0.146 4.346) 5.673 6.667 ( 0.892 1.156 0.230) 1.478 6.782 ( -1.772 0.113 -4.180) 4.541 6.929 ( -1.053 -0.639 2.710) 2.977 7.127 ( -4.766 -0.242 -2.251) 5.276 7.233 ( -1.752 0.455 -6.957) 7.189 7.473 ( 2.246 -4.624 1.273) 5.296 7.560 ( -2.268 -4.854 -1.150) 5.480 8.815 ( -1.952 0.279 6.319) 6.620 8.889 ( 1.150 -2.395 -5.572) 6.173 8.947 ( 7.510 0.703 0.783) 7.584 9.096 ( -0.630 3.652 0.042) 3.706 9.222 ( 4.566 0.552 3.594) 5.837 9.481 ( -4.112 5.930 -5.334) 8.973 9.599 ( 6.815 0.057 4.360) 8.090 9.787 ( -3.000 -0.651 1.764) 3.540 10.311 ( 7.187 -4.485 -6.706) 10.804 10.541 ( -12.432 -4.781 6.085) 14.643 10.758 ( 3.743 0.750 -1.155) 3.988 11.006 ( -8.116 4.503 0.496) 9.295 11.030 ( 10.796 4.899 4.286) 12.607 11.410 ( -4.427 3.162 -2.037) 5.810 11.474 ( 4.129 1.225 -1.479) 4.554 11.665 ( -3.102 -1.202 4.541) 5.629 11.798 ( 2.586 -0.903 0.633) 2.811 11.908 ( -7.915 -1.784 -7.064) 10.758 12.013 ( -0.974 3.117 3.979) 5.147 12.053 ( -0.820 2.604 -3.251) 4.245 12.154 ( 1.133 3.072 -1.264) 3.509 12.301 ( -3.078 -6.182 -1.705) 7.113 13.018 ( 10.258 -12.440 2.545) 16.323 13.164 ( 0.052 -9.463 2.805) 9.870 14.608 ( -0.287 -0.125 1.919) 1.944 14.733 ( -4.133 -0.705 -2.484) 4.874 14.890 ( 3.822 -4.289 1.545) 5.949 14.973 ( 0.392 -1.793 -1.973) 2.695 15.230 ( -3.317 3.154 1.445) 4.800 15.287 ( -1.577 5.958 -5.020) 7.948 15.382 ( 3.166 2.991 1.167) 4.509 15.485 ( -1.713 -0.811 -0.317) 1.922 15.731 ( 6.269 -3.353 3.188) 7.792 15.957 ( -3.940 -5.537 0.123) 6.797 16.370 ( 5.515 3.464 -5.086) 8.264 16.426 ( -3.867 -2.810 6.005) 7.675 16.853 ( 3.560 6.597 -4.767) 8.884 17.027 ( -8.150 1.182 0.661) 8.262 17.442 ( 4.173 0.318 2.093) 4.679 17.614 ( -3.364 0.619 -1.184) 3.620 25.683 ( -0.178 2.501 0.415) 2.541 25.704 ( -0.666 1.814 -0.448) 1.984 25.780 ( 1.188 -2.339 4.015) 4.796 25.822 ( 0.592 -2.061 0.400) 2.181 25.856 ( 1.883 -0.601 0.881) 2.164 26.077 ( -4.051 -1.714 -5.192) 6.806 26.418 ( -0.046 0.419 -0.970) 1.058 26.519 ( -0.525 1.918 -4.509) 4.928 26.823 ( 2.809 -1.243 10.107) 10.564 27.144 ( -5.825 -3.926 -9.054) 11.459 28.083 ( 9.503 -1.166 6.095) 11.350 28.247 ( 2.138 1.542 -3.402) 4.304 28.552 ( 6.834 -3.376 6.635) 10.106 28.881 ( -3.025 0.996 1.043) 3.351 29.128 ( -3.438 5.269 -0.116) 6.292 29.281 ( -7.113 3.925 -5.253) 9.675 ======================= Grid point 264 (127/140) ======================= q-point: (-0.22 0.11 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.712 ( 4.208 8.217 -4.973) 10.486 1.794 ( -10.811 10.318 3.542) 15.359 2.100 ( 5.519 8.592 -5.107) 11.418 2.141 ( -6.221 4.190 7.073) 10.309 2.346 ( 5.208 11.859 0.558) 12.964 2.469 ( -8.045 8.888 -0.306) 11.992 2.750 ( 3.759 4.902 12.736) 14.155 2.872 ( -0.095 -0.405 -4.582) 4.601 3.034 ( 7.621 1.165 5.187) 9.292 3.086 ( 0.254 1.640 5.628) 5.868 3.114 ( 2.913 1.427 -0.549) 3.290 3.281 ( -0.466 5.264 -7.518) 9.189 3.427 ( 0.770 9.353 -0.085) 9.385 3.520 ( -5.533 8.347 -5.421) 11.387 3.748 ( 2.732 -4.669 -1.894) 5.732 3.786 ( -3.474 -6.325 0.256) 7.220 4.089 ( 4.885 4.899 -7.452) 10.168 4.118 ( -7.321 1.835 6.656) 10.063 4.276 ( 5.303 -1.390 -2.022) 5.843 4.380 ( -6.422 -3.460 -2.545) 7.726 4.587 ( -1.700 1.684 9.635) 9.928 4.650 ( 0.463 0.662 -4.781) 4.848 4.907 ( 3.840 -2.122 10.240) 11.140 5.028 ( 0.990 -2.365 -8.617) 8.990 5.324 ( -1.272 1.324 3.122) 3.621 5.362 ( -0.376 2.792 -4.358) 5.189 5.764 ( 0.711 8.491 2.666) 8.928 5.799 ( 0.392 0.881 -0.426) 1.054 5.823 ( 1.490 1.629 0.199) 2.217 5.899 ( -3.581 -2.838 -5.163) 6.894 6.274 ( 1.259 -0.648 4.624) 4.836 6.335 ( -0.751 -0.361 -3.004) 3.117 6.646 ( 0.179 0.418 4.841) 4.862 6.661 ( 2.205 1.774 3.533) 4.527 6.799 ( 3.774 -3.455 -5.686) 7.649 6.900 ( -8.643 -1.412 -2.413) 9.084 7.130 ( 1.558 -1.681 0.910) 2.466 7.200 ( -2.561 -1.318 -5.546) 6.249 7.589 ( 5.642 -6.097 -0.557) 8.325 7.648 ( -3.101 -7.030 1.608) 7.850 8.785 ( 3.044 6.440 3.667) 8.012 8.873 ( -1.784 3.797 -5.175) 6.662 8.966 ( 2.350 5.906 2.864) 6.972 9.012 ( 1.588 4.174 -0.888) 4.553 9.248 ( 2.288 0.416 2.079) 3.119 9.313 ( -3.161 4.922 -3.394) 6.763 9.682 ( 5.750 -0.925 3.298) 6.693 9.766 ( -2.642 0.738 -0.508) 2.790 10.398 ( 10.673 -1.072 -6.649) 12.620 10.529 ( -13.555 -1.495 7.054) 15.353 10.750 ( 2.672 3.103 1.951) 4.536 10.858 ( -6.898 4.792 -2.413) 8.739 11.090 ( 13.223 1.879 3.562) 13.822 11.288 ( -9.025 3.121 -0.484) 9.562 11.528 ( 4.318 -1.434 4.180) 6.178 11.648 ( -4.471 0.812 -1.454) 4.771 11.805 ( 1.695 -0.768 0.794) 2.023 11.866 ( -3.750 -5.087 -7.828) 10.060 11.977 ( -2.770 2.797 3.959) 5.583 11.990 ( -1.359 1.713 -3.229) 3.900 12.257 ( 4.927 -7.589 5.610) 10.646 12.378 ( -2.854 -7.105 -4.974) 9.131 13.304 ( 9.916 -11.201 -1.435) 15.029 13.352 ( -0.796 -10.231 5.133) 11.474 14.651 ( 1.308 -3.624 2.268) 4.471 14.711 ( -3.310 -2.124 -1.738) 4.300 14.992 ( 5.819 -1.360 -0.248) 5.981 15.013 ( 1.828 -2.643 -0.745) 3.299 15.108 ( -2.725 6.462 0.040) 7.013 15.177 ( -7.425 2.877 -2.661) 8.396 15.381 ( 3.429 0.738 2.206) 4.144 15.453 ( -3.098 0.205 -1.985) 3.685 15.876 ( 9.970 -3.824 1.579) 10.795 16.009 ( -6.018 -3.631 0.642) 7.058 16.350 ( 6.505 1.756 -1.166) 6.838 16.456 ( -7.797 -3.718 1.795) 8.823 16.781 ( 8.986 4.353 -4.209) 10.835 16.941 ( -13.067 0.105 0.453) 13.075 17.470 ( 5.046 1.598 1.262) 5.442 17.559 ( -4.675 1.563 -1.042) 5.038 25.644 ( 0.131 2.414 0.794) 2.544 25.659 ( -0.807 2.250 -0.644) 2.476 25.824 ( 0.594 -0.433 1.880) 2.018 25.846 ( 0.091 -0.335 -1.708) 1.743 25.932 ( 3.808 -3.500 6.056) 7.964 26.054 ( -4.204 -2.478 -4.946) 6.948 26.401 ( 0.858 1.578 -0.296) 1.821 26.445 ( -1.794 2.927 -3.711) 5.055 26.935 ( 5.432 -2.571 10.199) 11.838 27.128 ( -6.956 -4.857 -9.657) 12.854 28.176 ( 7.469 0.072 -0.898) 7.523 28.216 ( 0.221 1.961 1.244) 2.333 28.727 ( 15.032 -1.766 1.299) 15.191 28.761 ( 2.405 11.944 3.503) 12.678 28.987 ( -3.698 6.677 1.380) 7.757 29.206 ( -18.661 -8.772 -3.718) 20.952 ======================= Grid point 265 (128/140) ======================= q-point: (-0.11 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.583 ( 7.209 9.018 -7.175) 13.593 1.583 ( -7.209 9.018 7.175) 13.593 1.969 ( 7.747 10.926 -9.531) 16.439 1.969 ( -7.747 10.926 9.531) 16.439 2.207 ( -8.112 12.774 -5.474) 16.092 2.207 ( 8.112 12.774 5.474) 16.092 2.725 ( -1.818 9.803 -15.614) 18.526 2.725 ( 1.818 9.803 15.614) 18.526 3.037 ( -4.902 6.467 -7.489) 11.042 3.037 ( 4.902 6.467 7.489) 11.042 3.145 ( -1.644 4.700 -14.329) 15.169 3.145 ( 1.644 4.700 14.329) 15.169 3.297 ( 2.373 3.207 -5.709) 6.964 3.297 ( -2.373 3.207 5.709) 6.964 3.852 ( -1.411 -2.672 -1.293) 3.287 3.852 ( 1.411 -2.672 1.293) 3.287 4.077 ( -4.367 -1.355 -1.044) 4.690 4.077 ( 4.367 -1.355 1.044) 4.690 4.332 ( -3.595 0.344 -4.752) 5.968 4.332 ( 3.595 0.344 4.752) 5.968 4.642 ( -2.025 -2.858 -5.025) 6.125 4.642 ( 2.025 -2.858 5.025) 6.125 5.002 ( -2.884 0.325 -8.542) 9.021 5.002 ( 2.884 0.325 8.542) 9.021 5.318 ( 5.519 -0.585 -4.930) 7.424 5.318 ( -5.519 -0.585 4.930) 7.424 5.635 ( -0.651 9.341 -6.815) 11.581 5.635 ( 0.651 9.341 6.815) 11.581 5.944 ( 0.475 -6.378 -5.198) 8.241 5.944 ( -0.475 -6.378 5.198) 8.241 6.322 ( -1.010 -1.159 -3.959) 4.247 6.322 ( 1.010 -1.159 3.959) 4.247 6.674 ( -0.708 -1.990 -0.964) 2.322 6.674 ( 0.708 -1.990 0.964) 2.322 6.879 ( 2.555 -3.280 -6.850) 8.013 6.879 ( -2.555 -3.280 6.850) 8.013 7.174 ( -1.185 -0.269 -3.756) 3.948 7.174 ( 1.185 -0.269 3.756) 3.948 7.744 ( -1.027 -7.262 -2.066) 7.620 7.744 ( 1.027 -7.262 2.066) 7.620 8.699 ( -3.557 8.581 -3.540) 9.941 8.699 ( 3.557 8.581 3.540) 9.941 8.873 ( -1.402 9.659 -4.830) 10.890 8.873 ( 1.402 9.659 4.830) 10.890 9.265 ( 3.504 0.434 -4.240) 5.517 9.265 ( -3.504 0.434 4.240) 5.517 9.735 ( -1.745 -0.399 -2.491) 3.067 9.735 ( 1.745 -0.399 2.491) 3.067 10.448 ( 7.947 2.010 -9.883) 12.840 10.448 ( -7.947 2.010 9.883) 12.840 10.732 ( -3.715 3.402 -3.852) 6.341 10.732 ( 3.715 3.402 3.852) 6.341 11.186 ( -6.586 -0.502 -2.314) 6.999 11.186 ( 6.586 -0.502 2.314) 6.999 11.588 ( -0.207 0.694 -7.343) 7.379 11.588 ( 0.207 0.694 7.343) 7.379 11.894 ( -1.424 -4.156 -6.422) 7.781 11.894 ( 1.424 -4.156 6.422) 7.781 11.958 ( -0.808 -0.835 -3.898) 4.067 11.958 ( 0.808 -0.835 3.898) 4.067 12.444 ( -0.428 -6.718 -7.662) 10.199 12.444 ( 0.428 -6.718 7.662) 10.199 13.506 ( 6.361 -7.247 -9.847) 13.782 13.506 ( -6.361 -7.247 9.847) 13.782 14.740 ( 0.457 -3.314 -1.663) 3.736 14.740 ( -0.457 -3.314 1.663) 3.736 15.024 ( -7.283 5.072 -2.392) 9.192 15.024 ( 7.283 5.072 2.392) 9.192 15.055 ( 1.030 -2.725 -3.471) 4.532 15.055 ( -1.030 -2.725 3.471) 4.532 15.448 ( -3.824 -4.205 -2.265) 6.119 15.448 ( 3.824 -4.205 2.265) 6.119 15.973 ( 1.132 1.749 -6.022) 6.372 15.973 ( -1.132 1.749 6.022) 6.372 16.438 ( -11.911 -3.471 -3.708) 12.949 16.438 ( 11.911 -3.471 3.708) 12.949 16.819 ( -8.109 1.313 -3.940) 9.110 16.819 ( 8.109 1.313 3.940) 9.110 17.482 ( 0.360 2.310 -4.917) 5.445 17.482 ( -0.360 2.310 4.917) 5.445 25.616 ( -0.087 1.773 -1.427) 2.277 25.616 ( 0.087 1.773 1.427) 2.277 25.829 ( -0.620 1.138 -1.168) 1.744 25.829 ( 0.620 1.138 1.168) 1.744 26.047 ( -0.845 -2.914 -6.301) 6.993 26.047 ( 0.845 -2.914 6.301) 6.993 26.382 ( 0.025 1.351 -1.288) 1.867 26.382 ( -0.025 1.351 1.288) 1.867 27.088 ( -7.870 -3.225 -10.601) 13.591 27.088 ( 7.870 -3.225 10.601) 13.591 28.194 ( 6.167 1.113 -5.050) 8.048 28.194 ( -6.167 1.113 5.050) 8.048 28.598 ( -5.312 12.631 -4.629) 14.463 28.598 ( 5.312 12.631 4.629) 14.463 29.167 ( -25.615 -8.554 -5.299) 27.521 29.167 ( 25.615 -8.554 5.299) 27.521 ======================= Grid point 269 (129/140) ======================= q-point: ( 0.22 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.909 ( 0.641 0.000 -13.599) 13.614 1.271 ( -5.366 -0.000 -8.747) 10.262 1.422 ( 0.919 0.000 -30.637) 30.650 1.863 ( 4.993 0.000 11.336) 12.387 2.166 ( 0.156 0.000 -4.593) 4.596 2.182 ( 10.122 0.000 -2.499) 10.426 2.239 ( 13.847 0.000 -6.360) 15.237 2.488 ( -1.186 -0.000 14.309) 14.359 2.770 ( 12.678 0.000 -8.381) 15.198 2.849 ( -7.005 -0.000 -11.462) 13.433 3.092 ( -3.598 -0.000 -4.197) 5.528 3.270 ( -0.973 -0.000 15.703) 15.733 3.353 ( -7.570 -0.000 4.165) 8.640 3.522 ( 12.198 0.000 1.099) 12.248 3.746 ( -8.207 -0.000 0.725) 8.239 3.937 ( -2.910 -0.000 4.021) 4.963 4.079 ( -0.092 -0.000 -0.244) 0.261 4.089 ( -3.053 -0.000 -1.969) 3.633 4.237 ( -1.982 -0.000 7.994) 8.236 4.271 ( 0.435 0.000 -14.051) 14.057 4.464 ( -5.919 -0.000 0.672) 5.957 4.774 ( 0.469 0.000 3.468) 3.499 4.964 ( 5.705 0.000 -6.080) 8.338 5.080 ( -5.862 -0.000 5.960) 8.359 5.249 ( -0.171 -0.000 2.728) 2.733 5.535 ( 3.473 0.000 7.282) 8.068 5.535 ( 1.997 0.000 -1.087) 2.274 5.650 ( 7.473 0.000 -1.381) 7.600 6.051 ( 0.418 0.000 -2.360) 2.397 6.136 ( 0.292 0.000 3.666) 3.678 6.396 ( 5.867 0.000 2.502) 6.379 6.421 ( 4.085 0.000 -4.619) 6.167 6.715 ( -6.681 -0.000 2.591) 7.166 6.745 ( -1.387 -0.000 -3.815) 4.059 6.870 ( 2.792 0.000 4.156) 5.007 6.985 ( 6.273 0.000 -5.375) 8.261 7.292 ( -4.558 -0.000 9.614) 10.640 7.329 ( 7.149 0.000 1.462) 7.297 7.435 ( -18.477 -0.000 -5.661) 19.325 7.705 ( -9.183 -0.000 -2.663) 9.561 8.326 ( -7.618 -0.000 -2.194) 7.927 8.662 ( 4.923 0.000 5.391) 7.301 8.683 ( 2.087 0.000 5.117) 5.527 8.932 ( 8.507 0.000 3.223) 9.097 9.131 ( -9.327 -0.000 1.699) 9.481 9.233 ( 1.820 0.000 -0.169) 1.828 9.499 ( -9.342 -0.000 1.660) 9.488 9.722 ( 1.473 0.000 -4.967) 5.180 10.208 ( -7.134 -0.000 -4.085) 8.221 10.451 ( -9.961 -0.000 -13.630) 16.882 10.566 ( 7.307 0.000 -5.659) 9.242 10.816 ( 0.934 0.000 2.865) 3.013 11.129 ( 7.945 0.000 9.310) 12.240 11.241 ( 3.878 0.000 -9.286) 10.063 11.429 ( 2.303 0.000 -5.060) 5.560 11.747 ( -0.078 -0.000 5.098) 5.099 11.812 ( -2.298 -0.000 -2.372) 3.302 11.935 ( 2.221 0.000 -4.554) 5.067 12.081 ( 1.570 0.000 7.468) 7.631 12.323 ( -8.108 -0.000 -0.177) 8.110 12.345 ( -5.867 -0.000 -11.647) 13.042 12.489 ( 8.384 0.000 2.135) 8.651 13.065 ( -28.240 -0.000 3.743) 28.487 13.425 ( -1.884 -0.000 -7.211) 7.453 14.705 ( -3.143 -0.000 -0.889) 3.267 14.818 ( 0.626 0.000 1.878) 1.980 14.989 ( 6.608 0.000 -2.438) 7.044 15.001 ( 1.875 0.000 1.633) 2.486 15.160 ( -10.127 -0.000 3.149) 10.605 15.421 ( 10.922 0.000 1.982) 11.100 15.538 ( -6.068 -0.000 -8.067) 10.094 15.548 ( -1.725 -0.000 7.556) 7.751 15.792 ( -0.939 -0.000 1.683) 1.927 15.959 ( 5.648 0.000 4.578) 7.270 16.201 ( 0.001 0.000 -3.465) 3.465 16.426 ( -5.469 -0.000 2.465) 5.999 17.060 ( 16.626 0.000 -3.848) 17.065 17.251 ( -5.335 -0.000 8.179) 9.765 17.578 ( 4.082 0.000 -3.063) 5.103 17.630 ( 10.231 0.000 14.438) 17.695 25.557 ( 1.410 0.000 -2.210) 2.622 25.599 ( 0.141 0.000 0.234) 0.273 25.760 ( -1.353 -0.000 0.604) 1.481 25.833 ( -1.055 -0.000 1.364) 1.724 25.960 ( -3.278 -0.000 -1.054) 3.444 26.131 ( 0.273 0.000 -2.276) 2.293 26.425 ( 0.300 0.000 0.384) 0.488 26.437 ( 1.373 0.000 1.027) 1.715 26.885 ( -3.093 -0.000 -0.396) 3.118 27.498 ( -6.572 -0.000 -4.960) 8.234 27.741 ( -13.605 -0.000 -15.417) 20.562 27.928 ( -8.384 -0.000 11.377) 14.132 28.279 ( -3.013 -0.000 2.540) 3.941 28.309 ( 0.326 0.000 -0.976) 1.029 29.298 ( 20.226 0.000 22.133) 29.982 30.048 ( 20.097 0.000 -15.751) 25.533 ======================= Grid point 270 (130/140) ======================= q-point: ( 0.33 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.079 ( 1.138 -23.020 -4.397) 23.464 1.397 ( 5.962 -12.828 -20.278) 24.724 1.450 ( 1.283 -19.750 -10.234) 22.281 2.001 ( 4.956 -5.137 7.676) 10.482 2.185 ( 1.691 -4.944 -4.583) 6.950 2.278 ( 7.727 1.953 4.122) 8.973 2.304 ( 2.981 -9.130 -7.962) 12.476 2.637 ( 4.150 -6.860 4.844) 9.367 2.736 ( -8.079 -1.979 -9.463) 12.598 2.876 ( 8.499 -3.815 -4.508) 10.350 3.057 ( -0.955 -1.456 -2.680) 3.196 3.246 ( -5.586 5.338 11.391) 13.764 3.386 ( -3.598 -3.639 6.778) 8.493 3.608 ( 4.160 0.149 -3.149) 5.219 3.662 ( -5.019 -0.301 -2.167) 5.475 3.988 ( -4.385 -6.534 4.881) 9.260 4.018 ( -1.478 1.311 0.510) 2.040 4.139 ( 0.144 -3.258 -0.042) 3.262 4.214 ( -1.284 -0.640 -8.446) 8.567 4.282 ( 3.185 -0.839 0.135) 3.296 4.411 ( -3.641 1.875 1.675) 4.425 4.754 ( 0.371 4.037 2.551) 4.790 4.955 ( 5.539 3.076 -5.657) 8.494 5.036 ( -7.173 1.408 3.075) 7.931 5.307 ( 0.588 -3.542 6.104) 7.081 5.522 ( 0.166 1.758 -0.517) 1.840 5.597 ( -0.572 -2.282 4.042) 4.676 5.717 ( 7.621 -2.275 -4.470) 9.123 6.012 ( 2.226 4.806 1.211) 5.434 6.163 ( 2.397 0.798 6.576) 7.045 6.324 ( 1.267 8.966 -2.708) 9.452 6.443 ( 4.714 0.765 -2.140) 5.234 6.591 ( -2.019 3.866 -0.745) 4.424 6.803 ( -2.395 -0.458 -1.919) 3.103 6.892 ( 6.036 3.409 2.820) 7.484 7.004 ( 1.093 -4.012 0.634) 4.207 7.252 ( -4.832 2.595 6.735) 8.686 7.301 ( -7.673 0.148 1.024) 7.743 7.466 ( -4.359 -6.796 -2.673) 8.505 7.569 ( -4.684 5.063 -3.385) 7.683 8.375 ( -5.778 -11.154 -0.789) 12.587 8.716 ( 0.642 -2.381 3.024) 3.902 8.765 ( 3.935 -2.509 7.126) 8.518 9.006 ( 6.907 -0.912 -0.111) 6.967 9.083 ( -7.925 -0.254 3.744) 8.769 9.271 ( -0.408 -2.548 2.106) 3.331 9.486 ( -3.795 -5.034 -1.719) 6.534 9.695 ( 1.370 2.126 -2.647) 3.661 10.142 ( -9.242 -2.495 -3.636) 10.241 10.347 ( -12.503 -6.253 -15.136) 20.604 10.611 ( 9.443 -0.072 -3.576) 10.097 10.873 ( 2.395 -4.276 1.091) 5.021 11.200 ( 9.233 2.868 0.519) 9.682 11.268 ( 5.897 -2.322 0.668) 6.373 11.465 ( 3.201 -3.327 -1.399) 4.824 11.724 ( -3.419 2.681 1.831) 4.715 11.779 ( -1.777 1.483 -0.533) 2.375 11.918 ( 2.391 1.362 -6.660) 7.206 12.131 ( -1.002 1.022 7.000) 7.144 12.195 ( -3.343 -0.247 -8.422) 9.065 12.322 ( -7.286 -4.336 -2.954) 8.978 12.534 ( 6.506 2.804 1.368) 7.215 12.873 ( -20.321 2.837 3.767) 20.861 13.331 ( -3.708 5.269 -6.439) 9.109 14.674 ( -0.973 0.998 -2.732) 3.067 14.840 ( -2.996 -0.501 4.340) 5.297 14.902 ( -0.859 8.748 1.805) 8.974 15.041 ( 4.449 -1.670 -1.745) 5.063 15.169 ( -3.082 -3.536 2.106) 5.142 15.369 ( -4.356 5.739 -3.810) 8.150 15.500 ( 5.368 1.736 2.857) 6.324 15.597 ( 2.708 -0.006 -0.300) 2.724 15.741 ( 1.817 5.119 2.213) 5.865 16.031 ( -0.287 -1.023 2.842) 3.034 16.192 ( 1.860 -1.142 -0.451) 2.229 16.447 ( -3.673 -3.862 0.185) 5.333 17.103 ( 13.204 5.341 -0.298) 14.247 17.304 ( 0.000 -3.254 4.283) 5.379 17.595 ( 2.765 -0.460 -3.430) 4.430 17.661 ( 0.720 8.975 13.982) 16.630 25.573 ( 1.753 -1.498 -1.725) 2.880 25.616 ( 0.103 -1.649 0.273) 1.674 25.758 ( -1.364 -0.725 -0.032) 1.545 25.834 ( -1.930 -0.691 0.784) 2.195 25.911 ( -1.554 2.695 -0.493) 3.150 26.108 ( -0.628 0.577 -3.061) 3.177 26.431 ( -1.354 -0.631 -0.317) 1.527 26.468 ( 0.220 -2.471 -0.299) 2.499 26.803 ( -0.620 5.426 -0.112) 5.463 27.368 ( -18.714 -5.312 -21.696) 29.140 27.723 ( 8.354 -0.873 6.718) 10.756 27.961 ( -5.625 -4.056 9.670) 11.899 28.297 ( -2.378 -2.779 0.585) 3.704 28.345 ( -1.202 -4.965 0.127) 5.110 29.509 ( 12.196 4.377 24.095) 27.358 30.039 ( 16.232 8.081 -16.770) 24.698 ======================= Grid point 271 (131/140) ======================= q-point: ( 0.44 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.488 ( 0.483 -23.908 -7.116) 24.949 1.661 ( 9.860 -18.119 -1.430) 20.678 1.751 ( 0.513 -18.238 -10.021) 20.816 2.119 ( 6.588 -0.736 -0.913) 6.692 2.266 ( -1.591 -0.886 6.915) 7.151 2.379 ( 7.927 -9.885 -6.457) 14.221 2.469 ( -4.628 -12.543 0.959) 13.404 2.635 ( -5.049 -2.552 -9.140) 10.749 2.817 ( 2.709 -2.956 1.641) 4.333 2.954 ( -0.818 -6.503 -0.868) 6.612 3.132 ( 1.480 -0.159 2.550) 2.953 3.190 ( -4.740 -4.955 6.461) 9.422 3.430 ( -1.739 0.949 5.009) 5.387 3.504 ( -9.635 1.541 -1.578) 9.884 3.738 ( 7.517 -3.798 -3.556) 9.142 3.991 ( 1.705 1.922 0.280) 2.584 4.111 ( -5.836 -6.464 2.778) 9.141 4.146 ( -0.273 2.354 5.922) 6.379 4.211 ( -1.526 -4.932 -13.766) 14.702 4.315 ( -3.284 -3.052 0.647) 4.529 4.396 ( 4.417 -1.857 -2.073) 5.220 4.717 ( 4.703 2.741 1.416) 5.625 4.874 ( 4.394 6.616 -5.818) 9.845 4.985 ( -6.336 0.578 2.842) 6.968 5.390 ( -1.382 -1.616 3.431) 4.036 5.493 ( 0.074 0.871 4.043) 4.136 5.629 ( -4.503 -2.375 0.119) 5.092 5.783 ( 2.423 -3.539 -6.961) 8.176 5.967 ( 6.498 5.222 4.352) 9.404 6.196 ( 3.488 2.662 6.688) 7.999 6.223 ( 5.481 4.273 0.988) 7.020 6.441 ( 2.297 0.916 -1.529) 2.907 6.506 ( -2.433 2.960 -1.781) 4.225 6.756 ( -3.163 2.398 0.568) 4.010 6.913 ( 7.782 2.137 3.943) 8.982 7.103 ( -2.311 -4.428 2.602) 5.632 7.165 ( -8.335 5.872 3.567) 10.802 7.234 ( -3.195 0.506 1.336) 3.500 7.446 ( -7.099 -1.154 -6.722) 9.845 7.514 ( 0.498 0.848 -3.296) 3.440 8.543 ( -3.939 -11.816 1.393) 12.533 8.803 ( -2.980 -7.252 0.816) 7.883 8.864 ( 3.418 -1.907 4.397) 5.887 9.054 ( -2.029 -0.674 1.185) 2.444 9.067 ( 4.597 -0.036 2.894) 5.432 9.332 ( -0.061 -3.605 4.731) 5.948 9.554 ( 3.947 -3.254 -6.515) 8.284 9.692 ( -0.120 -3.031 2.679) 4.047 10.107 ( -7.964 -3.935 -6.699) 11.126 10.313 ( -13.504 -7.885 -6.925) 17.102 10.675 ( 9.169 -0.309 -0.973) 9.225 10.984 ( 2.609 -5.965 -2.349) 6.922 11.213 ( 8.116 2.614 -2.600) 8.914 11.384 ( 7.168 -3.747 1.202) 8.177 11.557 ( 2.241 -3.533 3.695) 5.582 11.650 ( -3.296 2.883 2.185) 4.894 11.730 ( -1.264 2.817 1.702) 3.525 11.853 ( -0.047 3.116 -7.746) 8.349 12.073 ( -2.709 0.717 -3.712) 4.651 12.255 ( 1.213 -2.598 2.574) 3.853 12.326 ( -7.235 -4.554 0.332) 8.556 12.530 ( 3.260 0.918 -1.253) 3.611 12.689 ( -9.606 7.199 2.355) 12.233 13.133 ( -6.833 9.307 -5.376) 12.736 14.632 ( 2.105 1.882 -4.811) 5.578 14.732 ( -3.906 6.575 4.182) 8.717 14.888 ( -2.682 -1.510 3.656) 4.779 15.044 ( -0.513 2.536 -3.686) 4.504 15.225 ( -0.430 -3.643 5.248) 6.403 15.277 ( 0.965 0.864 -3.682) 3.903 15.499 ( 1.774 2.168 0.425) 2.833 15.579 ( 4.319 4.072 -3.800) 7.048 15.705 ( 3.808 3.309 2.848) 5.793 16.010 ( -5.732 1.816 2.481) 6.505 16.255 ( 1.106 -2.923 4.008) 5.082 16.462 ( -0.927 -1.141 -3.785) 4.061 17.122 ( 13.223 4.751 -0.471) 14.059 17.350 ( 0.879 1.075 2.871) 3.189 17.512 ( -1.911 11.432 8.145) 14.166 17.612 ( -1.513 -1.133 -1.289) 2.288 25.614 ( 1.676 -2.480 -0.949) 3.141 25.654 ( 0.074 -2.510 0.515) 2.564 25.758 ( -0.747 -0.256 -0.405) 0.887 25.825 ( -1.699 0.313 -0.344) 1.762 25.867 ( 0.304 1.819 0.962) 2.080 26.077 ( -2.383 -0.252 -4.310) 4.931 26.413 ( -2.283 -0.162 -1.934) 2.996 26.507 ( -0.639 -2.727 -2.067) 3.481 26.760 ( 1.886 1.746 4.919) 5.550 27.213 ( -10.511 -0.670 -15.012) 18.338 27.866 ( 6.434 -3.626 8.328) 11.130 28.066 ( -2.087 -7.027 6.088) 9.529 28.332 ( -1.419 -3.271 -0.042) 3.566 28.450 ( -3.249 -9.078 0.639) 9.664 29.566 ( 5.233 8.709 17.902) 20.585 29.882 ( 11.555 13.644 -15.485) 23.653 ======================= Grid point 272 (132/140) ======================= q-point: ( 0.56 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.790 ( 3.481 -13.801 -2.997) 14.545 1.943 ( -0.568 -12.353 -6.383) 13.916 1.995 ( 2.741 -7.357 -0.441) 7.863 2.188 ( 3.095 -7.627 1.028) 8.295 2.252 ( 0.683 2.375 -2.506) 3.520 2.536 ( -6.543 -7.493 -5.666) 11.448 2.623 ( 0.455 -6.552 5.697) 8.695 2.699 ( 3.303 -9.613 0.651) 10.185 2.875 ( -1.069 -3.288 5.395) 6.408 3.063 ( -0.565 -4.478 -4.066) 6.075 3.101 ( 0.043 -0.676 3.960) 4.018 3.332 ( -4.755 1.853 -4.401) 6.739 3.370 ( 1.757 -5.212 5.938) 8.094 3.495 ( -3.606 -5.480 1.867) 6.820 3.800 ( 5.611 4.450 3.185) 7.838 3.969 ( 0.409 2.217 -1.428) 2.669 4.069 ( -2.004 1.861 -4.601) 5.353 4.172 ( -5.528 -4.244 0.080) 6.970 4.236 ( 2.822 -3.659 -10.815) 11.760 4.269 ( -9.127 0.114 2.818) 9.553 4.571 ( 6.242 -8.637 2.505) 10.947 4.727 ( 5.940 2.157 -3.080) 7.031 4.811 ( 5.154 0.817 -5.220) 7.380 4.929 ( -5.936 2.173 3.805) 7.379 5.376 ( -0.556 1.965 4.472) 4.917 5.532 ( 0.153 0.486 5.973) 5.994 5.619 ( -5.722 -3.367 -2.790) 7.201 5.795 ( -2.838 -3.455 -8.741) 9.818 5.987 ( 8.941 3.299 4.391) 10.493 6.185 ( 2.006 5.402 4.540) 7.336 6.256 ( 8.062 -0.355 1.608) 8.228 6.385 ( -4.824 4.059 2.668) 6.845 6.519 ( 6.172 -3.527 -3.425) 7.891 6.692 ( -4.256 1.964 1.563) 4.941 6.941 ( -0.233 3.766 4.976) 6.245 7.002 ( -0.338 5.943 1.471) 6.131 7.116 ( -5.771 -0.114 1.110) 5.878 7.294 ( 0.503 -5.136 4.901) 7.117 7.342 ( -5.634 2.743 -9.954) 11.762 7.478 ( -1.145 -0.015 -5.566) 5.683 8.686 ( -3.065 -6.796 4.437) 8.675 8.836 ( -4.642 -1.923 -5.029) 7.109 8.957 ( 3.586 -4.075 2.814) 6.115 9.064 ( -0.368 -1.289 -2.812) 3.115 9.170 ( 9.141 -2.213 10.125) 13.820 9.430 ( 0.810 -4.870 1.838) 5.268 9.601 ( 4.157 -2.057 -1.973) 5.041 9.766 ( -3.440 -2.565 2.753) 5.099 10.109 ( 1.267 -6.291 -11.036) 12.766 10.325 ( -14.389 -7.569 2.270) 16.416 10.753 ( 9.105 -0.692 0.020) 9.131 11.046 ( -3.426 -2.568 -3.883) 5.780 11.216 ( 9.534 4.401 0.847) 10.535 11.458 ( 3.507 0.069 -5.619) 6.625 11.585 ( -4.341 -2.387 5.152) 7.147 11.657 ( 2.651 5.854 2.885) 7.044 11.727 ( 1.576 -2.096 7.533) 7.976 11.769 ( -2.860 -2.005 -8.025) 8.752 12.033 ( -0.469 0.724 -3.708) 3.807 12.229 ( -7.772 0.380 -1.094) 7.858 12.342 ( 1.225 5.853 3.670) 7.016 12.497 ( -5.173 8.526 -4.104) 10.784 12.622 ( 7.142 -7.057 3.885) 10.766 12.940 ( -7.742 1.177 -3.546) 8.597 14.620 ( 2.554 -1.002 -4.453) 5.230 14.652 ( -2.083 2.383 3.382) 4.632 14.891 ( -4.080 0.036 3.034) 5.084 14.961 ( -2.047 2.756 -2.897) 4.493 15.286 ( 2.816 -0.747 -0.841) 3.032 15.328 ( -0.092 -5.370 2.885) 6.097 15.468 ( 1.696 2.815 -1.098) 3.465 15.510 ( 2.984 5.043 -3.691) 6.925 15.707 ( 4.460 1.906 2.229) 5.338 15.922 ( -7.926 2.878 2.125) 8.696 16.334 ( -0.273 -2.834 6.669) 7.251 16.445 ( 1.942 0.389 -6.538) 6.832 17.107 ( 9.452 7.459 -2.749) 12.350 17.248 ( -2.733 11.006 2.962) 11.721 17.438 ( 0.751 0.591 5.849) 5.927 17.606 ( -2.729 -0.990 -2.226) 3.658 25.669 ( 1.560 -2.833 0.425) 3.262 25.704 ( 0.261 -2.777 0.650) 2.864 25.750 ( 0.194 0.938 0.204) 0.980 25.804 ( -1.082 0.644 -0.294) 1.293 25.856 ( 0.961 0.836 1.472) 1.946 26.033 ( -4.183 -0.628 -5.983) 7.327 26.406 ( -0.077 -0.833 0.197) 0.859 26.522 ( -1.476 -1.769 -4.029) 4.642 26.799 ( 2.078 -0.062 8.760) 9.003 27.091 ( -5.984 -0.119 -11.199) 12.698 28.012 ( 6.284 -3.274 7.815) 10.548 28.185 ( -0.287 -5.347 0.102) 5.356 28.400 ( 0.577 -4.931 3.722) 6.205 28.586 ( -5.338 -10.643 -0.405) 11.913 29.491 ( 1.353 11.236 10.120) 15.182 29.638 ( 6.148 15.049 -11.957) 20.180 ======================= Grid point 273 (133/140) ======================= q-point: ( 0.67 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.921 ( 6.208 2.205 -1.036) 6.669 2.026 ( -6.497 -0.630 -3.259) 7.296 2.084 ( -0.115 -6.197 3.270) 7.008 2.156 ( -2.900 -0.966 -5.082) 5.930 2.428 ( 6.235 -8.105 2.936) 10.639 2.557 ( -5.273 -4.048 -3.212) 7.383 2.740 ( 1.410 -3.072 6.049) 6.930 2.831 ( -2.919 -3.429 -4.090) 6.083 2.997 ( 2.828 -5.917 12.301) 13.940 3.076 ( 2.319 -0.417 -1.532) 2.811 3.152 ( 2.019 0.933 1.318) 2.585 3.259 ( -2.712 -2.243 -4.913) 6.044 3.512 ( 6.017 -6.421 -0.776) 8.834 3.596 ( -4.383 -6.048 2.625) 7.917 3.703 ( 4.943 10.149 0.405) 11.296 3.840 ( -9.058 4.730 -4.235) 11.062 4.108 ( 6.749 -3.497 -2.939) 8.150 4.204 ( -7.789 -2.355 8.041) 11.440 4.225 ( -0.153 -0.517 -7.183) 7.204 4.238 ( -2.438 -0.436 -2.064) 3.224 4.681 ( 0.565 1.163 5.136) 5.296 4.716 ( 2.604 1.106 -4.426) 5.253 4.849 ( 2.125 -1.895 0.180) 2.853 4.895 ( -0.672 -2.317 -2.677) 3.604 5.387 ( 1.654 1.605 8.086) 8.408 5.493 ( -2.146 2.991 -3.459) 5.052 5.668 ( 0.575 -4.098 4.055) 5.794 5.788 ( -4.171 -4.198 -8.925) 10.708 5.992 ( 6.384 5.821 2.435) 8.975 6.083 ( -2.656 7.696 0.146) 8.143 6.308 ( 1.663 2.243 4.005) 4.882 6.332 ( 1.000 -0.510 -0.871) 1.421 6.635 ( 7.116 -5.013 -3.117) 9.246 6.659 ( -1.785 -0.183 2.939) 3.443 6.836 ( -1.188 6.674 4.097) 7.921 6.942 ( -5.616 3.331 -1.531) 6.706 7.101 ( 0.227 0.192 4.062) 4.073 7.208 ( -3.107 2.601 -8.728) 9.623 7.408 ( 0.125 -5.115 4.374) 6.732 7.462 ( -0.931 -2.991 -5.390) 6.234 8.778 ( -3.021 -4.141 7.050) 8.717 8.821 ( 0.238 -2.593 -6.676) 7.166 9.034 ( 6.716 -0.044 -1.876) 6.973 9.084 ( -3.297 -2.188 2.279) 4.566 9.307 ( 8.250 0.193 6.770) 10.674 9.469 ( -4.282 0.014 -3.929) 5.811 9.660 ( 5.332 -0.976 0.742) 5.471 9.749 ( -5.860 -0.789 1.557) 6.114 10.234 ( 10.651 -7.699 -9.430) 16.175 10.360 ( -14.727 -7.281 7.033) 17.870 10.827 ( 9.233 0.703 -0.020) 9.259 10.983 ( -8.718 1.646 -2.380) 9.186 11.230 ( 10.488 5.163 5.745) 13.026 11.412 ( -3.461 2.856 -4.731) 6.520 11.555 ( 2.615 4.627 -1.430) 5.504 11.617 ( -5.826 -1.778 2.419) 6.554 11.762 ( 1.191 -2.372 -0.946) 2.817 11.825 ( -3.278 -2.406 -0.615) 4.112 12.030 ( 4.971 -0.592 0.786) 5.067 12.155 ( -7.357 1.663 -0.553) 7.563 12.224 ( 2.165 7.324 0.622) 7.663 12.275 ( -1.931 10.676 -2.279) 11.086 12.874 ( 6.318 -13.165 2.838) 14.876 12.976 ( -4.376 -10.681 -1.343) 11.620 14.623 ( 0.300 0.289 1.918) 1.963 14.662 ( -1.410 -2.271 -2.441) 3.620 14.878 ( 1.309 -0.559 0.393) 1.476 14.920 ( -2.916 -1.304 -0.598) 3.250 15.299 ( 2.268 3.167 1.887) 4.329 15.356 ( -2.031 3.719 -2.770) 5.062 15.444 ( 1.483 1.491 0.099) 2.105 15.455 ( 0.830 -0.407 -0.840) 1.249 15.744 ( 5.488 -1.209 2.157) 6.020 15.851 ( -6.669 -1.385 0.152) 6.814 16.398 ( -2.365 -1.566 7.459) 7.980 16.422 ( 3.973 0.972 -7.133) 8.222 17.003 ( 5.857 9.076 -3.965) 11.506 17.061 ( -5.872 8.308 2.837) 10.562 17.487 ( 4.016 -0.447 3.607) 5.416 17.580 ( -3.888 -0.295 -2.353) 4.554 25.716 ( 0.579 0.034 0.217) 0.619 25.722 ( -0.228 1.237 0.041) 1.259 25.765 ( 1.360 -2.293 2.107) 3.398 25.793 ( -0.902 -1.151 -0.109) 1.467 25.874 ( 2.671 -0.294 2.841) 3.910 25.983 ( -4.717 -1.289 -6.517) 8.148 26.432 ( 1.658 -0.303 2.370) 2.908 26.502 ( -2.064 -0.059 -4.654) 5.091 26.872 ( 2.521 -1.081 9.911) 10.284 27.016 ( -4.105 -1.524 -9.771) 10.707 28.140 ( 5.493 -2.373 5.743) 8.294 28.230 ( -0.906 -2.000 -3.370) 4.022 28.547 ( 6.121 -6.693 5.684) 10.704 28.703 ( -8.190 -9.928 -1.645) 12.975 29.323 ( 1.324 13.384 3.353) 13.861 29.384 ( -0.327 12.746 -6.129) 14.146 ======================= Grid point 274 (134/140) ======================= q-point: (-0.22 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.879 ( 2.937 7.475 -7.600) 11.057 1.879 ( -2.937 7.475 7.600) 11.057 2.169 ( 5.489 -0.918 -10.337) 11.740 2.169 ( -5.489 -0.918 10.337) 11.740 2.526 ( -2.876 3.313 -2.033) 4.835 2.526 ( 2.876 3.313 2.033) 4.835 2.814 ( -1.441 -1.678 -5.306) 5.748 2.814 ( 1.441 -1.678 5.306) 5.748 3.092 ( 1.852 -0.095 -4.008) 4.417 3.092 ( -1.852 -0.095 4.008) 4.417 3.217 ( -7.848 -0.672 -12.329) 14.630 3.217 ( 7.848 -0.672 12.329) 14.630 3.604 ( -3.945 3.594 -1.077) 5.444 3.604 ( 3.945 3.594 1.077) 5.444 3.684 ( -7.180 -0.955 -3.444) 8.020 3.684 ( 7.180 -0.955 3.444) 8.020 4.159 ( 5.680 3.074 -11.292) 13.009 4.159 ( -5.680 3.074 11.292) 13.009 4.253 ( 4.967 -4.353 -8.331) 10.632 4.253 ( -4.967 -4.353 8.331) 10.632 4.663 ( 4.206 3.070 -10.800) 11.990 4.663 ( -4.206 3.070 10.800) 11.990 4.924 ( 0.279 -3.545 -10.235) 10.836 4.924 ( -0.279 -3.545 10.235) 10.836 5.395 ( -0.175 3.563 -8.026) 8.783 5.395 ( 0.175 3.563 8.026) 8.783 5.781 ( -2.462 -3.449 -7.885) 8.952 5.781 ( 2.462 -3.449 7.885) 8.952 5.924 ( -2.459 7.390 -2.702) 8.244 5.924 ( 2.459 7.390 2.702) 8.244 6.314 ( -1.214 0.906 -4.325) 4.583 6.314 ( 1.214 0.906 4.325) 4.583 6.695 ( -2.334 -0.205 -5.681) 6.145 6.695 ( 2.334 -0.205 5.681) 6.145 6.807 ( -9.778 1.575 -4.060) 10.704 6.807 ( 9.778 1.575 4.060) 10.704 7.138 ( -1.260 -0.524 -5.779) 5.938 7.138 ( 1.260 -0.524 5.779) 5.938 7.516 ( 0.805 -5.928 -2.559) 6.507 7.516 ( -0.805 -5.928 2.559) 6.507 8.851 ( 2.015 -2.414 -7.160) 7.820 8.851 ( -2.015 -2.414 7.160) 7.820 9.058 ( -4.025 2.420 -0.301) 4.706 9.058 ( 4.025 2.420 0.301) 4.706 9.345 ( -5.235 4.699 -5.439) 8.892 9.345 ( 5.235 4.699 5.439) 8.892 9.726 ( -4.638 -0.847 -1.821) 5.054 9.726 ( 4.638 -0.847 1.821) 5.054 10.399 ( 11.999 -5.478 -14.157) 19.349 10.399 ( -11.999 -5.478 14.157) 19.349 10.862 ( -7.638 3.464 -1.323) 8.491 10.862 ( 7.638 3.464 1.323) 8.491 11.258 ( -10.044 4.391 -5.115) 12.097 11.258 ( 10.044 4.391 5.115) 12.097 11.581 ( -6.428 -0.674 -3.333) 7.272 11.581 ( 6.428 -0.674 3.333) 7.272 11.797 ( -1.633 -0.254 -0.088) 1.655 11.797 ( 1.633 -0.254 0.088) 1.655 12.047 ( 2.772 5.501 -3.386) 7.029 12.047 ( -2.772 5.501 3.386) 7.029 12.209 ( -2.464 -4.887 -4.674) 7.197 12.209 ( 2.464 -4.887 4.674) 7.197 13.147 ( 1.079 -13.017 -3.549) 13.535 13.147 ( -1.079 -13.017 3.549) 13.535 14.649 ( -2.337 -0.675 -3.149) 3.979 14.649 ( 2.337 -0.675 3.149) 3.979 14.950 ( -1.243 -4.580 -1.711) 5.044 14.950 ( 1.243 -4.580 1.711) 5.044 15.228 ( 0.497 6.984 -4.420) 8.280 15.228 ( -0.497 6.984 4.420) 8.280 15.441 ( -2.896 1.432 -0.768) 3.321 15.441 ( 2.896 1.432 0.768) 3.321 15.863 ( -6.324 -5.680 -1.658) 8.661 15.863 ( 6.324 -5.680 1.658) 8.661 16.408 ( 5.806 0.873 -6.381) 8.671 16.408 ( -5.806 0.873 6.381) 8.671 16.910 ( 3.946 5.251 -4.006) 7.694 16.910 ( -3.946 5.251 4.006) 7.694 17.534 ( -0.630 0.583 -5.241) 5.311 17.534 ( 0.630 0.583 5.241) 5.311 25.690 ( -0.183 2.347 -0.671) 2.448 25.690 ( 0.183 2.347 0.671) 2.448 25.818 ( -0.353 -1.829 -1.476) 2.376 25.818 ( 0.353 -1.829 1.476) 2.376 25.946 ( -0.748 -2.311 -9.429) 9.737 25.946 ( 0.748 -2.311 9.429) 9.737 26.452 ( -1.796 1.561 -3.601) 4.317 26.452 ( 1.796 1.561 3.601) 4.317 26.975 ( -4.059 -2.723 -9.783) 10.936 26.975 ( 4.059 -2.723 9.783) 10.936 28.217 ( 2.860 -0.281 -8.189) 8.679 28.217 ( -2.860 -0.281 8.189) 8.679 28.762 ( -8.341 -7.149 -4.308) 11.800 28.762 ( 8.341 -7.149 4.308) 11.800 29.140 ( -2.041 11.349 -4.866) 12.516 29.140 ( 2.041 11.349 4.866) 12.516 ======================= Grid point 280 (135/140) ======================= q-point: ( 0.33 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.911 ( 8.234 0.000 -1.800) 8.429 1.158 ( -0.489 -0.000 -4.729) 4.755 1.332 ( 16.350 0.000 -11.507) 19.994 1.929 ( -3.894 -0.000 -1.259) 4.092 2.168 ( -3.840 -0.000 -8.093) 8.958 2.215 ( 10.067 0.000 1.610) 10.195 2.400 ( 9.708 0.000 -1.385) 9.806 2.549 ( -14.355 -0.000 -7.971) 16.420 2.649 ( 1.608 0.000 9.151) 9.291 2.943 ( 19.949 0.000 -11.044) 22.802 3.028 ( -0.738 -0.000 -1.606) 1.768 3.250 ( -9.993 -0.000 3.765) 10.679 3.403 ( -1.072 -0.000 14.739) 14.778 3.586 ( -11.319 -0.000 -1.355) 11.400 3.639 ( 6.295 0.000 -6.977) 9.397 3.874 ( -7.610 -0.000 1.584) 7.773 4.026 ( -5.172 -0.000 0.143) 5.174 4.034 ( 0.322 0.000 -5.700) 5.709 4.272 ( 12.770 0.000 -6.097) 14.151 4.294 ( 0.405 0.000 4.855) 4.872 4.422 ( -4.207 -0.000 4.218) 5.958 4.797 ( -4.136 -0.000 5.316) 6.735 4.977 ( 3.351 0.000 -5.182) 6.171 4.996 ( -7.341 -0.000 1.198) 7.438 5.333 ( 1.384 0.000 8.379) 8.493 5.545 ( 2.072 0.000 -0.441) 2.118 5.586 ( -1.670 -0.000 1.439) 2.205 5.715 ( 5.257 0.000 -8.544) 10.032 6.082 ( 3.526 0.000 3.029) 4.648 6.238 ( 4.836 0.000 9.617) 10.765 6.431 ( 0.134 0.000 -6.024) 6.026 6.434 ( 2.956 0.000 -3.755) 4.779 6.673 ( -3.875 -0.000 2.299) 4.506 6.674 ( -2.727 -0.000 -3.146) 4.164 6.961 ( 3.043 0.000 3.164) 4.390 7.038 ( 7.385 0.000 -6.354) 9.742 7.214 ( -6.131 -0.000 4.541) 7.630 7.278 ( -7.798 -0.000 8.673) 11.663 7.372 ( -4.721 -0.000 0.642) 4.765 7.567 ( -1.893 -0.000 -6.210) 6.493 8.248 ( -0.771 -0.000 0.845) 1.144 8.692 ( -5.727 -0.000 -1.686) 5.970 8.799 ( 2.493 0.000 9.372) 9.698 9.016 ( 0.220 0.000 -1.893) 1.906 9.113 ( 4.500 0.000 7.503) 8.749 9.240 ( 1.685 0.000 -2.782) 3.252 9.403 ( -8.070 -0.000 7.592) 11.080 9.715 ( 2.689 0.000 -4.304) 5.075 10.025 ( -8.918 -0.000 -5.520) 10.488 10.113 ( -10.219 -0.000 -18.900) 21.486 10.676 ( 11.207 0.000 -3.417) 11.717 10.853 ( 0.069 0.000 2.577) 2.578 11.233 ( 6.029 0.000 -7.005) 9.243 11.375 ( 8.904 0.000 10.334) 13.641 11.452 ( 4.512 0.000 -0.368) 4.527 11.704 ( -7.157 -0.000 -2.984) 7.755 11.771 ( -0.782 -0.000 -1.345) 1.555 11.916 ( 1.497 0.000 -6.317) 6.492 12.114 ( -4.882 -0.000 -11.283) 12.294 12.163 ( -3.536 -0.000 4.152) 5.454 12.217 ( -3.703 -0.000 4.198) 5.598 12.517 ( -8.842 -0.000 -4.664) 9.996 12.875 ( -0.359 -0.000 9.996) 10.002 13.326 ( -2.967 -0.000 -6.198) 6.871 14.671 ( 0.469 0.000 -1.232) 1.318 14.830 ( -3.313 -0.000 3.632) 4.916 15.025 ( -8.444 -0.000 9.561) 12.755 15.053 ( 1.750 0.000 2.513) 3.062 15.082 ( 8.405 0.000 -10.421) 13.388 15.333 ( -6.467 -0.000 -7.421) 9.843 15.605 ( 6.266 0.000 2.229) 6.650 15.622 ( 1.475 0.000 6.622) 6.784 15.809 ( 2.147 0.000 0.322) 2.171 16.040 ( -0.993 -0.000 2.870) 3.037 16.202 ( 3.579 0.000 -2.197) 4.200 16.374 ( -3.847 -0.000 0.863) 3.943 17.274 ( 15.841 0.000 -3.526) 16.229 17.286 ( 0.194 0.000 7.404) 7.406 17.582 ( 0.813 0.000 -3.698) 3.786 17.789 ( -7.529 -0.000 13.966) 15.867 25.566 ( 1.940 0.000 -1.605) 2.518 25.602 ( -0.062 -0.000 0.058) 0.085 25.741 ( -1.148 -0.000 -0.017) 1.148 25.813 ( -2.354 -0.000 0.084) 2.355 25.923 ( -2.262 -0.000 2.543) 3.403 26.088 ( -0.980 -0.000 -5.725) 5.808 26.419 ( -0.593 -0.000 -0.793) 0.990 26.433 ( -1.372 -0.000 -1.751) 2.225 26.862 ( -1.817 -0.000 2.816) 3.352 27.090 ( -7.440 -0.000 -20.603) 21.905 27.794 ( 8.080 0.000 1.276) 8.180 27.934 ( -5.830 -0.000 11.193) 12.620 28.264 ( -2.121 -0.000 2.632) 3.380 28.299 ( -0.146 -0.000 -1.233) 1.242 29.758 ( 4.972 0.000 29.429) 29.846 30.138 ( 14.666 0.000 -19.906) 24.726 ======================= Grid point 281 (136/140) ======================= q-point: ( 0.44 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.113 ( 4.404 -17.605 3.041) 18.401 1.361 ( 0.645 -20.499 -9.263) 22.504 1.539 ( 19.242 -9.411 1.295) 21.460 2.020 ( -3.129 -13.603 2.000) 14.101 2.178 ( -4.776 -8.422 -10.843) 14.536 2.283 ( 7.488 -1.926 -2.265) 8.057 2.393 ( -5.739 1.599 2.553) 6.482 2.454 ( -2.997 -2.817 -7.439) 8.501 2.789 ( 3.412 -6.322 8.499) 11.129 2.959 ( 7.116 5.375 -5.587) 10.523 3.047 ( 0.884 -4.181 -1.437) 4.509 3.233 ( -7.312 0.611 3.372) 8.075 3.410 ( -1.676 1.727 7.140) 7.535 3.483 ( -4.766 2.157 -1.811) 5.536 3.688 ( 6.281 -5.364 -6.818) 10.710 3.911 ( -9.426 -9.269 1.792) 13.340 4.002 ( -2.048 -1.000 2.555) 3.423 4.060 ( 0.300 -4.832 -8.226) 9.545 4.260 ( 3.651 5.170 1.546) 6.515 4.333 ( -0.094 3.820 1.898) 4.267 4.417 ( 6.740 -1.039 0.590) 6.845 4.774 ( -4.995 0.104 3.641) 6.182 4.924 ( -5.734 2.324 0.223) 6.191 4.965 ( 2.082 2.122 -4.633) 5.505 5.385 ( 0.160 -0.951 7.201) 7.266 5.546 ( 1.400 1.957 3.093) 3.918 5.579 ( -2.002 -0.760 -1.948) 2.895 5.715 ( 1.627 -1.483 -8.680) 8.954 6.107 ( 5.337 3.116 5.335) 8.165 6.297 ( 3.434 2.623 1.987) 4.756 6.349 ( 4.004 4.203 1.962) 6.128 6.450 ( 3.059 -0.824 -3.323) 4.591 6.543 ( -3.079 4.992 0.067) 5.866 6.730 ( -6.378 -2.648 -1.072) 6.988 6.986 ( 3.070 0.426 1.730) 3.550 7.075 ( 7.880 -0.900 -1.802) 8.133 7.190 ( -5.201 0.896 0.131) 5.279 7.227 ( -8.610 3.801 8.403) 12.616 7.366 ( -4.700 -2.074 0.770) 5.195 7.509 ( 0.234 1.633 -6.641) 6.843 8.355 ( 2.290 -9.574 2.474) 10.150 8.654 ( -8.292 -4.667 -2.927) 9.955 8.876 ( 0.944 -1.799 7.784) 8.045 9.010 ( 0.619 -0.893 -4.376) 4.509 9.164 ( 5.533 1.457 7.480) 9.418 9.289 ( 0.153 -3.721 1.597) 4.052 9.459 ( 0.111 -6.336 4.242) 7.626 9.701 ( 0.654 0.900 -1.447) 1.826 9.953 ( -6.163 -2.449 -9.489) 11.577 10.027 ( -10.530 -7.961 -10.587) 16.922 10.745 ( 9.503 -0.074 -0.861) 9.542 10.899 ( -0.316 -4.103 0.170) 4.119 11.261 ( 7.853 -0.459 -4.988) 9.315 11.441 ( 5.655 1.389 4.474) 7.343 11.532 ( 0.239 -1.995 2.173) 2.959 11.651 ( -1.256 -1.607 1.622) 2.606 11.752 ( -0.606 0.987 -1.424) 1.836 11.867 ( -2.202 2.329 -5.733) 6.568 12.028 ( -1.767 0.096 -7.447) 7.654 12.164 ( -9.379 -4.914 -1.493) 10.694 12.253 ( 0.050 -1.135 8.054) 8.133 12.436 ( -7.365 -1.733 -5.280) 9.226 12.884 ( 5.972 7.508 8.288) 12.677 13.207 ( -4.924 7.078 -5.816) 10.401 14.665 ( 3.147 1.404 -2.485) 4.248 14.795 ( -7.717 2.475 4.409) 9.226 14.930 ( 1.398 5.441 3.584) 6.663 15.066 ( 0.930 2.078 -3.005) 3.770 15.168 ( 0.330 -4.895 1.541) 5.142 15.251 ( -2.711 -0.344 -5.632) 6.260 15.591 ( 2.232 4.705 4.679) 7.001 15.654 ( 3.021 2.817 -1.471) 4.385 15.807 ( 4.863 2.824 1.429) 5.802 16.009 ( -5.115 1.870 1.288) 5.597 16.244 ( 3.406 -2.171 1.642) 4.360 16.388 ( -3.010 -3.548 -1.988) 5.059 17.296 ( 10.989 3.504 0.910) 11.570 17.384 ( 5.690 -0.411 2.346) 6.168 17.571 ( -0.348 -0.569 -4.221) 4.273 17.695 ( -10.622 8.561 10.085) 16.965 25.587 ( 1.830 -1.594 -1.125) 2.675 25.617 ( -0.451 -1.813 0.160) 1.875 25.743 ( -0.393 -0.763 0.317) 0.915 25.800 ( -2.441 -0.709 -0.529) 2.596 25.909 ( -0.680 1.690 3.377) 3.837 26.039 ( -1.515 0.731 -7.062) 7.260 26.396 ( -0.907 0.433 -1.080) 1.475 26.441 ( -1.487 -2.274 -2.222) 3.510 26.831 ( 0.814 2.361 4.335) 5.003 27.031 ( -4.527 -4.369 -13.180) 14.605 27.884 ( 6.946 -3.204 1.773) 7.852 27.980 ( -4.131 -4.377 8.156) 10.136 28.281 ( -0.814 -2.041 1.331) 2.569 28.323 ( -1.371 -3.984 -0.523) 4.246 29.843 ( -0.502 7.784 25.762) 26.917 30.072 ( 11.828 8.249 -20.380) 24.966 ======================= Grid point 282 (137/140) ======================= q-point: ( 0.56 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.502 ( 3.036 -20.944 3.769) 21.496 1.625 ( -3.177 -18.197 -9.393) 20.724 1.901 ( 14.540 -13.312 7.659) 21.149 2.169 ( 0.292 -1.914 -10.120) 10.303 2.236 ( -0.347 -6.893 -1.955) 7.173 2.339 ( -10.220 -1.280 3.591) 10.907 2.468 ( 1.015 -12.974 3.188) 13.399 2.512 ( 0.709 -11.008 -5.595) 12.368 2.897 ( 3.045 1.031 4.278) 5.352 2.950 ( 0.877 -4.226 -2.037) 4.773 3.146 ( -2.390 0.959 0.947) 2.744 3.154 ( -3.832 -7.417 1.296) 8.449 3.407 ( -1.552 0.361 1.273) 2.039 3.429 ( -1.318 0.669 -0.366) 1.523 3.846 ( 9.387 -6.875 -1.142) 11.691 3.993 ( -6.739 -7.887 -3.332) 10.896 4.019 ( -3.077 1.374 7.124) 7.881 4.083 ( -0.167 0.200 -8.689) 8.693 4.199 ( 4.678 2.758 -3.292) 6.351 4.246 ( -6.622 2.676 4.471) 8.426 4.545 ( 12.048 -3.748 2.118) 12.794 4.742 ( -6.687 -0.498 -3.007) 7.348 4.856 ( 1.878 2.566 0.841) 3.289 4.916 ( -2.865 1.390 -1.359) 3.462 5.425 ( 1.948 0.606 4.787) 5.203 5.530 ( -5.027 -0.436 -2.701) 5.723 5.577 ( 1.619 0.625 7.195) 7.401 5.692 ( -1.676 -1.144 -9.660) 9.871 6.131 ( 7.180 2.829 5.819) 9.665 6.255 ( -1.358 1.849 -3.034) 3.803 6.348 ( 5.541 3.758 3.461) 7.538 6.440 ( -3.814 3.947 -0.729) 5.536 6.518 ( 8.571 -1.508 1.894) 8.906 6.678 ( -7.800 0.478 -0.751) 7.851 7.000 ( 1.443 1.366 1.615) 2.561 7.064 ( -4.491 5.886 -1.223) 7.504 7.138 ( 0.949 0.677 4.093) 4.256 7.205 ( -2.373 -3.370 -2.367) 4.753 7.347 ( 0.527 2.007 2.779) 3.469 7.446 ( -2.801 1.083 -6.436) 7.102 8.563 ( 2.891 -9.604 3.706) 10.693 8.684 ( -7.120 -7.144 -3.962) 10.836 8.947 ( 1.461 -2.169 5.606) 6.186 9.014 ( -0.238 -2.020 -5.144) 5.532 9.255 ( 7.176 -1.742 8.130) 10.983 9.358 ( -1.871 -4.195 1.161) 4.738 9.584 ( 7.234 -3.461 -3.001) 8.562 9.698 ( -6.871 -2.016 3.470) 7.957 9.962 ( 5.313 -7.198 -11.170) 14.311 10.072 ( -13.573 -10.048 1.208) 16.931 10.821 ( 7.981 -0.579 2.416) 8.359 10.946 ( -3.702 -3.332 -3.601) 6.147 11.319 ( 9.562 -0.236 -1.717) 9.717 11.446 ( -3.494 -0.211 -2.644) 4.387 11.561 ( 1.413 -0.828 7.205) 7.389 11.705 ( -2.466 0.268 -7.206) 7.621 11.739 ( 1.358 -1.187 5.917) 6.185 11.767 ( -1.319 4.176 -0.278) 4.388 12.021 ( 3.860 -1.374 -3.946) 5.688 12.139 ( -10.467 -2.349 -1.691) 10.860 12.344 ( 0.196 -4.868 6.672) 8.261 12.420 ( -2.499 -3.937 -6.091) 7.671 12.807 ( 7.827 11.115 5.840) 14.796 12.976 ( -7.329 10.717 -4.857) 13.862 14.648 ( 5.383 2.462 -4.269) 7.298 14.698 ( -6.076 3.987 4.544) 8.571 14.904 ( 1.081 1.972 3.150) 3.871 14.976 ( -3.313 3.688 -3.387) 6.004 15.253 ( -0.102 -4.038 2.042) 4.526 15.266 ( 1.104 -3.319 -2.471) 4.282 15.548 ( 1.241 4.347 3.466) 5.697 15.586 ( 1.467 4.631 -4.202) 6.423 15.808 ( 6.857 3.415 0.928) 7.716 15.922 ( -7.825 3.204 1.398) 8.570 16.324 ( 1.749 -2.640 5.192) 6.081 16.401 ( -1.247 -2.159 -5.399) 5.947 17.307 ( 13.073 7.224 -4.161) 15.505 17.397 ( -2.777 5.161 5.840) 8.274 17.508 ( -5.193 6.467 6.396) 10.474 17.551 ( -2.069 -0.813 -4.467) 4.990 25.635 ( 1.672 -2.810 -0.187) 3.275 25.654 ( -0.808 -2.974 0.244) 3.092 25.759 ( 0.725 -0.473 0.793) 1.174 25.791 ( -1.948 -0.484 -0.852) 2.181 25.899 ( 1.315 1.608 3.379) 3.967 25.977 ( -2.739 0.787 -6.129) 6.759 26.399 ( 0.890 -0.928 1.363) 1.874 26.451 ( -2.127 -2.200 -3.451) 4.612 26.858 ( 2.062 0.005 8.221) 8.476 26.988 ( -3.596 -1.315 -10.670) 11.336 28.013 ( 4.568 -4.919 3.808) 7.718 28.077 ( -2.247 -6.385 1.453) 6.923 28.341 ( 1.300 -4.540 2.136) 5.183 28.397 ( -3.134 -7.142 -1.284) 7.904 29.764 ( -2.514 12.673 18.754) 22.773 29.864 ( 7.419 13.718 -17.913) 23.750 ======================= Grid point 283 (138/140) ======================= q-point: ( 0.67 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.841 ( -1.612 -14.014 -6.009) 15.333 1.841 ( 1.612 -14.014 6.009) 15.333 2.123 ( -3.256 1.894 -3.058) 4.852 2.123 ( 3.256 1.894 3.058) 4.852 2.351 ( -11.449 -9.062 -0.612) 14.614 2.351 ( 11.449 -9.062 0.612) 14.614 2.689 ( -0.856 -9.214 -4.918) 10.479 2.689 ( 0.856 -9.214 4.918) 10.479 2.977 ( -1.024 -4.278 -9.920) 10.852 2.977 ( 1.024 -4.278 9.920) 10.852 3.196 ( -2.935 -1.794 -8.412) 9.088 3.196 ( 2.935 -1.794 8.412) 9.088 3.449 ( -1.069 -5.211 -3.447) 6.338 3.449 ( 1.069 -5.211 3.447) 6.338 3.906 ( -2.008 8.887 -5.709) 10.752 3.906 ( 2.008 8.887 5.709) 10.752 4.068 ( 1.488 -6.014 -4.629) 7.734 4.068 ( -1.488 -6.014 4.629) 7.734 4.220 ( 7.428 -0.856 -10.586) 12.961 4.220 ( -7.428 -0.856 10.586) 12.961 4.695 ( -2.964 -2.396 -6.266) 7.334 4.695 ( 2.964 -2.396 6.266) 7.334 4.862 ( -1.362 0.877 -0.846) 1.827 4.862 ( 1.362 0.877 0.846) 1.827 5.465 ( -4.283 0.612 -6.467) 7.781 5.465 ( 4.283 0.612 6.467) 7.781 5.653 ( -1.948 -2.653 -10.040) 10.566 5.653 ( 1.948 -2.653 10.040) 10.566 6.155 ( -6.745 4.819 -2.804) 8.751 6.155 ( 6.745 4.819 2.804) 8.751 6.348 ( -0.877 2.051 -0.766) 2.359 6.348 ( 0.877 2.051 0.766) 2.359 6.621 ( -4.340 -1.603 -0.863) 4.706 6.621 ( 4.340 -1.603 0.863) 4.706 6.956 ( 0.637 4.457 -5.294) 6.949 6.956 ( -0.637 4.457 5.294) 6.949 7.169 ( -0.275 1.046 -11.582) 11.632 7.169 ( 0.275 1.046 11.582) 11.632 7.387 ( -2.874 -1.299 -6.072) 6.842 7.387 ( 2.874 -1.299 6.072) 6.842 8.727 ( -0.920 -5.050 -6.255) 8.091 8.727 ( 0.920 -5.050 6.255) 8.091 9.026 ( 1.293 -2.828 -6.008) 6.765 9.026 ( -1.293 -2.828 6.008) 6.765 9.383 ( -5.040 -2.665 -6.142) 8.381 9.383 ( 5.040 -2.665 6.142) 8.381 9.676 ( -3.621 -2.053 -1.243) 4.344 9.676 ( 3.621 -2.053 1.243) 4.344 10.146 ( 11.216 -9.055 -14.203) 20.237 10.146 ( -11.216 -9.055 14.203) 20.237 10.909 ( -6.385 -0.481 -4.788) 7.996 10.909 ( 6.385 -0.481 4.788) 7.996 11.386 ( -7.617 1.365 -3.505) 8.495 11.386 ( 7.617 1.365 3.505) 8.495 11.607 ( -0.001 2.022 -7.890) 8.145 11.607 ( 0.001 2.022 7.890) 8.145 11.760 ( -1.711 -1.024 -2.045) 2.857 11.760 ( 1.711 -1.024 2.045) 2.857 12.081 ( -3.146 -0.444 -4.442) 5.461 12.081 ( 3.146 -0.444 4.442) 5.461 12.402 ( -1.210 4.927 -4.586) 6.838 12.402 ( 1.210 4.927 4.586) 6.838 12.786 ( -6.428 -1.841 -4.733) 8.193 12.786 ( 6.428 -1.841 4.733) 8.193 14.636 ( 3.957 0.842 -3.798) 5.549 14.636 ( -3.957 0.842 3.798) 5.549 14.899 ( -0.674 1.345 -3.310) 3.636 14.899 ( 0.674 1.345 3.310) 3.636 15.322 ( 2.357 -3.127 -3.066) 4.973 15.322 ( -2.357 -3.127 3.066) 4.973 15.498 ( -0.429 4.158 -2.356) 4.798 15.498 ( 0.429 4.158 2.356) 4.798 15.812 ( -5.162 2.615 -1.296) 5.930 15.812 ( 5.162 2.615 1.296) 5.930 16.397 ( 0.826 -1.581 -7.369) 7.582 16.397 ( -0.826 -1.581 7.369) 7.582 17.203 ( 5.157 11.163 -4.954) 13.257 17.203 ( -5.157 11.163 4.954) 13.257 17.523 ( -1.703 -0.902 -5.706) 6.022 17.523 ( 1.703 -0.902 5.706) 6.022 25.698 ( -0.639 -2.921 -0.565) 3.043 25.698 ( 0.639 -2.921 0.565) 3.043 25.773 ( -1.705 0.289 -1.046) 2.021 25.773 ( 1.705 0.289 1.046) 2.021 25.916 ( 0.893 0.435 -8.277) 8.336 25.916 ( -0.893 0.435 8.277) 8.336 26.448 ( -2.214 -1.523 -3.697) 4.570 26.448 ( 2.214 -1.523 3.697) 4.570 26.926 ( -2.633 -0.525 -9.980) 10.335 26.926 ( 2.633 -0.525 9.980) 10.335 28.142 ( 0.676 -4.341 -7.231) 8.461 28.142 ( -0.676 -4.341 7.231) 8.461 28.486 ( -4.173 -8.134 -3.978) 9.970 28.486 ( 4.173 -8.134 3.978) 9.970 29.587 ( 3.225 14.534 -12.555) 19.475 29.587 ( -3.225 14.534 12.555) 19.475 ======================= Grid point 291 (139/140) ======================= q-point: ( 0.44 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.051 ( 6.353 0.000 3.004) 7.027 1.123 ( -0.178 -0.000 -2.812) 2.818 1.660 ( 23.301 0.000 8.658) 24.858 1.869 ( -2.192 -0.000 3.625) 4.236 1.985 ( -5.690 -0.000 -9.609) 11.167 2.129 ( -17.788 -0.000 -15.804) 23.795 2.418 ( 6.452 0.000 2.449) 6.902 2.479 ( 0.544 0.000 0.426) 0.691 2.819 ( 5.277 0.000 12.017) 13.125 2.990 ( -0.474 -0.000 -7.990) 8.004 3.076 ( 6.125 0.000 -5.964) 8.549 3.139 ( -8.261 -0.000 3.247) 8.876 3.477 ( 1.790 0.000 0.698) 1.921 3.551 ( 4.511 0.000 11.035) 11.921 3.583 ( -2.314 -0.000 -8.532) 8.840 3.739 ( -9.682 -0.000 -2.539) 10.009 3.983 ( -1.933 -0.000 2.110) 2.861 3.994 ( 1.354 0.000 -4.828) 5.014 4.341 ( 2.762 0.000 0.087) 2.764 4.379 ( -2.571 -0.000 1.863) 3.175 4.481 ( 13.092 0.000 0.709) 13.111 4.692 ( -13.463 -0.000 2.018) 13.613 4.955 ( -1.319 -0.000 3.168) 3.431 4.970 ( 1.777 0.000 -4.124) 4.490 5.419 ( 0.796 0.000 7.645) 7.686 5.521 ( -2.669 -0.000 -6.485) 7.013 5.609 ( 3.337 0.000 3.225) 4.640 5.679 ( -0.129 -0.000 -5.333) 5.335 6.200 ( 4.755 0.000 5.832) 7.524 6.312 ( -1.535 -0.000 -6.859) 7.029 6.430 ( 2.698 0.000 6.572) 7.104 6.451 ( 3.448 0.000 -2.278) 4.133 6.607 ( -4.584 -0.000 0.052) 4.585 6.608 ( -2.371 -0.000 -2.229) 3.255 7.039 ( 4.113 0.000 3.349) 5.304 7.080 ( 6.141 0.000 -7.003) 9.314 7.179 ( -6.910 -0.000 6.448) 9.451 7.237 ( -8.332 -0.000 -2.591) 8.726 7.352 ( 2.816 0.000 11.591) 11.928 7.488 ( -0.673 -0.000 -9.314) 9.338 8.324 ( 6.999 0.000 4.074) 8.098 8.513 ( -10.662 -0.000 -4.844) 11.710 8.907 ( -0.521 -0.000 10.021) 10.035 8.983 ( 0.987 0.000 -7.677) 7.740 9.241 ( 1.276 0.000 4.180) 4.370 9.249 ( 3.385 0.000 -3.710) 5.022 9.455 ( 0.516 0.000 17.488) 17.496 9.667 ( -3.296 -0.000 -10.789) 11.281 9.849 ( -0.192 -0.000 -11.744) 11.746 9.868 ( -6.313 -0.000 -0.920) 6.379 10.802 ( 8.115 0.000 -2.906) 8.620 10.858 ( -3.074 -0.000 2.853) 4.194 11.302 ( 9.024 0.000 -2.496) 9.363 11.448 ( -8.141 -0.000 -2.021) 8.388 11.576 ( 8.008 0.000 5.857) 9.922 11.649 ( 3.891 0.000 3.983) 5.568 11.751 ( 0.914 0.000 -4.095) 4.196 11.814 ( -9.719 -0.000 -3.449) 10.312 11.991 ( 1.602 0.000 -5.973) 6.184 12.050 ( -7.823 -0.000 -0.184) 7.825 12.284 ( -0.166 -0.000 7.702) 7.704 12.357 ( -3.145 -0.000 -4.840) 5.772 13.040 ( 7.048 0.000 7.300) 10.148 13.202 ( -5.447 -0.000 -6.082) 8.165 14.698 ( 4.671 0.000 -1.669) 4.960 14.772 ( -7.328 -0.000 2.983) 7.912 15.036 ( -1.611 -0.000 8.738) 8.885 15.084 ( 0.603 0.000 -1.260) 1.397 15.123 ( 7.723 0.000 -8.446) 11.444 15.185 ( -6.414 -0.000 -1.372) 6.559 15.683 ( 2.379 0.000 0.399) 2.412 15.688 ( 0.098 0.000 3.180) 3.181 15.877 ( 5.990 0.000 0.984) 6.070 15.987 ( -6.032 -0.000 -0.747) 6.078 16.256 ( 4.203 0.000 -0.144) 4.206 16.318 ( -3.832 -0.000 -0.100) 3.833 17.384 ( 3.315 0.000 5.859) 6.732 17.445 ( 6.274 0.000 -3.629) 7.248 17.565 ( 7.554 0.000 -5.722) 9.477 17.710 ( -15.131 -0.000 8.659) 17.433 25.582 ( 1.666 0.000 -1.004) 1.946 25.596 ( -0.930 -0.000 0.257) 0.965 25.738 ( 0.460 0.000 0.821) 0.941 25.770 ( -2.212 -0.000 -1.062) 2.454 25.939 ( -1.385 -0.000 6.322) 6.472 26.002 ( 0.023 0.000 -8.760) 8.760 26.397 ( -0.829 -0.000 -0.510) 0.973 26.400 ( -0.407 -0.000 -1.094) 1.167 26.875 ( -1.881 -0.000 5.437) 5.753 26.918 ( 1.274 0.000 -9.842) 9.924 27.902 ( 7.238 0.000 -3.713) 8.135 27.943 ( -5.911 -0.000 8.372) 10.248 28.267 ( -0.835 -0.000 2.499) 2.635 28.283 ( -0.033 -0.000 -1.829) 1.829 30.018 ( -6.081 -0.000 27.027) 27.703 30.125 ( 11.092 0.000 -23.362) 25.861 ======================= Grid point 292 (140/140) ======================= q-point: ( 0.56 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.246 ( -3.485 -15.950 -9.151) 18.716 1.246 ( 3.485 -15.950 9.151) 18.716 1.909 ( -15.975 -6.163 -11.489) 20.620 1.909 ( 15.975 -6.163 11.489) 20.620 2.093 ( -7.017 -15.284 -6.766) 18.128 2.093 ( 7.017 -15.284 6.766) 18.128 2.441 ( -1.725 2.215 -2.426) 3.711 2.441 ( 1.725 2.215 2.426) 3.711 2.926 ( -3.321 -0.638 -7.105) 7.869 2.926 ( 3.321 -0.638 7.105) 7.869 3.098 ( -8.703 -0.609 1.241) 8.812 3.098 ( 8.703 -0.609 -1.241) 8.812 3.455 ( 1.674 4.121 -5.551) 7.113 3.455 ( -1.674 4.121 5.551) 7.113 3.763 ( 0.343 -9.811 -5.489) 11.247 3.763 ( -0.343 -9.811 5.489) 11.247 4.013 ( 1.869 -3.003 -5.853) 6.839 4.013 ( -1.869 -3.003 5.853) 6.839 4.309 ( 3.177 5.592 -4.842) 8.050 4.309 ( -3.177 5.592 4.842) 8.050 4.612 ( -13.830 -2.204 -0.895) 14.033 4.612 ( 13.830 -2.204 0.895) 14.033 4.931 ( -0.520 3.102 -3.875) 4.991 4.931 ( 0.520 3.102 3.875) 4.991 5.474 ( -2.976 -0.432 -6.406) 7.077 5.474 ( 2.976 -0.432 6.406) 7.077 5.639 ( -1.817 0.803 -5.960) 6.282 5.639 ( 1.817 0.803 5.960) 6.282 6.241 ( -3.630 1.971 -6.189) 7.441 6.241 ( 3.630 1.971 6.189) 7.441 6.447 ( -1.934 1.796 -3.701) 4.546 6.447 ( 1.934 1.796 3.701) 4.546 6.592 ( -7.189 -0.428 -3.633) 8.066 6.592 ( 7.189 -0.428 3.633) 8.066 7.074 ( -3.967 1.361 -4.272) 5.986 7.074 ( 3.967 1.361 4.272) 5.986 7.164 ( 4.410 0.729 -6.171) 7.620 7.164 ( -4.410 0.729 6.171) 7.620 7.415 ( -2.004 1.359 -8.590) 8.924 7.415 ( 2.004 1.359 8.590) 8.924 8.477 ( -8.200 -7.263 -4.338) 11.781 8.477 ( 8.200 -7.263 4.338) 11.781 8.956 ( 0.433 -1.042 -7.917) 7.997 8.956 ( -0.433 -1.042 7.917) 7.997 9.279 ( -1.686 -2.544 -2.138) 3.726 9.279 ( 1.686 -2.544 2.138) 3.726 9.597 ( -4.125 -3.111 -11.861) 12.938 9.597 ( 4.125 -3.111 11.861) 12.938 9.867 ( 7.127 -4.662 -7.125) 11.104 9.867 ( -7.127 -4.662 7.125) 11.104 10.858 ( -0.497 -1.869 -3.417) 3.927 10.858 ( 0.497 -1.869 3.417) 3.927 11.374 ( -8.602 -0.576 -0.763) 8.655 11.374 ( 8.602 -0.576 0.763) 8.655 11.646 ( -4.874 1.312 -8.996) 10.316 11.646 ( 4.874 1.312 8.996) 10.316 11.761 ( -0.278 -1.243 -5.557) 5.701 11.761 ( 0.278 -1.243 5.557) 5.701 12.018 ( -1.256 -2.089 -0.938) 2.612 12.018 ( 1.256 -2.089 0.938) 2.612 12.329 ( -0.754 -1.555 -6.275) 6.509 12.329 ( 0.754 -1.555 6.275) 6.509 13.059 ( -6.740 7.671 -6.221) 11.958 13.059 ( 6.740 7.671 6.221) 11.958 14.716 ( 6.260 1.860 -2.939) 7.161 14.716 ( -6.260 1.860 2.939) 7.161 15.006 ( -1.242 5.034 -5.661) 7.677 15.006 ( 1.242 5.034 5.661) 7.677 15.195 ( 3.689 -4.058 -6.940) 8.846 15.195 ( -3.689 -4.058 6.940) 8.846 15.650 ( 0.252 4.521 -3.942) 6.003 15.650 ( -0.252 4.521 3.942) 6.003 15.914 ( -4.241 2.139 -2.313) 5.283 15.914 ( 4.241 2.139 2.313) 5.283 16.317 ( -2.220 -2.862 -3.297) 4.899 16.317 ( 2.220 -2.862 3.297) 4.899 17.434 ( 0.028 0.362 -4.598) 4.612 17.434 ( -0.028 0.362 4.598) 4.612 17.582 ( 11.533 5.072 -6.158) 14.024 17.582 ( -11.533 5.072 6.158) 14.024 25.605 ( 0.357 -1.816 -0.576) 1.938 25.605 ( -0.357 -1.816 0.576) 1.938 25.759 ( -1.462 -0.878 -1.119) 2.040 25.759 ( 1.462 -0.878 1.119) 2.040 25.954 ( 1.110 1.191 -7.932) 8.097 25.954 ( -1.110 1.191 7.932) 8.097 26.400 ( -0.904 -0.778 -1.531) 1.941 26.400 ( 0.904 -0.778 1.531) 1.941 26.901 ( -0.093 -1.068 -8.264) 8.334 26.901 ( 0.093 -1.068 8.264) 8.334 27.969 ( 4.933 -4.236 -5.539) 8.541 27.969 ( -4.933 -4.236 5.539) 8.541 28.296 ( -0.232 -2.710 -1.854) 3.291 28.296 ( 0.232 -2.710 1.854) 3.291 30.012 ( 7.850 8.451 -23.346) 26.040 30.012 ( -7.850 8.451 23.346) 26.040 =================== 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 3/46656 10.0 1370.328 783.146 984.738 -0.000 -117.041 0.000 3/46656 20.0 207.096 178.743 182.535 -0.000 -4.727 0.000 3/46656 30.0 82.036 82.673 75.621 -0.000 -0.900 0.000 3/46656 40.0 45.448 48.913 43.151 -0.000 -0.204 0.000 3/46656 50.0 29.671 32.999 28.776 -0.000 0.010 0.000 3/46656 60.0 21.365 24.189 21.047 -0.000 0.087 0.000 3/46656 70.0 16.416 18.772 16.363 -0.000 0.114 0.000 3/46656 80.0 13.207 15.183 13.280 -0.000 0.121 0.000 3/46656 90.0 10.991 12.668 11.126 -0.000 0.119 0.000 3/46656 100.0 9.386 10.828 9.550 -0.000 0.113 0.000 3/46656 110.0 8.179 9.434 8.355 -0.000 0.107 0.000 3/46656 120.0 7.244 8.347 7.421 -0.000 0.099 0.000 3/46656 130.0 6.501 7.480 6.674 -0.000 0.092 0.000 3/46656 140.0 5.897 6.775 6.064 -0.000 0.086 0.000 3/46656 150.0 5.399 6.191 5.557 -0.000 0.080 0.000 3/46656 160.0 4.980 5.700 5.130 -0.000 0.075 0.000 3/46656 170.0 4.624 5.282 4.766 -0.000 0.070 0.000 3/46656 180.0 4.318 4.922 4.451 -0.000 0.066 0.000 3/46656 190.0 4.053 4.610 4.177 -0.000 0.062 0.000 3/46656 200.0 3.820 4.336 3.936 -0.000 0.058 0.000 3/46656 210.0 3.614 4.093 3.723 -0.000 0.055 0.000 3/46656 220.0 3.430 3.878 3.533 -0.000 0.053 0.000 3/46656 230.0 3.266 3.685 3.362 -0.000 0.050 0.000 3/46656 240.0 3.118 3.511 3.208 -0.000 0.048 0.000 3/46656 250.0 2.984 3.353 3.068 -0.000 0.046 0.000 3/46656 260.0 2.862 3.210 2.941 -0.000 0.044 0.000 3/46656 270.0 2.751 3.079 2.824 -0.000 0.043 0.000 3/46656 280.0 2.648 2.959 2.717 -0.000 0.041 0.000 3/46656 290.0 2.554 2.849 2.618 -0.000 0.040 0.000 3/46656 300.0 2.467 2.747 2.527 -0.000 0.039 0.000 3/46656 310.0 2.386 2.652 2.442 -0.000 0.038 0.000 3/46656 320.0 2.310 2.564 2.363 -0.000 0.037 0.000 3/46656 330.0 2.240 2.482 2.289 -0.000 0.036 0.000 3/46656 340.0 2.174 2.405 2.220 -0.000 0.035 0.000 3/46656 350.0 2.112 2.333 2.156 -0.000 0.034 0.000 3/46656 360.0 2.054 2.266 2.095 -0.000 0.034 0.000 3/46656 370.0 2.000 2.202 2.038 -0.000 0.033 0.000 3/46656 380.0 1.948 2.143 1.983 -0.000 0.032 0.000 3/46656 390.0 1.899 2.086 1.932 -0.000 0.032 0.000 3/46656 400.0 1.853 2.033 1.884 -0.000 0.031 0.000 3/46656 410.0 1.808 1.982 1.838 -0.000 0.031 0.000 3/46656 420.0 1.767 1.934 1.794 -0.000 0.030 0.000 3/46656 430.0 1.727 1.888 1.752 -0.000 0.030 0.000 3/46656 440.0 1.689 1.845 1.713 -0.000 0.029 0.000 3/46656 450.0 1.652 1.803 1.675 -0.000 0.029 0.000 3/46656 460.0 1.618 1.763 1.639 -0.000 0.028 0.000 3/46656 470.0 1.585 1.726 1.604 -0.000 0.028 0.000 3/46656 480.0 1.553 1.689 1.571 -0.000 0.028 0.000 3/46656 490.0 1.522 1.655 1.540 -0.000 0.027 0.000 3/46656 500.0 1.493 1.621 1.509 -0.000 0.027 0.000 3/46656 510.0 1.465 1.590 1.480 -0.000 0.026 0.000 3/46656 520.0 1.438 1.559 1.452 -0.000 0.026 0.000 3/46656 530.0 1.411 1.529 1.425 -0.000 0.026 0.000 3/46656 540.0 1.386 1.501 1.399 -0.000 0.025 0.000 3/46656 550.0 1.362 1.474 1.374 -0.000 0.025 0.000 3/46656 560.0 1.339 1.448 1.350 -0.000 0.025 0.000 3/46656 570.0 1.316 1.422 1.326 -0.000 0.024 0.000 3/46656 580.0 1.294 1.398 1.304 -0.000 0.024 0.000 3/46656 590.0 1.273 1.374 1.282 -0.000 0.024 0.000 3/46656 600.0 1.253 1.351 1.261 -0.000 0.023 0.000 3/46656 610.0 1.233 1.329 1.241 -0.000 0.023 0.000 3/46656 620.0 1.214 1.308 1.221 -0.000 0.023 0.000 3/46656 630.0 1.195 1.287 1.202 -0.000 0.023 0.000 3/46656 640.0 1.177 1.267 1.184 -0.000 0.022 0.000 3/46656 650.0 1.160 1.248 1.166 -0.000 0.022 0.000 3/46656 660.0 1.143 1.229 1.148 -0.000 0.022 0.000 3/46656 670.0 1.127 1.211 1.132 -0.000 0.022 0.000 3/46656 680.0 1.111 1.193 1.115 -0.000 0.021 0.000 3/46656 690.0 1.095 1.176 1.099 -0.000 0.021 0.000 3/46656 700.0 1.080 1.159 1.084 -0.000 0.021 0.000 3/46656 710.0 1.065 1.143 1.069 -0.000 0.021 0.000 3/46656 720.0 1.051 1.127 1.054 -0.000 0.020 0.000 3/46656 730.0 1.037 1.112 1.040 -0.000 0.020 0.000 3/46656 740.0 1.024 1.097 1.026 -0.000 0.020 0.000 3/46656 750.0 1.010 1.083 1.013 -0.000 0.020 0.000 3/46656 760.0 0.998 1.068 1.000 -0.000 0.020 0.000 3/46656 770.0 0.985 1.055 0.987 -0.000 0.019 0.000 3/46656 780.0 0.973 1.041 0.975 -0.000 0.019 0.000 3/46656 790.0 0.961 1.028 0.962 -0.000 0.019 0.000 3/46656 800.0 0.949 1.015 0.951 -0.000 0.019 0.000 3/46656 810.0 0.938 1.003 0.939 -0.000 0.019 0.000 3/46656 820.0 0.927 0.991 0.928 -0.000 0.018 0.000 3/46656 830.0 0.916 0.979 0.917 -0.000 0.018 0.000 3/46656 840.0 0.905 0.967 0.906 -0.000 0.018 0.000 3/46656 850.0 0.895 0.956 0.896 -0.000 0.018 0.000 3/46656 860.0 0.885 0.945 0.885 -0.000 0.018 0.000 3/46656 870.0 0.875 0.934 0.875 -0.000 0.018 0.000 3/46656 880.0 0.865 0.924 0.865 -0.000 0.017 0.000 3/46656 890.0 0.856 0.914 0.856 -0.000 0.017 0.000 3/46656 900.0 0.847 0.903 0.846 -0.000 0.017 0.000 3/46656 910.0 0.838 0.894 0.837 -0.000 0.017 0.000 3/46656 920.0 0.829 0.884 0.828 -0.000 0.017 0.000 3/46656 930.0 0.820 0.875 0.820 -0.000 0.017 0.000 3/46656 940.0 0.812 0.865 0.811 -0.000 0.016 0.000 3/46656 950.0 0.803 0.856 0.803 -0.000 0.016 0.000 3/46656 960.0 0.795 0.847 0.794 -0.000 0.016 0.000 3/46656 970.0 0.787 0.839 0.786 -0.000 0.016 0.000 3/46656 980.0 0.779 0.830 0.778 -0.000 0.016 0.000 3/46656 990.0 0.772 0.822 0.771 -0.000 0.016 0.000 3/46656 1000.0 0.764 0.814 0.763 -0.000 0.016 0.000 3/46656 Thermal conductivity related properties were written into "kappa-m996.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 01:05:58]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|