----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-09 02:12:49]------------------------- 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: [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.268548800126780 0.000000000000000 0.000000000000000 b 0.000000000000000 5.979683800000000 0.000000000000000 c -3.502947732988866 0.000000000000000 9.611259401560645 Atomic positions (fractional): *1 Li 0.28810205942852 0.22312664695640 0.14196520220668 6.941 *2 Li 0.28316116338787 0.76980488744246 0.13934237771047 6.941 *3 Li 0.66623845630990 0.50378485891910 0.12455357457427 6.941 4 Li 0.33376154369010 0.00378485891910 0.37544642542573 6.941 5 Li 0.71683883661213 0.26980488744246 0.36065762228953 6.941 6 Li 0.71189794057148 0.72312664695640 0.35803479779332 6.941 7 Li 0.28810205942852 0.27687335304360 0.64196520220668 6.941 8 Li 0.28316116338787 0.73019511255754 0.63934237771047 6.941 9 Li 0.66623845630990 0.99621514108090 0.62455357457427 6.941 10 Li 0.33376154369010 0.49621514108090 0.87544642542573 6.941 11 Li 0.71683883661213 0.23019511255754 0.86065762228953 6.941 12 Li 0.71189794057148 0.77687335304360 0.85803479779332 6.941 *13 Hf 0.76829959749826 0.99679280875168 0.13307769235449 178.490 14 Hf 0.23170040250174 0.49679280875168 0.36692230764551 178.490 15 Hf 0.76829959749826 0.50320719124832 0.63307769235449 178.490 16 Hf 0.23170040250174 0.00320719124832 0.86692230764551 178.490 *17 O 0.00000000000000 0.00000000000000 0.00000000000000 15.999 *18 O 0.50560722578729 0.23386927220431 0.00186548879539 15.999 *19 O 0.45958221432965 0.49632121794361 0.24429243985493 15.999 *20 O 0.98838986077072 0.73383633145682 0.24246139409518 15.999 21 O 0.01161013922928 0.23383633145682 0.25753860590481 15.999 22 O 0.54041778567035 0.99632121794361 0.25570756014507 15.999 23 O 0.49439277421271 0.73386927220431 0.49813451120461 15.999 24 O 0.00000000000000 0.50000000000000 0.50000000000000 15.999 25 O 0.50560722578729 0.26613072779569 0.50186548879538 15.999 26 O 0.45958221432965 0.00367878205639 0.74429243985493 15.999 27 O 0.98838986077072 0.76616366854318 0.74246139409518 15.999 28 O 0.01161013922928 0.26616366854318 0.75753860590482 15.999 29 O 0.54041778567035 0.50367878205639 0.75570756014507 15.999 30 O 0.49439277421271 0.76613072779569 0.99813451120462 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.268548800126780 0.000000000000000 0.000000000000000 b 0.000000000000000 5.979683800000000 0.000000000000000 c -3.502947732988866 0.000000000000000 9.611259401560645 Atomic positions (fractional): *1 Li 0.28810205942852 0.22312664695640 0.14196520220668 6.941 > 1 *2 Li 0.28316116338787 0.76980488744246 0.13934237771047 6.941 > 2 *3 Li 0.66623845630990 0.50378485891910 0.12455357457427 6.941 > 3 4 Li 0.33376154369010 0.00378485891910 0.37544642542573 6.941 > 4 5 Li 0.71683883661213 0.26980488744246 0.36065762228953 6.941 > 5 6 Li 0.71189794057148 0.72312664695640 0.35803479779332 6.941 > 6 7 Li 0.28810205942852 0.27687335304360 0.64196520220668 6.941 > 7 8 Li 0.28316116338787 0.73019511255754 0.63934237771047 6.941 > 8 9 Li 0.66623845630990 0.99621514108090 0.62455357457427 6.941 > 9 10 Li 0.33376154369010 0.49621514108090 0.87544642542573 6.941 > 10 11 Li 0.71683883661213 0.23019511255754 0.86065762228953 6.941 > 11 12 Li 0.71189794057148 0.77687335304360 0.85803479779332 6.941 > 12 *13 Hf 0.76829959749826 0.99679280875168 0.13307769235449 178.490 > 13 14 Hf 0.23170040250174 0.49679280875168 0.36692230764551 178.490 > 14 15 Hf 0.76829959749826 0.50320719124832 0.63307769235449 178.490 > 15 16 Hf 0.23170040250174 0.00320719124832 0.86692230764551 178.490 > 16 *17 O 0.00000000000000 0.00000000000000 0.00000000000000 15.999 > 17 *18 O 0.50560722578729 0.23386927220431 0.00186548879539 15.999 > 18 *19 O 0.45958221432965 0.49632121794361 0.24429243985493 15.999 > 19 *20 O 0.98838986077072 0.73383633145682 0.24246139409518 15.999 > 20 21 O 0.01161013922928 0.23383633145682 0.25753860590481 15.999 > 21 22 O 0.54041778567035 0.99632121794361 0.25570756014507 15.999 > 22 23 O 0.49439277421271 0.73386927220431 0.49813451120461 15.999 > 23 24 O 0.00000000000000 0.50000000000000 0.50000000000000 15.999 > 24 25 O 0.50560722578729 0.26613072779569 0.50186548879538 15.999 > 25 26 O 0.45958221432965 0.00367878205639 0.74429243985493 15.999 > 26 27 O 0.98838986077072 0.76616366854318 0.74246139409518 15.999 > 27 28 O 0.01161013922928 0.26616366854318 0.75753860590482 15.999 > 28 29 O 0.54041778567035 0.50367878205639 0.75570756014507 15.999 > 29 30 O 0.49439277421271 0.76613072779569 0.99813451120462 15.999 > 30 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.537097600253560 0.000000000000000 0.000000000000000 b 0.000000000000000 11.959367600000000 0.000000000000000 c -3.502947732988866 0.000000000000000 9.611259401560645 Atomic positions (fractional): *1 Li 0.14405102971426 0.11156332347820 0.14196520220668 6.941 > 1 2 Li 0.64405102971426 0.11156332347820 0.14196520220668 6.941 > 1 3 Li 0.14405102971426 0.61156332347820 0.14196520220668 6.941 > 1 4 Li 0.64405102971426 0.61156332347820 0.14196520220668 6.941 > 1 *5 Li 0.14158058169394 0.38490244372123 0.13934237771047 6.941 > 2 6 Li 0.64158058169394 0.38490244372123 0.13934237771047 6.941 > 2 7 Li 0.14158058169394 0.88490244372123 0.13934237771047 6.941 > 2 8 Li 0.64158058169394 0.88490244372123 0.13934237771047 6.941 > 2 *9 Li 0.33311922815495 0.25189242945955 0.12455357457427 6.941 > 3 10 Li 0.83311922815495 0.25189242945955 0.12455357457427 6.941 > 3 11 Li 0.33311922815495 0.75189242945955 0.12455357457427 6.941 > 3 12 Li 0.83311922815495 0.75189242945955 0.12455357457427 6.941 > 3 13 Li 0.16688077184505 0.00189242945955 0.37544642542573 6.941 > 4 14 Li 0.66688077184505 0.00189242945955 0.37544642542573 6.941 > 4 15 Li 0.16688077184505 0.50189242945955 0.37544642542573 6.941 > 4 16 Li 0.66688077184505 0.50189242945955 0.37544642542573 6.941 > 4 17 Li 0.35841941830606 0.13490244372123 0.36065762228953 6.941 > 5 18 Li 0.85841941830606 0.13490244372123 0.36065762228953 6.941 > 5 19 Li 0.35841941830606 0.63490244372123 0.36065762228953 6.941 > 5 20 Li 0.85841941830606 0.63490244372123 0.36065762228953 6.941 > 5 21 Li 0.35594897028574 0.36156332347820 0.35803479779332 6.941 > 6 22 Li 0.85594897028574 0.36156332347820 0.35803479779332 6.941 > 6 23 Li 0.35594897028574 0.86156332347820 0.35803479779332 6.941 > 6 24 Li 0.85594897028574 0.86156332347820 0.35803479779332 6.941 > 6 25 Li 0.14405102971426 0.13843667652180 0.64196520220668 6.941 > 7 26 Li 0.64405102971426 0.13843667652180 0.64196520220668 6.941 > 7 27 Li 0.14405102971426 0.63843667652180 0.64196520220668 6.941 > 7 28 Li 0.64405102971426 0.63843667652180 0.64196520220668 6.941 > 7 29 Li 0.14158058169394 0.36509755627877 0.63934237771047 6.941 > 8 30 Li 0.64158058169394 0.36509755627877 0.63934237771047 6.941 > 8 31 Li 0.14158058169394 0.86509755627877 0.63934237771047 6.941 > 8 32 Li 0.64158058169394 0.86509755627877 0.63934237771047 6.941 > 8 33 Li 0.33311922815495 0.49810757054045 0.62455357457427 6.941 > 9 34 Li 0.83311922815495 0.49810757054045 0.62455357457427 6.941 > 9 35 Li 0.33311922815495 0.99810757054045 0.62455357457427 6.941 > 9 36 Li 0.83311922815495 0.99810757054045 0.62455357457427 6.941 > 9 37 Li 0.16688077184505 0.24810757054045 0.87544642542573 6.941 > 10 38 Li 0.66688077184505 0.24810757054045 0.87544642542573 6.941 > 10 39 Li 0.16688077184505 0.74810757054045 0.87544642542573 6.941 > 10 40 Li 0.66688077184505 0.74810757054045 0.87544642542573 6.941 > 10 41 Li 0.35841941830606 0.11509755627877 0.86065762228953 6.941 > 11 42 Li 0.85841941830606 0.11509755627877 0.86065762228953 6.941 > 11 43 Li 0.35841941830606 0.61509755627877 0.86065762228953 6.941 > 11 44 Li 0.85841941830606 0.61509755627877 0.86065762228953 6.941 > 11 45 Li 0.35594897028574 0.38843667652180 0.85803479779332 6.941 > 12 46 Li 0.85594897028574 0.38843667652180 0.85803479779332 6.941 > 12 47 Li 0.35594897028574 0.88843667652180 0.85803479779332 6.941 > 12 48 Li 0.85594897028574 0.88843667652180 0.85803479779332 6.941 > 12 *49 Hf 0.38414979874913 0.49839640437584 0.13307769235449 178.490 > 13 50 Hf 0.88414979874913 0.49839640437584 0.13307769235449 178.490 > 13 51 Hf 0.38414979874913 0.99839640437584 0.13307769235449 178.490 > 13 52 Hf 0.88414979874913 0.99839640437584 0.13307769235449 178.490 > 13 53 Hf 0.11585020125087 0.24839640437584 0.36692230764551 178.490 > 14 54 Hf 0.61585020125087 0.24839640437584 0.36692230764551 178.490 > 14 55 Hf 0.11585020125087 0.74839640437584 0.36692230764551 178.490 > 14 56 Hf 0.61585020125087 0.74839640437584 0.36692230764551 178.490 > 14 57 Hf 0.38414979874913 0.25160359562416 0.63307769235449 178.490 > 15 58 Hf 0.88414979874913 0.25160359562416 0.63307769235449 178.490 > 15 59 Hf 0.38414979874913 0.75160359562416 0.63307769235449 178.490 > 15 60 Hf 0.88414979874913 0.75160359562416 0.63307769235449 178.490 > 15 61 Hf 0.11585020125087 0.00160359562416 0.86692230764551 178.490 > 16 62 Hf 0.61585020125087 0.00160359562416 0.86692230764551 178.490 > 16 63 Hf 0.11585020125087 0.50160359562416 0.86692230764551 178.490 > 16 64 Hf 0.61585020125087 0.50160359562416 0.86692230764551 178.490 > 16 *65 O 0.00000000000000 0.00000000000000 0.00000000000000 15.999 > 17 66 O 0.50000000000000 0.00000000000000 0.00000000000000 15.999 > 17 67 O 0.00000000000000 0.50000000000000 0.00000000000000 15.999 > 17 68 O 0.50000000000000 0.50000000000000 0.00000000000000 15.999 > 17 *69 O 0.25280361289364 0.11693463610216 0.00186548879539 15.999 > 18 70 O 0.75280361289364 0.11693463610216 0.00186548879539 15.999 > 18 71 O 0.25280361289364 0.61693463610216 0.00186548879539 15.999 > 18 72 O 0.75280361289364 0.61693463610216 0.00186548879539 15.999 > 18 *73 O 0.22979110716482 0.24816060897181 0.24429243985493 15.999 > 19 74 O 0.72979110716482 0.24816060897181 0.24429243985493 15.999 > 19 75 O 0.22979110716482 0.74816060897181 0.24429243985493 15.999 > 19 76 O 0.72979110716482 0.74816060897181 0.24429243985493 15.999 > 19 *77 O 0.49419493038536 0.36691816572841 0.24246139409518 15.999 > 20 78 O 0.99419493038536 0.36691816572841 0.24246139409518 15.999 > 20 79 O 0.49419493038536 0.86691816572841 0.24246139409518 15.999 > 20 80 O 0.99419493038536 0.86691816572841 0.24246139409518 15.999 > 20 81 O 0.00580506961464 0.11691816572841 0.25753860590481 15.999 > 21 82 O 0.50580506961464 0.11691816572841 0.25753860590481 15.999 > 21 83 O 0.00580506961464 0.61691816572841 0.25753860590481 15.999 > 21 84 O 0.50580506961464 0.61691816572841 0.25753860590481 15.999 > 21 85 O 0.27020889283518 0.49816060897181 0.25570756014507 15.999 > 22 86 O 0.77020889283518 0.49816060897181 0.25570756014507 15.999 > 22 87 O 0.27020889283518 0.99816060897181 0.25570756014507 15.999 > 22 88 O 0.77020889283518 0.99816060897181 0.25570756014507 15.999 > 22 89 O 0.24719638710636 0.36693463610216 0.49813451120461 15.999 > 23 90 O 0.74719638710636 0.36693463610216 0.49813451120461 15.999 > 23 91 O 0.24719638710636 0.86693463610216 0.49813451120461 15.999 > 23 92 O 0.74719638710636 0.86693463610216 0.49813451120461 15.999 > 23 93 O 0.00000000000000 0.25000000000000 0.50000000000000 15.999 > 24 94 O 0.50000000000000 0.25000000000000 0.50000000000000 15.999 > 24 95 O 0.00000000000000 0.75000000000000 0.50000000000000 15.999 > 24 96 O 0.50000000000000 0.75000000000000 0.50000000000000 15.999 > 24 97 O 0.25280361289364 0.13306536389784 0.50186548879538 15.999 > 25 98 O 0.75280361289364 0.13306536389784 0.50186548879538 15.999 > 25 99 O 0.25280361289364 0.63306536389784 0.50186548879538 15.999 > 25 100 O 0.75280361289364 0.63306536389784 0.50186548879538 15.999 > 25 101 O 0.22979110716482 0.00183939102819 0.74429243985493 15.999 > 26 102 O 0.72979110716482 0.00183939102819 0.74429243985493 15.999 > 26 103 O 0.22979110716482 0.50183939102819 0.74429243985493 15.999 > 26 104 O 0.72979110716482 0.50183939102819 0.74429243985493 15.999 > 26 105 O 0.49419493038536 0.38308183427159 0.74246139409518 15.999 > 27 106 O 0.99419493038536 0.38308183427159 0.74246139409518 15.999 > 27 107 O 0.49419493038536 0.88308183427159 0.74246139409518 15.999 > 27 108 O 0.99419493038536 0.88308183427159 0.74246139409518 15.999 > 27 109 O 0.00580506961464 0.13308183427159 0.75753860590482 15.999 > 28 110 O 0.50580506961464 0.13308183427159 0.75753860590482 15.999 > 28 111 O 0.00580506961464 0.63308183427159 0.75753860590482 15.999 > 28 112 O 0.50580506961464 0.63308183427159 0.75753860590482 15.999 > 28 113 O 0.27020889283518 0.25183939102819 0.75570756014507 15.999 > 29 114 O 0.77020889283518 0.25183939102819 0.75570756014507 15.999 > 29 115 O 0.27020889283518 0.75183939102819 0.75570756014507 15.999 > 29 116 O 0.77020889283518 0.75183939102819 0.75570756014507 15.999 > 29 117 O 0.24719638710636 0.38306536389784 0.99813451120462 15.999 > 30 118 O 0.74719638710636 0.38306536389784 0.99813451120462 15.999 > 30 119 O 0.24719638710636 0.88306536389784 0.99813451120462 15.999 > 30 120 O 0.74719638710636 0.88306536389784 0.99813451120462 15.999 > 30 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.6962817 0.0000000 0.0339045 0.0000000 3.4790613 0.0000000 0.0339068 0.0000000 3.6906096 -------------------------- Born effective charges -------------------------- 1 Li 1.0130840 -0.1126806 -0.0522976 -0.0349998 0.9076783 0.1971240 -0.0635307 0.2258986 0.9319314 2 Li 1.0195695 0.1143872 -0.0419101 0.0358149 0.9180482 -0.1969311 -0.0655883 -0.2335500 0.9294084 3 Li 0.9652761 0.0176450 0.0060139 0.0075483 1.2820392 0.0083516 0.0036773 0.0052604 1.0433012 4 Li 0.9652761 -0.0176450 0.0060139 -0.0075483 1.2820392 -0.0083516 0.0036773 -0.0052604 1.0433012 5 Li 1.0195695 -0.1143872 -0.0419101 -0.0358149 0.9180482 0.1969311 -0.0655883 0.2335500 0.9294084 6 Li 1.0130840 0.1126806 -0.0522976 0.0349998 0.9076783 -0.1971240 -0.0635307 -0.2258986 0.9319314 7 Li 1.0130840 0.1126806 -0.0522976 0.0349998 0.9076783 -0.1971240 -0.0635307 -0.2258986 0.9319314 8 Li 1.0195695 -0.1143872 -0.0419101 -0.0358149 0.9180482 0.1969311 -0.0655883 0.2335500 0.9294084 9 Li 0.9652761 -0.0176450 0.0060139 -0.0075483 1.2820392 -0.0083516 0.0036773 -0.0052604 1.0433012 10 Li 0.9652761 0.0176450 0.0060139 0.0075483 1.2820392 0.0083516 0.0036773 0.0052604 1.0433012 11 Li 1.0195695 0.1143872 -0.0419101 0.0358149 0.9180482 -0.1969311 -0.0655883 -0.2335500 0.9294084 12 Li 1.0130840 -0.1126806 -0.0522976 -0.0349998 0.9076783 0.1971240 -0.0635307 0.2258986 0.9319314 13 Hf 5.2992036 -0.0389710 0.1795082 0.0274720 4.5297104 0.0586507 0.1800591 -0.0824945 5.3221738 14 Hf 5.2992036 0.0389710 0.1795082 -0.0274720 4.5297104 -0.0586507 0.1800591 0.0824945 5.3221738 15 Hf 5.2992036 0.0389710 0.1795082 -0.0274720 4.5297104 -0.0586507 0.1800591 0.0824945 5.3221738 16 Hf 5.2992036 -0.0389710 0.1795082 0.0274720 4.5297104 0.0586507 0.1800591 -0.0824945 5.3221738 17 O -3.3106156 -0.0121151 1.0708158 -0.0084067 -1.2919133 -0.0087831 1.1636558 0.0392274 -2.5854919 18 O -2.0083819 0.0160850 -0.6146741 0.0184187 -2.2843335 0.0285779 -0.6179693 0.0270847 -2.5763676 19 O -2.5159713 -0.0093219 0.6823885 0.0100787 -1.7034914 0.0011106 0.6475635 -0.0068030 -2.0233228 20 O -2.1174723 0.7356580 -0.6944366 0.7833448 -3.0036946 1.3349888 -0.6660395 1.3724823 -2.3343785 21 O -2.1174723 -0.7356580 -0.6944366 -0.7833448 -3.0036946 -1.3349888 -0.6660395 -1.3724823 -2.3343785 22 O -2.5159713 0.0093219 0.6823885 -0.0100787 -1.7034914 -0.0011106 0.6475635 0.0068030 -2.0233228 23 O -2.0083819 -0.0160850 -0.6146741 -0.0184187 -2.2843335 -0.0285779 -0.6179693 -0.0270847 -2.5763676 24 O -3.3106156 0.0121151 1.0708158 0.0084067 -1.2919133 0.0087831 1.1636558 -0.0392274 -2.5854919 25 O -2.0083819 -0.0160850 -0.6146741 -0.0184187 -2.2843335 -0.0285779 -0.6179693 -0.0270847 -2.5763676 26 O -2.5159713 0.0093219 0.6823885 -0.0100787 -1.7034914 -0.0011106 0.6475635 0.0068030 -2.0233228 27 O -2.1174723 -0.7356580 -0.6944366 -0.7833448 -3.0036946 -1.3349888 -0.6660395 -1.3724823 -2.3343785 28 O -2.1174723 0.7356580 -0.6944366 0.7833448 -3.0036946 1.3349888 -0.6660395 1.3724823 -2.3343785 29 O -2.5159713 -0.0093219 0.6823885 0.0100787 -1.7034914 0.0011106 0.6475635 -0.0068030 -2.0233228 30 O -2.0083819 0.0160850 -0.6146741 0.0184187 -2.2843335 0.0285779 -0.6179693 0.0270847 -2.5763676 ---------------------------------------------------------------------------- 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: 360/360 Permutation basis: 16560/16560 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 4194 Number of blocks in projector: 4194 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: 902 Use submatrix version of eigh solver. (1) Block: 500 / 902 (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: 902 / 902 (1) 386 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: 902 Use submatrix version of eigh solver. (1) Block: 500 / 902 (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: 902 / 902 (1) 386 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: 902 Use submatrix version of eigh solver. (1) Block: 500 / 902 (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: 902 / 902 (1) 391 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: 496 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 496 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 496 Use standard eigh solver. Tree of FC basis block matrices: - (4194, 4123), data: False |-- (496, 488), data: True |-- (496, 488), data: True |-- (496, 488), data: True |-- (902, 887), data: False |-- (902, 11), data: (902, 26) @ (26, 11) |-- (402, 391), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (902, 886), data: False |-- (902, 16), data: (902, 32) @ (32, 16) |-- (402, 386), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (902, 886), data: False |-- (902, 16), data: (902, 32) @ (32, 16) |-- (402, 386), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True ----- Solver_atoms: 1 -- 120 / 120 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 960 - Time: 1.185 Solver_block: 200 / 960 - Time: 1.115 Solver_block: 300 / 960 - Time: 1.099 Solver_block: 400 / 960 - Time: 1.114 Solver_block: 500 / 960 - Time: 1.113 Solver_block: 600 / 960 - Time: 1.117 Solver_block: 700 / 960 - Time: 1.133 Solver_block: 800 / 960 - Time: 1.119 Solver_block: 900 / 960 - Time: 1.120 Solver_block: 960 / 960 - Time: 0.733 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 11.095 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 360/360 Permutation basis: 16560/16560 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 4194 Number of blocks in projector: 4194 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: 902 Use submatrix version of eigh solver. (1) Block: 500 / 902 (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: 902 / 902 (1) 386 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: 902 Use submatrix version of eigh solver. (1) Block: 500 / 902 (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: 902 / 902 (1) 386 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: 902 Use submatrix version of eigh solver. (1) Block: 500 / 902 (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: 902 / 902 (1) 391 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: 496 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 496 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 496 Use standard eigh solver. Tree of FC basis block matrices: - (4194, 4123), data: False |-- (496, 488), data: True |-- (496, 488), data: True |-- (496, 488), data: True |-- (902, 887), data: False |-- (902, 11), data: (902, 26) @ (26, 11) |-- (402, 391), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (902, 886), data: False |-- (902, 16), data: (902, 32) @ (32, 16) |-- (402, 386), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (902, 886), data: False |-- (902, 16), data: (902, 32) @ (32, 16) |-- (402, 386), 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 02:13:44]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 02:13:45]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.268548800126780 0.000000000000000 0.000000000000000 b 0.000000000000000 5.979683800000000 0.000000000000000 c -3.502947732988866 0.000000000000000 9.611259401560645 Atomic positions (fractional): 1 Li 0.28810205942852 0.22312664695640 0.14196520220668 6.941 2 Li 0.28316116338787 0.76980488744246 0.13934237771047 6.941 3 Li 0.66623845630990 0.50378485891910 0.12455357457427 6.941 4 Li 0.33376154369010 0.00378485891910 0.37544642542573 6.941 5 Li 0.71683883661213 0.26980488744246 0.36065762228953 6.941 6 Li 0.71189794057148 0.72312664695640 0.35803479779332 6.941 7 Li 0.28810205942852 0.27687335304360 0.64196520220668 6.941 8 Li 0.28316116338787 0.73019511255754 0.63934237771047 6.941 9 Li 0.66623845630990 0.99621514108090 0.62455357457427 6.941 10 Li 0.33376154369010 0.49621514108090 0.87544642542573 6.941 11 Li 0.71683883661213 0.23019511255754 0.86065762228953 6.941 12 Li 0.71189794057148 0.77687335304360 0.85803479779332 6.941 13 Hf 0.76829959749826 0.99679280875168 0.13307769235449 178.490 14 Hf 0.23170040250174 0.49679280875168 0.36692230764551 178.490 15 Hf 0.76829959749826 0.50320719124832 0.63307769235449 178.490 16 Hf 0.23170040250174 0.00320719124832 0.86692230764551 178.490 17 O 0.00000000000000 0.00000000000000 0.00000000000000 15.999 18 O 0.50560722578729 0.23386927220431 0.00186548879539 15.999 19 O 0.45958221432965 0.49632121794361 0.24429243985493 15.999 20 O 0.98838986077072 0.73383633145682 0.24246139409518 15.999 21 O 0.01161013922928 0.23383633145682 0.25753860590481 15.999 22 O 0.54041778567035 0.99632121794361 0.25570756014507 15.999 23 O 0.49439277421271 0.73386927220431 0.49813451120461 15.999 24 O 0.00000000000000 0.50000000000000 0.50000000000000 15.999 25 O 0.50560722578729 0.26613072779569 0.50186548879538 15.999 26 O 0.45958221432965 0.00367878205639 0.74429243985493 15.999 27 O 0.98838986077072 0.76616366854318 0.74246139409518 15.999 28 O 0.01161013922928 0.26616366854318 0.75753860590482 15.999 29 O 0.54041778567035 0.50367878205639 0.75570756014507 15.999 30 O 0.49439277421271 0.76613072779569 0.99813451120462 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.537097600253560 0.000000000000000 0.000000000000000 b 0.000000000000000 11.959367600000000 0.000000000000000 c -3.502947732988866 0.000000000000000 9.611259401560645 Atomic positions (fractional): 1 Li 0.14405102971426 0.11156332347820 0.14196520220668 6.941 > 1 2 Li 0.64405102971426 0.11156332347820 0.14196520220668 6.941 > 1 3 Li 0.14405102971426 0.61156332347820 0.14196520220668 6.941 > 1 4 Li 0.64405102971426 0.61156332347820 0.14196520220668 6.941 > 1 5 Li 0.14158058169394 0.38490244372123 0.13934237771047 6.941 > 5 6 Li 0.64158058169394 0.38490244372123 0.13934237771047 6.941 > 5 7 Li 0.14158058169394 0.88490244372123 0.13934237771047 6.941 > 5 8 Li 0.64158058169394 0.88490244372123 0.13934237771047 6.941 > 5 9 Li 0.33311922815495 0.25189242945955 0.12455357457427 6.941 > 9 10 Li 0.83311922815495 0.25189242945955 0.12455357457427 6.941 > 9 11 Li 0.33311922815495 0.75189242945955 0.12455357457427 6.941 > 9 12 Li 0.83311922815495 0.75189242945955 0.12455357457427 6.941 > 9 13 Li 0.16688077184505 0.00189242945955 0.37544642542573 6.941 > 13 14 Li 0.66688077184505 0.00189242945955 0.37544642542573 6.941 > 13 15 Li 0.16688077184505 0.50189242945955 0.37544642542573 6.941 > 13 16 Li 0.66688077184505 0.50189242945955 0.37544642542573 6.941 > 13 17 Li 0.35841941830606 0.13490244372123 0.36065762228953 6.941 > 17 18 Li 0.85841941830606 0.13490244372123 0.36065762228953 6.941 > 17 19 Li 0.35841941830606 0.63490244372123 0.36065762228953 6.941 > 17 20 Li 0.85841941830606 0.63490244372123 0.36065762228953 6.941 > 17 21 Li 0.35594897028574 0.36156332347820 0.35803479779332 6.941 > 21 22 Li 0.85594897028574 0.36156332347820 0.35803479779332 6.941 > 21 23 Li 0.35594897028574 0.86156332347820 0.35803479779332 6.941 > 21 24 Li 0.85594897028574 0.86156332347820 0.35803479779332 6.941 > 21 25 Li 0.14405102971426 0.13843667652180 0.64196520220668 6.941 > 25 26 Li 0.64405102971426 0.13843667652180 0.64196520220668 6.941 > 25 27 Li 0.14405102971426 0.63843667652180 0.64196520220668 6.941 > 25 28 Li 0.64405102971426 0.63843667652180 0.64196520220668 6.941 > 25 29 Li 0.14158058169394 0.36509755627877 0.63934237771047 6.941 > 29 30 Li 0.64158058169394 0.36509755627877 0.63934237771047 6.941 > 29 31 Li 0.14158058169394 0.86509755627877 0.63934237771047 6.941 > 29 32 Li 0.64158058169394 0.86509755627877 0.63934237771047 6.941 > 29 33 Li 0.33311922815495 0.49810757054045 0.62455357457427 6.941 > 33 34 Li 0.83311922815495 0.49810757054045 0.62455357457427 6.941 > 33 35 Li 0.33311922815495 0.99810757054045 0.62455357457427 6.941 > 33 36 Li 0.83311922815495 0.99810757054045 0.62455357457427 6.941 > 33 37 Li 0.16688077184505 0.24810757054045 0.87544642542573 6.941 > 37 38 Li 0.66688077184505 0.24810757054045 0.87544642542573 6.941 > 37 39 Li 0.16688077184505 0.74810757054045 0.87544642542573 6.941 > 37 40 Li 0.66688077184505 0.74810757054045 0.87544642542573 6.941 > 37 41 Li 0.35841941830606 0.11509755627877 0.86065762228953 6.941 > 41 42 Li 0.85841941830606 0.11509755627877 0.86065762228953 6.941 > 41 43 Li 0.35841941830606 0.61509755627877 0.86065762228953 6.941 > 41 44 Li 0.85841941830606 0.61509755627877 0.86065762228953 6.941 > 41 45 Li 0.35594897028574 0.38843667652180 0.85803479779332 6.941 > 45 46 Li 0.85594897028574 0.38843667652180 0.85803479779332 6.941 > 45 47 Li 0.35594897028574 0.88843667652180 0.85803479779332 6.941 > 45 48 Li 0.85594897028574 0.88843667652180 0.85803479779332 6.941 > 45 49 Hf 0.38414979874913 0.49839640437584 0.13307769235449 178.490 > 49 50 Hf 0.88414979874913 0.49839640437584 0.13307769235449 178.490 > 49 51 Hf 0.38414979874913 0.99839640437584 0.13307769235449 178.490 > 49 52 Hf 0.88414979874913 0.99839640437584 0.13307769235449 178.490 > 49 53 Hf 0.11585020125087 0.24839640437584 0.36692230764551 178.490 > 53 54 Hf 0.61585020125087 0.24839640437584 0.36692230764551 178.490 > 53 55 Hf 0.11585020125087 0.74839640437584 0.36692230764551 178.490 > 53 56 Hf 0.61585020125087 0.74839640437584 0.36692230764551 178.490 > 53 57 Hf 0.38414979874913 0.25160359562416 0.63307769235449 178.490 > 57 58 Hf 0.88414979874913 0.25160359562416 0.63307769235449 178.490 > 57 59 Hf 0.38414979874913 0.75160359562416 0.63307769235449 178.490 > 57 60 Hf 0.88414979874913 0.75160359562416 0.63307769235449 178.490 > 57 61 Hf 0.11585020125087 0.00160359562416 0.86692230764551 178.490 > 61 62 Hf 0.61585020125087 0.00160359562416 0.86692230764551 178.490 > 61 63 Hf 0.11585020125087 0.50160359562416 0.86692230764551 178.490 > 61 64 Hf 0.61585020125087 0.50160359562416 0.86692230764551 178.490 > 61 65 O 0.00000000000000 0.00000000000000 0.00000000000000 15.999 > 65 66 O 0.50000000000000 0.00000000000000 0.00000000000000 15.999 > 65 67 O 0.00000000000000 0.50000000000000 0.00000000000000 15.999 > 65 68 O 0.50000000000000 0.50000000000000 0.00000000000000 15.999 > 65 69 O 0.25280361289364 0.11693463610216 0.00186548879539 15.999 > 69 70 O 0.75280361289364 0.11693463610216 0.00186548879539 15.999 > 69 71 O 0.25280361289364 0.61693463610216 0.00186548879539 15.999 > 69 72 O 0.75280361289364 0.61693463610216 0.00186548879539 15.999 > 69 73 O 0.22979110716482 0.24816060897181 0.24429243985493 15.999 > 73 74 O 0.72979110716482 0.24816060897181 0.24429243985493 15.999 > 73 75 O 0.22979110716482 0.74816060897181 0.24429243985493 15.999 > 73 76 O 0.72979110716482 0.74816060897181 0.24429243985493 15.999 > 73 77 O 0.49419493038536 0.36691816572841 0.24246139409518 15.999 > 77 78 O 0.99419493038536 0.36691816572841 0.24246139409518 15.999 > 77 79 O 0.49419493038536 0.86691816572841 0.24246139409518 15.999 > 77 80 O 0.99419493038536 0.86691816572841 0.24246139409518 15.999 > 77 81 O 0.00580506961464 0.11691816572841 0.25753860590481 15.999 > 81 82 O 0.50580506961464 0.11691816572841 0.25753860590481 15.999 > 81 83 O 0.00580506961464 0.61691816572841 0.25753860590481 15.999 > 81 84 O 0.50580506961464 0.61691816572841 0.25753860590481 15.999 > 81 85 O 0.27020889283518 0.49816060897181 0.25570756014507 15.999 > 85 86 O 0.77020889283518 0.49816060897181 0.25570756014507 15.999 > 85 87 O 0.27020889283518 0.99816060897181 0.25570756014507 15.999 > 85 88 O 0.77020889283518 0.99816060897181 0.25570756014507 15.999 > 85 89 O 0.24719638710636 0.36693463610216 0.49813451120461 15.999 > 89 90 O 0.74719638710636 0.36693463610216 0.49813451120461 15.999 > 89 91 O 0.24719638710636 0.86693463610216 0.49813451120461 15.999 > 89 92 O 0.74719638710636 0.86693463610216 0.49813451120461 15.999 > 89 93 O 0.00000000000000 0.25000000000000 0.50000000000000 15.999 > 93 94 O 0.50000000000000 0.25000000000000 0.50000000000000 15.999 > 93 95 O 0.00000000000000 0.75000000000000 0.50000000000000 15.999 > 93 96 O 0.50000000000000 0.75000000000000 0.50000000000000 15.999 > 93 97 O 0.25280361289364 0.13306536389784 0.50186548879538 15.999 > 97 98 O 0.75280361289364 0.13306536389784 0.50186548879538 15.999 > 97 99 O 0.25280361289364 0.63306536389784 0.50186548879538 15.999 > 97 100 O 0.75280361289364 0.63306536389784 0.50186548879538 15.999 > 97 101 O 0.22979110716482 0.00183939102819 0.74429243985493 15.999 > 101 102 O 0.72979110716482 0.00183939102819 0.74429243985493 15.999 > 101 103 O 0.22979110716482 0.50183939102819 0.74429243985493 15.999 > 101 104 O 0.72979110716482 0.50183939102819 0.74429243985493 15.999 > 101 105 O 0.49419493038536 0.38308183427159 0.74246139409518 15.999 > 105 106 O 0.99419493038536 0.38308183427159 0.74246139409518 15.999 > 105 107 O 0.49419493038536 0.88308183427159 0.74246139409518 15.999 > 105 108 O 0.99419493038536 0.88308183427159 0.74246139409518 15.999 > 105 109 O 0.00580506961464 0.13308183427159 0.75753860590482 15.999 > 109 110 O 0.50580506961464 0.13308183427159 0.75753860590482 15.999 > 109 111 O 0.00580506961464 0.63308183427159 0.75753860590482 15.999 > 109 112 O 0.50580506961464 0.63308183427159 0.75753860590482 15.999 > 109 113 O 0.27020889283518 0.25183939102819 0.75570756014507 15.999 > 113 114 O 0.77020889283518 0.25183939102819 0.75570756014507 15.999 > 113 115 O 0.27020889283518 0.75183939102819 0.75570756014507 15.999 > 113 116 O 0.77020889283518 0.75183939102819 0.75570756014507 15.999 > 113 117 O 0.24719638710636 0.38306536389784 0.99813451120462 15.999 > 117 118 O 0.74719638710636 0.38306536389784 0.99813451120462 15.999 > 117 119 O 0.24719638710636 0.88306536389784 0.99813451120462 15.999 > 117 120 O 0.74719638710636 0.88306536389784 0.99813451120462 15.999 > 117 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.6962817 0.0000000 0.0339045 0.0000000 3.4790613 0.0000000 0.0339068 0.0000000 3.6906096 -------------------------- Born effective charges -------------------------- 1 Li 1.0130840 -0.1126806 -0.0522976 -0.0349998 0.9076783 0.1971240 -0.0635307 0.2258986 0.9319314 2 Li 1.0195695 0.1143872 -0.0419101 0.0358149 0.9180482 -0.1969311 -0.0655883 -0.2335500 0.9294084 3 Li 0.9652761 0.0176450 0.0060139 0.0075483 1.2820392 0.0083516 0.0036773 0.0052604 1.0433012 4 Li 0.9652761 -0.0176450 0.0060139 -0.0075483 1.2820392 -0.0083516 0.0036773 -0.0052604 1.0433012 5 Li 1.0195695 -0.1143872 -0.0419101 -0.0358149 0.9180482 0.1969311 -0.0655883 0.2335500 0.9294084 6 Li 1.0130840 0.1126806 -0.0522976 0.0349998 0.9076783 -0.1971240 -0.0635307 -0.2258986 0.9319314 7 Li 1.0130840 0.1126806 -0.0522976 0.0349998 0.9076783 -0.1971240 -0.0635307 -0.2258986 0.9319314 8 Li 1.0195695 -0.1143872 -0.0419101 -0.0358149 0.9180482 0.1969311 -0.0655883 0.2335500 0.9294084 9 Li 0.9652761 -0.0176450 0.0060139 -0.0075483 1.2820392 -0.0083516 0.0036773 -0.0052604 1.0433012 10 Li 0.9652761 0.0176450 0.0060139 0.0075483 1.2820392 0.0083516 0.0036773 0.0052604 1.0433012 11 Li 1.0195695 0.1143872 -0.0419101 0.0358149 0.9180482 -0.1969311 -0.0655883 -0.2335500 0.9294084 12 Li 1.0130840 -0.1126806 -0.0522976 -0.0349998 0.9076783 0.1971240 -0.0635307 0.2258986 0.9319314 13 Hf 5.2992036 -0.0389710 0.1795082 0.0274720 4.5297104 0.0586507 0.1800591 -0.0824945 5.3221738 14 Hf 5.2992036 0.0389710 0.1795082 -0.0274720 4.5297104 -0.0586507 0.1800591 0.0824945 5.3221738 15 Hf 5.2992036 0.0389710 0.1795082 -0.0274720 4.5297104 -0.0586507 0.1800591 0.0824945 5.3221738 16 Hf 5.2992036 -0.0389710 0.1795082 0.0274720 4.5297104 0.0586507 0.1800591 -0.0824945 5.3221738 17 O -3.3106156 -0.0121151 1.0708158 -0.0084067 -1.2919133 -0.0087831 1.1636558 0.0392274 -2.5854919 18 O -2.0083819 0.0160850 -0.6146741 0.0184187 -2.2843335 0.0285779 -0.6179693 0.0270847 -2.5763676 19 O -2.5159713 -0.0093219 0.6823885 0.0100787 -1.7034914 0.0011106 0.6475635 -0.0068030 -2.0233228 20 O -2.1174723 0.7356580 -0.6944366 0.7833448 -3.0036946 1.3349888 -0.6660395 1.3724823 -2.3343785 21 O -2.1174723 -0.7356580 -0.6944366 -0.7833448 -3.0036946 -1.3349888 -0.6660395 -1.3724823 -2.3343785 22 O -2.5159713 0.0093219 0.6823885 -0.0100787 -1.7034914 -0.0011106 0.6475635 0.0068030 -2.0233228 23 O -2.0083819 -0.0160850 -0.6146741 -0.0184187 -2.2843335 -0.0285779 -0.6179693 -0.0270847 -2.5763676 24 O -3.3106156 0.0121151 1.0708158 0.0084067 -1.2919133 0.0087831 1.1636558 -0.0392274 -2.5854919 25 O -2.0083819 -0.0160850 -0.6146741 -0.0184187 -2.2843335 -0.0285779 -0.6179693 -0.0270847 -2.5763676 26 O -2.5159713 0.0093219 0.6823885 -0.0100787 -1.7034914 -0.0011106 0.6475635 0.0068030 -2.0233228 27 O -2.1174723 -0.7356580 -0.6944366 -0.7833448 -3.0036946 -1.3349888 -0.6660395 -1.3724823 -2.3343785 28 O -2.1174723 0.7356580 -0.6944366 0.7833448 -3.0036946 1.3349888 -0.6660395 1.3724823 -2.3343785 29 O -2.5159713 -0.0093219 0.6823885 0.0100787 -1.7034914 0.0011106 0.6475635 -0.0068030 -2.0233228 30 O -2.0083819 0.0160850 -0.6146741 0.0184187 -2.2843335 0.0285779 -0.6179693 0.0270847 -2.5763676 ---------------------------------------------------------------------------- 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] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] Computing fc3[ 5, 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] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] Computing fc3[ 9, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] 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] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] Computing fc3[ 65, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] Computing fc3[ 69, 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] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] Computing fc3[ 77, 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] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000001 (xxx) 0.00000001 (xxx) 0.00000001 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000001 (yz) -0.00000001 (yz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 02:14:26]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 02:14:26]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.268548800126780 0.000000000000000 0.000000000000000 b 0.000000000000000 5.979683800000000 0.000000000000000 c -3.502947732988866 0.000000000000000 9.611259401560645 Atomic positions (fractional): 1 Li 0.28810205942852 0.22312664695640 0.14196520220668 6.941 2 Li 0.28316116338787 0.76980488744246 0.13934237771047 6.941 3 Li 0.66623845630990 0.50378485891910 0.12455357457427 6.941 4 Li 0.33376154369010 0.00378485891910 0.37544642542573 6.941 5 Li 0.71683883661213 0.26980488744246 0.36065762228953 6.941 6 Li 0.71189794057148 0.72312664695640 0.35803479779332 6.941 7 Li 0.28810205942852 0.27687335304360 0.64196520220668 6.941 8 Li 0.28316116338787 0.73019511255754 0.63934237771047 6.941 9 Li 0.66623845630990 0.99621514108090 0.62455357457427 6.941 10 Li 0.33376154369010 0.49621514108090 0.87544642542573 6.941 11 Li 0.71683883661213 0.23019511255754 0.86065762228953 6.941 12 Li 0.71189794057148 0.77687335304360 0.85803479779332 6.941 13 Hf 0.76829959749826 0.99679280875168 0.13307769235449 178.490 14 Hf 0.23170040250174 0.49679280875168 0.36692230764551 178.490 15 Hf 0.76829959749826 0.50320719124832 0.63307769235449 178.490 16 Hf 0.23170040250174 0.00320719124832 0.86692230764551 178.490 17 O 0.00000000000000 0.00000000000000 0.00000000000000 15.999 18 O 0.50560722578729 0.23386927220431 0.00186548879539 15.999 19 O 0.45958221432965 0.49632121794361 0.24429243985493 15.999 20 O 0.98838986077072 0.73383633145682 0.24246139409518 15.999 21 O 0.01161013922928 0.23383633145682 0.25753860590481 15.999 22 O 0.54041778567035 0.99632121794361 0.25570756014507 15.999 23 O 0.49439277421271 0.73386927220431 0.49813451120461 15.999 24 O 0.00000000000000 0.50000000000000 0.50000000000000 15.999 25 O 0.50560722578729 0.26613072779569 0.50186548879538 15.999 26 O 0.45958221432965 0.00367878205639 0.74429243985493 15.999 27 O 0.98838986077072 0.76616366854318 0.74246139409518 15.999 28 O 0.01161013922928 0.26616366854318 0.75753860590482 15.999 29 O 0.54041778567035 0.50367878205639 0.75570756014507 15.999 30 O 0.49439277421271 0.76613072779569 0.99813451120462 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.537097600253560 0.000000000000000 0.000000000000000 b 0.000000000000000 11.959367600000000 0.000000000000000 c -3.502947732988866 0.000000000000000 9.611259401560645 Atomic positions (fractional): 1 Li 0.14405102971426 0.11156332347820 0.14196520220668 6.941 > 1 2 Li 0.64405102971426 0.11156332347820 0.14196520220668 6.941 > 1 3 Li 0.14405102971426 0.61156332347820 0.14196520220668 6.941 > 1 4 Li 0.64405102971426 0.61156332347820 0.14196520220668 6.941 > 1 5 Li 0.14158058169394 0.38490244372123 0.13934237771047 6.941 > 5 6 Li 0.64158058169394 0.38490244372123 0.13934237771047 6.941 > 5 7 Li 0.14158058169394 0.88490244372123 0.13934237771047 6.941 > 5 8 Li 0.64158058169394 0.88490244372123 0.13934237771047 6.941 > 5 9 Li 0.33311922815495 0.25189242945955 0.12455357457427 6.941 > 9 10 Li 0.83311922815495 0.25189242945955 0.12455357457427 6.941 > 9 11 Li 0.33311922815495 0.75189242945955 0.12455357457427 6.941 > 9 12 Li 0.83311922815495 0.75189242945955 0.12455357457427 6.941 > 9 13 Li 0.16688077184505 0.00189242945955 0.37544642542573 6.941 > 13 14 Li 0.66688077184505 0.00189242945955 0.37544642542573 6.941 > 13 15 Li 0.16688077184505 0.50189242945955 0.37544642542573 6.941 > 13 16 Li 0.66688077184505 0.50189242945955 0.37544642542573 6.941 > 13 17 Li 0.35841941830606 0.13490244372123 0.36065762228953 6.941 > 17 18 Li 0.85841941830606 0.13490244372123 0.36065762228953 6.941 > 17 19 Li 0.35841941830606 0.63490244372123 0.36065762228953 6.941 > 17 20 Li 0.85841941830606 0.63490244372123 0.36065762228953 6.941 > 17 21 Li 0.35594897028574 0.36156332347820 0.35803479779332 6.941 > 21 22 Li 0.85594897028574 0.36156332347820 0.35803479779332 6.941 > 21 23 Li 0.35594897028574 0.86156332347820 0.35803479779332 6.941 > 21 24 Li 0.85594897028574 0.86156332347820 0.35803479779332 6.941 > 21 25 Li 0.14405102971426 0.13843667652180 0.64196520220668 6.941 > 25 26 Li 0.64405102971426 0.13843667652180 0.64196520220668 6.941 > 25 27 Li 0.14405102971426 0.63843667652180 0.64196520220668 6.941 > 25 28 Li 0.64405102971426 0.63843667652180 0.64196520220668 6.941 > 25 29 Li 0.14158058169394 0.36509755627877 0.63934237771047 6.941 > 29 30 Li 0.64158058169394 0.36509755627877 0.63934237771047 6.941 > 29 31 Li 0.14158058169394 0.86509755627877 0.63934237771047 6.941 > 29 32 Li 0.64158058169394 0.86509755627877 0.63934237771047 6.941 > 29 33 Li 0.33311922815495 0.49810757054045 0.62455357457427 6.941 > 33 34 Li 0.83311922815495 0.49810757054045 0.62455357457427 6.941 > 33 35 Li 0.33311922815495 0.99810757054045 0.62455357457427 6.941 > 33 36 Li 0.83311922815495 0.99810757054045 0.62455357457427 6.941 > 33 37 Li 0.16688077184505 0.24810757054045 0.87544642542573 6.941 > 37 38 Li 0.66688077184505 0.24810757054045 0.87544642542573 6.941 > 37 39 Li 0.16688077184505 0.74810757054045 0.87544642542573 6.941 > 37 40 Li 0.66688077184505 0.74810757054045 0.87544642542573 6.941 > 37 41 Li 0.35841941830606 0.11509755627877 0.86065762228953 6.941 > 41 42 Li 0.85841941830606 0.11509755627877 0.86065762228953 6.941 > 41 43 Li 0.35841941830606 0.61509755627877 0.86065762228953 6.941 > 41 44 Li 0.85841941830606 0.61509755627877 0.86065762228953 6.941 > 41 45 Li 0.35594897028574 0.38843667652180 0.85803479779332 6.941 > 45 46 Li 0.85594897028574 0.38843667652180 0.85803479779332 6.941 > 45 47 Li 0.35594897028574 0.88843667652180 0.85803479779332 6.941 > 45 48 Li 0.85594897028574 0.88843667652180 0.85803479779332 6.941 > 45 49 Hf 0.38414979874913 0.49839640437584 0.13307769235449 178.490 > 49 50 Hf 0.88414979874913 0.49839640437584 0.13307769235449 178.490 > 49 51 Hf 0.38414979874913 0.99839640437584 0.13307769235449 178.490 > 49 52 Hf 0.88414979874913 0.99839640437584 0.13307769235449 178.490 > 49 53 Hf 0.11585020125087 0.24839640437584 0.36692230764551 178.490 > 53 54 Hf 0.61585020125087 0.24839640437584 0.36692230764551 178.490 > 53 55 Hf 0.11585020125087 0.74839640437584 0.36692230764551 178.490 > 53 56 Hf 0.61585020125087 0.74839640437584 0.36692230764551 178.490 > 53 57 Hf 0.38414979874913 0.25160359562416 0.63307769235449 178.490 > 57 58 Hf 0.88414979874913 0.25160359562416 0.63307769235449 178.490 > 57 59 Hf 0.38414979874913 0.75160359562416 0.63307769235449 178.490 > 57 60 Hf 0.88414979874913 0.75160359562416 0.63307769235449 178.490 > 57 61 Hf 0.11585020125087 0.00160359562416 0.86692230764551 178.490 > 61 62 Hf 0.61585020125087 0.00160359562416 0.86692230764551 178.490 > 61 63 Hf 0.11585020125087 0.50160359562416 0.86692230764551 178.490 > 61 64 Hf 0.61585020125087 0.50160359562416 0.86692230764551 178.490 > 61 65 O 0.00000000000000 0.00000000000000 0.00000000000000 15.999 > 65 66 O 0.50000000000000 0.00000000000000 0.00000000000000 15.999 > 65 67 O 0.00000000000000 0.50000000000000 0.00000000000000 15.999 > 65 68 O 0.50000000000000 0.50000000000000 0.00000000000000 15.999 > 65 69 O 0.25280361289364 0.11693463610216 0.00186548879539 15.999 > 69 70 O 0.75280361289364 0.11693463610216 0.00186548879539 15.999 > 69 71 O 0.25280361289364 0.61693463610216 0.00186548879539 15.999 > 69 72 O 0.75280361289364 0.61693463610216 0.00186548879539 15.999 > 69 73 O 0.22979110716482 0.24816060897181 0.24429243985493 15.999 > 73 74 O 0.72979110716482 0.24816060897181 0.24429243985493 15.999 > 73 75 O 0.22979110716482 0.74816060897181 0.24429243985493 15.999 > 73 76 O 0.72979110716482 0.74816060897181 0.24429243985493 15.999 > 73 77 O 0.49419493038536 0.36691816572841 0.24246139409518 15.999 > 77 78 O 0.99419493038536 0.36691816572841 0.24246139409518 15.999 > 77 79 O 0.49419493038536 0.86691816572841 0.24246139409518 15.999 > 77 80 O 0.99419493038536 0.86691816572841 0.24246139409518 15.999 > 77 81 O 0.00580506961464 0.11691816572841 0.25753860590481 15.999 > 81 82 O 0.50580506961464 0.11691816572841 0.25753860590481 15.999 > 81 83 O 0.00580506961464 0.61691816572841 0.25753860590481 15.999 > 81 84 O 0.50580506961464 0.61691816572841 0.25753860590481 15.999 > 81 85 O 0.27020889283518 0.49816060897181 0.25570756014507 15.999 > 85 86 O 0.77020889283518 0.49816060897181 0.25570756014507 15.999 > 85 87 O 0.27020889283518 0.99816060897181 0.25570756014507 15.999 > 85 88 O 0.77020889283518 0.99816060897181 0.25570756014507 15.999 > 85 89 O 0.24719638710636 0.36693463610216 0.49813451120461 15.999 > 89 90 O 0.74719638710636 0.36693463610216 0.49813451120461 15.999 > 89 91 O 0.24719638710636 0.86693463610216 0.49813451120461 15.999 > 89 92 O 0.74719638710636 0.86693463610216 0.49813451120461 15.999 > 89 93 O 0.00000000000000 0.25000000000000 0.50000000000000 15.999 > 93 94 O 0.50000000000000 0.25000000000000 0.50000000000000 15.999 > 93 95 O 0.00000000000000 0.75000000000000 0.50000000000000 15.999 > 93 96 O 0.50000000000000 0.75000000000000 0.50000000000000 15.999 > 93 97 O 0.25280361289364 0.13306536389784 0.50186548879538 15.999 > 97 98 O 0.75280361289364 0.13306536389784 0.50186548879538 15.999 > 97 99 O 0.25280361289364 0.63306536389784 0.50186548879538 15.999 > 97 100 O 0.75280361289364 0.63306536389784 0.50186548879538 15.999 > 97 101 O 0.22979110716482 0.00183939102819 0.74429243985493 15.999 > 101 102 O 0.72979110716482 0.00183939102819 0.74429243985493 15.999 > 101 103 O 0.22979110716482 0.50183939102819 0.74429243985493 15.999 > 101 104 O 0.72979110716482 0.50183939102819 0.74429243985493 15.999 > 101 105 O 0.49419493038536 0.38308183427159 0.74246139409518 15.999 > 105 106 O 0.99419493038536 0.38308183427159 0.74246139409518 15.999 > 105 107 O 0.49419493038536 0.88308183427159 0.74246139409518 15.999 > 105 108 O 0.99419493038536 0.88308183427159 0.74246139409518 15.999 > 105 109 O 0.00580506961464 0.13308183427159 0.75753860590482 15.999 > 109 110 O 0.50580506961464 0.13308183427159 0.75753860590482 15.999 > 109 111 O 0.00580506961464 0.63308183427159 0.75753860590482 15.999 > 109 112 O 0.50580506961464 0.63308183427159 0.75753860590482 15.999 > 109 113 O 0.27020889283518 0.25183939102819 0.75570756014507 15.999 > 113 114 O 0.77020889283518 0.25183939102819 0.75570756014507 15.999 > 113 115 O 0.27020889283518 0.75183939102819 0.75570756014507 15.999 > 113 116 O 0.77020889283518 0.75183939102819 0.75570756014507 15.999 > 113 117 O 0.24719638710636 0.38306536389784 0.99813451120462 15.999 > 117 118 O 0.74719638710636 0.38306536389784 0.99813451120462 15.999 > 117 119 O 0.24719638710636 0.88306536389784 0.99813451120462 15.999 > 117 120 O 0.74719638710636 0.88306536389784 0.99813451120462 15.999 > 117 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.6962817 0.0000000 0.0339045 0.0000000 3.4790613 0.0000000 0.0339068 0.0000000 3.6906096 -------------------------- Born effective charges -------------------------- 1 Li 1.0130840 -0.1126806 -0.0522976 -0.0349998 0.9076783 0.1971240 -0.0635307 0.2258986 0.9319314 2 Li 1.0195695 0.1143872 -0.0419101 0.0358149 0.9180482 -0.1969311 -0.0655883 -0.2335500 0.9294084 3 Li 0.9652761 0.0176450 0.0060139 0.0075483 1.2820392 0.0083516 0.0036773 0.0052604 1.0433012 4 Li 0.9652761 -0.0176450 0.0060139 -0.0075483 1.2820392 -0.0083516 0.0036773 -0.0052604 1.0433012 5 Li 1.0195695 -0.1143872 -0.0419101 -0.0358149 0.9180482 0.1969311 -0.0655883 0.2335500 0.9294084 6 Li 1.0130840 0.1126806 -0.0522976 0.0349998 0.9076783 -0.1971240 -0.0635307 -0.2258986 0.9319314 7 Li 1.0130840 0.1126806 -0.0522976 0.0349998 0.9076783 -0.1971240 -0.0635307 -0.2258986 0.9319314 8 Li 1.0195695 -0.1143872 -0.0419101 -0.0358149 0.9180482 0.1969311 -0.0655883 0.2335500 0.9294084 9 Li 0.9652761 -0.0176450 0.0060139 -0.0075483 1.2820392 -0.0083516 0.0036773 -0.0052604 1.0433012 10 Li 0.9652761 0.0176450 0.0060139 0.0075483 1.2820392 0.0083516 0.0036773 0.0052604 1.0433012 11 Li 1.0195695 0.1143872 -0.0419101 0.0358149 0.9180482 -0.1969311 -0.0655883 -0.2335500 0.9294084 12 Li 1.0130840 -0.1126806 -0.0522976 -0.0349998 0.9076783 0.1971240 -0.0635307 0.2258986 0.9319314 13 Hf 5.2992036 -0.0389710 0.1795082 0.0274720 4.5297104 0.0586507 0.1800591 -0.0824945 5.3221738 14 Hf 5.2992036 0.0389710 0.1795082 -0.0274720 4.5297104 -0.0586507 0.1800591 0.0824945 5.3221738 15 Hf 5.2992036 0.0389710 0.1795082 -0.0274720 4.5297104 -0.0586507 0.1800591 0.0824945 5.3221738 16 Hf 5.2992036 -0.0389710 0.1795082 0.0274720 4.5297104 0.0586507 0.1800591 -0.0824945 5.3221738 17 O -3.3106156 -0.0121151 1.0708158 -0.0084067 -1.2919133 -0.0087831 1.1636558 0.0392274 -2.5854919 18 O -2.0083819 0.0160850 -0.6146741 0.0184187 -2.2843335 0.0285779 -0.6179693 0.0270847 -2.5763676 19 O -2.5159713 -0.0093219 0.6823885 0.0100787 -1.7034914 0.0011106 0.6475635 -0.0068030 -2.0233228 20 O -2.1174723 0.7356580 -0.6944366 0.7833448 -3.0036946 1.3349888 -0.6660395 1.3724823 -2.3343785 21 O -2.1174723 -0.7356580 -0.6944366 -0.7833448 -3.0036946 -1.3349888 -0.6660395 -1.3724823 -2.3343785 22 O -2.5159713 0.0093219 0.6823885 -0.0100787 -1.7034914 -0.0011106 0.6475635 0.0068030 -2.0233228 23 O -2.0083819 -0.0160850 -0.6146741 -0.0184187 -2.2843335 -0.0285779 -0.6179693 -0.0270847 -2.5763676 24 O -3.3106156 0.0121151 1.0708158 0.0084067 -1.2919133 0.0087831 1.1636558 -0.0392274 -2.5854919 25 O -2.0083819 -0.0160850 -0.6146741 -0.0184187 -2.2843335 -0.0285779 -0.6179693 -0.0270847 -2.5763676 26 O -2.5159713 0.0093219 0.6823885 -0.0100787 -1.7034914 -0.0011106 0.6475635 0.0068030 -2.0233228 27 O -2.1174723 -0.7356580 -0.6944366 -0.7833448 -3.0036946 -1.3349888 -0.6660395 -1.3724823 -2.3343785 28 O -2.1174723 0.7356580 -0.6944366 0.7833448 -3.0036946 1.3349888 -0.6660395 1.3724823 -2.3343785 29 O -2.5159713 -0.0093219 0.6823885 0.0100787 -1.7034914 0.0011106 0.6475635 -0.0068030 -2.0233228 30 O -2.0083819 0.0160850 -0.6146741 0.0184187 -2.2843335 0.0285779 -0.6179693 0.0270847 -2.5763676 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000001 (xxx) 0.00000001 (xxx) 0.00000001 (xxx) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 10 8 5 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.62, Number of G-points: 297, Lambda: 0.12 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/130) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 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 1.373 ( 0.000 0.000 0.000) 0.000 2.993 ( 0.000 0.000 0.000) 0.000 3.258 ( 0.000 0.000 0.000) 0.000 3.370 ( 0.000 0.000 0.000) 0.000 3.620 ( 0.000 0.000 0.000) 0.000 4.499 ( 0.000 0.000 0.000) 0.000 4.505 ( 0.000 0.000 0.000) 0.000 4.521 ( 0.000 0.000 0.000) 0.000 4.702 ( 0.000 0.000 0.000) 0.000 5.045 ( 0.000 0.000 0.000) 0.000 5.227 ( 0.000 0.000 0.000) 0.000 5.322 ( 0.000 0.000 0.000) 0.000 5.656 ( 0.000 0.000 0.000) 0.000 6.078 ( 0.000 0.000 0.000) 0.000 6.414 ( 0.000 0.000 0.000) 0.000 6.597 ( 0.000 0.000 0.000) 0.000 6.642 ( 0.000 0.000 0.000) 0.000 7.021 ( 0.000 0.000 0.000) 0.000 7.083 ( 0.000 0.000 0.000) 0.000 7.262 ( 0.000 0.000 0.000) 0.000 7.407 ( 0.000 0.000 0.000) 0.000 7.790 ( 0.000 0.000 0.000) 0.000 7.951 ( 0.000 0.000 0.000) 0.000 8.148 ( 0.000 0.000 0.000) 0.000 8.484 ( 0.000 0.000 0.000) 0.000 8.888 ( 0.000 0.000 0.000) 0.000 9.015 ( 0.000 0.000 0.000) 0.000 9.018 ( 0.000 0.000 0.000) 0.000 9.142 ( 0.000 0.000 0.000) 0.000 9.220 ( 0.000 0.000 0.000) 0.000 9.536 ( 0.000 0.000 0.000) 0.000 9.676 ( 0.000 0.000 0.000) 0.000 9.923 ( 0.000 0.000 0.000) 0.000 10.089 ( 0.000 0.000 0.000) 0.000 10.108 ( 0.000 0.000 0.000) 0.000 10.126 ( 0.000 0.000 0.000) 0.000 10.386 ( 0.000 0.000 0.000) 0.000 10.650 ( 0.000 0.000 0.000) 0.000 10.704 ( 0.000 0.000 0.000) 0.000 10.919 ( 0.000 0.000 0.000) 0.000 10.968 ( 0.000 0.000 0.000) 0.000 11.126 ( 0.000 0.000 0.000) 0.000 11.648 ( 0.000 0.000 0.000) 0.000 11.688 ( 0.000 0.000 0.000) 0.000 11.709 ( 0.000 0.000 0.000) 0.000 11.717 ( 0.000 0.000 0.000) 0.000 11.787 ( 0.000 0.000 0.000) 0.000 12.095 ( 0.000 0.000 0.000) 0.000 12.174 ( 0.000 0.000 0.000) 0.000 12.253 ( 0.000 0.000 0.000) 0.000 12.381 ( 0.000 0.000 0.000) 0.000 12.405 ( 0.000 0.000 0.000) 0.000 12.464 ( 0.000 0.000 0.000) 0.000 12.716 ( 0.000 0.000 0.000) 0.000 12.795 ( 0.000 0.000 0.000) 0.000 12.863 ( 0.000 0.000 0.000) 0.000 13.256 ( 0.000 0.000 0.000) 0.000 13.519 ( 0.000 0.000 0.000) 0.000 13.581 ( 0.000 0.000 0.000) 0.000 13.635 ( 0.000 0.000 0.000) 0.000 13.686 ( 0.000 0.000 0.000) 0.000 13.850 ( 0.000 0.000 0.000) 0.000 13.913 ( 0.000 0.000 0.000) 0.000 14.212 ( 0.000 0.000 0.000) 0.000 14.246 ( 0.000 0.000 0.000) 0.000 14.307 ( 0.000 0.000 0.000) 0.000 14.343 ( 0.000 0.000 0.000) 0.000 14.448 ( 0.000 0.000 0.000) 0.000 14.495 ( 0.000 0.000 0.000) 0.000 15.085 ( 0.000 0.000 0.000) 0.000 15.204 ( 0.000 0.000 0.000) 0.000 15.477 ( 0.000 0.000 0.000) 0.000 15.691 ( 0.000 0.000 0.000) 0.000 15.822 ( 0.000 0.000 0.000) 0.000 15.917 ( 0.000 0.000 0.000) 0.000 16.215 ( 0.000 0.000 0.000) 0.000 16.527 ( 0.000 0.000 0.000) 0.000 16.678 ( 0.000 0.000 0.000) 0.000 18.353 ( 0.000 0.000 0.000) 0.000 18.563 ( 0.000 0.000 0.000) 0.000 18.970 ( 0.000 0.000 0.000) 0.000 18.981 ( 0.000 0.000 0.000) 0.000 19.325 ( 0.000 0.000 0.000) 0.000 19.392 ( 0.000 0.000 0.000) 0.000 21.303 ( 0.000 0.000 0.000) 0.000 23.621 ( 0.000 0.000 0.000) 0.000 24.733 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/130) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.725 ( 32.572 0.000 11.215) 34.449 0.755 ( 37.107 0.000 5.291) 37.482 1.317 ( 53.621 0.000 33.077) 63.002 1.590 ( 17.994 0.000 10.891) 21.033 2.940 ( -2.428 0.000 -5.075) 5.626 3.266 ( 1.305 0.000 -1.232) 1.794 3.402 ( 4.963 0.000 -8.550) 9.886 3.646 ( -0.019 0.000 6.879) 6.879 4.383 ( -8.971 0.000 -3.838) 9.758 4.422 ( -4.306 0.000 -14.260) 14.896 4.545 ( -1.435 0.000 3.722) 3.989 4.660 ( -3.274 0.000 -4.804) 5.814 5.044 ( -3.050 0.000 4.303) 5.275 5.333 ( 0.948 0.000 6.418) 6.488 5.346 ( 6.769 0.000 0.938) 6.834 5.647 ( 1.623 0.000 -2.824) 3.257 6.141 ( 2.010 0.000 6.494) 6.798 6.633 ( 3.568 0.000 0.441) 3.596 6.648 ( 0.267 0.000 1.268) 1.295 6.937 ( -7.711 0.000 -2.928) 8.248 7.012 ( -4.438 0.000 32.881) 33.180 7.112 ( 5.194 0.000 3.837) 6.457 7.382 ( 12.442 0.000 -12.822) 17.866 7.692 ( -21.630 0.000 -6.007) 22.449 7.851 ( 7.609 0.000 -1.656) 7.787 8.114 ( -4.477 0.000 2.347) 5.055 8.421 ( -6.252 0.000 -0.001) 6.252 8.824 ( 0.665 0.000 -17.505) 17.517 8.946 ( -3.333 0.000 0.020) 3.333 9.034 ( -3.650 0.000 4.286) 5.630 9.092 ( -1.437 0.000 -1.194) 1.869 9.245 ( -3.615 0.000 14.289) 14.739 9.343 ( 9.374 0.000 1.028) 9.430 9.687 ( 3.792 0.000 -6.808) 7.793 9.860 ( -1.753 0.000 -1.863) 2.558 10.089 ( -0.079 0.000 0.070) 0.106 10.114 ( 23.630 0.000 -55.404) 60.232 10.167 ( 6.557 0.000 -2.796) 7.128 10.204 ( 10.250 0.000 -4.897) 11.360 10.352 ( -2.283 0.000 -2.884) 3.679 10.636 ( -3.271 0.000 4.517) 5.577 10.691 ( -2.573 0.000 3.099) 4.028 10.863 ( -3.888 0.000 -2.796) 4.789 11.084 ( -3.393 0.000 -2.885) 4.454 11.576 ( -7.360 0.000 -1.171) 7.453 11.617 ( -8.609 0.000 -9.117) 12.540 11.635 ( -4.965 0.000 8.033) 9.443 11.673 ( -3.505 0.000 0.500) 3.540 11.847 ( 3.503 0.000 4.543) 5.736 11.871 ( -1.766 0.000 4.274) 4.624 12.007 ( -3.221 0.000 -18.770) 19.044 12.094 ( -6.352 0.000 3.810) 7.408 12.182 ( -0.244 0.000 -0.752) 0.791 12.324 ( -5.452 0.000 4.418) 7.017 12.578 ( 7.574 0.000 -0.183) 7.576 12.580 ( 3.414 0.000 21.974) 22.238 12.744 ( 2.552 0.000 0.511) 2.603 12.777 ( -3.237 0.000 3.432) 4.717 12.816 ( -2.229 0.000 -2.148) 3.095 13.370 ( 9.056 0.000 -0.334) 9.062 13.462 ( -7.770 0.000 1.324) 7.882 13.546 ( -2.787 0.000 -3.051) 4.132 13.620 ( 0.748 0.000 -4.514) 4.576 13.695 ( -0.557 0.000 3.346) 3.392 13.900 ( -2.427 0.000 -0.922) 2.596 14.179 ( 0.832 0.000 -0.878) 1.210 14.219 ( -10.364 0.000 11.634) 15.581 14.276 ( 3.115 0.000 -2.920) 4.269 14.413 ( -7.087 0.000 0.464) 7.103 14.463 ( 11.959 0.000 6.774) 13.744 14.581 ( 13.396 0.000 -13.876) 19.287 15.008 ( -4.439 0.000 -0.671) 4.490 15.214 ( 0.537 0.000 1.274) 1.382 15.300 ( -20.013 0.000 66.814) 69.747 15.419 ( -5.569 0.000 -0.593) 5.601 15.814 ( -1.367 0.000 1.551) 2.068 15.868 ( -3.770 0.000 -1.527) 4.067 16.233 ( 2.993 0.000 -5.600) 6.349 16.374 ( -10.490 0.000 34.390) 35.955 16.498 ( -3.896 0.000 4.770) 6.159 17.287 ( 7.829 0.000 -24.100) 25.339 18.542 ( -0.177 0.000 -6.262) 6.264 18.974 ( 0.221 0.000 0.314) 0.384 18.989 ( 0.634 0.000 0.398) 0.749 19.113 ( -21.808 0.000 6.977) 22.897 19.387 ( -0.505 0.000 -0.150) 0.526 21.512 ( 16.493 0.000 7.805) 18.246 21.546 ( 30.058 0.000 -81.137) 86.526 24.500 ( -11.624 0.000 36.559) 38.363 24.632 ( -8.291 0.000 -5.781) 10.107 ======================= Grid point 2 (3/130) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.360 ( 27.017 0.000 6.346) 27.752 1.470 ( 34.838 0.000 3.415) 35.005 2.007 ( 19.713 0.000 13.293) 23.776 2.554 ( 48.076 0.000 29.422) 56.364 2.866 ( -0.574 0.000 -6.980) 7.004 3.294 ( 2.825 0.000 -1.503) 3.200 3.370 ( -0.211 0.000 -18.905) 18.906 3.699 ( -0.932 0.000 10.404) 10.446 4.168 ( -11.024 0.000 -1.798) 11.169 4.246 ( -0.847 0.000 -13.814) 13.840 4.514 ( -7.296 0.000 -6.617) 9.850 4.536 ( -2.416 0.000 4.043) 4.710 4.918 ( -12.052 0.000 1.803) 12.187 5.375 ( -0.805 0.000 -8.326) 8.365 5.511 ( 10.427 0.000 10.690) 14.933 5.746 ( 7.953 0.000 1.466) 8.087 6.271 ( 6.597 0.000 7.666) 10.114 6.660 ( -1.926 0.000 0.096) 1.928 6.733 ( 5.702 0.000 2.197) 6.111 6.749 ( -6.036 0.000 -5.652) 8.269 7.153 ( -25.294 0.000 -7.751) 26.455 7.203 ( 3.092 0.000 17.277) 17.552 7.305 ( 11.904 0.000 -0.295) 11.908 7.495 ( 8.266 0.000 -8.591) 11.922 8.013 ( -8.315 0.000 3.907) 9.187 8.041 ( 14.420 0.000 -8.739) 16.861 8.267 ( -8.808 0.000 -0.971) 8.861 8.701 ( 0.827 0.000 -20.980) 20.997 8.844 ( -8.915 0.000 5.562) 10.508 8.868 ( -13.816 0.000 6.305) 15.186 9.146 ( 4.513 0.000 -0.380) 4.529 9.276 ( -2.796 0.000 12.229) 12.545 9.519 ( 8.230 0.000 -0.325) 8.236 9.728 ( 5.829 0.000 -8.131) 10.005 9.795 ( -4.193 0.000 -0.045) 4.194 10.086 ( -0.277 0.000 0.202) 0.343 10.212 ( 13.395 0.000 -17.991) 22.430 10.267 ( 2.432 0.000 2.283) 3.336 10.270 ( -3.884 0.000 -2.852) 4.819 10.450 ( 16.582 0.000 -0.154) 16.583 10.582 ( -5.954 0.000 4.908) 7.716 10.641 ( -5.190 0.000 3.130) 6.061 10.790 ( 0.132 0.000 -3.227) 3.229 10.955 ( -7.621 0.000 -4.211) 8.707 11.277 ( -16.396 0.000 -14.093) 21.621 11.420 ( -7.916 0.000 -0.443) 7.928 11.590 ( -6.706 0.000 11.829) 13.597 11.606 ( -2.827 0.000 -1.177) 3.062 11.792 ( -3.117 0.000 -21.033) 21.263 11.833 ( -3.776 0.000 0.960) 3.896 11.932 ( 1.722 0.000 1.836) 2.517 12.061 ( -2.530 0.000 9.200) 9.541 12.206 ( -1.269 0.000 8.686) 8.778 12.290 ( -2.270 0.000 7.676) 8.004 12.646 ( -2.817 0.000 -2.515) 3.776 12.693 ( 3.333 0.000 0.678) 3.401 12.736 ( -2.232 0.000 -1.174) 2.522 12.827 ( 6.059 0.000 0.834) 6.116 12.914 ( 3.145 0.000 26.636) 26.821 13.259 ( -13.871 0.000 -0.113) 13.871 13.439 ( -1.001 0.000 -6.785) 6.859 13.447 ( -4.401 0.000 -5.480) 7.028 13.558 ( -3.245 0.000 -0.554) 3.292 13.796 ( -5.761 0.000 -2.649) 6.341 13.824 ( 11.418 0.000 3.306) 11.887 14.127 ( -9.893 0.000 -4.369) 10.815 14.180 ( -2.488 0.000 11.448) 11.715 14.288 ( 6.435 0.000 -2.798) 7.017 14.397 ( 6.041 0.000 -4.782) 7.705 14.726 ( 13.607 0.000 -15.121) 20.342 14.783 ( 14.389 0.000 5.711) 15.481 14.883 ( -5.061 0.000 -7.743) 9.250 15.241 ( 0.681 0.000 2.986) 3.062 15.280 ( -7.188 0.000 -2.314) 7.551 15.395 ( -4.322 0.000 25.834) 26.193 15.774 ( -4.170 0.000 -3.218) 5.267 15.792 ( -2.988 0.000 4.004) 4.997 16.223 ( 0.169 0.000 -6.698) 6.700 16.320 ( -9.847 0.000 5.560) 11.308 16.548 ( 3.460 0.000 11.171) 11.695 17.264 ( 0.389 0.000 -4.930) 4.945 18.442 ( -3.422 0.000 -17.531) 17.862 18.734 ( -23.703 0.000 19.055) 30.413 18.984 ( 0.651 0.000 0.128) 0.664 19.006 ( 0.760 0.000 0.474) 0.896 19.371 ( -0.865 0.000 -0.529) 1.014 21.557 ( 12.682 0.000 -33.035) 35.386 21.930 ( 17.597 0.000 13.993) 22.483 24.362 ( -13.234 0.000 -10.942) 17.172 24.540 ( -4.203 0.000 17.784) 18.274 ======================= Grid point 3 (4/130) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.800 ( 16.739 0.000 -1.851) 16.841 2.116 ( 31.288 0.000 0.984) 31.303 2.423 ( 15.980 0.000 6.231) 17.151 2.822 ( 0.851 0.000 -8.395) 8.438 3.125 ( -8.413 0.000 -20.198) 21.880 3.362 ( 5.090 0.000 0.295) 5.098 3.527 ( 29.768 0.000 26.158) 39.628 3.751 ( -0.931 0.000 9.548) 9.593 3.964 ( -7.505 0.000 2.872) 8.036 4.251 ( 5.729 0.000 -6.686) 8.805 4.322 ( -5.959 0.000 -5.438) 8.067 4.507 ( -3.350 0.000 3.646) 4.952 4.665 ( -14.127 0.000 0.982) 14.161 5.263 ( -2.409 0.000 -13.594) 13.806 5.809 ( 12.111 0.000 9.917) 15.654 5.886 ( 5.256 0.000 0.617) 5.292 6.467 ( -9.221 0.000 -9.178) 13.010 6.474 ( 4.741 0.000 7.520) 8.890 6.581 ( -22.516 0.000 0.536) 22.522 6.764 ( 4.026 0.000 1.658) 4.353 6.906 ( 10.440 0.000 -4.860) 11.516 7.421 ( 6.741 0.000 10.342) 12.345 7.443 ( 4.365 0.000 -5.692) 7.173 7.636 ( 10.514 0.000 -7.197) 12.742 7.859 ( -10.633 0.000 4.916) 11.714 8.035 ( -10.286 0.000 -3.394) 10.832 8.298 ( 16.175 0.000 -9.342) 18.679 8.570 ( 0.436 0.000 -20.305) 20.310 8.662 ( -12.878 0.000 10.676) 16.727 8.718 ( -8.464 0.000 7.988) 11.638 9.229 ( 3.985 0.000 0.611) 4.031 9.317 ( -0.179 0.000 8.375) 8.377 9.642 ( 4.789 0.000 -0.674) 4.836 9.715 ( -3.544 0.000 0.215) 3.551 9.789 ( 5.494 0.000 -6.241) 8.315 10.080 ( -0.403 0.000 -0.026) 0.404 10.181 ( -3.652 0.000 -1.224) 3.851 10.255 ( -3.249 0.000 -0.827) 3.353 10.380 ( 12.318 0.000 -4.658) 13.169 10.477 ( -6.894 0.000 0.353) 6.903 10.538 ( -6.251 0.000 -1.182) 6.361 10.741 ( -12.290 0.000 -1.221) 12.350 10.747 ( 10.486 0.000 2.449) 10.768 10.868 ( 8.790 0.000 0.994) 8.846 10.882 ( -14.460 0.000 -10.697) 17.987 11.282 ( -7.130 0.000 2.128) 7.440 11.560 ( -4.674 0.000 12.050) 12.924 11.561 ( -0.496 0.000 -2.397) 2.447 11.641 ( 0.773 0.000 -14.944) 14.964 11.740 ( -4.541 0.000 -3.841) 5.948 11.933 ( -1.545 0.000 -0.411) 1.599 12.091 ( -1.576 0.000 8.948) 9.086 12.226 ( -4.489 0.000 11.235) 12.099 12.327 ( -1.022 0.000 9.117) 9.174 12.574 ( -1.812 0.000 -3.863) 4.267 12.674 ( -3.156 0.000 -1.200) 3.376 12.725 ( 0.043 0.000 1.344) 1.344 12.925 ( -6.242 0.000 0.601) 6.271 13.006 ( -2.818 0.000 3.208) 4.270 13.118 ( -0.394 0.000 16.839) 16.844 13.300 ( -7.157 0.000 -1.600) 7.334 13.324 ( -3.028 0.000 -7.793) 8.360 13.613 ( 8.666 0.000 2.637) 9.058 13.664 ( -6.394 0.000 -6.954) 9.447 13.877 ( -10.440 0.000 -3.009) 10.865 14.063 ( 9.363 0.000 3.835) 10.118 14.243 ( 1.116 0.000 8.513) 8.586 14.422 ( 8.521 0.000 -6.551) 10.749 14.499 ( 8.308 0.000 -3.684) 9.089 14.733 ( -5.066 0.000 -5.676) 7.608 14.873 ( 14.054 0.000 -17.214) 22.223 15.056 ( 9.648 0.000 0.378) 9.656 15.142 ( -3.543 0.000 -3.153) 4.743 15.289 ( 1.062 0.000 6.922) 7.003 15.481 ( 0.796 0.000 8.346) 8.384 15.667 ( -5.025 0.000 -2.502) 5.613 15.756 ( -4.296 0.000 5.921) 7.315 16.129 ( -12.944 0.000 3.788) 13.487 16.149 ( -3.273 0.000 -5.204) 6.147 16.724 ( 8.580 0.000 4.078) 9.499 17.236 ( -2.399 0.000 2.529) 3.486 18.158 ( -12.828 0.000 -11.116) 16.974 18.543 ( -10.102 0.000 12.332) 15.942 18.999 ( 0.758 0.000 0.134) 0.770 19.023 ( 0.646 0.000 0.368) 0.743 19.346 ( -1.217 0.000 -0.974) 1.559 21.568 ( 6.103 0.000 -15.423) 16.587 22.330 ( 12.714 0.000 17.091) 21.301 24.013 ( -13.321 0.000 -14.246) 19.504 24.579 ( -1.974 0.000 10.161) 10.350 ======================= Grid point 4 (5/130) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.967 ( 5.223 0.000 -6.518) 8.353 2.605 ( 13.555 0.000 0.151) 13.556 2.682 ( -5.970 0.000 -15.998) 17.076 2.740 ( 21.879 0.000 -1.448) 21.927 2.974 ( 1.042 0.000 -0.720) 1.267 3.467 ( 1.863 0.000 2.753) 3.324 3.605 ( -13.920 0.000 4.709) 14.695 3.793 ( -0.183 0.000 5.226) 5.229 4.124 ( -6.011 0.000 -4.086) 7.268 4.350 ( 21.600 0.000 22.370) 31.097 4.374 ( -1.339 0.000 0.782) 1.551 4.466 ( -2.597 0.000 2.256) 3.439 4.479 ( -0.287 0.000 -1.234) 1.267 5.093 ( -4.715 0.000 -17.227) 17.860 5.953 ( 1.796 0.000 -0.098) 1.799 6.064 ( 7.439 0.000 7.016) 10.226 6.129 ( -16.472 0.000 -1.455) 16.536 6.264 ( -5.145 0.000 -7.279) 8.914 6.702 ( 6.677 0.000 6.146) 9.075 6.869 ( 5.082 0.000 1.632) 5.337 7.101 ( 12.387 0.000 -2.770) 12.693 7.449 ( 0.557 0.000 -3.194) 3.242 7.513 ( -5.707 0.000 4.040) 6.992 7.700 ( 0.576 0.000 -6.631) 6.656 7.746 ( -1.762 0.000 4.763) 5.078 7.811 ( -6.536 0.000 -7.743) 10.133 8.448 ( -0.994 0.000 -11.845) 11.887 8.518 ( 2.051 0.000 -7.227) 7.512 8.596 ( 5.601 0.000 13.934) 15.017 8.643 ( -4.281 0.000 4.841) 6.463 9.298 ( 2.386 0.000 0.992) 2.584 9.384 ( 2.172 0.000 4.201) 4.729 9.644 ( -1.630 0.000 -0.187) 1.641 9.726 ( 2.166 0.000 0.240) 2.179 9.835 ( 2.649 0.000 -3.535) 4.418 10.077 ( 0.675 0.000 -1.243) 1.414 10.115 ( -3.283 0.000 0.369) 3.304 10.177 ( -3.286 0.000 -1.000) 3.435 10.342 ( -4.956 0.000 -4.956) 7.009 10.391 ( -5.823 0.000 -6.197) 8.503 10.530 ( -9.388 0.000 4.539) 10.427 10.610 ( 12.937 0.000 0.335) 12.941 10.632 ( -6.643 0.000 -2.485) 7.092 10.884 ( 5.187 0.000 -1.271) 5.340 10.994 ( 0.743 0.000 1.388) 1.574 11.165 ( -8.783 0.000 4.843) 10.030 11.551 ( 0.044 0.000 -0.319) 0.322 11.580 ( -2.338 0.000 9.142) 9.436 11.610 ( 4.853 0.000 -10.403) 11.479 11.650 ( 0.539 0.000 -6.446) 6.468 11.892 ( -2.030 0.000 -0.225) 2.043 12.092 ( -6.239 0.000 10.073) 11.848 12.199 ( -2.878 0.000 5.069) 5.829 12.351 ( -1.492 0.000 4.886) 5.108 12.524 ( -0.950 0.000 -3.071) 3.215 12.619 ( -1.644 0.000 -0.321) 1.675 12.709 ( -2.865 0.000 1.986) 3.486 12.781 ( -2.495 0.000 3.757) 4.511 13.102 ( 3.651 0.000 3.465) 5.034 13.141 ( -3.738 0.000 7.832) 8.678 13.196 ( -1.212 0.000 -6.278) 6.394 13.235 ( -1.414 0.000 -6.145) 6.306 13.413 ( -11.202 0.000 -9.959) 14.989 13.762 ( -2.203 0.000 0.418) 2.242 13.869 ( 10.351 0.000 11.344) 15.357 14.183 ( 0.347 0.000 2.925) 2.946 14.333 ( 3.467 0.000 3.409) 4.862 14.467 ( 3.188 0.000 -10.786) 11.247 14.633 ( -0.167 0.000 0.965) 0.980 14.674 ( 6.541 0.000 -0.070) 6.541 14.996 ( 4.363 0.000 -5.766) 7.231 15.062 ( 6.430 0.000 -12.586) 14.133 15.199 ( 3.387 0.000 -1.564) 3.730 15.382 ( 2.621 0.000 6.862) 7.345 15.539 ( 2.316 0.000 -0.389) 2.348 15.553 ( -5.856 0.000 0.363) 5.867 15.717 ( -3.151 0.000 4.340) 5.363 15.911 ( -11.783 0.000 3.699) 12.350 16.050 ( -3.603 0.000 -2.600) 4.443 16.900 ( 7.880 0.000 -0.612) 7.904 17.207 ( -3.301 0.000 4.676) 5.724 17.888 ( -9.003 0.000 -4.063) 9.877 18.466 ( -4.472 0.000 4.582) 6.402 19.012 ( 0.508 0.000 0.062) 0.511 19.036 ( 0.482 0.000 0.252) 0.544 19.316 ( -1.109 0.000 -0.906) 1.432 21.575 ( 2.485 0.000 -6.202) 6.682 22.634 ( 7.239 0.000 14.484) 16.192 23.697 ( -9.028 0.000 -12.841) 15.697 24.603 ( -0.930 0.000 4.766) 4.856 ======================= Grid point 5 (6/130) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 65 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.980 ( 0.000 0.000 0.000) 0.000 2.550 ( 0.000 0.000 0.000) 0.000 2.701 ( 0.000 0.000 0.000) 0.000 3.001 ( 0.000 0.000 0.000) 0.000 3.119 ( 0.000 0.000 0.000) 0.000 3.270 ( 0.000 0.000 0.000) 0.000 3.571 ( 0.000 0.000 0.000) 0.000 3.810 ( 0.000 0.000 0.000) 0.000 4.047 ( 0.000 0.000 0.000) 0.000 4.319 ( 0.000 0.000 -0.000) 0.000 4.442 ( 0.000 0.000 0.000) 0.000 4.521 ( 0.000 0.000 0.000) 0.000 4.815 ( -0.000 0.000 -0.000) 0.000 4.818 ( 0.000 0.000 0.000) 0.000 5.952 ( 0.000 0.000 0.000) 0.000 5.975 ( 0.000 0.000 0.000) 0.000 6.146 ( 0.000 0.000 0.000) 0.000 6.206 ( 0.000 0.000 -0.000) 0.000 6.793 ( 0.000 0.000 0.000) 0.000 6.935 ( 0.000 0.000 0.000) 0.000 7.312 ( 0.000 0.000 -0.000) 0.000 7.345 ( -0.000 0.000 0.000) 0.000 7.449 ( 0.000 0.000 0.000) 0.000 7.615 ( 0.000 0.000 0.000) 0.000 7.755 ( 0.000 0.000 0.000) 0.000 7.776 ( 0.000 0.000 0.000) 0.000 8.392 ( 0.000 0.000 0.000) 0.000 8.487 ( 0.000 0.000 -0.000) 0.000 8.619 ( 0.000 0.000 0.000) 0.000 8.745 ( 0.000 0.000 0.000) 0.000 9.325 ( 0.000 0.000 -0.000) 0.000 9.426 ( 0.000 0.000 0.000) 0.000 9.630 ( 0.000 0.000 0.000) 0.000 9.748 ( 0.000 0.000 0.000) 0.000 9.844 ( 0.000 0.000 0.000) 0.000 10.063 ( 0.000 0.000 -0.000) 0.000 10.097 ( 0.000 0.000 0.000) 0.000 10.139 ( 0.000 0.000 0.000) 0.000 10.262 ( 0.000 0.000 0.000) 0.000 10.303 ( -0.000 0.000 0.000) 0.000 10.462 ( 0.000 0.000 0.000) 0.000 10.568 ( 0.000 0.000 0.000) 0.000 10.793 ( 0.000 0.000 0.000) 0.000 10.938 ( 0.000 0.000 0.000) 0.000 10.974 ( 0.000 0.000 0.000) 0.000 11.045 ( -0.000 0.000 0.000) 0.000 11.550 ( 0.000 0.000 -0.000) 0.000 11.575 ( 0.000 0.000 0.000) 0.000 11.637 ( 0.000 0.000 -0.000) 0.000 11.657 ( 0.000 0.000 0.000) 0.000 11.869 ( 0.000 0.000 -0.000) 0.000 12.042 ( -0.000 0.000 0.000) 0.000 12.196 ( 0.000 0.000 0.000) 0.000 12.352 ( 0.000 0.000 -0.000) 0.000 12.502 ( 0.000 0.000 0.000) 0.000 12.604 ( 0.000 0.000 0.000) 0.000 12.702 ( 0.000 0.000 0.000) 0.000 12.797 ( 0.000 0.000 0.000) 0.000 13.138 ( -0.000 0.000 0.000) 0.000 13.154 ( 0.000 0.000 -0.000) 0.000 13.157 ( 0.000 0.000 -0.000) 0.000 13.169 ( -0.000 0.000 -0.000) 0.000 13.255 ( 0.000 0.000 0.000) 0.000 13.748 ( 0.000 0.000 0.000) 0.000 14.055 ( 0.000 0.000 0.000) 0.000 14.156 ( -0.000 0.000 -0.000) 0.000 14.383 ( 0.000 0.000 -0.000) 0.000 14.449 ( 0.000 0.000 0.000) 0.000 14.629 ( 0.000 0.000 0.000) 0.000 14.763 ( 0.000 0.000 0.000) 0.000 14.992 ( 0.000 0.000 -0.000) 0.000 15.119 ( 0.000 0.000 0.000) 0.000 15.221 ( 0.000 0.000 0.000) 0.000 15.436 ( 0.000 0.000 0.000) 0.000 15.486 ( 0.000 0.000 0.000) 0.000 15.558 ( 0.000 0.000 0.000) 0.000 15.712 ( 0.000 0.000 -0.000) 0.000 15.789 ( -0.000 0.000 0.000) 0.000 16.002 ( 0.000 0.000 0.000) 0.000 16.981 ( 0.000 0.000 0.000) 0.000 17.186 ( 0.000 0.000 0.000) 0.000 17.785 ( 0.000 0.000 -0.000) 0.000 18.438 ( 0.000 0.000 0.000) 0.000 19.017 ( 0.000 0.000 0.000) 0.000 19.042 ( 0.000 0.000 0.000) 0.000 19.300 ( 0.000 0.000 0.000) 0.000 21.577 ( 0.000 0.000 0.000) 0.000 22.766 ( 0.000 0.000 -0.000) 0.000 23.551 ( 0.000 0.000 0.000) 0.000 24.610 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 11 (7/130) ======================= q-point: ( 0.00 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.722 ( 0.000 33.754 0.000) 33.754 0.811 ( 0.000 37.826 0.000) 37.826 1.268 ( 0.000 59.110 0.000) 59.110 1.975 ( 0.000 44.354 0.000) 44.354 3.230 ( 0.000 0.649 0.000) 0.649 3.433 ( 0.000 5.892 0.000) 5.892 3.526 ( 0.000 18.070 0.000) 18.070 3.639 ( 0.000 2.333 0.000) 2.333 4.395 ( 0.000 -7.897 0.000) 7.897 4.441 ( 0.000 -3.774 0.000) 3.774 4.593 ( 0.000 6.141 0.000) 6.141 4.663 ( 0.000 -3.846 0.000) 3.846 5.128 ( 0.000 6.436 0.000) 6.436 5.306 ( 0.000 7.295 0.000) 7.295 5.641 ( 0.000 -1.240 0.000) 1.240 5.965 ( 0.000 11.491 0.000) 11.491 6.135 ( 0.000 3.697 0.000) 3.697 6.389 ( 0.000 -1.020 0.000) 1.020 6.646 ( 0.000 3.655 0.000) 3.655 6.985 ( 0.000 -8.820 0.000) 8.820 7.050 ( 0.000 8.192 0.000) 8.192 7.128 ( 0.000 6.977 0.000) 6.977 7.360 ( 0.000 4.013 0.000) 4.013 7.431 ( 0.000 2.099 0.000) 2.099 7.640 ( 0.000 -9.988 0.000) 9.988 8.060 ( 0.000 6.261 0.000) 6.261 8.131 ( 0.000 -1.881 0.000) 1.881 8.476 ( 0.000 -0.719 0.000) 0.719 8.836 ( 0.000 -5.374 0.000) 5.374 9.004 ( 0.000 -1.229 0.000) 1.229 9.057 ( 0.000 -10.585 0.000) 10.585 9.108 ( 0.000 -2.535 0.000) 2.535 9.222 ( 0.000 1.867 0.000) 1.867 9.524 ( 0.000 -1.215 0.000) 1.215 9.550 ( 0.000 -7.306 0.000) 7.306 10.006 ( 0.000 7.037 0.000) 7.037 10.099 ( 0.000 -0.668 0.000) 0.668 10.153 ( 0.000 4.938 0.000) 4.938 10.191 ( 0.000 4.038 0.000) 4.038 10.618 ( 0.000 7.554 0.000) 7.554 10.637 ( 0.000 -3.563 0.000) 3.563 10.683 ( 0.000 0.167 0.000) 0.167 10.878 ( 0.000 -3.397 0.000) 3.397 11.000 ( 0.000 3.060 0.000) 3.060 11.342 ( 0.000 15.489 0.000) 15.489 11.463 ( 0.000 -10.180 0.000) 10.180 11.478 ( 0.000 -12.575 0.000) 12.575 11.738 ( 0.000 1.530 0.000) 1.530 11.807 ( 0.000 1.177 0.000) 1.177 11.910 ( 0.000 -1.810 0.000) 1.810 12.127 ( 0.000 -3.559 0.000) 3.559 12.188 ( 0.000 -1.708 0.000) 1.708 12.236 ( 0.000 4.939 0.000) 4.939 12.523 ( 0.000 3.580 0.000) 3.580 12.559 ( 0.000 10.027 0.000) 10.027 12.679 ( 0.000 8.770 0.000) 8.770 12.791 ( 0.000 -5.489 0.000) 5.489 12.860 ( 0.000 8.048 0.000) 8.048 13.161 ( 0.000 -6.350 0.000) 6.350 13.505 ( 0.000 -3.577 0.000) 3.577 13.532 ( 0.000 0.052 0.000) 0.052 13.664 ( 0.000 2.875 0.000) 2.875 13.772 ( 0.000 9.257 0.000) 9.257 13.900 ( 0.000 -0.753 0.000) 0.753 13.948 ( 0.000 6.258 0.000) 6.258 14.167 ( 0.000 -9.232 0.000) 9.232 14.194 ( 0.000 -0.744 0.000) 0.744 14.195 ( 0.000 -3.417 0.000) 3.417 14.368 ( 0.000 -6.280 0.000) 6.280 14.383 ( 0.000 4.049 0.000) 4.049 14.530 ( 0.000 1.027 0.000) 1.027 14.916 ( 0.000 -12.011 0.000) 12.011 15.111 ( 0.000 -9.025 0.000) 9.025 15.487 ( 0.000 0.963 0.000) 0.963 15.759 ( 0.000 -6.002 0.000) 6.002 15.794 ( 0.000 6.211 0.000) 6.211 15.895 ( 0.000 -1.463 0.000) 1.463 16.220 ( 0.000 0.921 0.000) 0.921 16.233 ( 0.000 1.671 0.000) 1.671 16.442 ( 0.000 -7.967 0.000) 7.967 16.684 ( 0.000 0.700 0.000) 0.700 18.379 ( 0.000 -20.573 0.000) 20.573 18.387 ( 0.000 3.111 0.000) 3.111 18.861 ( 0.000 -6.300 0.000) 6.300 19.339 ( 0.000 1.212 0.000) 1.212 19.381 ( 0.000 -0.724 0.000) 0.724 21.553 ( 0.000 20.599 0.000) 20.599 23.452 ( 0.000 3.545 0.000) 3.545 23.572 ( 0.000 -4.711 0.000) 4.711 24.651 ( 0.000 -7.569 0.000) 7.569 ======================= Grid point 12 (8/130) ======================= q-point: ( 0.10 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.065 ( 22.184 27.628 7.904) 36.303 1.124 ( 26.586 24.894 6.606) 37.016 1.751 ( 37.162 36.160 18.770) 55.144 2.086 ( 8.806 39.083 6.333) 40.560 3.118 ( -3.263 4.981 -11.706) 13.134 3.444 ( -1.885 17.710 1.899) 17.911 3.518 ( 2.300 11.702 1.880) 12.073 3.635 ( 2.115 -0.276 -1.212) 2.454 4.343 ( -4.965 -3.752 -5.326) 8.191 4.381 ( -5.184 -2.209 -3.306) 6.533 4.582 ( -0.478 4.378 0.407) 4.423 4.621 ( -3.738 -3.634 -2.833) 5.933 5.118 ( -1.639 4.962 2.256) 5.692 5.390 ( 4.611 4.498 -1.905) 6.718 5.572 ( -10.844 18.159 3.630) 21.460 5.644 ( 2.287 0.079 -2.465) 3.363 6.183 ( 4.142 3.877 2.464) 6.185 6.659 ( 0.503 1.499 4.642) 4.904 6.753 ( 5.045 5.380 8.823) 11.499 6.942 ( -3.442 -1.100 -4.326) 5.637 6.999 ( -5.656 2.239 22.230) 23.047 7.083 ( -0.521 -3.457 -4.983) 6.087 7.346 ( 4.808 2.609 -1.915) 5.796 7.697 ( 8.181 -3.807 -9.231) 12.909 7.869 ( -9.257 2.853 -3.228) 10.210 8.108 ( -4.670 -0.350 5.282) 7.059 8.377 ( 9.236 -14.695 -2.895) 17.596 8.475 ( 30.201 -19.951 -13.948) 38.791 8.793 ( 0.773 -3.241 -14.266) 14.649 8.996 ( -6.438 -2.443 14.618) 16.159 9.029 ( -8.673 -3.120 5.918) 10.954 9.169 ( 4.797 -6.435 4.901) 9.405 9.268 ( 4.717 -5.455 3.378) 7.964 9.574 ( 6.714 -6.077 -6.497) 11.146 9.699 ( 18.406 -8.276 -12.329) 23.649 9.979 ( -1.889 5.574 -1.069) 5.982 10.119 ( 1.397 0.699 -2.584) 3.020 10.166 ( 1.710 -1.171 -3.971) 4.480 10.195 ( 1.647 3.972 4.705) 6.374 10.519 ( -2.406 7.584 -9.330) 12.261 10.646 ( -2.876 -1.233 8.999) 9.528 10.709 ( -1.131 1.864 4.684) 5.166 10.851 ( -2.093 -0.311 -2.277) 3.108 11.136 ( 3.075 -6.223 14.028) 15.651 11.281 ( -3.765 7.706 -2.664) 8.981 11.397 ( -5.153 -8.739 -2.971) 10.571 11.508 ( 1.854 -6.433 0.289) 6.701 11.724 ( -2.165 3.645 1.622) 4.539 11.811 ( 2.686 -1.068 -5.399) 6.124 11.947 ( -3.513 -1.650 11.667) 12.295 12.026 ( -3.835 5.167 -8.910) 10.991 12.092 ( -3.797 6.177 -6.572) 9.787 12.294 ( -1.727 -9.267 13.408) 16.390 12.460 ( -3.956 9.133 -2.685) 10.309 12.541 ( -2.949 4.703 1.857) 5.853 12.693 ( 1.160 2.985 -2.614) 4.134 12.766 ( -0.892 -0.513 -0.248) 1.058 12.940 ( 4.098 9.195 10.294) 14.398 13.266 ( -10.511 7.266 -10.118) 16.299 13.310 ( 1.657 1.303 -4.392) 4.871 13.491 ( -3.800 -0.482 -0.128) 3.832 13.521 ( -2.640 1.945 -1.730) 3.707 13.703 ( -4.790 5.143 -2.898) 7.602 13.742 ( -3.517 5.287 -0.150) 6.352 13.957 ( -5.623 2.154 -1.957) 6.332 14.144 ( -6.743 -2.731 6.417) 9.701 14.198 ( 2.344 0.087 3.111) 3.896 14.290 ( 5.351 -0.182 -6.299) 8.267 14.313 ( 5.540 -6.573 0.602) 8.617 14.529 ( 0.943 3.080 1.508) 3.556 14.565 ( 12.850 -0.541 -12.497) 17.933 14.895 ( -2.005 -9.340 -3.045) 10.027 15.068 ( -3.916 -8.663 7.874) 12.344 15.439 ( -4.576 1.614 0.360) 4.865 15.480 ( -22.150 9.266 35.730) 43.048 15.762 ( -1.036 -5.283 3.127) 6.226 15.860 ( -2.996 -0.643 -1.557) 3.438 16.243 ( 2.529 1.045 -5.338) 5.999 16.358 ( -7.321 -2.770 19.925) 21.407 16.425 ( -0.587 -5.338 7.193) 8.977 17.003 ( 25.427 -15.780 -30.852) 42.981 18.324 ( -2.901 -21.964 -7.564) 23.410 18.557 ( 9.231 -11.072 4.977) 15.250 18.806 ( -9.157 -5.886 9.549) 14.480 19.276 ( -4.994 6.750 0.442) 8.408 19.411 ( 3.030 -0.105 -2.609) 4.000 21.714 ( 12.709 17.279 7.348) 22.673 22.395 ( -21.049 39.371 -50.166) 67.154 24.233 ( 5.436 -17.129 31.117) 35.933 24.553 ( -7.941 -7.286 -5.670) 12.178 ======================= Grid point 13 (9/130) ======================= q-point: ( 0.20 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.586 ( 24.516 18.853 8.481) 32.069 1.698 ( 29.196 18.212 2.682) 34.515 2.351 ( 13.181 26.967 7.091) 30.842 2.636 ( 34.450 12.256 17.224) 40.418 3.024 ( 3.538 3.779 -10.017) 11.276 3.414 ( -0.274 19.409 -2.738) 19.603 3.582 ( 2.977 14.359 0.091) 14.665 3.683 ( 1.691 -0.642 3.147) 3.630 4.167 ( -9.903 -0.026 -1.483) 10.013 4.259 ( -1.552 2.273 -8.959) 9.373 4.487 ( -6.316 -2.324 -5.534) 8.713 4.556 ( -3.719 1.689 3.600) 5.444 5.028 ( -10.556 8.671 0.472) 13.669 5.394 ( -1.445 1.773 -7.236) 7.589 5.542 ( 5.920 3.466 7.684) 10.301 5.770 ( 7.269 2.817 2.709) 8.253 6.326 ( 7.935 5.024 5.187) 10.729 6.674 ( -5.769 -3.596 1.696) 7.007 6.762 ( -6.416 1.607 1.449) 6.771 6.858 ( -1.196 9.646 -0.815) 9.754 6.917 ( -5.235 -9.530 -14.037) 17.756 7.164 ( 4.468 -2.938 18.575) 19.330 7.486 ( 7.059 11.457 -3.813) 13.987 7.590 ( 1.587 6.835 -6.987) 9.902 7.971 ( 9.796 -4.636 -1.787) 10.984 8.036 ( -2.323 0.473 -0.550) 2.434 8.246 ( -8.335 -2.338 -2.775) 9.091 8.691 ( 1.235 -1.300 -19.701) 19.783 8.746 ( -1.053 -8.008 0.347) 8.084 8.837 ( -13.309 -2.399 6.668) 15.078 9.080 ( 5.692 -6.470 5.750) 10.360 9.216 ( -2.858 -4.852 11.738) 13.019 9.449 ( 10.097 -8.266 -0.943) 13.083 9.668 ( 7.384 -2.871 -6.442) 10.211 9.899 ( 1.037 2.891 -0.404) 3.098 9.953 ( 6.451 -5.539 -7.688) 11.463 10.070 ( -0.819 -8.657 -6.189) 10.673 10.219 ( 0.568 3.140 3.253) 4.556 10.320 ( 8.537 -5.759 3.711) 10.946 10.445 ( 1.346 9.498 -6.572) 11.628 10.647 ( -2.202 0.647 4.722) 5.250 10.706 ( -3.765 1.143 7.525) 8.492 10.769 ( -4.024 3.604 -2.477) 5.943 11.119 ( -5.146 6.658 -4.822) 9.699 11.162 ( -8.873 -6.507 -6.840) 12.956 11.306 ( -3.413 -5.206 2.931) 6.880 11.529 ( 2.058 -3.845 -5.690) 7.169 11.681 ( -4.176 7.199 3.851) 9.171 11.802 ( -3.034 4.529 -1.534) 5.663 11.849 ( -6.326 4.620 0.056) 7.834 11.913 ( -0.972 1.880 -3.493) 4.084 12.113 ( -0.801 1.477 13.558) 13.661 12.326 ( -2.527 -7.701 3.892) 8.991 12.390 ( -1.461 7.540 3.518) 8.448 12.490 ( -4.103 2.330 4.946) 6.836 12.662 ( -1.705 -0.979 -2.413) 3.112 12.797 ( 2.823 2.100 -0.673) 3.582 12.966 ( -6.155 8.578 -5.413) 11.865 13.115 ( 2.772 7.950 17.066) 19.030 13.285 ( -12.578 3.817 -0.439) 13.152 13.397 ( -1.344 -0.120 -5.836) 5.990 13.524 ( -4.305 3.123 -3.550) 6.395 13.610 ( -2.092 3.590 1.095) 4.297 13.723 ( 3.627 -5.663 1.712) 6.939 13.812 ( -2.940 -1.027 -3.924) 5.009 14.115 ( -1.609 -2.725 6.283) 7.035 14.192 ( -8.097 3.889 -6.410) 11.035 14.310 ( 6.832 1.546 -1.868) 7.249 14.402 ( 6.777 0.431 -3.996) 7.879 14.668 ( 5.335 -5.211 -11.837) 13.990 14.725 ( 11.454 -4.700 7.181) 14.313 14.818 ( 2.313 -3.074 -8.983) 9.772 15.107 ( 0.963 -10.026 7.694) 12.674 15.328 ( -5.828 2.475 -1.047) 6.418 15.419 ( -5.836 0.037 15.944) 16.978 15.752 ( -3.378 -3.384 4.221) 6.378 15.781 ( -3.389 -0.223 -1.657) 3.779 16.235 ( 0.636 1.198 -6.478) 6.618 16.263 ( -9.251 -5.528 4.451) 11.659 16.539 ( 4.521 -0.596 10.303) 11.267 17.139 ( 7.036 -10.361 -11.550) 17.038 18.151 ( -8.408 -24.171 -10.761) 27.762 18.648 ( -9.200 -3.574 12.189) 15.683 18.740 ( 1.411 -11.537 6.349) 13.244 19.205 ( -2.332 10.850 -0.341) 11.103 19.428 ( 0.620 2.138 -3.125) 3.837 21.949 ( -2.407 27.994 -25.238) 37.768 22.066 ( 14.386 12.405 12.272) 22.615 24.290 ( -12.591 -6.618 -10.769) 17.841 24.419 ( -0.583 -10.375 16.503) 19.502 ======================= Grid point 14 (10/130) ======================= q-point: ( 0.30 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.038 ( 17.429 18.198 3.182) 25.398 2.255 ( 28.571 12.234 -0.836) 31.092 2.633 ( 11.632 16.758 3.140) 20.640 2.849 ( 0.150 1.565 -14.172) 14.259 3.169 ( 1.024 8.469 -8.402) 11.973 3.601 ( 10.495 12.327 8.730) 18.394 3.667 ( 10.115 18.922 9.389) 23.421 3.734 ( -0.126 -1.481 7.361) 7.509 3.971 ( -9.451 1.404 3.033) 10.025 4.254 ( 4.800 0.936 -3.892) 6.250 4.346 ( -2.138 1.210 -5.075) 5.639 4.513 ( -3.039 0.291 3.556) 4.687 4.778 ( -14.265 10.549 1.812) 17.835 5.294 ( -1.387 3.041 -11.974) 12.432 5.791 ( 11.086 -1.576 9.158) 14.465 5.890 ( 3.927 0.843 0.710) 4.079 6.395 ( -18.635 -9.663 -5.158) 21.616 6.480 ( -12.189 -3.108 -4.013) 13.204 6.547 ( 7.140 3.460 6.110) 10.014 6.905 ( 8.015 0.485 -3.956) 8.951 6.929 ( 4.213 13.942 1.388) 14.631 7.367 ( 5.024 -3.560 9.549) 11.362 7.465 ( 1.315 1.648 -7.187) 7.490 7.736 ( 7.517 7.958 -6.277) 12.619 7.906 ( -7.470 3.546 3.983) 9.178 8.025 ( -7.778 -0.053 -4.332) 8.903 8.273 ( 18.027 -2.104 -8.291) 19.954 8.576 ( 0.882 0.542 -19.523) 19.551 8.634 ( -12.219 -2.232 12.589) 17.685 8.674 ( -8.382 -3.256 7.850) 11.937 9.179 ( 1.394 -4.576 2.613) 5.451 9.302 ( 4.896 -2.039 7.352) 9.066 9.597 ( 6.274 -5.868 -1.425) 8.708 9.742 ( 3.296 1.418 -4.312) 5.610 9.853 ( -1.689 6.687 0.511) 6.916 10.023 ( 0.863 -10.425 -3.329) 10.978 10.034 ( 2.388 -7.011 -3.523) 8.202 10.216 ( -2.565 2.473 3.698) 5.135 10.427 ( -0.190 -3.194 -1.917) 3.730 10.493 ( 4.085 6.171 1.068) 7.477 10.587 ( -5.031 2.779 -6.654) 8.792 10.636 ( -8.481 -2.588 8.437) 12.240 10.741 ( -0.544 0.575 -0.737) 1.081 10.958 ( -2.077 0.539 -6.491) 6.837 11.005 ( -1.326 8.452 -5.197) 10.010 11.258 ( -2.663 -0.999 2.865) 4.037 11.515 ( 3.055 -3.988 -10.775) 11.889 11.618 ( -5.340 7.056 3.010) 9.347 11.709 ( -3.776 5.004 -2.656) 6.808 11.776 ( -4.470 11.612 7.604) 14.583 11.910 ( 0.512 -2.087 -0.936) 2.344 12.153 ( -5.193 2.077 13.378) 14.500 12.279 ( -4.133 1.822 2.976) 5.409 12.430 ( 0.762 -5.340 4.760) 7.194 12.479 ( -1.234 0.436 7.591) 7.703 12.610 ( -1.898 0.731 -2.705) 3.384 12.771 ( -4.188 3.787 -1.898) 5.957 12.952 ( 3.516 -1.905 1.111) 4.150 13.023 ( -12.605 6.869 2.641) 14.596 13.208 ( -4.055 2.121 10.506) 11.460 13.298 ( -3.295 1.997 -6.499) 7.555 13.390 ( -4.322 6.680 -5.671) 9.770 13.616 ( -3.419 -1.757 -3.388) 5.124 13.678 ( 3.341 1.176 1.798) 3.973 13.912 ( -4.907 -0.872 -3.567) 6.129 13.996 ( 5.337 -1.942 1.729) 5.937 14.178 ( 1.602 -5.053 3.481) 6.342 14.435 ( 3.776 0.224 -4.031) 5.528 14.476 ( 6.206 -3.227 -4.033) 8.074 14.581 ( -2.255 -7.688 -5.103) 9.499 14.916 ( 13.285 2.206 -13.436) 19.023 14.985 ( 10.079 -5.649 2.994) 11.936 15.165 ( -0.529 -5.242 3.724) 6.452 15.241 ( -1.665 0.944 1.267) 2.296 15.442 ( 0.206 -4.137 5.365) 6.777 15.674 ( -4.582 0.629 -1.082) 4.750 15.731 ( -4.162 -2.981 4.590) 6.876 16.090 ( -11.496 -3.639 3.871) 12.664 16.179 ( -2.135 2.872 -5.254) 6.357 16.716 ( 8.182 -0.691 4.564) 9.394 17.163 ( 1.072 -6.654 -2.089) 7.056 17.896 ( -10.751 -20.775 -6.927) 24.396 18.548 ( -8.145 0.559 9.598) 12.600 18.816 ( 2.148 -12.008 3.376) 12.657 19.174 ( -0.825 10.552 -0.450) 10.594 19.396 ( -1.404 2.832 -3.058) 4.398 21.808 ( 0.472 19.472 -13.000) 23.417 22.419 ( 11.176 8.136 16.337) 21.401 23.952 ( -12.846 -5.696 -14.271) 20.028 24.494 ( -0.763 -7.775 9.665) 12.428 ======================= Grid point 15 (11/130) ======================= q-point: ( 0.40 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.272 ( 7.411 23.167 -2.416) 24.444 2.650 ( 0.069 0.131 -12.232) 12.233 2.774 ( 18.785 8.715 -4.544) 21.201 2.849 ( 9.129 12.627 -0.444) 15.588 3.122 ( -0.042 14.323 -0.741) 14.342 3.620 ( -13.637 7.365 4.222) 16.063 3.718 ( 1.752 11.956 -0.437) 12.091 3.798 ( 1.055 3.916 5.536) 6.862 3.979 ( -2.343 -6.571 4.061) 8.072 4.324 ( 1.508 -1.579 2.070) 3.009 4.400 ( 1.023 0.295 1.112) 1.540 4.517 ( 3.076 1.479 0.529) 3.454 4.652 ( 3.062 15.161 11.898) 19.514 5.168 ( -2.661 7.029 -14.866) 16.658 5.931 ( 0.795 -1.405 0.083) 1.617 5.992 ( -6.732 -7.788 2.239) 10.535 6.067 ( -0.380 -4.115 2.527) 4.844 6.257 ( -6.372 -1.342 -6.725) 9.361 6.727 ( 5.947 2.392 4.547) 7.859 7.035 ( 6.322 6.077 -0.589) 8.788 7.048 ( 6.761 2.790 1.015) 7.384 7.415 ( -0.608 -3.267 -1.537) 3.662 7.470 ( -0.832 -0.109 -0.827) 1.178 7.730 ( -3.931 1.812 -3.721) 5.708 7.789 ( -4.728 2.512 3.159) 6.217 7.897 ( -0.121 7.659 -8.897) 11.740 8.460 ( -1.397 1.081 -9.820) 9.977 8.502 ( 0.981 -1.396 -3.746) 4.116 8.597 ( -3.880 -3.378 4.347) 6.735 8.628 ( 8.568 3.155 11.765) 14.892 9.219 ( 1.132 -6.388 2.652) 7.009 9.441 ( 4.946 3.933 2.780) 6.903 9.670 ( 2.741 -3.388 -1.633) 4.654 9.728 ( -1.690 3.534 0.126) 3.920 9.862 ( 0.603 2.267 -0.375) 2.376 9.992 ( -0.318 -6.755 -4.282) 8.004 10.065 ( 2.641 -5.255 -1.830) 6.159 10.198 ( -2.103 2.314 3.203) 4.476 10.335 ( -3.856 1.929 -5.345) 6.867 10.434 ( -5.302 5.723 -5.801) 9.723 10.461 ( -10.103 -6.397 6.094) 13.421 10.581 ( -0.880 0.815 0.851) 1.471 10.738 ( 5.686 7.558 0.342) 9.465 10.956 ( 0.585 -1.580 -2.535) 3.043 11.002 ( 1.442 4.769 -2.032) 5.380 11.274 ( -1.258 7.699 5.973) 9.825 11.505 ( 0.976 -3.964 -5.478) 6.832 11.529 ( -0.686 -2.249 -4.298) 4.899 11.637 ( -2.188 4.220 -2.317) 5.289 11.770 ( -1.722 15.153 5.983) 16.382 11.909 ( 0.631 -0.320 -1.395) 1.564 12.104 ( -9.110 0.500 11.732) 14.862 12.219 ( -3.066 0.781 2.409) 3.977 12.475 ( 1.870 -5.848 0.835) 6.196 12.514 ( -1.327 2.129 6.215) 6.702 12.559 ( -1.561 1.475 -1.750) 2.771 12.664 ( -4.402 0.118 -0.250) 4.411 12.915 ( -0.933 12.173 4.019) 12.853 13.046 ( 3.111 -3.989 4.816) 6.984 13.172 ( -2.916 1.025 3.334) 4.546 13.207 ( -1.947 0.961 -5.261) 5.692 13.287 ( -2.344 5.937 -6.048) 8.793 13.415 ( -9.517 0.438 -10.403) 14.106 13.743 ( -2.238 0.778 1.884) 3.027 13.891 ( 5.465 -3.086 5.061) 8.063 14.156 ( 5.725 -3.431 2.966) 7.304 14.221 ( 1.532 -10.516 0.182) 10.628 14.359 ( -3.300 -7.226 -4.540) 9.150 14.558 ( 0.620 -4.371 -2.209) 4.936 14.622 ( 7.478 -3.625 -0.578) 8.331 15.059 ( 4.230 2.067 -2.676) 5.416 15.103 ( 7.772 2.589 -10.918) 13.650 15.187 ( 2.968 -0.625 1.009) 3.197 15.275 ( 0.689 -7.672 5.282) 9.340 15.493 ( 3.010 -4.807 -0.116) 5.673 15.584 ( -4.487 2.849 0.604) 5.349 15.679 ( -3.846 -4.329 3.394) 6.712 15.904 ( -9.862 -0.675 3.429) 10.463 16.100 ( -2.661 4.741 -2.799) 6.115 16.886 ( 7.088 -1.381 0.467) 7.237 17.159 ( -1.278 -4.504 1.819) 5.023 17.684 ( -7.235 -16.866 -3.039) 18.602 18.478 ( -4.262 1.082 4.383) 6.208 18.866 ( 1.221 -10.815 1.823) 11.035 19.163 ( -0.201 9.582 -0.169) 9.586 19.345 ( -1.682 2.154 -2.184) 3.498 21.758 ( 0.500 15.410 -5.334) 16.314 22.699 ( 6.672 6.171 14.269) 16.918 23.641 ( -8.834 -5.190 -13.097) 16.629 24.530 ( -0.516 -6.813 4.548) 8.208 ======================= Grid point 16 (12/130) ======================= q-point: (-0.50 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.326 ( -0.000 26.561 0.000) 26.561 2.562 ( 0.000 1.397 0.000) 1.397 2.887 ( -0.000 15.412 -0.000) 15.412 3.117 ( -0.000 10.951 0.000) 10.951 3.123 ( 0.000 0.513 -0.000) 0.513 3.396 ( 0.000 12.374 -0.000) 12.374 3.745 ( 0.000 8.271 -0.000) 8.271 3.837 ( 0.000 8.265 -0.000) 8.265 3.949 ( 0.000 -6.265 0.000) 6.265 4.340 ( -0.000 3.293 -0.000) 3.293 4.357 ( 0.000 -5.406 0.000) 5.406 4.568 ( -0.000 1.378 0.000) 1.378 4.875 ( -0.000 6.319 -0.000) 6.319 5.009 ( 0.000 14.669 0.000) 14.669 5.860 ( 0.000 -8.435 0.000) 8.435 5.938 ( 0.000 -2.295 0.000) 2.295 6.146 ( 0.000 -0.778 0.000) 0.778 6.168 ( -0.000 -3.488 -0.000) 3.488 6.806 ( 0.000 0.968 0.000) 0.968 7.105 ( -0.000 15.627 0.000) 15.627 7.133 ( 0.000 -13.277 -0.000) 13.277 7.400 ( 0.000 -4.539 0.000) 4.539 7.433 ( -0.000 7.340 -0.000) 7.340 7.637 ( -0.000 2.149 0.000) 2.149 7.785 ( 0.000 0.944 -0.000) 0.944 7.866 ( 0.000 7.447 0.000) 7.447 8.412 ( 0.000 2.087 -0.000) 2.087 8.478 ( 0.000 -1.130 0.000) 1.130 8.574 ( -0.000 -3.554 0.000) 3.554 8.793 ( 0.000 4.723 -0.000) 4.723 9.244 ( 0.000 -6.969 0.000) 6.969 9.501 ( -0.000 6.495 -0.000) 6.495 9.696 ( -0.000 5.933 0.000) 5.933 9.702 ( 0.000 -6.747 -0.000) 6.747 9.857 ( 0.000 0.442 0.000) 0.442 9.967 ( 0.000 -4.141 0.000) 4.141 10.111 ( 0.000 -8.191 -0.000) 8.191 10.165 ( -0.000 4.346 0.000) 4.346 10.277 ( 0.000 7.520 0.000) 7.520 10.357 ( 0.000 6.783 -0.000) 6.783 10.378 ( -0.000 -7.811 0.000) 7.811 10.566 ( 0.000 1.060 -0.000) 1.060 10.857 ( 0.000 6.384 0.000) 6.384 10.913 ( 0.000 -6.120 -0.000) 6.120 11.021 ( 0.000 6.601 -0.000) 6.601 11.243 ( -0.000 15.655 0.000) 15.655 11.508 ( -0.000 -7.909 0.000) 7.909 11.528 ( 0.000 -5.879 0.000) 5.879 11.598 ( 0.000 4.501 -0.000) 4.501 11.773 ( 0.000 13.294 -0.000) 13.294 11.922 ( 0.000 2.257 0.000) 2.257 12.030 ( -0.000 -0.092 0.000) 0.092 12.203 ( 0.000 -0.426 0.000) 0.426 12.505 ( -0.000 -11.158 0.000) 11.158 12.511 ( 0.000 11.399 -0.000) 11.399 12.535 ( 0.000 2.848 0.000) 2.848 12.630 ( 0.000 -3.853 -0.000) 3.853 12.957 ( 0.000 12.536 0.000) 12.536 13.128 ( 0.000 0.559 0.000) 0.559 13.134 ( -0.000 -1.947 -0.000) 1.947 13.177 ( -0.000 2.758 -0.000) 2.758 13.209 ( 0.000 1.523 0.000) 1.523 13.258 ( 0.000 2.735 0.000) 2.735 13.728 ( 0.000 -0.154 0.000) 0.154 13.974 ( 0.000 -8.600 -0.000) 8.600 14.235 ( 0.000 -13.926 0.000) 13.926 14.235 ( 0.000 3.770 -0.000) 3.770 14.302 ( 0.000 -9.794 -0.000) 9.794 14.554 ( 0.000 -5.406 0.000) 5.406 14.701 ( 0.000 -5.080 0.000) 5.080 15.062 ( 0.000 2.943 0.000) 2.943 15.169 ( -0.000 2.159 0.000) 2.159 15.221 ( 0.000 1.110 -0.000) 1.110 15.306 ( 0.000 -8.691 0.000) 8.691 15.530 ( -0.000 3.984 -0.000) 3.984 15.534 ( 0.000 -3.209 0.000) 3.209 15.651 ( 0.000 -6.568 -0.000) 6.568 15.809 ( -0.000 1.554 0.000) 1.554 16.061 ( 0.000 5.564 0.000) 5.564 16.962 ( 0.000 -1.918 0.000) 1.918 17.149 ( 0.000 -3.555 0.000) 3.555 17.601 ( 0.000 -15.369 -0.000) 15.369 18.451 ( 0.000 1.201 0.000) 1.201 18.885 ( 0.000 -10.338 -0.000) 10.338 19.161 ( 0.000 9.221 0.000) 9.221 19.319 ( 0.000 1.624 0.000) 1.624 21.745 ( 0.000 14.276 -0.000) 14.276 22.827 ( 0.000 5.931 -0.000) 5.931 23.494 ( 0.000 -5.372 0.000) 5.372 24.540 ( 0.000 -6.565 0.000) 6.565 ======================= Grid point 22 (13/130) ======================= q-point: ( 0.00 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.396 ( 0.000 30.481 0.000) 30.481 1.565 ( 0.000 34.032 0.000) 34.032 2.405 ( 0.000 48.087 0.000) 48.087 2.821 ( 0.000 28.315 0.000) 28.315 3.198 ( 0.000 -1.616 0.000) 1.616 3.585 ( 0.000 -1.947 0.000) 1.947 3.601 ( 0.000 9.630 0.000) 9.630 4.072 ( 0.000 25.767 0.000) 25.767 4.222 ( 0.000 -8.203 0.000) 8.203 4.370 ( 0.000 -1.713 0.000) 1.713 4.561 ( 0.000 -5.553 0.000) 5.553 4.843 ( 0.000 18.298 0.000) 18.298 5.245 ( 0.000 3.619 0.000) 3.619 5.517 ( 0.000 12.048 0.000) 12.048 5.614 ( 0.000 -1.054 0.000) 1.054 6.124 ( 0.000 -4.285 0.000) 4.285 6.258 ( 0.000 15.126 0.000) 15.126 6.464 ( 0.000 7.720 0.000) 7.720 6.698 ( 0.000 0.578 0.000) 0.578 6.739 ( 0.000 -14.157 0.000) 14.157 7.282 ( 0.000 10.669 0.000) 10.669 7.350 ( 0.000 12.244 0.000) 12.244 7.365 ( 0.000 -11.108 0.000) 11.108 7.489 ( 0.000 11.074 0.000) 11.074 7.552 ( 0.000 4.671 0.000) 4.671 8.067 ( 0.000 -3.666 0.000) 3.666 8.164 ( 0.000 3.559 0.000) 3.559 8.451 ( 0.000 -2.098 0.000) 2.098 8.653 ( 0.000 -9.842 0.000) 9.842 8.854 ( 0.000 -7.017 0.000) 7.017 8.954 ( 0.000 -3.641 0.000) 3.641 9.064 ( 0.000 -1.446 0.000) 1.446 9.272 ( 0.000 2.321 0.000) 2.321 9.447 ( 0.000 -2.770 0.000) 2.770 9.492 ( 0.000 -1.638 0.000) 1.638 10.110 ( 0.000 2.140 0.000) 2.140 10.111 ( 0.000 -2.355 0.000) 2.355 10.237 ( 0.000 2.243 0.000) 2.243 10.267 ( 0.000 3.453 0.000) 3.453 10.489 ( 0.000 -7.978 0.000) 7.978 10.711 ( 0.000 1.220 0.000) 1.220 10.768 ( 0.000 -6.712 0.000) 6.712 10.840 ( 0.000 13.129 0.000) 13.129 11.116 ( 0.000 8.777 0.000) 8.777 11.256 ( 0.000 -5.771 0.000) 5.771 11.323 ( 0.000 -3.011 0.000) 3.011 11.535 ( 0.000 -1.284 0.000) 1.284 11.752 ( 0.000 -0.749 0.000) 0.749 11.834 ( 0.000 2.271 0.000) 2.271 11.952 ( 0.000 6.962 0.000) 6.962 12.023 ( 0.000 2.975 0.000) 2.975 12.197 ( 0.000 0.739 0.000) 0.739 12.476 ( 0.000 7.347 0.000) 7.347 12.531 ( 0.000 -9.019 0.000) 9.019 12.586 ( 0.000 3.052 0.000) 3.052 12.823 ( 0.000 3.897 0.000) 3.897 12.847 ( 0.000 5.735 0.000) 5.735 12.970 ( 0.000 4.267 0.000) 4.267 13.040 ( 0.000 -5.308 0.000) 5.308 13.461 ( 0.000 0.255 0.000) 0.255 13.510 ( 0.000 -2.366 0.000) 2.366 13.689 ( 0.000 -4.151 0.000) 4.151 13.889 ( 0.000 -0.957 0.000) 0.957 13.908 ( 0.000 2.238 0.000) 2.238 14.013 ( 0.000 0.774 0.000) 0.774 14.029 ( 0.000 -2.015 0.000) 2.015 14.157 ( 0.000 2.540 0.000) 2.540 14.242 ( 0.000 5.019 0.000) 5.019 14.337 ( 0.000 6.992 0.000) 6.992 14.441 ( 0.000 -0.092 0.000) 0.092 14.512 ( 0.000 -1.803 0.000) 1.803 14.661 ( 0.000 -11.295 0.000) 11.295 14.920 ( 0.000 -7.780 0.000) 7.780 15.456 ( 0.000 -4.253 0.000) 4.253 15.572 ( 0.000 -11.712 0.000) 11.712 15.858 ( 0.000 -1.834 0.000) 1.834 15.882 ( 0.000 1.923 0.000) 1.923 16.185 ( 0.000 -12.719 0.000) 12.719 16.264 ( 0.000 -0.428 0.000) 0.428 16.278 ( 0.000 2.315 0.000) 2.315 16.716 ( 0.000 2.546 0.000) 2.546 17.824 ( 0.000 -28.349 0.000) 28.349 18.472 ( 0.000 4.754 0.000) 4.754 18.779 ( 0.000 -2.560 0.000) 2.560 19.368 ( 0.000 1.364 0.000) 1.364 19.371 ( 0.000 -0.156 0.000) 0.156 22.032 ( 0.000 23.298 0.000) 23.298 23.426 ( 0.000 -9.185 0.000) 9.185 23.558 ( 0.000 6.475 0.000) 6.475 24.440 ( 0.000 -11.964 0.000) 11.964 ======================= Grid point 23 (14/130) ======================= q-point: ( 0.10 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.617 ( 19.046 24.406 3.354) 31.139 1.716 ( 13.573 30.342 3.466) 33.419 2.601 ( 15.743 39.912 8.493) 43.737 2.866 ( 3.989 28.377 2.381) 28.755 3.112 ( -1.702 -0.691 -16.669) 16.770 3.517 ( -5.059 -6.097 14.514) 16.535 3.745 ( 10.658 9.753 -8.320) 16.672 4.025 ( -3.442 25.615 -1.440) 25.885 4.278 ( 0.390 -1.149 4.507) 4.668 4.329 ( -2.482 -1.931 2.473) 4.000 4.526 ( -3.361 -4.699 -1.027) 5.868 4.785 ( -4.341 15.659 -3.222) 16.566 5.210 ( -1.743 3.310 -1.019) 3.877 5.507 ( -0.772 5.192 -4.350) 6.818 5.682 ( 6.205 4.605 -0.672) 7.757 5.926 ( -13.967 12.726 5.720) 19.742 6.302 ( 7.133 8.069 -2.961) 11.169 6.611 ( -10.743 -8.881 13.890) 19.678 6.751 ( 9.857 -1.463 20.437) 22.737 6.764 ( 4.914 -10.088 -17.318) 20.635 7.065 ( -11.644 0.961 -7.142) 13.694 7.301 ( -3.306 20.781 4.200) 21.457 7.520 ( 10.976 8.834 1.496) 14.169 7.576 ( 14.523 -2.573 -1.994) 14.883 7.873 ( 3.991 -2.396 -13.940) 14.696 8.055 ( 18.878 -5.125 -8.031) 21.145 8.141 ( -6.319 4.432 12.734) 14.890 8.398 ( -0.375 -2.466 -5.305) 5.862 8.681 ( 2.146 -6.928 -6.889) 10.003 8.927 ( 6.436 -10.494 -4.635) 13.154 8.934 ( -6.194 -3.707 11.734) 13.776 8.988 ( -5.555 -2.646 6.127) 8.683 9.197 ( -7.801 -2.930 6.794) 10.752 9.506 ( 8.497 -1.171 -6.046) 10.494 9.626 ( 12.026 -0.893 -5.952) 13.448 9.983 ( -4.340 -6.523 -10.597) 13.179 10.142 ( 2.541 0.542 -1.156) 2.844 10.239 ( -2.820 6.324 3.023) 7.555 10.276 ( -1.614 4.015 6.061) 7.448 10.528 ( -1.191 -6.546 11.440) 13.234 10.687 ( -1.602 2.720 0.480) 3.192 10.790 ( 1.393 -2.231 -1.260) 2.917 10.844 ( 1.682 9.925 -2.777) 10.442 11.150 ( -0.708 6.675 7.409) 9.998 11.242 ( -1.783 -3.925 0.552) 4.346 11.279 ( -3.030 -2.608 -1.690) 4.340 11.524 ( 0.694 -1.349 -4.514) 4.762 11.739 ( 3.307 -2.408 -11.295) 12.013 11.849 ( 1.858 5.255 1.007) 5.664 11.981 ( -4.335 5.373 1.934) 7.170 12.033 ( -1.077 2.042 19.257) 19.395 12.184 ( -1.363 2.611 0.148) 2.949 12.401 ( -6.581 10.163 -2.235) 12.312 12.508 ( -1.545 -5.146 0.749) 5.425 12.560 ( -1.829 -0.313 -3.047) 3.567 12.730 ( -3.839 0.869 -2.836) 4.852 12.850 ( -0.145 4.798 0.114) 4.801 13.046 ( 4.556 2.188 4.539) 6.793 13.177 ( 7.668 -7.340 5.689) 12.043 13.316 ( -13.010 -2.174 -7.323) 15.087 13.474 ( -0.214 -0.159 -2.507) 2.521 13.623 ( -5.527 2.013 -1.976) 6.205 13.763 ( -8.023 0.980 1.680) 8.255 13.844 ( -4.992 5.094 -3.235) 7.832 13.949 ( -5.293 -0.587 0.122) 5.327 14.130 ( 6.608 -4.615 2.596) 8.468 14.175 ( -8.024 5.697 4.636) 10.878 14.280 ( 8.689 2.040 -4.786) 10.127 14.292 ( 4.228 2.563 -3.537) 6.079 14.539 ( 3.388 -2.131 1.838) 4.404 14.588 ( 9.269 2.041 -7.414) 12.044 14.696 ( 2.970 -8.273 -0.229) 8.793 14.888 ( -2.367 -7.266 -0.396) 7.653 15.411 ( -4.362 -4.414 0.903) 6.271 15.557 ( -4.216 -9.867 -1.241) 10.801 15.665 ( -17.851 3.254 19.013) 26.282 15.847 ( -1.252 -0.518 -1.332) 1.900 16.174 ( -4.115 -12.647 3.848) 13.845 16.274 ( 1.712 1.701 -5.140) 5.678 16.376 ( 5.976 -1.115 5.316) 8.076 16.808 ( 14.561 -3.638 -19.990) 24.997 17.762 ( -4.583 -27.804 -4.660) 28.562 18.503 ( 0.048 2.010 7.554) 7.817 18.741 ( -6.793 -1.865 8.457) 11.006 19.375 ( 0.946 3.178 -1.230) 3.537 19.406 ( 3.881 -0.042 -2.036) 4.383 22.135 ( 7.699 21.159 6.657) 23.480 22.922 ( -18.948 14.538 -24.296) 34.069 23.931 ( 9.491 -11.274 19.476) 24.423 24.349 ( -7.156 -11.569 -5.783) 14.782 ======================= Grid point 24 (15/130) ======================= q-point: ( 0.20 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.034 ( 19.073 21.093 6.341) 29.136 2.093 ( 23.214 19.769 1.881) 30.549 2.913 ( 6.456 24.493 2.868) 25.491 2.947 ( 0.521 1.018 -16.269) 16.309 3.118 ( 18.173 20.203 8.094) 28.354 3.574 ( 1.405 -6.901 9.241) 11.619 3.891 ( 9.866 8.774 -5.531) 14.314 3.946 ( -3.669 22.348 -0.082) 22.648 4.183 ( -6.373 4.277 -1.933) 7.915 4.382 ( -0.859 7.220 4.498) 8.550 4.442 ( -3.069 0.291 0.465) 3.118 4.640 ( -8.505 8.889 -1.360) 12.377 5.191 ( -2.304 5.804 -0.162) 6.246 5.449 ( -1.565 3.639 -5.138) 6.487 5.666 ( -2.781 7.633 -0.082) 8.125 5.884 ( 2.068 8.013 6.447) 10.490 6.427 ( -13.174 -17.705 4.755) 22.575 6.463 ( 5.477 4.729 -0.125) 7.237 6.624 ( -6.688 -5.255 -8.535) 12.050 6.891 ( 0.606 2.695 -8.857) 9.277 7.063 ( 8.230 -2.790 14.806) 17.168 7.297 ( -0.204 22.403 3.494) 22.674 7.667 ( -8.626 3.066 -8.319) 12.370 7.802 ( 13.533 11.231 -4.896) 18.255 7.850 ( 19.573 -2.307 -1.533) 19.768 8.062 ( -6.438 0.869 1.150) 6.597 8.183 ( -3.784 -0.842 -2.303) 4.509 8.600 ( 15.902 -4.772 -10.094) 19.431 8.637 ( 0.520 -3.339 -9.695) 10.267 8.788 ( -12.544 -2.222 7.156) 14.611 8.926 ( -0.417 -6.699 14.777) 16.229 9.098 ( -3.494 -6.696 7.651) 10.751 9.181 ( 10.143 -14.635 -1.647) 17.883 9.639 ( 9.575 -1.014 -7.202) 12.024 9.805 ( 9.628 -3.092 -4.904) 11.238 9.862 ( -1.693 -7.040 -4.125) 8.334 10.156 ( -5.711 9.162 0.759) 10.823 10.227 ( 4.510 -2.063 1.386) 5.149 10.280 ( -1.668 1.448 5.101) 5.559 10.560 ( -4.944 -4.318 11.907) 13.596 10.673 ( -0.300 3.847 -0.048) 3.859 10.777 ( -0.729 4.452 -3.673) 5.818 10.856 ( 1.267 8.722 -2.685) 9.214 11.102 ( -7.011 4.425 0.402) 8.300 11.198 ( -1.671 1.038 -0.540) 2.040 11.253 ( -0.688 -0.311 1.516) 1.694 11.500 ( 1.082 -1.066 -7.144) 7.304 11.754 ( 5.094 -4.317 -7.055) 9.714 11.864 ( -3.770 4.292 3.369) 6.632 11.919 ( -2.275 2.552 2.737) 4.379 12.111 ( -4.073 11.941 9.071) 15.540 12.165 ( -1.605 2.495 7.324) 7.902 12.249 ( -7.285 7.683 2.379) 10.851 12.467 ( -4.936 -1.876 1.625) 5.525 12.534 ( 1.363 -1.805 -0.013) 2.262 12.664 ( -1.607 -0.953 -2.012) 2.746 12.845 ( -0.675 3.206 1.169) 3.478 12.999 ( -11.406 -3.338 -6.113) 13.365 13.147 ( -0.321 -2.712 8.214) 8.656 13.339 ( 2.213 -6.129 0.230) 6.520 13.449 ( -1.405 3.404 -1.217) 3.878 13.472 ( -4.145 -2.409 -1.742) 5.100 13.650 ( -4.689 2.696 -0.284) 5.417 13.763 ( -1.393 7.409 -2.279) 7.876 13.796 ( -7.623 1.690 -3.358) 8.499 14.114 ( -1.095 3.107 3.104) 4.527 14.212 ( -1.200 -2.504 -5.631) 6.278 14.330 ( 4.751 -1.655 -1.487) 5.246 14.416 ( 4.560 1.113 -2.113) 5.147 14.598 ( -3.093 0.064 -5.816) 6.588 14.647 ( 5.715 -2.347 5.551) 8.306 14.786 ( 11.026 -0.188 -8.975) 14.219 14.902 ( 2.721 -8.027 5.103) 9.893 15.324 ( -5.483 -2.974 0.815) 6.290 15.383 ( -8.598 -3.463 5.134) 10.596 15.610 ( -3.358 -9.537 7.001) 12.298 15.789 ( -3.165 0.696 -1.928) 3.770 16.097 ( -6.582 -9.646 3.990) 12.340 16.275 ( 2.429 2.531 -6.381) 7.282 16.529 ( 5.887 -0.543 7.252) 9.356 16.925 ( 10.806 -8.401 -17.001) 21.826 17.606 ( -7.465 -25.524 -5.447) 27.146 18.561 ( -0.386 -1.774 8.891) 9.074 18.660 ( -8.035 -0.720 10.477) 13.223 19.378 ( 0.181 5.716 -1.455) 5.901 19.455 ( 2.310 0.953 -2.771) 3.731 22.374 ( 9.435 16.892 11.349) 22.431 22.492 ( -10.979 20.991 -16.001) 28.586 24.105 ( -10.890 -10.387 -10.126) 18.139 24.162 ( 3.040 -13.169 12.202) 18.208 ======================= Grid point 25 (16/130) ======================= q-point: ( 0.30 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.413 ( 15.707 16.715 5.998) 23.708 2.547 ( 23.551 13.992 -2.388) 27.498 2.811 ( -0.528 0.607 -16.502) 16.521 3.056 ( 6.341 16.337 1.531) 17.592 3.451 ( 7.620 14.696 4.454) 17.143 3.669 ( 3.005 -4.315 4.819) 7.132 3.894 ( -1.863 11.650 5.271) 12.922 3.992 ( -1.998 9.204 -3.160) 9.934 4.098 ( 1.339 9.489 -1.515) 9.702 4.310 ( -2.770 1.898 -2.862) 4.412 4.486 ( -0.895 14.973 1.380) 15.063 4.512 ( 0.076 4.231 7.145) 8.304 5.050 ( -10.554 13.557 1.893) 17.285 5.393 ( 0.800 6.555 -7.177) 9.753 5.761 ( 7.553 -0.736 6.525) 10.008 5.936 ( 0.118 3.085 0.864) 3.206 6.089 ( -17.550 -17.004 -2.391) 24.553 6.389 ( -9.000 -5.913 -4.950) 11.851 6.674 ( 7.678 7.381 1.722) 10.789 6.868 ( 1.781 -3.188 -6.166) 7.166 7.264 ( 5.174 -3.578 4.544) 7.760 7.340 ( 1.606 17.367 3.987) 17.891 7.509 ( -2.994 4.215 -3.157) 6.058 7.908 ( 2.407 3.956 -10.119) 11.128 7.949 ( -3.300 5.280 -0.019) 6.227 8.095 ( -1.722 4.342 -4.452) 6.452 8.270 ( 23.383 5.101 -5.059) 24.462 8.555 ( -2.718 -3.024 -7.516) 8.546 8.615 ( -8.034 -0.232 11.608) 14.119 8.631 ( -7.019 0.967 3.842) 8.060 9.051 ( -1.714 -7.358 4.763) 8.931 9.208 ( 13.552 -6.807 6.190) 16.380 9.359 ( 8.556 -15.103 -2.788) 17.581 9.752 ( 8.065 -3.661 -8.432) 12.229 9.844 ( 0.850 -3.239 2.534) 4.199 9.937 ( 4.401 -0.986 -0.952) 4.610 10.049 ( -4.840 8.425 0.475) 9.727 10.214 ( -4.495 -2.705 2.841) 5.966 10.372 ( 4.676 -2.233 1.112) 5.300 10.477 ( -10.438 -6.639 7.249) 14.338 10.659 ( -1.080 5.420 -1.262) 5.669 10.720 ( -2.559 6.433 -3.535) 7.774 10.872 ( 3.241 12.342 -4.239) 13.446 10.986 ( -3.106 6.927 -1.629) 7.764 11.158 ( -1.384 5.883 -1.652) 6.265 11.251 ( 0.281 0.627 0.882) 1.118 11.475 ( 1.235 -0.098 -5.985) 6.112 11.793 ( -5.954 0.124 4.722) 7.600 11.810 ( 2.022 1.697 -0.743) 2.742 11.890 ( -0.128 1.110 -5.115) 5.235 12.050 ( -3.977 10.874 2.145) 11.775 12.176 ( -3.692 1.454 6.736) 7.818 12.201 ( -4.239 6.962 13.799) 16.027 12.341 ( -8.742 -1.760 2.018) 9.143 12.579 ( 2.104 -0.790 0.275) 2.265 12.629 ( -0.796 -3.656 -2.657) 4.589 12.781 ( -6.496 -2.228 -2.323) 7.249 12.892 ( 0.460 1.307 7.591) 7.716 13.143 ( -3.667 -4.340 5.214) 7.711 13.216 ( -7.033 5.878 -1.231) 9.248 13.414 ( -2.857 4.855 -5.942) 8.188 13.501 ( 1.014 -4.022 1.813) 4.527 13.585 ( -1.283 -3.403 -3.844) 5.292 13.630 ( -3.035 3.646 -3.156) 5.698 13.795 ( 2.768 -0.882 -0.347) 2.926 14.076 ( -6.774 3.699 -6.287) 9.955 14.120 ( 0.060 0.758 -0.359) 0.841 14.323 ( -5.022 -6.618 -3.646) 9.073 14.441 ( 3.832 -1.198 -1.813) 4.405 14.534 ( -0.095 0.804 -3.394) 3.489 14.828 ( 6.786 -8.833 7.408) 13.377 14.973 ( 13.836 1.950 -7.074) 15.661 15.008 ( 3.228 -6.100 6.173) 9.259 15.239 ( -3.022 -3.386 0.445) 4.560 15.328 ( 0.022 -5.330 -0.940) 5.412 15.580 ( -3.635 -9.845 3.402) 11.032 15.719 ( -3.046 1.806 -0.698) 3.610 15.988 ( -7.464 -5.595 3.988) 10.145 16.268 ( 0.888 5.527 -5.184) 7.630 16.697 ( 6.603 -1.158 5.898) 8.929 16.991 ( 6.215 -8.815 -9.878) 14.626 17.429 ( -7.317 -21.832 -3.597) 23.305 18.562 ( -6.032 0.620 7.970) 10.015 18.633 ( -0.547 -4.833 6.625) 8.219 19.363 ( -0.613 6.722 -1.183) 6.853 19.448 ( -0.891 2.265 -2.822) 3.727 22.243 ( -5.622 20.175 -9.283) 22.909 22.645 ( 8.095 12.628 14.805) 21.075 23.793 ( -11.640 -8.781 -14.219) 20.366 24.275 ( 1.240 -12.621 8.055) 15.024 ======================= Grid point 26 (17/130) ======================= q-point: ( 0.40 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.676 ( 0.286 3.557 -9.882) 10.507 2.691 ( 8.420 14.152 1.161) 16.508 2.951 ( 19.047 8.640 -5.256) 21.565 3.173 ( 4.476 14.305 1.240) 15.040 3.476 ( -4.803 13.530 3.341) 14.741 3.743 ( 2.289 -0.961 1.386) 2.843 3.868 ( -4.070 15.926 0.308) 16.441 3.927 ( -5.314 7.090 6.167) 10.795 4.069 ( 0.613 7.115 -4.910) 8.666 4.273 ( -2.827 -3.049 1.551) 4.438 4.491 ( 4.540 -2.025 -1.921) 5.329 4.606 ( -1.496 18.872 3.591) 19.269 4.990 ( 2.474 17.280 11.153) 20.715 5.358 ( 0.606 9.981 -9.444) 13.754 5.761 ( -11.423 -12.915 -0.681) 17.255 5.913 ( -0.544 -0.727 2.080) 2.270 5.983 ( 5.329 -3.340 2.734) 6.858 6.195 ( -6.512 -4.538 -5.475) 9.642 6.778 ( 2.184 -0.385 0.652) 2.312 6.873 ( 1.886 -5.191 -2.207) 5.948 7.288 ( -2.795 -9.211 -1.254) 9.707 7.445 ( 8.835 10.152 -0.069) 13.458 7.500 ( 0.514 11.763 2.056) 11.952 7.824 ( -3.743 7.264 -5.084) 9.624 7.903 ( -3.204 10.240 1.606) 10.849 8.038 ( 0.110 4.978 -8.721) 10.042 8.429 ( -1.725 -4.124 -1.670) 4.771 8.520 ( -7.955 0.612 11.680) 14.145 8.534 ( 4.536 0.697 -12.591) 13.401 8.751 ( 12.391 8.340 10.098) 18.030 9.055 ( -0.612 -8.980 3.336) 9.599 9.432 ( 4.542 -12.324 -2.986) 13.470 9.508 ( 10.596 -2.813 2.622) 11.272 9.829 ( 2.900 3.021 -4.650) 6.258 9.876 ( 1.597 -4.375 2.163) 5.135 9.922 ( -4.701 -1.067 -0.695) 4.871 9.996 ( -0.941 4.704 -0.513) 4.825 10.200 ( 1.332 -2.367 1.810) 3.264 10.277 ( -10.538 -8.727 3.602) 14.149 10.435 ( 0.288 1.081 0.087) 1.122 10.619 ( -1.330 11.195 -3.594) 11.832 10.645 ( -2.848 6.204 0.093) 6.827 10.868 ( -1.553 5.423 -4.012) 6.922 11.000 ( 4.322 12.313 0.411) 13.056 11.146 ( 1.154 6.798 -1.110) 6.984 11.302 ( 3.960 -1.008 1.128) 4.239 11.467 ( 1.247 0.690 -3.272) 3.569 11.697 ( -6.229 6.513 1.844) 9.199 11.775 ( -3.122 8.097 -1.872) 8.878 11.866 ( -2.928 -0.138 2.218) 3.676 11.997 ( -0.823 -0.664 -3.568) 3.721 12.148 ( -3.666 -4.438 5.172) 7.739 12.214 ( -3.914 -4.702 1.320) 6.258 12.248 ( -0.995 15.149 11.181) 18.854 12.577 ( -0.796 -8.746 -2.420) 9.109 12.610 ( -0.390 1.893 -0.425) 1.979 12.683 ( -2.769 1.045 -0.291) 2.973 12.975 ( 1.678 -1.107 7.396) 7.664 13.127 ( -0.356 4.380 4.698) 6.434 13.145 ( -1.652 -1.943 2.798) 3.786 13.289 ( -4.487 5.240 -6.136) 9.233 13.440 ( -6.496 3.735 -6.689) 10.044 13.487 ( -0.066 9.797 -4.741) 10.883 13.678 ( 3.064 -12.737 0.353) 13.105 13.813 ( -1.427 -0.168 1.285) 1.927 13.935 ( -3.089 -5.560 -4.905) 8.032 14.121 ( 1.153 -0.650 -0.972) 1.642 14.227 ( -2.245 -5.791 -1.420) 6.372 14.502 ( -1.429 -1.332 -0.645) 2.057 14.521 ( 4.436 -6.230 -1.532) 7.799 14.954 ( 2.216 -12.711 3.655) 13.410 15.074 ( 0.514 -2.581 1.720) 3.144 15.175 ( 6.458 -1.833 3.686) 7.659 15.241 ( 5.455 0.382 -4.486) 7.073 15.352 ( 4.139 -5.508 -3.696) 7.818 15.522 ( -4.565 -9.535 2.252) 10.809 15.663 ( -2.966 3.786 0.885) 4.890 15.886 ( -5.288 -0.904 2.784) 6.044 16.242 ( -0.342 8.611 -2.916) 9.098 16.841 ( 4.711 -2.867 3.018) 6.286 17.028 ( 2.779 -7.619 -3.984) 9.036 17.294 ( -4.653 -18.464 -1.614) 19.109 18.506 ( -3.731 1.515 3.985) 5.665 18.669 ( 0.234 -6.839 3.441) 7.659 19.346 ( -0.351 6.551 -0.493) 6.579 19.398 ( -2.046 3.093 -2.111) 4.267 22.125 ( -2.244 18.246 -4.053) 18.825 22.881 ( 5.716 10.426 14.619) 18.844 23.495 ( -8.550 -7.887 -14.377) 18.493 24.329 ( 0.285 -12.095 3.890) 12.708 ======================= Grid point 27 (18/130) ======================= q-point: (-0.50 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.622 ( 0.000 4.671 0.000) 4.671 2.795 ( -0.000 14.968 0.000) 14.968 3.149 ( -0.000 2.268 0.000) 2.268 3.224 ( -0.000 13.982 0.000) 13.982 3.411 ( 0.000 15.112 -0.000) 15.112 3.770 ( 0.000 0.893 -0.000) 0.893 3.830 ( -0.000 28.069 0.000) 28.069 3.866 ( 0.000 -1.231 -0.000) 1.231 4.074 ( 0.000 5.368 -0.000) 5.368 4.244 ( -0.000 -5.449 -0.000) 5.449 4.543 ( -0.000 -3.726 0.000) 3.726 4.577 ( 0.000 19.588 -0.000) 19.588 5.129 ( -0.000 19.191 -0.000) 19.191 5.294 ( 0.000 9.807 0.000) 9.807 5.642 ( 0.000 -10.953 0.000) 10.953 5.900 ( 0.000 -1.314 0.000) 1.314 6.070 ( 0.000 -5.486 0.000) 5.486 6.100 ( -0.000 -3.322 -0.000) 3.322 6.794 ( 0.000 -7.013 0.000) 7.013 6.889 ( 0.000 -3.546 0.000) 3.546 7.243 ( 0.000 -10.367 0.000) 10.367 7.511 ( -0.000 9.139 0.000) 9.139 7.588 ( -0.000 16.407 0.000) 16.407 7.725 ( 0.000 6.494 0.000) 6.494 7.873 ( 0.000 9.856 -0.000) 9.856 8.000 ( 0.000 5.222 0.000) 5.222 8.407 ( 0.000 -5.534 -0.000) 5.534 8.489 ( 0.000 5.313 -0.000) 5.313 8.523 ( -0.000 -0.968 0.000) 0.968 8.939 ( 0.000 8.768 -0.000) 8.768 9.064 ( 0.000 -9.661 0.000) 9.661 9.448 ( 0.000 -14.823 -0.000) 14.823 9.666 ( 0.000 8.448 -0.000) 8.448 9.798 ( -0.000 -9.618 -0.000) 9.618 9.839 ( 0.000 6.571 0.000) 6.571 9.907 ( 0.000 1.727 0.000) 1.727 10.069 ( 0.000 3.674 -0.000) 3.674 10.074 ( -0.000 -14.705 0.000) 14.705 10.282 ( -0.000 -0.018 -0.000) 0.018 10.426 ( 0.000 -0.454 0.000) 0.454 10.579 ( 0.000 15.244 0.000) 15.244 10.631 ( 0.000 5.262 -0.000) 5.262 10.820 ( 0.000 4.227 0.000) 4.227 11.061 ( 0.000 12.421 -0.000) 12.421 11.161 ( 0.000 6.218 -0.000) 6.218 11.358 ( -0.000 -2.855 0.000) 2.855 11.470 ( 0.000 0.679 0.000) 0.679 11.629 ( 0.000 12.418 0.000) 12.418 11.728 ( 0.000 7.533 -0.000) 7.533 11.826 ( 0.000 -4.128 0.000) 4.128 11.980 ( -0.000 4.530 0.000) 4.530 12.122 ( 0.000 -8.383 -0.000) 8.383 12.189 ( 0.000 -2.982 -0.000) 2.982 12.291 ( 0.000 12.201 -0.000) 12.201 12.557 ( 0.000 -8.847 0.000) 8.847 12.602 ( 0.000 1.553 -0.000) 1.553 12.660 ( 0.000 3.208 -0.000) 3.208 13.027 ( 0.000 -4.574 -0.000) 4.574 13.141 ( 0.000 1.315 0.000) 1.315 13.183 ( -0.000 -2.265 0.000) 2.265 13.210 ( -0.000 4.778 -0.000) 4.778 13.312 ( 0.000 9.384 0.000) 9.384 13.469 ( 0.000 14.321 -0.000) 14.321 13.706 ( 0.000 -14.122 -0.000) 14.122 13.797 ( 0.000 6.709 0.000) 6.709 13.891 ( 0.000 -16.953 -0.000) 16.953 14.137 ( 0.000 -2.872 -0.000) 2.872 14.204 ( -0.000 -5.738 0.000) 5.738 14.481 ( 0.000 -1.576 -0.000) 1.576 14.564 ( 0.000 -8.071 0.000) 8.071 14.982 ( -0.000 -14.001 0.000) 14.001 15.077 ( 0.000 -1.505 0.000) 1.505 15.239 ( 0.000 -2.620 0.000) 2.620 15.305 ( 0.000 1.281 -0.000) 1.281 15.434 ( 0.000 -10.804 -0.000) 10.804 15.438 ( -0.000 -4.154 0.000) 4.154 15.632 ( 0.000 4.865 0.000) 4.865 15.843 ( 0.000 1.513 0.000) 1.513 16.227 ( 0.000 9.923 0.000) 9.923 16.899 ( 0.000 -4.015 0.000) 4.015 17.041 ( -0.000 -6.642 -0.000) 6.642 17.242 ( 0.000 -17.098 -0.000) 17.098 18.484 ( 0.000 1.735 0.000) 1.735 18.684 ( 0.000 -7.489 -0.000) 7.489 19.347 ( 0.000 7.319 0.000) 7.319 19.362 ( 0.000 2.362 0.000) 2.362 22.091 ( 0.000 17.488 0.000) 17.488 23.017 ( -0.000 12.240 -0.000) 12.240 23.331 ( 0.000 -10.078 0.000) 10.078 24.345 ( 0.000 -11.916 -0.000) 11.916 ======================= Grid point 33 (19/130) ======================= q-point: ( 0.00 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.988 ( 0.000 25.988 0.000) 25.988 2.225 ( 0.000 28.956 0.000) 28.956 2.843 ( 0.000 -13.160 0.000) 13.160 3.155 ( 0.000 -11.118 0.000) 11.118 3.251 ( 0.000 29.579 0.000) 29.579 3.781 ( 0.000 19.896 0.000) 19.896 3.800 ( 0.000 7.640 0.000) 7.640 4.058 ( 0.000 -6.954 0.000) 6.954 4.229 ( 0.000 -4.140 0.000) 4.140 4.425 ( 0.000 -7.977 0.000) 7.977 4.677 ( 0.000 22.749 0.000) 22.749 5.246 ( 0.000 -4.092 0.000) 4.092 5.312 ( 0.000 24.747 0.000) 24.747 5.618 ( 0.000 2.168 0.000) 2.168 5.711 ( 0.000 2.617 0.000) 2.617 6.102 ( 0.000 5.745 0.000) 5.745 6.375 ( 0.000 -17.842 0.000) 17.842 6.545 ( 0.000 10.277 0.000) 10.277 6.656 ( 0.000 -3.837 0.000) 3.837 6.663 ( 0.000 8.160 0.000) 8.160 7.123 ( 0.000 -10.811 0.000) 10.811 7.218 ( 0.000 -12.237 0.000) 12.237 7.681 ( 0.000 18.652 0.000) 18.652 7.695 ( 0.000 8.091 0.000) 8.091 7.923 ( 0.000 23.756 0.000) 23.756 8.001 ( 0.000 -2.356 0.000) 2.356 8.219 ( 0.000 1.988 0.000) 1.988 8.356 ( 0.000 -7.960 0.000) 7.960 8.549 ( 0.000 1.044 0.000) 1.044 8.760 ( 0.000 -1.495 0.000) 1.495 8.866 ( 0.000 -4.167 0.000) 4.167 9.029 ( 0.000 -3.298 0.000) 3.298 9.302 ( 0.000 0.484 0.000) 0.484 9.428 ( 0.000 0.907 0.000) 0.907 9.456 ( 0.000 -2.217 0.000) 2.217 9.769 ( 0.000 -24.308 0.000) 24.308 10.191 ( 0.000 5.197 0.000) 5.197 10.246 ( 0.000 -0.477 0.000) 0.477 10.313 ( 0.000 -0.103 0.000) 0.103 10.413 ( 0.000 -2.312 0.000) 2.312 10.642 ( 0.000 -2.917 0.000) 2.917 10.712 ( 0.000 -1.256 0.000) 1.256 11.130 ( 0.000 11.119 0.000) 11.119 11.235 ( 0.000 1.921 0.000) 1.921 11.362 ( 0.000 12.365 0.000) 12.365 11.364 ( 0.000 9.445 0.000) 9.445 11.493 ( 0.000 0.165 0.000) 0.165 11.767 ( 0.000 3.880 0.000) 3.880 11.870 ( 0.000 -0.224 0.000) 0.224 11.906 ( 0.000 -3.701 0.000) 3.701 12.108 ( 0.000 -10.723 0.000) 10.723 12.268 ( 0.000 -0.545 0.000) 0.545 12.391 ( 0.000 -2.156 0.000) 2.156 12.466 ( 0.000 4.263 0.000) 4.263 12.614 ( 0.000 -3.797 0.000) 3.797 12.786 ( 0.000 -6.651 0.000) 6.651 12.947 ( 0.000 4.553 0.000) 4.553 12.975 ( 0.000 1.574 0.000) 1.574 13.116 ( 0.000 9.404 0.000) 9.404 13.401 ( 0.000 -7.550 0.000) 7.550 13.510 ( 0.000 -9.324 0.000) 9.324 13.515 ( 0.000 1.079 0.000) 1.079 13.852 ( 0.000 0.955 0.000) 0.955 13.948 ( 0.000 -0.712 0.000) 0.712 14.060 ( 0.000 4.365 0.000) 4.365 14.065 ( 0.000 6.297 0.000) 6.297 14.328 ( 0.000 2.767 0.000) 2.767 14.337 ( 0.000 -0.585 0.000) 0.585 14.375 ( 0.000 8.147 0.000) 8.147 14.405 ( 0.000 -7.737 0.000) 7.737 14.477 ( 0.000 -2.671 0.000) 2.671 14.644 ( 0.000 12.753 0.000) 12.753 14.821 ( 0.000 -1.574 0.000) 1.574 15.283 ( 0.000 -15.351 0.000) 15.351 15.348 ( 0.000 -3.447 0.000) 3.447 15.819 ( 0.000 -9.264 0.000) 9.264 15.848 ( 0.000 -9.712 0.000) 9.712 15.883 ( 0.000 -1.343 0.000) 1.343 16.293 ( 0.000 1.631 0.000) 1.631 16.315 ( 0.000 1.042 0.000) 1.042 16.799 ( 0.000 5.690 0.000) 5.690 17.300 ( 0.000 -20.590 0.000) 20.590 18.573 ( 0.000 4.700 0.000) 4.700 18.728 ( 0.000 -2.655 0.000) 2.655 19.375 ( 0.000 0.547 0.000) 0.547 19.388 ( 0.000 0.477 0.000) 0.477 22.490 ( 0.000 20.279 0.000) 20.279 23.191 ( 0.000 -13.204 0.000) 13.204 23.719 ( 0.000 8.870 0.000) 8.870 24.177 ( 0.000 -12.619 0.000) 12.619 ======================= Grid point 34 (20/130) ======================= q-point: ( 0.10 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.105 ( 12.171 22.010 -1.666) 25.206 2.324 ( 9.205 27.249 1.746) 28.815 2.847 ( 3.434 -12.105 -8.728) 15.314 3.218 ( 6.388 -11.748 -0.412) 13.379 3.333 ( 5.554 26.235 5.321) 27.339 3.558 ( -11.116 18.541 0.529) 21.624 3.879 ( 3.955 0.770 -3.574) 5.386 4.131 ( -5.062 -6.867 -0.130) 8.532 4.278 ( 8.452 1.690 11.923) 14.712 4.440 ( -0.480 -3.187 2.893) 4.331 4.661 ( -1.209 22.936 -0.547) 22.975 5.124 ( -8.271 7.038 -6.643) 12.731 5.300 ( -0.766 12.933 -0.351) 12.960 5.592 ( -1.087 4.057 -2.788) 5.042 5.769 ( 4.302 -0.178 -1.058) 4.434 6.110 ( -3.474 6.529 6.272) 9.697 6.259 ( -10.357 -16.242 0.505) 19.270 6.542 ( -0.052 10.182 0.063) 10.182 6.603 ( -5.223 -7.643 1.685) 9.409 6.804 ( 10.765 5.793 5.099) 13.246 7.025 ( -3.690 -4.587 -9.281) 10.991 7.350 ( 12.946 -10.928 -0.482) 16.949 7.717 ( 0.654 11.079 3.185) 11.546 7.860 ( 10.592 16.107 2.087) 19.390 7.953 ( -1.360 9.349 -4.949) 10.665 8.033 ( 12.148 5.965 -7.704) 15.573 8.247 ( -0.585 3.559 6.585) 7.508 8.311 ( 1.565 -5.389 -3.732) 6.739 8.570 ( 3.832 -1.556 -6.966) 8.102 8.763 ( 3.599 -3.833 -7.520) 9.176 8.855 ( -4.694 -3.544 9.191) 10.912 8.954 ( -9.157 -1.952 7.128) 11.767 9.125 ( -13.003 -3.393 6.179) 14.791 9.447 ( 4.589 -10.048 -10.323) 15.119 9.622 ( 10.912 0.333 -3.161) 11.366 9.741 ( -0.348 -10.809 0.623) 10.832 10.176 ( 0.668 2.171 -2.473) 3.358 10.288 ( 0.008 2.060 6.104) 6.442 10.362 ( 0.233 -7.774 -1.861) 7.997 10.389 ( -2.017 2.977 10.129) 10.749 10.683 ( 3.958 -0.846 -0.934) 4.154 10.741 ( 1.515 -1.558 3.796) 4.374 11.131 ( -0.135 11.043 1.001) 11.090 11.223 ( -1.972 1.205 2.808) 3.637 11.314 ( -0.806 8.876 -7.013) 11.341 11.382 ( -1.934 13.074 5.677) 14.384 11.493 ( 0.451 0.921 -1.113) 1.513 11.745 ( 2.267 3.948 -11.370) 12.247 11.894 ( -1.015 -2.743 4.860) 5.672 11.927 ( -0.187 -3.010 7.241) 7.843 12.107 ( 0.033 -10.825 -0.499) 10.836 12.247 ( -1.911 -0.997 0.846) 2.316 12.398 ( -0.838 -0.432 3.287) 3.419 12.446 ( -2.046 3.137 1.232) 3.943 12.608 ( -1.653 -0.090 -0.033) 1.656 12.740 ( -1.991 -1.182 -3.192) 3.943 12.858 ( -4.713 -1.296 0.686) 4.936 12.999 ( -2.785 -3.613 -2.945) 5.430 13.153 ( 3.274 4.895 -0.511) 5.911 13.277 ( -6.371 -0.591 -1.126) 6.497 13.432 ( -6.479 -3.644 -0.084) 7.434 13.559 ( -0.397 -6.679 0.481) 6.708 13.846 ( -1.335 4.371 1.948) 4.968 13.917 ( -3.511 -0.164 0.521) 3.553 13.964 ( -2.170 5.167 -1.063) 5.704 14.177 ( 2.568 8.921 -3.370) 9.876 14.259 ( -1.974 -0.117 -3.457) 3.982 14.348 ( -4.221 0.762 -2.243) 4.840 14.387 ( 6.830 5.661 -1.885) 9.069 14.458 ( 2.725 -3.619 7.260) 8.558 14.527 ( 6.683 -2.398 -0.509) 7.118 14.707 ( 4.979 6.029 -2.506) 8.211 14.814 ( 0.318 -0.015 -1.676) 1.706 15.265 ( -1.839 -16.020 0.126) 16.126 15.295 ( -5.124 -3.893 1.982) 6.734 15.670 ( -15.255 -6.891 7.293) 18.259 15.842 ( -0.525 0.177 0.170) 0.579 15.919 ( -1.055 -8.213 3.682) 9.062 16.306 ( 1.943 1.226 -5.348) 5.820 16.350 ( 7.157 -1.302 -3.325) 7.998 16.811 ( 4.421 3.401 -9.722) 11.209 17.255 ( -3.002 -19.633 -4.018) 20.264 18.571 ( -2.930 3.806 7.629) 9.015 18.701 ( -5.343 -2.158 7.715) 9.629 19.412 ( 3.780 0.583 -1.466) 4.096 19.418 ( 3.154 1.013 -1.460) 3.620 22.557 ( 4.497 18.690 5.754) 20.066 23.063 ( -8.679 -1.143 -7.488) 11.520 23.789 ( 3.618 -1.274 6.212) 7.300 24.097 ( -6.109 -11.908 -5.517) 14.476 ======================= Grid point 35 (21/130) ======================= q-point: ( 0.20 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.384 ( 17.073 14.284 -1.405) 22.305 2.567 ( 14.009 23.046 2.580) 27.093 2.844 ( 4.638 -7.379 -14.744) 17.127 3.335 ( -4.844 -0.183 8.169) 9.499 3.386 ( 8.737 5.193 -4.764) 11.225 3.571 ( 6.642 17.758 7.857) 20.523 3.927 ( 0.995 -4.666 -1.872) 5.125 4.028 ( -0.832 -4.532 -0.535) 4.639 4.414 ( -4.822 5.101 3.137) 7.689 4.485 ( 2.571 3.142 9.954) 10.750 4.642 ( -0.831 20.547 -0.891) 20.583 4.916 ( -6.629 11.411 -4.956) 14.097 5.298 ( 0.171 6.544 0.737) 6.588 5.562 ( 0.402 7.534 -2.198) 7.859 5.791 ( -0.749 2.626 -3.247) 4.243 5.970 ( -12.876 -17.912 -3.046) 22.269 6.104 ( -6.696 6.485 8.538) 12.641 6.435 ( -9.839 -6.332 0.298) 11.704 6.639 ( 6.226 2.891 2.876) 7.442 6.880 ( -1.710 -5.051 -9.396) 10.804 7.084 ( 9.869 8.193 2.340) 13.038 7.612 ( 0.549 -8.703 -0.934) 8.770 7.649 ( 5.401 5.811 -4.045) 8.905 7.842 ( -2.787 3.864 -2.912) 5.584 8.092 ( 4.064 14.778 -2.506) 15.531 8.150 ( 14.268 11.274 -3.936) 18.606 8.304 ( 0.807 9.472 3.537) 10.143 8.520 ( 15.314 -1.587 -6.498) 16.712 8.596 ( 8.626 -1.480 -8.253) 12.030 8.735 ( -8.001 -2.966 3.651) 9.281 8.815 ( -6.691 -3.539 14.426) 16.292 8.907 ( 5.625 -8.526 -1.402) 10.310 8.966 ( -8.365 -7.027 7.479) 13.239 9.448 ( 2.794 -19.400 -6.807) 20.749 9.766 ( 5.918 1.901 1.011) 6.297 9.820 ( 7.307 0.629 -1.600) 7.506 10.201 ( 3.054 -0.473 -1.341) 3.369 10.276 ( -4.341 -1.294 -4.049) 6.076 10.301 ( -3.181 2.544 5.710) 7.013 10.434 ( -4.288 -3.251 10.407) 11.716 10.751 ( 2.418 3.274 0.829) 4.153 10.806 ( 3.446 0.071 0.650) 3.507 11.142 ( -0.745 9.135 4.743) 10.320 11.221 ( -0.791 0.051 5.382) 5.440 11.250 ( -0.453 12.571 -6.614) 14.212 11.364 ( -2.299 11.891 0.906) 12.145 11.492 ( 0.410 2.620 -1.771) 3.189 11.719 ( 3.550 2.704 -11.059) 11.925 11.833 ( -9.114 -2.698 8.714) 12.895 11.996 ( 3.062 -2.909 -1.772) 4.580 12.101 ( 0.245 -12.350 -1.220) 12.413 12.221 ( -2.821 -6.349 3.553) 7.803 12.390 ( -2.112 3.563 2.993) 5.110 12.416 ( -4.542 2.601 5.724) 7.756 12.538 ( -2.585 4.924 -2.649) 6.160 12.692 ( -3.011 6.642 -2.004) 7.563 12.824 ( -2.638 -11.236 3.365) 12.022 12.848 ( -4.924 -4.700 -0.075) 6.807 13.142 ( -5.807 2.737 0.724) 6.461 13.221 ( -0.939 -1.435 2.118) 2.725 13.358 ( 1.769 -4.817 -3.825) 6.401 13.491 ( -5.149 -2.386 -3.157) 6.494 13.761 ( -7.558 5.082 -0.132) 9.108 13.858 ( -4.799 0.716 -0.608) 4.890 13.945 ( 2.599 9.340 -3.223) 10.217 14.171 ( -0.862 2.084 -5.796) 6.220 14.213 ( -1.444 3.092 -0.095) 3.414 14.251 ( -1.763 -2.872 -1.615) 3.737 14.505 ( 0.817 7.711 0.761) 7.791 14.552 ( 2.121 -5.635 5.915) 8.440 14.621 ( 2.624 0.073 -1.397) 2.974 14.817 ( 10.199 2.205 -3.607) 11.040 14.839 ( 4.076 2.347 -0.981) 4.805 15.208 ( -4.975 -11.138 1.924) 12.350 15.226 ( -2.646 -7.970 -0.051) 8.398 15.429 ( -12.408 -7.187 6.238) 15.638 15.802 ( -2.836 0.485 -0.455) 2.913 15.904 ( -2.440 -7.346 3.039) 8.316 16.339 ( 5.412 3.522 -6.027) 8.833 16.498 ( 8.482 -2.812 0.980) 8.989 16.824 ( 5.002 -0.858 -12.466) 13.459 17.149 ( -4.491 -17.266 -4.448) 18.387 18.571 ( -3.376 1.846 9.622) 10.363 18.644 ( -6.709 -1.019 9.598) 11.755 19.455 ( 1.823 2.048 -1.800) 3.280 19.475 ( 2.878 0.840 -1.611) 3.403 22.714 ( 5.564 14.492 9.689) 18.299 22.827 ( -9.374 10.962 -7.780) 16.388 23.888 ( -7.836 -9.340 -7.954) 14.557 23.903 ( 1.496 -10.644 4.710) 11.735 ======================= Grid point 36 (22/130) ======================= q-point: ( 0.30 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.683 ( 13.935 8.517 -0.333) 16.335 2.806 ( 4.526 2.429 -12.668) 13.670 2.876 ( 14.527 14.280 -1.513) 20.426 3.310 ( -1.388 5.243 6.497) 8.464 3.565 ( 10.259 -3.401 -1.920) 10.977 3.667 ( -3.119 4.069 6.212) 8.055 3.944 ( 4.684 1.287 1.506) 5.085 4.114 ( 4.543 -0.781 2.740) 5.362 4.311 ( -5.684 5.874 -1.312) 8.278 4.476 ( -7.784 -1.802 1.672) 8.163 4.545 ( -4.960 22.999 -3.471) 23.782 4.928 ( 6.524 14.821 3.578) 16.584 5.271 ( -5.016 6.309 2.951) 8.584 5.567 ( -0.781 5.956 -2.243) 6.412 5.708 ( -8.588 -12.084 -2.177) 14.984 5.780 ( 1.876 2.499 1.842) 3.627 6.049 ( -4.662 5.030 2.943) 7.463 6.244 ( -9.298 -7.143 -0.790) 11.752 6.771 ( -2.552 -3.137 -8.634) 9.534 6.801 ( 6.865 -0.687 1.948) 7.169 7.162 ( -1.451 -0.528 -2.724) 3.131 7.435 ( -7.470 -3.558 -2.253) 8.575 7.763 ( 3.336 8.716 3.383) 9.927 7.939 ( 13.356 -1.723 -13.018) 18.730 8.150 ( 5.571 17.440 -5.444) 19.101 8.244 ( -4.267 9.911 4.608) 11.734 8.455 ( 5.553 6.048 -10.569) 13.383 8.505 ( 0.712 1.314 -3.549) 3.851 8.625 ( -5.240 3.214 17.361) 18.417 8.706 ( 0.464 5.851 4.265) 7.256 8.888 ( -4.469 -7.387 6.912) 11.059 9.039 ( 14.710 -9.968 0.391) 17.773 9.062 ( 13.779 -10.775 -1.171) 17.531 9.486 ( 3.801 -19.812 -0.299) 20.175 9.879 ( 4.723 3.178 0.640) 5.729 9.944 ( 6.713 0.313 -1.337) 6.852 10.162 ( -4.025 1.847 -3.057) 5.381 10.197 ( -6.189 1.869 1.177) 6.571 10.287 ( -1.066 -3.699 2.270) 4.469 10.364 ( -6.159 -3.981 3.590) 8.165 10.773 ( -0.586 5.408 2.218) 5.874 10.878 ( 4.672 7.010 -3.047) 8.958 11.167 ( -1.659 5.524 8.004) 9.865 11.213 ( 1.339 19.300 -6.208) 20.318 11.264 ( 0.889 1.856 4.749) 5.175 11.326 ( 0.128 9.456 -3.378) 10.042 11.484 ( 0.067 2.843 -0.911) 2.986 11.699 ( -6.418 0.944 2.636) 7.002 11.746 ( 2.477 -4.294 -2.791) 5.688 11.980 ( -1.691 -1.191 -5.025) 5.434 12.104 ( 0.282 -12.436 -0.332) 12.443 12.161 ( -5.016 -9.975 0.967) 11.207 12.320 ( -7.933 5.475 2.681) 10.005 12.366 ( -3.922 3.975 4.912) 7.437 12.526 ( 0.643 0.181 1.731) 1.855 12.597 ( -2.717 3.002 -3.654) 5.454 12.745 ( -1.875 1.543 1.798) 3.022 12.922 ( 0.857 -2.695 10.905) 11.266 13.033 ( -5.340 -2.158 3.475) 6.727 13.227 ( 0.214 -4.441 -1.755) 4.780 13.350 ( -3.844 -2.335 -3.462) 5.675 13.388 ( 1.427 -6.027 -5.153) 8.057 13.613 ( -6.620 4.447 -1.436) 8.103 13.729 ( -6.697 3.855 -3.023) 8.298 13.958 ( -0.121 7.298 -3.261) 7.994 14.098 ( -2.744 -0.605 -5.503) 6.179 14.160 ( -1.223 2.367 -3.060) 4.057 14.243 ( -0.445 -2.667 0.504) 2.750 14.461 ( -3.944 8.334 1.208) 9.299 14.580 ( -3.086 2.883 -4.628) 6.265 14.635 ( 2.603 -7.816 5.129) 9.705 14.925 ( 1.758 -2.977 4.773) 5.894 14.982 ( 3.285 -1.645 1.353) 3.916 15.120 ( 0.802 -7.804 -2.335) 8.185 15.243 ( 5.305 -2.912 -1.926) 6.351 15.337 ( -1.808 -11.291 2.544) 11.714 15.758 ( -1.562 1.949 0.346) 2.522 15.879 ( -2.290 -4.436 3.154) 5.906 16.402 ( 4.590 7.091 -4.497) 9.569 16.661 ( 5.891 -2.951 5.336) 8.479 16.835 ( 5.242 -4.831 -11.941) 13.907 17.041 ( -3.997 -14.454 -2.632) 15.226 18.570 ( -3.583 0.347 7.612) 8.420 18.590 ( -4.509 -0.468 7.209) 8.515 19.456 ( -0.378 2.691 -1.624) 3.165 19.490 ( -0.167 1.347 -1.394) 1.945 22.619 ( -6.886 15.674 -5.776) 18.068 22.885 ( 4.027 7.889 11.465) 14.488 23.637 ( -8.629 -3.997 -11.876) 15.214 23.987 ( 1.733 -14.375 5.082) 15.345 ======================= Grid point 37 (23/130) ======================= q-point: ( 0.40 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.773 ( 1.433 5.749 -8.647) 10.482 2.889 ( 7.549 4.344 -0.303) 8.715 3.129 ( 10.927 8.447 -2.613) 14.056 3.352 ( 1.059 1.986 4.125) 4.699 3.647 ( 0.346 5.052 3.724) 6.286 3.739 ( 8.562 0.414 -1.461) 8.696 3.996 ( -8.289 5.767 9.759) 14.043 4.131 ( 1.490 3.146 -4.862) 5.979 4.211 ( -7.323 -2.430 1.978) 7.965 4.389 ( 2.551 -3.596 -2.890) 5.271 4.455 ( -2.272 23.261 -2.281) 23.483 5.035 ( -0.111 18.237 -0.215) 18.238 5.239 ( -0.331 -2.489 6.401) 6.876 5.462 ( -2.242 -3.029 0.832) 3.860 5.677 ( 1.367 13.187 -2.238) 13.445 5.872 ( 2.829 -1.660 4.133) 5.276 5.956 ( -4.850 -0.932 -0.522) 4.966 6.097 ( -4.498 -3.199 -2.187) 5.937 6.652 ( -3.318 -5.538 -5.920) 8.759 6.909 ( 2.057 -1.412 3.419) 4.233 7.062 ( -4.155 -6.152 -6.150) 9.640 7.376 ( 1.806 -7.113 -0.169) 7.341 7.854 ( 3.226 10.692 2.207) 11.384 8.052 ( 8.219 4.712 -13.316) 16.342 8.162 ( -2.285 14.111 -3.417) 14.698 8.182 ( -3.901 13.630 2.107) 14.333 8.339 ( -6.737 -3.503 3.616) 8.410 8.504 ( 1.012 2.669 2.892) 4.064 8.646 ( -0.871 7.730 -1.426) 7.909 8.858 ( -1.699 -7.114 5.163) 8.953 8.943 ( 11.754 6.017 8.155) 15.520 9.162 ( 5.305 -9.491 -5.709) 12.281 9.405 ( 15.027 -7.093 1.906) 16.726 9.570 ( 3.380 -21.091 3.068) 21.580 9.932 ( 1.170 4.542 -2.033) 5.112 10.002 ( -5.356 4.917 0.520) 7.289 10.069 ( -4.886 1.898 -3.212) 6.148 10.121 ( 4.270 -4.379 0.458) 6.133 10.178 ( -6.640 -0.677 3.101) 7.360 10.342 ( -1.313 -6.674 -0.575) 6.826 10.777 ( -0.344 8.126 1.646) 8.298 10.931 ( 2.824 12.463 -2.524) 13.026 11.152 ( -1.256 17.989 -1.479) 18.093 11.241 ( 0.951 7.272 3.168) 7.989 11.292 ( 0.303 3.898 2.212) 4.492 11.339 ( 3.311 10.198 -4.441) 11.605 11.497 ( 1.205 -0.720 0.973) 1.708 11.600 ( -5.526 0.645 3.937) 6.815 11.810 ( 4.508 -6.728 -1.251) 8.195 11.905 ( -1.895 1.015 -3.682) 4.264 12.040 ( -5.561 -5.350 0.168) 7.718 12.122 ( -1.171 -9.351 0.979) 9.474 12.200 ( -4.158 4.317 0.116) 5.995 12.289 ( -5.338 -1.565 0.026) 5.563 12.539 ( -0.466 4.668 2.271) 5.212 12.580 ( 0.490 -4.730 -0.196) 4.759 12.758 ( 1.265 8.615 2.188) 8.979 12.940 ( -2.614 -0.960 2.500) 3.742 13.043 ( -0.407 -5.326 11.099) 12.318 13.181 ( -0.956 -0.107 -5.198) 5.286 13.272 ( -2.903 -6.864 -5.494) 9.259 13.387 ( 0.605 -12.023 0.770) 12.063 13.521 ( -1.985 2.619 -0.959) 3.423 13.584 ( -5.340 4.953 -3.911) 8.267 13.904 ( -2.038 5.554 -2.298) 6.347 13.996 ( -3.971 2.940 -3.397) 5.996 14.126 ( -0.358 -1.141 -3.912) 4.090 14.247 ( 0.410 5.107 1.033) 5.226 14.412 ( -0.756 3.804 -1.062) 4.021 14.502 ( -2.740 2.082 -0.584) 3.490 14.710 ( 1.499 -8.401 3.786) 9.336 14.954 ( -0.721 -13.334 1.071) 13.396 14.973 ( -0.439 -7.902 2.002) 8.164 15.174 ( 0.807 -10.351 -0.158) 10.383 15.359 ( 4.935 1.576 -1.213) 5.320 15.371 ( 5.632 -0.999 -0.655) 5.757 15.739 ( -1.222 3.611 1.150) 3.981 15.864 ( -1.229 -1.433 2.259) 2.943 16.443 ( 2.210 10.144 -2.427) 10.662 16.777 ( 1.703 -2.993 6.320) 7.197 16.860 ( 4.876 -7.840 -8.977) 12.877 16.968 ( -2.358 -12.022 -0.998) 12.292 18.535 ( -3.065 1.190 3.704) 4.953 18.581 ( -1.392 -2.118 3.859) 4.617 19.429 ( -1.069 2.566 -1.117) 2.996 19.464 ( -1.265 1.988 -0.798) 2.488 22.491 ( -3.418 16.526 -2.951) 17.132 23.018 ( 1.997 -2.374 10.219) 10.679 23.423 ( -5.127 5.856 -10.595) 13.147 24.037 ( 0.663 -15.568 2.726) 15.819 ======================= Grid point 38 (24/130) ======================= q-point: (-0.50 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.754 ( 0.000 7.492 0.000) 7.492 2.961 ( 0.000 1.793 0.000) 1.793 3.222 ( -0.000 4.586 -0.000) 4.586 3.380 ( 0.000 0.889 0.000) 0.889 3.709 ( -0.000 13.136 0.000) 13.136 3.835 ( 0.000 4.900 -0.000) 4.900 3.881 ( 0.000 1.815 0.000) 1.815 4.119 ( -0.000 -6.736 0.000) 6.736 4.138 ( 0.000 3.578 -0.000) 3.578 4.423 ( -0.000 -7.412 0.000) 7.412 4.429 ( 0.000 25.650 -0.000) 25.650 5.012 ( 0.000 20.749 0.000) 20.749 5.238 ( 0.000 -13.929 -0.000) 13.929 5.549 ( -0.000 -0.210 -0.000) 0.210 5.632 ( 0.000 25.062 0.000) 25.062 5.858 ( 0.000 -2.873 0.000) 2.873 5.955 ( 0.000 -5.001 -0.000) 5.001 6.048 ( 0.000 -0.656 0.000) 0.656 6.595 ( 0.000 -7.034 0.000) 7.034 6.960 ( 0.000 -16.375 0.000) 16.375 6.967 ( -0.000 7.696 -0.000) 7.696 7.414 ( 0.000 -9.574 0.000) 9.574 7.897 ( 0.000 9.361 0.000) 9.361 8.087 ( -0.000 17.753 0.000) 17.753 8.095 ( 0.000 4.188 0.000) 4.188 8.146 ( 0.000 12.125 -0.000) 12.125 8.289 ( 0.000 -3.415 -0.000) 3.415 8.560 ( -0.000 9.214 -0.000) 9.214 8.608 ( 0.000 3.843 0.000) 3.843 8.858 ( 0.000 -7.411 0.000) 7.411 9.146 ( -0.000 9.565 -0.000) 9.565 9.150 ( 0.000 -13.093 0.000) 13.093 9.594 ( -0.000 -9.137 -0.000) 9.137 9.620 ( 0.000 -21.390 -0.000) 21.390 9.873 ( 0.000 5.918 -0.000) 5.918 9.965 ( 0.000 2.492 0.002) 2.492 9.965 ( -0.000 4.406 -0.002) 4.406 10.141 ( -0.000 2.623 0.000) 2.623 10.257 ( -0.003 -10.467 -0.001) 10.467 10.257 ( 0.003 -2.418 0.001) 2.418 10.780 ( 0.000 8.734 -0.000) 8.734 10.949 ( 0.000 15.754 0.000) 15.754 11.134 ( -0.000 20.873 -0.000) 20.873 11.247 ( 0.000 3.698 -0.000) 3.698 11.324 ( -0.000 -0.406 0.000) 0.406 11.356 ( 0.000 12.994 -0.000) 12.994 11.525 ( 0.000 -6.685 -0.000) 6.685 11.552 ( -0.000 7.063 0.000) 7.063 11.861 ( -0.000 -6.978 0.000) 6.978 11.874 ( 0.000 3.980 -0.000) 3.980 11.975 ( -0.000 -7.334 0.000) 7.334 12.102 ( 0.000 0.765 -0.000) 0.765 12.185 ( -0.000 9.973 -0.000) 9.973 12.213 ( 0.000 -15.325 0.000) 15.325 12.544 ( 0.000 3.557 0.000) 3.557 12.581 ( 0.000 -4.680 -0.000) 4.680 12.789 ( -0.000 9.553 -0.000) 9.553 12.924 ( 0.000 -1.536 -0.000) 1.536 13.105 ( -0.000 -6.151 -0.000) 6.151 13.133 ( 0.000 -0.968 0.000) 0.968 13.202 ( 0.000 -5.656 -0.000) 5.656 13.404 ( 0.000 -15.759 0.000) 15.759 13.506 ( 0.000 0.415 0.000) 0.415 13.507 ( -0.000 7.363 -0.000) 7.363 13.879 ( 0.000 5.927 -0.000) 5.927 13.938 ( -0.000 4.900 -0.000) 4.900 14.103 ( 0.000 -2.005 -0.000) 2.005 14.259 ( 0.000 7.703 0.000) 7.703 14.407 ( 0.000 0.857 0.000) 0.857 14.472 ( 0.000 1.658 -0.000) 1.658 14.736 ( -0.000 -7.474 0.000) 7.474 14.951 ( 0.000 -16.845 0.000) 16.845 14.985 ( 0.000 -9.332 0.000) 9.332 15.166 ( 0.000 -12.024 -0.000) 12.024 15.398 ( 0.000 2.910 0.000) 2.910 15.444 ( -0.000 1.696 0.000) 1.696 15.729 ( 0.000 4.582 -0.000) 4.582 15.861 ( 0.000 -0.229 -0.000) 0.229 16.455 ( 0.000 11.367 -0.000) 11.367 16.812 ( 0.000 -3.442 0.000) 3.442 16.880 ( 0.000 -8.549 -0.000) 8.549 16.941 ( 0.000 -10.992 0.000) 10.992 18.518 ( 0.000 1.483 0.000) 1.483 18.582 ( 0.000 -2.745 -0.000) 2.745 19.413 ( 0.000 2.389 0.000) 2.389 19.447 ( 0.000 2.268 0.000) 2.268 22.448 ( 0.000 16.507 0.000) 16.507 23.083 ( -0.000 -13.416 -0.000) 13.416 23.326 ( 0.000 16.842 0.000) 16.842 24.052 ( 0.000 -15.824 -0.000) 15.824 ======================= Grid point 44 (25/130) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.478 ( 0.000 -20.771 0.000) 20.771 2.478 ( 0.000 20.771 0.000) 20.771 2.769 ( 0.000 -22.915 0.000) 22.915 2.769 ( 0.000 22.915 0.000) 22.915 3.725 ( 0.000 -14.982 0.000) 14.982 3.725 ( 0.000 14.982 0.000) 14.982 4.048 ( 0.000 -1.902 0.000) 1.902 4.048 ( 0.000 1.902 0.000) 1.902 4.218 ( 0.000 -9.902 0.000) 9.902 4.218 ( 0.000 9.902 0.000) 9.902 5.062 ( 0.000 -13.614 0.000) 13.614 5.062 ( 0.000 13.614 0.000) 13.614 5.652 ( 0.000 -5.504 0.000) 5.504 5.652 ( 0.000 5.504 0.000) 5.504 5.878 ( 0.000 -23.295 0.000) 23.295 5.878 ( 0.000 23.295 0.000) 23.295 6.414 ( 0.000 -14.276 0.000) 14.276 6.414 ( 0.000 14.276 0.000) 14.276 6.758 ( 0.000 -3.257 0.000) 3.257 6.758 ( 0.000 3.257 0.000) 3.257 7.000 ( 0.000 -3.604 0.000) 3.604 7.000 ( 0.000 3.604 0.000) 3.604 7.862 ( 0.000 -6.892 0.000) 6.892 7.862 ( 0.000 6.892 0.000) 6.892 8.083 ( 0.000 -16.148 0.000) 16.148 8.083 ( 0.000 16.148 0.000) 16.148 8.245 ( 0.000 -2.904 0.000) 2.904 8.245 ( 0.000 2.904 0.000) 2.904 8.788 ( 0.000 -7.587 0.000) 7.587 8.788 ( 0.000 7.587 0.000) 7.587 8.793 ( 0.000 -15.548 0.000) 15.548 8.793 ( 0.000 15.548 0.000) 15.548 9.338 ( 0.000 -5.517 0.000) 5.517 9.338 ( 0.000 5.517 0.000) 5.517 9.471 ( 0.000 -3.382 0.000) 3.382 9.471 ( 0.000 3.382 0.000) 3.382 10.252 ( 0.000 -1.044 0.000) 1.044 10.252 ( 0.000 1.044 0.000) 1.044 10.331 ( 0.000 -4.711 0.000) 4.711 10.331 ( 0.000 4.711 0.000) 4.711 10.662 ( 0.000 -2.975 0.000) 2.975 10.662 ( 0.000 2.975 0.000) 2.975 11.241 ( 0.000 -1.829 0.000) 1.829 11.241 ( 0.000 1.829 0.000) 1.829 11.521 ( 0.000 -0.614 0.000) 0.614 11.521 ( 0.000 0.614 0.000) 0.614 11.713 ( 0.000 -18.599 0.000) 18.599 11.713 ( 0.000 18.599 0.000) 18.599 11.833 ( 0.000 -2.068 0.000) 2.068 11.833 ( 0.000 2.068 0.000) 2.068 12.038 ( 0.000 -12.084 0.000) 12.084 12.038 ( 0.000 12.084 0.000) 12.084 12.456 ( 0.000 -6.576 0.000) 6.576 12.456 ( 0.000 6.576 0.000) 6.576 12.653 ( 0.000 -5.672 0.000) 5.672 12.653 ( 0.000 5.672 0.000) 5.672 13.032 ( 0.000 -0.962 0.000) 0.962 13.032 ( 0.000 0.962 0.000) 0.962 13.243 ( 0.000 -4.032 0.000) 4.032 13.243 ( 0.000 4.032 0.000) 4.032 13.456 ( 0.000 -4.756 0.000) 4.756 13.456 ( 0.000 4.756 0.000) 4.756 13.911 ( 0.000 -2.813 0.000) 2.813 13.911 ( 0.000 2.813 0.000) 2.813 14.184 ( 0.000 -5.670 0.000) 5.670 14.184 ( 0.000 5.670 0.000) 5.670 14.230 ( 0.000 -6.499 0.000) 6.499 14.230 ( 0.000 6.499 0.000) 6.499 14.398 ( 0.000 -3.877 0.000) 3.877 14.398 ( 0.000 3.877 0.000) 3.877 14.666 ( 0.000 -11.377 0.000) 11.377 14.666 ( 0.000 11.377 0.000) 11.377 14.966 ( 0.000 -14.053 0.000) 14.053 14.966 ( 0.000 14.053 0.000) 14.053 15.462 ( 0.000 -14.536 0.000) 14.536 15.462 ( 0.000 14.536 0.000) 14.536 15.848 ( 0.000 -1.499 0.000) 1.499 15.848 ( 0.000 1.499 0.000) 1.499 16.319 ( 0.000 -0.681 0.000) 0.681 16.319 ( 0.000 0.681 0.000) 0.681 16.971 ( 0.000 -11.339 0.000) 11.339 16.971 ( 0.000 11.339 0.000) 11.339 18.662 ( 0.000 -3.696 0.000) 3.696 18.662 ( 0.000 3.696 0.000) 3.696 19.388 ( 0.000 -0.467 0.000) 0.467 19.388 ( 0.000 0.467 0.000) 0.467 22.877 ( 0.000 -16.778 0.000) 16.778 22.877 ( 0.000 16.778 0.000) 16.778 23.928 ( 0.000 -11.066 0.000) 11.066 23.928 ( 0.000 11.066 0.000) 11.066 ======================= Grid point 46 (26/130) ======================= q-point: ( 0.10 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.526 ( 6.961 -18.030 -5.828) 20.187 2.526 ( 6.961 18.030 -5.828) 20.187 2.841 ( 6.739 -21.946 1.047) 22.981 2.841 ( 6.739 21.946 1.047) 22.981 3.744 ( 0.616 -12.863 1.242) 12.938 3.744 ( 0.616 12.863 1.242) 12.938 3.912 ( -7.556 -13.665 -0.689) 15.630 3.912 ( -7.556 13.665 -0.689) 15.630 4.364 ( 6.848 -4.548 7.459) 11.101 4.364 ( 6.848 4.548 7.459) 11.101 5.028 ( -2.503 -11.636 -2.268) 12.116 5.028 ( -2.503 11.636 -2.268) 12.116 5.671 ( 1.813 -8.751 -0.271) 8.941 5.671 ( 1.813 8.751 -0.271) 8.941 5.771 ( -7.606 -20.641 -4.870) 22.530 5.771 ( -7.606 20.641 -4.870) 22.530 6.400 ( -5.785 -12.040 8.184) 15.666 6.400 ( -5.786 12.040 8.184) 15.666 6.751 ( -0.411 -9.706 -3.606) 10.363 6.751 ( -0.411 9.706 -3.606) 10.363 7.104 ( 12.494 -11.293 -1.579) 16.915 7.104 ( 12.494 11.293 -1.579) 16.915 7.902 ( -1.862 -7.079 -1.019) 7.390 7.902 ( -1.862 7.079 -1.019) 7.390 8.133 ( 9.863 -10.474 -0.700) 14.404 8.133 ( 9.863 10.474 -0.700) 14.404 8.268 ( 3.572 -1.488 -1.610) 4.191 8.268 ( 3.572 1.488 -1.610) 4.191 8.738 ( 2.841 -7.384 -15.183) 17.121 8.738 ( 2.841 7.384 -15.183) 17.121 8.820 ( -5.337 -7.113 15.102) 17.526 8.820 ( -5.337 7.113 15.102) 17.526 9.131 ( -12.018 -7.933 0.749) 14.419 9.131 ( -12.018 7.933 0.749) 14.419 9.652 ( 10.323 -1.938 -0.278) 10.507 9.652 ( 10.323 1.938 -0.278) 10.507 10.231 ( -0.093 -3.997 -3.578) 5.366 10.231 ( -0.093 3.997 -3.578) 5.366 10.368 ( -0.098 -4.130 6.827) 7.980 10.368 ( -0.098 4.130 6.827) 7.980 10.702 ( 3.035 -2.166 2.424) 4.447 10.702 ( 3.035 2.166 2.424) 4.447 11.226 ( -2.155 -1.360 2.181) 3.354 11.226 ( -2.155 1.360 2.181) 3.354 11.528 ( -0.040 -2.162 2.013) 2.954 11.528 ( -0.040 2.162 2.013) 2.954 11.707 ( 0.287 -18.086 -2.546) 18.267 11.707 ( 0.287 18.086 -2.546) 18.267 11.821 ( 0.367 -1.135 -4.363) 4.523 11.821 ( 0.367 1.135 -4.363) 4.523 12.028 ( -1.888 -11.248 1.714) 11.534 12.028 ( -1.888 11.248 1.714) 11.534 12.485 ( 0.820 -6.882 5.563) 8.887 12.485 ( 0.820 6.882 5.563) 8.887 12.633 ( -1.495 -6.766 -2.042) 7.224 12.633 ( -1.495 6.766 -2.042) 7.224 12.914 ( -7.840 -4.939 -2.356) 9.561 12.914 ( -7.840 4.939 -2.356) 9.561 13.290 ( 0.782 -5.970 -0.967) 6.099 13.290 ( 0.782 5.970 -0.967) 6.099 13.391 ( -3.949 -6.280 0.270) 7.423 13.391 ( -3.949 6.280 0.270) 7.423 13.898 ( -1.960 -1.807 0.588) 2.730 13.898 ( -1.960 1.807 0.588) 2.730 14.139 ( -2.056 -9.230 -0.402) 9.465 14.139 ( -2.056 9.230 -0.402) 9.465 14.363 ( 5.891 -7.071 -1.425) 9.313 14.363 ( 5.891 7.071 -1.425) 9.313 14.368 ( 1.352 -2.342 -1.422) 3.055 14.368 ( 1.352 2.342 -1.422) 3.055 14.690 ( 3.454 -10.547 -0.057) 11.098 14.690 ( 3.454 10.547 -0.057) 11.098 14.935 ( -2.739 -13.765 0.194) 14.036 14.935 ( -2.739 13.765 0.194) 14.036 15.404 ( -7.045 -13.322 3.455) 15.461 15.404 ( -7.045 13.322 3.455) 15.461 15.854 ( -1.599 -0.894 2.249) 2.900 15.854 ( -1.599 0.894 2.249) 2.900 16.327 ( 4.143 -0.923 -5.376) 6.849 16.327 ( 4.143 0.923 -5.376) 6.849 16.949 ( -0.298 -10.093 -5.479) 11.488 16.949 ( -0.298 10.093 -5.479) 11.488 18.646 ( -4.239 -3.190 7.511) 9.196 18.646 ( -4.239 3.190 7.511) 9.196 19.424 ( 3.692 -0.330 -1.349) 3.945 19.424 ( 3.692 0.330 -1.349) 3.945 22.897 ( 0.636 -13.257 2.946) 13.595 22.897 ( 0.636 13.257 2.946) 13.595 23.877 ( -3.638 -8.446 -3.267) 9.759 23.877 ( -3.638 8.446 -3.267) 9.759 ======================= Grid point 48 (27/130) ======================= q-point: ( 0.20 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.650 ( 10.797 -11.040 -8.330) 17.545 2.650 ( 10.797 11.040 -8.330) 17.545 3.014 ( 9.275 -19.093 2.538) 21.378 3.014 ( 9.275 19.093 2.538) 21.378 3.683 ( -5.965 -11.097 0.231) 12.600 3.683 ( -5.965 11.097 0.231) 12.600 3.898 ( 4.649 -7.605 2.128) 9.164 3.898 ( 4.649 7.605 2.128) 9.164 4.492 ( -0.604 -2.104 7.768) 8.070 4.492 ( -0.604 2.104 7.768) 8.070 4.965 ( -0.694 -7.004 -3.414) 7.822 4.965 ( -0.694 7.004 -3.414) 7.822 5.549 ( -9.941 -17.404 -3.405) 20.331 5.549 ( -9.941 17.404 -3.405) 20.331 5.742 ( 3.888 -6.709 -0.912) 7.808 5.742 ( 3.888 6.709 -0.912) 7.808 6.286 ( -11.402 -7.998 8.409) 16.269 6.286 ( -11.402 7.998 8.409) 16.269 6.729 ( 2.077 -7.055 -5.838) 9.390 6.729 ( 2.077 7.055 -5.838) 9.390 7.348 ( 9.221 -14.320 -3.249) 17.340 7.348 ( 9.221 14.320 -3.249) 17.340 7.778 ( -3.007 -6.118 -3.632) 7.724 7.778 ( -3.007 6.118 -3.632) 7.724 8.315 ( 5.040 -2.080 -2.577) 6.031 8.315 ( 5.040 2.080 -2.577) 6.031 8.470 ( 18.997 -6.657 1.798) 20.209 8.470 ( 18.997 6.657 1.798) 20.209 8.677 ( -2.867 -6.035 -6.329) 9.203 8.677 ( -2.867 6.035 -6.329) 9.203 8.795 ( -4.093 -2.216 7.904) 9.172 8.795 ( -4.093 2.216 7.904) 9.172 8.992 ( -3.618 -16.831 3.116) 17.496 8.992 ( -3.618 16.831 3.116) 17.496 9.816 ( 7.417 -1.638 -0.602) 7.619 9.816 ( 7.417 1.638 -0.602) 7.619 10.210 ( 0.723 -2.331 -4.118) 4.787 10.210 ( 0.723 2.331 -4.118) 4.787 10.380 ( -4.301 -3.961 6.659) 8.862 10.380 ( -4.301 3.961 6.659) 8.862 10.794 ( 4.294 -1.222 2.900) 5.324 10.794 ( 4.294 1.222 2.900) 5.324 11.206 ( -2.197 -1.155 5.461) 5.999 11.206 ( -2.197 1.155 5.461) 5.999 11.547 ( -0.039 -5.318 3.256) 6.236 11.547 ( -0.039 5.318 3.256) 6.236 11.685 ( -0.079 -17.331 -4.433) 17.889 11.685 ( -0.079 17.331 -4.433) 17.889 11.793 ( 0.930 -5.825 -6.693) 8.922 11.793 ( 0.930 5.825 -6.693) 8.922 11.980 ( -3.851 -11.445 -0.105) 12.077 11.980 ( -3.851 11.445 -0.105) 12.077 12.521 ( -3.032 -5.985 1.847) 6.959 12.521 ( -3.032 5.985 1.847) 6.959 12.583 ( -2.590 -9.583 4.857) 11.051 12.583 ( -2.590 9.583 4.857) 11.051 12.793 ( -2.059 -1.855 -0.904) 2.916 12.793 ( -2.059 1.855 -0.904) 2.916 13.204 ( -6.753 -2.819 1.910) 7.563 13.204 ( -6.753 2.819 1.910) 7.563 13.374 ( 0.743 -6.668 -4.133) 7.880 13.374 ( 0.743 6.668 -4.133) 7.880 13.831 ( -5.488 -1.923 0.191) 5.819 13.831 ( -5.488 1.923 0.191) 5.819 14.096 ( -0.779 -6.140 -4.456) 7.626 14.096 ( -0.779 6.140 -4.456) 7.626 14.296 ( -3.264 -1.823 -2.376) 4.430 14.296 ( -3.264 1.823 -2.376) 4.430 14.495 ( 3.980 -4.758 0.645) 6.236 14.495 ( 3.980 4.758 0.645) 6.236 14.814 ( 5.600 -9.999 2.526) 11.735 14.814 ( 5.600 9.998 2.526) 11.735 14.901 ( 1.508 -8.391 -0.981) 8.581 14.901 ( 1.508 8.391 -0.981) 8.581 15.252 ( -10.351 -8.271 3.699) 13.756 15.252 ( -10.351 8.271 3.699) 13.756 15.819 ( -2.079 -1.599 0.947) 2.789 15.819 ( -2.079 1.599 0.947) 2.789 16.420 ( 8.497 -4.103 -4.510) 10.459 16.420 ( 8.497 4.103 -4.510) 10.459 16.893 ( -0.887 -7.526 -6.504) 9.986 16.893 ( -0.887 7.526 -6.504) 9.986 18.613 ( -5.224 -1.905 9.461) 10.974 18.613 ( -5.224 1.905 9.461) 10.974 19.480 ( 2.629 -0.492 -1.490) 3.062 19.480 ( 2.629 0.492 -1.490) 3.062 22.918 ( -1.327 -3.262 3.060) 4.665 22.918 ( -1.327 3.262 3.060) 4.665 23.775 ( -3.618 -0.210 -3.693) 5.174 23.775 ( -3.618 0.210 -3.693) 5.174 ======================= Grid point 50 (28/130) ======================= q-point: ( 0.30 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.795 ( 9.719 -2.622 -8.197) 12.981 2.795 ( 9.719 2.622 -8.197) 12.981 3.191 ( 6.355 -13.061 3.411) 14.920 3.191 ( 6.355 13.061 3.411) 14.920 3.623 ( 0.484 -5.592 0.821) 5.673 3.623 ( 0.484 5.592 0.821) 5.673 4.036 ( 6.328 -5.596 4.167) 9.419 4.036 ( 6.328 5.596 4.167) 9.419 4.418 ( -9.036 -4.069 0.491) 9.922 4.418 ( -9.036 4.069 0.491) 9.922 4.968 ( 0.810 -12.782 -1.106) 12.855 4.968 ( 0.810 12.782 -1.106) 12.855 5.373 ( -5.832 -7.369 0.150) 9.399 5.373 ( -5.832 7.369 0.150) 9.399 5.806 ( 3.348 -3.005 -1.387) 4.707 5.806 ( 3.348 3.005 -1.387) 4.707 6.132 ( -9.151 -3.419 5.913) 11.419 6.132 ( -9.151 3.419 5.913) 11.419 6.730 ( 1.296 -1.991 -5.445) 5.941 6.730 ( 1.296 1.991 -5.445) 5.941 7.290 ( -7.134 -9.151 -3.385) 12.087 7.290 ( -7.134 9.151 -3.385) 12.087 7.875 ( 11.983 -3.843 -6.576) 14.198 7.875 ( 11.983 3.843 -6.576) 14.198 8.372 ( 2.212 -1.673 -2.383) 3.657 8.372 ( 2.212 1.673 -2.383) 3.657 8.520 ( -8.920 -5.572 1.595) 10.638 8.520 ( -8.920 5.572 1.595) 10.638 8.783 ( 1.975 -4.468 10.513) 11.593 8.783 ( 1.975 4.468 10.513) 11.593 8.901 ( 18.043 -3.050 -4.300) 18.797 8.901 ( 18.043 3.050 -4.300) 18.797 8.998 ( 1.029 -22.867 4.491) 23.327 8.998 ( 1.029 22.867 4.491) 23.327 9.930 ( 5.581 -1.560 -1.915) 6.103 9.930 ( 5.581 1.560 -1.915) 6.103 10.202 ( 0.491 -2.981 -2.019) 3.634 10.202 ( 0.491 2.981 -2.019) 3.634 10.286 ( -8.521 -4.097 2.645) 9.818 10.286 ( -8.521 4.097 2.645) 9.818 10.891 ( 3.830 -4.853 1.971) 6.488 10.891 ( 3.830 4.853 1.971) 6.488 11.227 ( -0.496 -1.982 7.638) 7.907 11.227 ( -0.496 1.982 7.638) 7.907 11.556 ( -1.514 -8.626 2.908) 9.228 11.556 ( -1.514 8.626 2.908) 9.228 11.665 ( 2.051 -17.538 -4.768) 18.290 11.665 ( 2.051 17.538 -4.768) 18.290 11.759 ( 0.145 -11.100 -6.639) 12.935 11.759 ( 0.145 11.100 -6.639) 12.935 11.897 ( -3.806 -12.717 -0.937) 13.307 11.897 ( -3.806 12.717 -0.937) 13.307 12.422 ( -6.010 -2.698 -0.134) 6.589 12.422 ( -6.010 2.698 -0.134) 6.589 12.565 ( -2.325 -1.114 1.686) 3.081 12.565 ( -2.325 1.114 1.686) 3.081 12.834 ( 1.785 -3.511 7.919) 8.845 12.834 ( 1.785 3.511 7.919) 8.845 13.113 ( -4.009 -6.858 2.569) 8.349 13.113 ( -4.009 6.858 2.569) 8.349 13.323 ( -1.796 -0.261 -8.119) 8.319 13.323 ( -1.796 0.261 -8.119) 8.319 13.708 ( -6.508 -4.373 -0.476) 7.855 13.708 ( -6.508 4.373 -0.476) 7.855 14.045 ( -1.512 -3.539 -4.404) 5.849 14.045 ( -1.512 3.539 -4.404) 5.849 14.220 ( -2.721 -1.389 -2.349) 3.854 14.220 ( -2.721 1.389 -2.349) 3.854 14.555 ( 1.992 -2.352 1.371) 3.374 14.555 ( 1.992 2.352 1.371) 3.374 14.811 ( -3.881 -16.571 -0.343) 17.023 14.811 ( -3.881 16.571 -0.343) 17.023 14.935 ( -3.583 -5.001 2.897) 6.800 14.935 ( -3.583 5.001 2.897) 6.800 15.218 ( 7.366 -0.998 0.464) 7.448 15.218 ( 7.366 0.998 0.464) 7.448 15.806 ( -0.339 -2.733 1.495) 3.134 15.806 ( -0.339 2.733 1.495) 3.134 16.552 ( 7.201 -6.839 -2.182) 10.168 16.552 ( 7.201 6.839 -2.182) 10.168 16.837 ( -0.637 -5.056 -4.779) 6.986 16.837 ( -0.637 5.056 -4.779) 6.986 18.581 ( -4.255 -0.557 7.298) 8.466 18.581 ( -4.255 0.557 7.298) 8.466 19.493 ( -0.136 -0.938 -1.264) 1.580 19.493 ( -0.136 0.938 -1.264) 1.580 22.880 ( -3.680 -8.100 0.697) 8.924 22.880 ( -3.680 8.100 0.697) 8.925 23.711 ( -1.287 -10.516 -1.417) 10.689 23.711 ( -1.287 10.516 -1.417) 10.689 ======================= Grid point 52 (29/130) ======================= q-point: ( 0.40 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.884 ( 4.627 -3.896 -5.557) 8.214 2.884 ( 4.627 3.896 -5.557) 8.214 3.292 ( 2.456 -6.370 2.582) 7.299 3.292 ( 2.456 6.370 2.582) 7.299 3.724 ( 8.905 -2.286 0.236) 9.197 3.724 ( 8.905 2.286 0.236) 9.197 4.113 ( -7.356 -4.686 8.563) 12.223 4.113 ( -7.356 4.686 8.563) 12.223 4.258 ( -1.082 -6.150 -5.865) 8.567 4.258 ( -1.082 6.150 -5.865) 8.567 4.927 ( -3.041 -19.661 -1.661) 19.964 4.927 ( -3.041 19.661 -1.661) 19.964 5.358 ( 1.961 -10.042 2.323) 10.492 5.358 ( 1.961 10.042 2.323) 10.492 5.845 ( 1.018 -3.204 0.294) 3.375 5.845 ( 1.018 3.204 0.294) 3.375 6.036 ( -3.683 -6.181 2.168) 7.515 6.036 ( -3.683 6.181 2.168) 7.515 6.679 ( -2.582 -9.828 -4.709) 11.200 6.679 ( -2.582 9.828 -4.709) 11.200 7.188 ( -1.676 -10.000 -0.598) 10.157 7.188 ( -1.676 10.000 -0.598) 10.157 8.021 ( 8.608 -5.363 -8.331) 13.125 8.021 ( 8.608 5.363 -8.331) 13.125 8.285 ( -9.483 -0.621 3.529) 10.137 8.285 ( -9.483 0.621 3.529) 10.137 8.469 ( 1.117 -10.636 0.259) 10.698 8.469 ( 1.117 10.636 0.259) 10.698 8.865 ( 2.687 -7.492 3.343) 8.633 8.865 ( 2.687 7.492 3.343) 8.633 9.013 ( -0.087 -24.352 2.494) 24.479 9.013 ( -0.087 24.352 2.494) 24.479 9.247 ( 14.310 -6.239 1.667) 15.699 9.247 ( 14.310 6.239 1.667) 15.699 10.014 ( 5.099 -3.624 -2.218) 6.637 10.014 ( 5.099 3.624 -2.218) 6.637 10.093 ( -9.269 -2.567 -1.164) 9.688 10.093 ( -9.269 2.567 -1.164) 9.688 10.215 ( -1.138 -4.913 0.988) 5.139 10.215 ( -1.138 4.913 0.988) 5.139 10.957 ( 1.893 -7.590 1.067) 7.895 10.957 ( 1.893 7.590 1.067) 7.895 11.275 ( 0.333 -1.542 4.892) 5.140 11.275 ( 0.333 1.542 4.892) 5.140 11.551 ( -0.507 -9.692 2.754) 10.088 11.551 ( -0.507 9.692 2.754) 10.088 11.672 ( 0.888 -18.114 -5.467) 18.942 11.672 ( 0.888 18.114 -5.467) 18.942 11.730 ( 1.797 -14.491 -2.594) 14.831 11.730 ( 1.797 14.491 -2.594) 14.831 11.833 ( -2.909 -11.746 0.102) 12.101 11.833 ( -2.909 11.746 0.102) 12.101 12.319 ( -3.889 -3.800 -0.875) 5.507 12.319 ( -3.889 3.800 -0.875) 5.507 12.539 ( -1.141 -2.067 0.770) 2.483 12.539 ( -1.141 2.067 0.770) 2.483 12.900 ( -0.977 -6.381 7.651) 10.011 12.900 ( -0.977 6.381 7.651) 10.011 13.099 ( -0.189 -10.460 3.542) 11.045 13.099 ( -0.189 10.460 3.542) 11.045 13.206 ( -3.012 -2.126 -9.673) 10.351 13.206 ( -3.012 2.126 -9.673) 10.351 13.602 ( -4.037 -3.265 -0.323) 5.202 13.602 ( -4.037 3.265 -0.323) 5.202 13.986 ( -1.682 -3.060 -2.363) 4.216 13.986 ( -1.682 3.060 -2.363) 4.216 14.168 ( -1.265 -4.658 -1.567) 5.074 14.168 ( -1.265 4.658 -1.567) 5.074 14.590 ( 0.872 -3.444 0.670) 3.615 14.590 ( 0.872 3.444 0.670) 3.615 14.723 ( -3.235 -8.757 -0.906) 9.379 14.723 ( -3.235 8.757 -0.906) 9.379 14.901 ( -1.702 -8.687 2.306) 9.147 14.901 ( -1.702 8.687 2.306) 9.147 15.379 ( 7.089 -0.668 -0.116) 7.121 15.379 ( 7.089 0.668 -0.116) 7.121 15.815 ( -0.061 -3.305 1.473) 3.619 15.815 ( -0.061 3.305 1.473) 3.619 16.649 ( 3.791 -9.174 -0.466) 9.938 16.649 ( 3.791 9.174 -0.466) 9.938 16.805 ( -0.061 -3.298 -2.588) 4.193 16.805 ( -0.061 3.298 -2.588) 4.193 18.555 ( -2.372 -0.829 3.704) 4.475 18.555 ( -2.372 0.829 3.704) 4.475 19.469 ( -1.160 -1.144 -0.794) 1.812 19.469 ( -1.160 1.144 -0.794) 1.812 22.812 ( -2.882 -13.906 -0.524) 14.211 22.812 ( -2.882 13.906 -0.524) 14.211 23.696 ( -0.153 -16.375 0.062) 16.376 23.696 ( -0.153 16.375 0.062) 16.376 ======================= Grid point 54 (30/130) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 65 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.906 ( 0.000 -6.036 0.000) 6.036 2.906 ( 0.000 6.036 0.000) 6.036 3.325 ( 0.000 -4.691 -0.000) 4.691 3.325 ( 0.000 4.691 0.000) 4.691 3.902 ( 0.000 -0.737 -0.000) 0.737 3.902 ( 0.000 0.737 -0.000) 0.737 3.950 ( -0.000 -9.727 0.000) 9.727 3.950 ( -0.000 9.727 0.000) 9.727 4.258 ( 0.000 -7.590 0.000) 7.590 4.258 ( 0.000 7.590 0.000) 7.590 4.887 ( 0.000 -18.977 0.000) 18.977 4.887 ( 0.000 18.977 0.000) 18.977 5.398 ( 0.000 -14.531 0.000) 14.531 5.398 ( 0.000 14.531 0.000) 14.531 5.852 ( 0.000 -2.426 0.000) 2.426 5.852 ( 0.000 2.426 0.000) 2.426 6.014 ( 0.000 -6.490 0.000) 6.490 6.014 ( 0.000 6.490 0.000) 6.490 6.625 ( 0.000 -11.835 0.000) 11.835 6.625 ( 0.000 11.835 0.000) 11.835 7.180 ( 0.000 -11.802 -0.000) 11.802 7.180 ( 0.000 11.802 0.000) 11.802 8.090 ( -0.000 -8.429 0.000) 8.429 8.090 ( -0.000 8.429 0.000) 8.429 8.179 ( 0.000 -3.341 -0.000) 3.341 8.179 ( 0.000 3.341 -0.000) 3.341 8.484 ( 0.000 -12.717 0.000) 12.717 8.484 ( 0.000 12.717 0.000) 12.717 8.911 ( 0.000 -9.379 -0.000) 9.379 8.911 ( 0.000 9.379 -0.000) 9.379 9.015 ( 0.000 -26.491 -0.000) 26.491 9.015 ( 0.000 26.491 -0.000) 26.491 9.411 ( 0.000 -7.792 0.000) 7.792 9.411 ( 0.000 7.792 0.000) 7.792 9.973 ( 0.000 -2.209 0.000) 2.209 9.973 ( 0.000 2.209 0.000) 2.209 10.073 ( 0.000 -6.736 -0.000) 6.736 10.073 ( 0.000 6.736 -0.000) 6.736 10.196 ( 0.000 -2.968 0.000) 2.968 10.196 ( -0.000 2.968 0.000) 2.968 10.978 ( 0.000 -8.905 0.000) 8.905 10.978 ( 0.000 8.905 0.000) 8.905 11.295 ( 0.000 -1.341 -0.000) 1.341 11.295 ( 0.000 1.341 -0.000) 1.341 11.563 ( 0.000 -4.133 -0.000) 4.133 11.563 ( 0.000 4.133 -0.000) 4.133 11.652 ( 0.000 -9.790 0.000) 9.790 11.652 ( 0.000 9.790 0.000) 9.790 11.766 ( 0.000 -10.141 0.000) 10.141 11.766 ( 0.000 10.141 0.000) 10.141 11.786 ( 0.000 -4.644 0.000) 4.644 11.786 ( 0.000 4.644 0.000) 4.644 12.277 ( 0.000 -3.370 -0.000) 3.370 12.277 ( 0.000 3.370 -0.000) 3.370 12.531 ( 0.000 -2.088 0.000) 2.088 12.531 ( 0.000 2.088 0.000) 2.088 12.916 ( 0.000 -9.375 -0.000) 9.375 12.916 ( 0.000 9.375 -0.000) 9.375 13.107 ( 0.000 -9.427 0.000) 9.427 13.107 ( 0.000 9.427 0.000) 9.427 13.139 ( 0.000 -4.134 0.000) 4.134 13.139 ( 0.000 4.134 0.000) 4.134 13.561 ( 0.000 -1.839 0.000) 1.839 13.561 ( 0.000 1.839 0.000) 1.839 13.961 ( 0.000 -2.302 -0.000) 2.302 13.961 ( 0.000 2.302 -0.000) 2.302 14.150 ( 0.000 -6.176 0.000) 6.176 14.150 ( 0.000 6.176 0.000) 6.176 14.599 ( 0.000 -8.978 -0.000) 8.978 14.599 ( 0.000 8.978 -0.000) 8.978 14.692 ( 0.000 -1.082 0.000) 1.082 14.692 ( 0.000 1.082 0.000) 1.082 14.893 ( 0.000 -8.197 0.000) 8.197 14.893 ( 0.000 8.197 0.000) 8.197 15.449 ( 0.000 -1.319 0.000) 1.319 15.449 ( 0.000 1.319 0.000) 1.319 15.820 ( 0.000 -3.640 -0.000) 3.640 15.820 ( 0.000 3.640 0.000) 3.640 16.684 ( 0.000 -10.285 0.000) 10.285 16.684 ( 0.000 10.285 0.000) 10.285 16.796 ( 0.000 -2.727 0.000) 2.727 16.796 ( 0.000 2.727 -0.000) 2.727 18.545 ( 0.000 -1.223 -0.000) 1.223 18.545 ( 0.000 1.223 -0.000) 1.223 19.453 ( 0.000 -1.205 0.000) 1.205 19.453 ( 0.000 1.205 0.000) 1.205 22.781 ( 0.000 -15.269 0.000) 15.269 22.781 ( 0.000 15.269 0.000) 15.269 23.696 ( 0.000 -17.883 0.000) 17.883 23.696 ( 0.000 17.883 0.000) 17.883 ======================= Grid point 99 (31/130) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.709 ( -3.225 0.000 34.619) 34.769 0.776 ( -2.375 0.000 34.131) 34.214 1.352 ( 10.525 0.000 56.819) 57.786 1.475 ( 9.443 0.000 13.524) 16.495 2.860 ( -0.556 0.000 -25.888) 25.894 3.024 ( 3.939 0.000 -5.469) 6.740 3.211 ( 0.403 0.000 -4.238) 4.257 3.922 ( -4.386 0.000 14.407) 15.060 4.287 ( -8.182 0.000 -21.064) 22.598 4.446 ( -3.376 0.000 -4.550) 5.666 4.527 ( 5.013 0.000 -0.214) 5.017 4.654 ( -2.563 0.000 -3.686) 4.490 5.139 ( 4.601 0.000 8.147) 9.356 5.394 ( -1.773 0.000 12.220) 12.348 5.470 ( -1.958 0.000 12.939) 13.086 5.633 ( -2.644 0.000 -0.304) 2.661 6.325 ( -3.145 0.000 8.309) 8.884 6.530 ( 2.493 0.000 -6.789) 7.232 6.679 ( 0.008 0.000 2.961) 2.961 6.833 ( 8.521 0.000 -16.898) 18.925 6.990 ( -2.450 0.000 -4.691) 5.292 7.120 ( 65.879 0.000 4.734) 66.049 7.364 ( -16.487 0.000 4.693) 17.142 7.552 ( 4.973 0.000 -22.853) 23.388 7.792 ( 0.368 0.000 0.664) 0.759 8.226 ( -35.592 0.000 2.317) 35.667 8.343 ( -2.088 0.000 -2.668) 3.387 8.550 ( -0.937 0.000 5.684) 5.760 8.613 ( -1.755 0.000 -2.776) 3.284 8.849 ( 10.348 0.000 -16.276) 19.287 9.025 ( 0.379 0.000 -3.993) 4.011 9.151 ( 3.788 0.000 -5.891) 7.004 9.477 ( 2.741 0.000 17.457) 17.671 9.777 ( -12.329 0.000 9.377) 15.489 9.801 ( -9.740 0.000 6.225) 11.559 10.057 ( -8.938 0.000 5.141) 10.311 10.090 ( -0.078 0.000 -0.142) 0.162 10.150 ( -4.977 0.000 3.430) 6.044 10.162 ( -0.954 0.000 4.315) 4.419 10.353 ( -2.013 0.000 -2.719) 3.382 10.526 ( 7.633 0.000 -11.398) 13.718 10.692 ( 4.219 0.000 2.227) 4.770 10.894 ( -2.799 0.000 -2.118) 3.510 11.190 ( -4.188 0.000 3.140) 5.234 11.502 ( 4.804 0.000 -9.246) 10.420 11.581 ( 0.339 0.000 -20.155) 20.158 11.641 ( -2.649 0.000 -5.310) 5.934 11.659 ( 11.633 0.000 -3.780) 12.232 11.770 ( 1.350 0.000 1.569) 2.069 11.903 ( -5.936 0.000 -2.213) 6.335 12.038 ( -4.904 0.000 10.457) 11.550 12.205 ( 0.342 0.000 2.471) 2.494 12.249 ( 0.847 0.000 6.457) 6.513 12.407 ( 1.713 0.000 -1.351) 2.182 12.560 ( -0.985 0.000 7.305) 7.371 12.731 ( 0.044 0.000 1.506) 1.506 12.732 ( -0.890 0.000 5.417) 5.489 12.849 ( -3.553 0.000 -0.038) 3.553 12.962 ( 3.851 0.000 21.513) 21.855 13.255 ( 2.717 0.000 0.396) 2.746 13.522 ( -1.167 0.000 -5.091) 5.223 13.562 ( -2.163 0.000 -2.411) 3.239 13.590 ( -4.243 0.000 0.838) 4.325 13.762 ( -0.341 0.000 3.407) 3.424 13.908 ( 0.212 0.000 -0.469) 0.515 14.093 ( 2.678 0.000 -9.939) 10.294 14.124 ( 11.575 0.000 -11.588) 16.379 14.280 ( -5.467 0.000 1.649) 5.711 14.305 ( 9.013 0.000 -0.200) 9.015 14.374 ( -2.125 0.000 -10.969) 11.173 14.685 ( -15.284 0.000 13.504) 20.395 15.048 ( 3.859 0.000 0.143) 3.862 15.192 ( 1.952 0.000 -1.088) 2.235 15.284 ( 51.758 0.000 -1.670) 51.785 15.529 ( -2.974 0.000 4.859) 5.697 15.835 ( 0.888 0.000 0.915) 1.275 15.946 ( -0.928 0.000 1.922) 2.135 16.077 ( 18.017 0.000 -6.393) 19.118 16.252 ( -8.808 0.000 3.890) 9.629 16.550 ( 0.588 0.000 0.804) 0.996 18.271 ( 8.737 0.000 -5.985) 10.591 18.455 ( -1.255 0.000 -8.777) 8.866 18.973 ( 0.127 0.000 0.398) 0.418 18.987 ( 0.146 0.000 0.416) 0.441 19.401 ( 2.763 0.000 5.698) 6.333 19.449 ( -3.969 0.000 4.299) 5.851 21.098 ( -88.724 0.000 2.376) 88.756 21.285 ( 9.890 0.000 -1.675) 10.031 24.634 ( 30.666 0.000 1.116) 30.686 24.724 ( -5.978 0.000 -0.888) 6.043 ======================= Grid point 100 (32/130) ======================= q-point: ( 0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.121 ( 19.394 0.000 26.260) 32.646 1.125 ( 14.600 0.000 20.360) 25.054 1.795 ( 17.804 0.000 6.974) 19.121 2.271 ( 35.881 0.000 50.469) 61.924 2.702 ( 1.886 0.000 -22.667) 22.745 3.052 ( 4.151 0.000 -10.292) 11.097 3.208 ( 2.337 0.000 -3.445) 4.163 3.863 ( -5.829 0.000 -9.027) 10.745 4.073 ( -1.712 0.000 -4.552) 4.864 4.310 ( -6.914 0.000 -2.869) 7.486 4.544 ( -5.638 0.000 -5.627) 7.966 4.585 ( 1.237 0.000 1.133) 1.678 5.241 ( -4.534 0.000 14.273) 14.976 5.366 ( -5.734 0.000 -3.207) 6.570 5.512 ( 1.199 0.000 10.042) 10.114 5.704 ( 5.358 0.000 10.959) 12.199 6.379 ( 0.574 0.000 13.731) 13.743 6.561 ( 5.494 0.000 -7.186) 9.046 6.702 ( 0.425 0.000 2.535) 2.570 6.830 ( -8.130 0.000 -7.126) 10.811 6.920 ( 10.266 0.000 -20.728) 23.132 7.207 ( 2.556 0.000 -4.499) 5.174 7.325 ( -9.962 0.000 -20.763) 23.029 7.512 ( -9.980 0.000 16.141) 18.977 7.843 ( 3.737 0.000 1.054) 3.883 8.246 ( -5.126 0.000 -2.763) 5.823 8.429 ( 11.456 0.000 -12.276) 16.791 8.478 ( -9.802 0.000 5.225) 11.108 8.563 ( 19.395 0.000 -15.685) 24.944 8.949 ( 7.467 0.000 -9.283) 11.913 9.045 ( 4.098 0.000 -1.036) 4.227 9.291 ( 11.558 0.000 -4.221) 12.305 9.600 ( -1.522 0.000 5.651) 5.853 9.660 ( -6.322 0.000 0.539) 6.344 9.751 ( 1.468 0.000 19.966) 20.020 9.951 ( -7.123 0.000 10.692) 12.847 10.088 ( -0.005 0.000 -0.487) 0.487 10.224 ( 6.980 0.000 3.338) 7.737 10.274 ( 6.870 0.000 3.787) 7.844 10.287 ( -2.569 0.000 -3.231) 4.128 10.575 ( 4.164 0.000 -8.711) 9.655 10.746 ( -1.218 0.000 4.418) 4.583 10.784 ( -5.175 0.000 -4.478) 6.843 11.093 ( -7.454 0.000 0.723) 7.489 11.391 ( -10.240 0.000 -14.170) 17.483 11.462 ( -2.020 0.000 -6.565) 6.869 11.466 ( -3.886 0.000 -17.660) 18.083 11.759 ( -6.891 0.000 -0.421) 6.904 11.796 ( -1.516 0.000 5.294) 5.507 11.837 ( 7.982 0.000 -1.658) 8.152 11.996 ( -5.970 0.000 6.467) 8.801 12.177 ( -2.037 0.000 3.264) 3.848 12.387 ( 3.066 0.000 13.312) 13.660 12.398 ( -0.625 0.000 0.493) 0.796 12.667 ( 4.409 0.000 9.577) 10.543 12.701 ( -5.653 0.000 -0.494) 5.675 12.754 ( -1.911 0.000 -0.759) 2.056 12.766 ( 2.464 0.000 1.893) 3.107 13.221 ( 5.404 0.000 25.334) 25.904 13.303 ( 0.244 0.000 -3.491) 3.500 13.413 ( -6.005 0.000 -7.251) 9.415 13.496 ( -6.196 0.000 0.153) 6.197 13.591 ( 6.038 0.000 1.251) 6.166 13.755 ( -2.165 0.000 2.784) 3.526 13.869 ( -4.712 0.000 -2.348) 5.265 14.069 ( 4.173 0.000 -8.330) 9.317 14.166 ( -5.177 0.000 -10.967) 12.128 14.239 ( 9.028 0.000 -11.581) 14.684 14.265 ( -0.248 0.000 -7.379) 7.384 14.516 ( -8.445 0.000 9.071) 12.393 14.564 ( 13.578 0.000 2.622) 13.829 14.940 ( -7.013 0.000 -1.197) 7.115 15.239 ( 2.945 0.000 1.266) 3.206 15.461 ( -7.244 0.000 4.112) 8.329 15.648 ( 2.901 0.000 -4.308) 5.194 15.885 ( -7.518 0.000 3.085) 8.127 15.888 ( 2.423 0.000 2.066) 3.184 16.143 ( -2.260 0.000 -2.501) 3.371 16.451 ( 9.415 0.000 -11.318) 14.722 16.593 ( 10.851 0.000 -6.216) 12.506 17.640 ( -48.922 0.000 27.624) 56.182 18.309 ( -5.866 0.000 -13.698) 14.901 18.977 ( 0.048 0.000 0.290) 0.294 18.994 ( 0.758 0.000 0.043) 0.759 19.316 ( -14.300 0.000 9.624) 17.237 19.402 ( -1.705 0.000 0.704) 1.845 20.832 ( 20.482 0.000 -2.645) 20.652 21.680 ( 25.660 0.000 8.618) 27.069 24.501 ( -14.286 0.000 -6.723) 15.789 24.811 ( -2.195 0.000 3.824) 4.409 ======================= Grid point 101 (33/130) ======================= q-point: ( 0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.503 ( 14.740 0.000 4.451) 15.398 1.691 ( 23.583 0.000 17.040) 29.095 2.162 ( 17.126 0.000 0.678) 17.139 2.600 ( 2.811 0.000 -22.455) 22.631 3.016 ( -1.466 0.000 -6.230) 6.400 3.207 ( 17.235 0.000 8.376) 19.163 3.341 ( 24.629 0.000 28.361) 37.562 3.733 ( 5.064 0.000 -17.742) 18.451 4.086 ( 1.163 0.000 5.923) 6.036 4.168 ( -7.349 0.000 1.567) 7.514 4.374 ( -7.548 0.000 -5.851) 9.550 4.593 ( -1.553 0.000 1.659) 2.273 5.116 ( -17.870 0.000 16.391) 24.249 5.193 ( -7.089 0.000 -9.291) 11.687 5.711 ( 11.043 0.000 8.324) 13.829 5.884 ( 4.432 0.000 10.938) 11.802 6.525 ( 5.195 0.000 8.401) 9.878 6.550 ( -12.254 0.000 -9.061) 15.240 6.596 ( 1.075 0.000 -8.790) 8.855 6.741 ( 2.143 0.000 1.560) 2.650 6.961 ( -12.853 0.000 -6.692) 14.491 7.018 ( 14.469 0.000 -21.470) 25.891 7.313 ( 10.763 0.000 -10.554) 15.074 7.504 ( -1.619 0.000 11.347) 11.462 7.947 ( 7.288 0.000 -0.935) 7.348 8.121 ( -6.963 0.000 -0.698) 6.998 8.282 ( -12.823 0.000 2.076) 12.990 8.316 ( -4.333 0.000 -9.599) 10.532 8.816 ( 7.985 0.000 -5.992) 9.983 8.964 ( -3.165 0.000 4.976) 5.897 9.157 ( 6.162 0.000 1.732) 6.401 9.469 ( 9.640 0.000 -4.186) 10.510 9.571 ( -5.952 0.000 11.154) 12.643 9.610 ( 2.718 0.000 -4.681) 5.412 9.832 ( -3.788 0.000 1.587) 4.107 10.061 ( 10.721 0.000 10.818) 15.230 10.080 ( -0.368 0.000 -1.153) 1.211 10.218 ( -2.436 0.000 -2.209) 3.289 10.315 ( -0.379 0.000 1.711) 1.753 10.533 ( -3.126 0.000 -7.716) 8.325 10.537 ( 14.997 0.000 5.125) 15.849 10.701 ( -7.352 0.000 4.873) 8.820 10.705 ( 2.796 0.000 -3.852) 4.760 10.912 ( -10.430 0.000 -4.504) 11.361 11.051 ( -14.140 0.000 -5.823) 15.292 11.328 ( 2.072 0.000 -17.376) 17.499 11.370 ( -3.574 0.000 -2.953) 4.636 11.648 ( -4.641 0.000 0.232) 4.646 11.763 ( -4.839 0.000 2.859) 5.621 11.873 ( -6.855 0.000 0.882) 6.911 11.943 ( 0.103 0.000 2.487) 2.489 12.181 ( -0.654 0.000 4.198) 4.249 12.405 ( 0.277 0.000 0.210) 0.348 12.495 ( -1.198 0.000 10.580) 10.647 12.591 ( -4.218 0.000 -0.921) 4.318 12.724 ( -2.782 0.000 2.305) 3.613 12.773 ( 0.874 0.000 5.442) 5.512 12.887 ( 6.117 0.000 7.295) 9.520 13.218 ( -9.368 0.000 -4.808) 10.530 13.227 ( -4.130 0.000 -1.634) 4.441 13.348 ( -8.175 0.000 -2.038) 8.425 13.530 ( 7.388 0.000 9.101) 11.722 13.585 ( -6.281 0.000 15.015) 16.276 13.700 ( -8.263 0.000 -7.615) 11.237 13.875 ( 11.719 0.000 1.600) 11.828 13.961 ( -6.624 0.000 -10.287) 12.235 14.151 ( 8.496 0.000 -7.560) 11.372 14.266 ( 5.735 0.000 -7.544) 9.476 14.322 ( 6.151 0.000 -5.235) 8.077 14.446 ( 0.146 0.000 -4.442) 4.445 14.814 ( -5.829 0.000 1.740) 6.083 14.839 ( 12.778 0.000 -1.063) 12.822 15.317 ( 1.259 0.000 5.242) 5.391 15.338 ( -7.197 0.000 6.681) 9.820 15.631 ( -2.652 0.000 2.267) 3.488 15.751 ( -7.016 0.000 1.444) 7.163 15.932 ( -0.689 0.000 4.161) 4.217 16.105 ( -0.228 0.000 -4.433) 4.439 16.387 ( -8.044 0.000 1.113) 8.121 16.686 ( 1.777 0.000 -5.908) 6.170 17.241 ( -9.185 0.000 8.346) 12.410 18.061 ( -7.687 0.000 -18.557) 20.086 18.976 ( -1.145 0.000 0.914) 1.465 19.010 ( 0.891 0.000 -0.189) 0.911 19.093 ( -15.523 0.000 13.001) 20.248 19.365 ( -2.225 0.000 -0.926) 2.410 21.181 ( 17.128 0.000 -5.112) 17.875 22.246 ( 22.309 0.000 16.616) 27.817 24.121 ( -17.650 0.000 -12.184) 21.448 24.768 ( -4.879 0.000 5.408) 7.283 ======================= Grid point 102 (34/130) ======================= q-point: ( 0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.737 ( 10.526 0.000 -3.653) 11.142 2.225 ( 22.526 0.000 8.877) 24.212 2.444 ( 14.082 0.000 -3.424) 14.492 2.477 ( 1.202 0.000 -20.576) 20.611 2.990 ( 0.417 0.000 4.269) 4.289 3.367 ( 7.550 0.000 0.083) 7.550 3.761 ( 5.404 0.000 -10.180) 11.525 3.959 ( -6.206 0.000 11.178) 12.785 4.183 ( -2.810 0.000 -0.678) 2.891 4.222 ( 4.579 0.000 -1.178) 4.729 4.231 ( 23.409 0.000 24.811) 34.111 4.546 ( -3.783 0.000 -0.035) 3.783 4.852 ( -20.526 0.000 16.088) 26.079 4.980 ( -7.004 0.000 -13.595) 15.294 5.979 ( 10.776 0.000 5.851) 12.262 6.005 ( 0.881 0.000 7.332) 7.385 6.289 ( -8.256 0.000 -7.595) 11.218 6.297 ( -14.069 0.000 -16.320) 21.547 6.726 ( 4.905 0.000 12.384) 13.320 6.815 ( 4.360 0.000 1.930) 4.768 6.918 ( 4.976 0.000 2.068) 5.389 7.165 ( 15.191 0.000 -17.929) 23.499 7.396 ( 6.648 0.000 -13.351) 14.915 7.569 ( 2.047 0.000 4.249) 4.716 7.962 ( -10.174 0.000 2.091) 10.386 7.985 ( -11.403 0.000 -1.678) 11.526 8.155 ( 8.790 0.000 -4.033) 9.671 8.191 ( -0.269 0.000 -12.160) 12.163 8.860 ( -1.468 0.000 5.227) 5.429 8.949 ( -4.909 0.000 15.669) 16.420 9.280 ( 4.207 0.000 4.227) 5.963 9.529 ( -4.233 0.000 8.745) 9.715 9.607 ( 5.439 0.000 -1.440) 5.627 9.668 ( 6.539 0.000 -6.580) 9.277 9.763 ( -4.620 0.000 3.877) 6.032 10.054 ( -0.918 0.000 -2.402) 2.571 10.171 ( -1.626 0.000 -0.125) 1.631 10.241 ( -3.995 0.000 0.153) 3.998 10.358 ( 12.546 0.000 2.573) 12.807 10.370 ( -6.995 0.000 -7.315) 10.121 10.515 ( -12.276 0.000 -0.512) 12.287 10.707 ( -7.342 0.000 -1.223) 7.443 10.712 ( 7.132 0.000 -4.674) 8.527 10.810 ( -10.706 0.000 0.761) 10.733 10.927 ( 11.065 0.000 4.835) 12.076 11.309 ( -1.536 0.000 0.704) 1.690 11.312 ( 6.609 0.000 -11.554) 13.311 11.588 ( -2.181 0.000 0.709) 2.293 11.647 ( -7.688 0.000 -0.247) 7.692 11.727 ( -6.630 0.000 -1.210) 6.740 11.940 ( -1.891 0.000 1.021) 2.149 12.196 ( -0.685 0.000 2.841) 2.922 12.374 ( -1.844 0.000 -5.293) 5.605 12.481 ( -5.222 0.000 3.618) 6.352 12.533 ( -3.078 0.000 2.986) 4.289 12.665 ( -4.708 0.000 1.598) 4.971 12.792 ( -2.315 0.000 1.699) 2.872 12.958 ( -7.398 0.000 3.685) 8.265 13.066 ( -0.156 0.000 0.521) 0.544 13.139 ( -4.141 0.000 -1.877) 4.547 13.247 ( -0.957 0.000 3.561) 3.687 13.401 ( -8.546 0.000 4.516) 9.666 13.460 ( -9.399 0.000 -11.833) 15.112 13.821 ( -3.574 0.000 -1.986) 4.088 13.874 ( 8.048 0.000 16.144) 18.039 14.096 ( 9.485 0.000 0.189) 9.487 14.241 ( 6.896 0.000 -6.518) 9.489 14.352 ( -2.372 0.000 0.280) 2.389 14.395 ( 11.995 0.000 -6.907) 13.841 14.527 ( 16.988 0.000 -13.333) 21.595 14.751 ( -3.661 0.000 5.635) 6.720 15.014 ( 7.448 0.000 -3.734) 8.331 15.236 ( -7.822 0.000 12.264) 14.546 15.415 ( 2.768 0.000 3.801) 4.702 15.602 ( -2.700 0.000 4.940) 5.630 15.658 ( -4.010 0.000 2.186) 4.567 15.896 ( -6.606 0.000 4.442) 7.961 16.059 ( -1.695 0.000 -3.374) 3.776 16.200 ( -11.955 0.000 2.506) 12.215 16.689 ( 5.001 0.000 -8.632) 9.976 17.221 ( 1.373 0.000 -1.560) 2.078 17.794 ( -5.680 0.000 -19.540) 20.348 18.860 ( -14.028 0.000 13.189) 19.254 19.012 ( -0.567 0.000 1.765) 1.854 19.024 ( 0.806 0.000 -0.217) 0.834 19.310 ( -1.956 0.000 -2.818) 3.430 21.412 ( 9.722 0.000 -0.474) 9.734 22.690 ( 10.758 0.000 16.485) 19.685 23.724 ( -12.915 0.000 -12.776) 18.166 24.706 ( -4.456 0.000 2.240) 4.988 ======================= Grid point 103 (35/130) ======================= q-point: ( 0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.904 ( 8.836 0.000 1.494) 8.961 2.452 ( 7.101 0.000 -4.504) 8.409 2.571 ( 10.517 0.000 -3.712) 11.153 2.753 ( 19.959 0.000 3.658) 20.291 3.049 ( 0.370 0.000 6.285) 6.296 3.485 ( 3.411 0.000 -1.157) 3.601 3.755 ( -17.967 0.000 9.439) 20.296 3.756 ( 0.771 0.000 -8.039) 8.076 4.073 ( -3.532 0.000 -0.055) 3.533 4.403 ( 9.006 0.000 -0.994) 9.061 4.466 ( -3.422 0.000 -2.185) 4.060 4.603 ( -15.871 0.000 14.620) 21.579 4.724 ( -6.670 0.000 -16.327) 17.637 4.840 ( 16.618 0.000 21.397) 27.092 5.890 ( -6.025 0.000 -17.160) 18.187 6.121 ( -4.562 0.000 13.443) 14.196 6.139 ( 0.032 0.000 -5.700) 5.700 6.177 ( 2.982 0.000 4.671) 5.542 6.849 ( -0.349 0.000 6.771) 6.780 6.921 ( 4.165 0.000 2.750) 4.991 7.064 ( 10.220 0.000 -2.232) 10.461 7.323 ( 9.572 0.000 -8.957) 13.109 7.452 ( 11.975 0.000 -13.014) 17.685 7.586 ( -5.815 0.000 3.352) 6.712 7.731 ( -11.027 0.000 -1.785) 11.170 7.806 ( -5.091 0.000 0.549) 5.120 8.150 ( 4.560 0.000 -10.619) 11.557 8.288 ( 6.864 0.000 -8.454) 10.889 8.859 ( -4.186 0.000 10.715) 11.503 8.996 ( -3.751 0.000 17.930) 18.318 9.359 ( 0.607 0.000 4.689) 4.728 9.513 ( -3.547 0.000 7.360) 8.170 9.668 ( 1.303 0.000 0.066) 1.304 9.727 ( -1.248 0.000 2.145) 2.481 9.753 ( 6.771 0.000 -5.267) 8.578 10.022 ( -0.083 0.000 -3.250) 3.251 10.139 ( -2.342 0.000 0.937) 2.522 10.163 ( -2.784 0.000 -0.238) 2.794 10.247 ( -0.504 0.000 -2.397) 2.449 10.323 ( -6.597 0.000 0.178) 6.599 10.592 ( -6.020 0.000 2.997) 6.725 10.603 ( 11.653 0.000 -2.181) 11.856 10.647 ( -6.760 0.000 1.709) 6.972 10.812 ( 6.895 0.000 -5.383) 8.747 11.007 ( -2.147 0.000 0.651) 2.243 11.226 ( -10.538 0.000 1.135) 10.599 11.403 ( 9.647 0.000 -8.228) 12.680 11.566 ( -0.936 0.000 1.037) 1.397 11.594 ( -5.854 0.000 -4.878) 7.620 11.619 ( 4.546 0.000 3.093) 5.499 11.896 ( -2.237 0.000 -1.024) 2.461 12.186 ( -1.732 0.000 0.448) 1.789 12.288 ( -1.186 0.000 -8.976) 9.054 12.327 ( -12.859 0.000 3.659) 13.370 12.520 ( -0.406 0.000 3.124) 3.150 12.606 ( -1.384 0.000 -0.668) 1.537 12.728 ( -2.702 0.000 -0.755) 2.805 12.845 ( -5.034 0.000 -0.541) 5.063 13.039 ( -2.777 0.000 -6.407) 6.983 13.085 ( 1.058 0.000 -4.726) 4.843 13.203 ( -4.246 0.000 -2.996) 5.196 13.344 ( -3.570 0.000 10.338) 10.937 13.350 ( 0.245 0.000 10.705) 10.707 13.772 ( -1.696 0.000 0.656) 1.818 14.032 ( 1.872 0.000 0.920) 2.086 14.174 ( -2.279 0.000 -1.952) 3.001 14.306 ( 2.437 0.000 -6.662) 7.093 14.362 ( 7.840 0.000 1.788) 8.041 14.572 ( 11.002 0.000 -8.204) 13.725 14.738 ( -2.900 0.000 7.551) 8.089 14.856 ( 19.961 0.000 0.027) 19.961 15.087 ( 2.590 0.000 -0.387) 2.619 15.210 ( -3.591 0.000 11.161) 11.725 15.452 ( -0.631 0.000 -0.394) 0.744 15.604 ( -1.149 0.000 6.258) 6.363 15.624 ( -3.376 0.000 7.190) 7.943 15.756 ( -8.326 0.000 -0.341) 8.333 16.003 ( -10.759 0.000 3.910) 11.448 16.005 ( -1.569 0.000 -1.776) 2.369 16.743 ( 8.291 0.000 -14.031) 16.298 17.216 ( -0.870 0.000 -2.846) 2.976 17.602 ( -0.132 0.000 -18.389) 18.389 18.708 ( -11.407 0.000 13.708) 17.833 19.019 ( 0.122 0.000 0.683) 0.694 19.036 ( 0.515 0.000 -0.181) 0.546 19.263 ( -0.088 0.000 -4.183) 4.184 21.561 ( 5.084 0.000 4.319) 6.671 22.806 ( -4.840 0.000 -1.203) 4.987 23.562 ( 1.116 0.000 3.017) 3.217 24.630 ( -3.589 0.000 -2.130) 4.174 ======================= Grid point 104 (36/130) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.085 ( 4.841 0.000 9.233) 10.425 2.659 ( 1.469 0.000 -4.085) 4.341 2.695 ( 14.103 0.000 13.073) 19.230 3.061 ( -2.980 0.000 5.451) 6.212 3.122 ( 11.840 0.000 1.518) 11.937 3.331 ( -16.448 0.000 2.306) 16.608 3.567 ( -4.760 0.000 0.451) 4.781 3.688 ( -0.992 0.000 -10.446) 10.493 4.074 ( 2.694 0.000 3.049) 4.069 4.388 ( -6.206 0.000 -10.564) 12.252 4.421 ( -7.865 0.000 -10.431) 13.064 4.478 ( -7.080 0.000 13.399) 15.155 4.503 ( 2.393 0.000 -1.802) 2.996 5.225 ( 8.527 0.000 18.271) 20.163 5.778 ( 7.642 0.000 -15.982) 17.715 6.066 ( -3.505 0.000 -7.834) 8.582 6.127 ( -5.652 0.000 14.352) 15.425 6.283 ( 4.119 0.000 7.646) 8.685 6.799 ( -6.749 0.000 0.190) 6.752 6.958 ( -2.997 0.000 2.095) 3.656 7.257 ( 10.776 0.000 -5.192) 11.962 7.397 ( 4.334 0.000 -6.625) 7.917 7.411 ( -11.806 0.000 5.596) 13.065 7.617 ( 4.316 0.000 -0.730) 4.377 7.694 ( 15.300 0.000 -4.566) 15.967 7.728 ( -4.395 0.000 -4.974) 6.638 8.230 ( 9.593 0.000 -6.434) 11.551 8.285 ( -0.268 0.000 -9.640) 9.644 8.861 ( -4.341 0.000 14.219) 14.867 8.980 ( -10.190 0.000 13.249) 16.714 9.366 ( -2.708 0.000 3.827) 4.688 9.471 ( -5.753 0.000 4.226) 7.138 9.674 ( -1.014 0.000 3.230) 3.385 9.724 ( 0.034 0.000 -1.406) 1.406 9.846 ( 5.008 0.000 -0.899) 5.088 10.028 ( 2.715 0.000 -2.853) 3.938 10.127 ( -0.547 0.000 2.416) 2.478 10.148 ( 0.966 0.000 0.744) 1.220 10.278 ( 5.222 0.000 -0.614) 5.258 10.324 ( 3.864 0.000 5.612) 6.814 10.504 ( -4.998 0.000 3.364) 6.025 10.610 ( 1.251 0.000 4.586) 4.753 10.716 ( 1.838 0.000 -5.768) 6.054 10.893 ( 4.836 0.000 -4.393) 6.533 10.953 ( -2.617 0.000 -8.015) 8.431 11.042 ( -5.040 0.000 4.094) 6.493 11.423 ( -5.020 0.000 -13.282) 14.199 11.546 ( 9.236 0.000 -7.037) 11.611 11.563 ( 1.297 0.000 0.523) 1.398 11.749 ( 3.182 0.000 9.951) 10.447 11.867 ( 0.546 0.000 -1.638) 1.727 12.095 ( -9.903 0.000 5.162) 11.167 12.168 ( -2.448 0.000 -1.859) 3.074 12.221 ( 0.626 0.000 -8.972) 8.994 12.555 ( 1.693 0.000 3.091) 3.524 12.592 ( 0.013 0.000 -0.123) 0.124 12.661 ( -3.734 0.000 -5.276) 6.464 12.743 ( -1.393 0.000 -3.165) 3.458 12.957 ( -0.079 0.000 -10.220) 10.220 13.051 ( 0.444 0.000 -6.583) 6.598 13.277 ( 8.713 0.000 7.153) 11.273 13.362 ( -3.480 0.000 10.422) 10.987 13.439 ( -0.262 0.000 14.065) 14.067 13.753 ( -0.912 0.000 0.724) 1.164 13.915 ( -8.235 0.000 -8.725) 11.998 14.122 ( -0.677 0.000 -3.011) 3.086 14.305 ( 0.550 0.000 -6.715) 6.737 14.548 ( 7.235 0.000 7.768) 10.616 14.653 ( 2.885 0.000 -8.049) 8.550 14.734 ( -3.474 0.000 8.466) 9.151 15.117 ( 1.086 0.000 4.153) 4.292 15.190 ( 7.396 0.000 1.462) 7.539 15.265 ( 4.582 0.000 12.168) 13.002 15.377 ( -5.022 0.000 -5.506) 7.452 15.601 ( -6.547 0.000 11.551) 13.277 15.612 ( -1.537 0.000 -4.843) 5.081 15.655 ( -1.803 0.000 6.009) 6.274 15.857 ( -6.064 0.000 3.901) 7.211 16.003 ( 2.831 0.000 -0.120) 2.833 16.790 ( 7.406 0.000 -16.742) 18.307 17.141 ( -4.041 0.000 -4.305) 5.904 17.554 ( 8.413 0.000 -17.335) 19.269 18.624 ( -7.203 0.000 13.460) 15.266 19.021 ( -0.267 0.000 0.405) 0.485 19.037 ( -0.209 0.000 -0.475) 0.519 19.258 ( 2.589 0.000 -4.000) 4.765 21.681 ( 2.877 0.000 9.451) 9.879 22.591 ( -9.351 0.000 -13.937) 16.783 23.729 ( 7.524 0.000 14.141) 16.018 24.541 ( -2.656 0.000 -6.615) 7.128 ======================= Grid point 105 (37/130) ======================= q-point: (-0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.127 ( -8.862 0.000 8.135) 12.030 2.531 ( -11.539 0.000 -7.638) 13.838 2.795 ( -29.615 0.000 2.593) 29.728 2.952 ( -1.368 0.000 7.994) 8.111 3.200 ( 13.574 0.000 20.320) 24.437 3.390 ( 2.292 0.000 -4.035) 4.641 3.504 ( 0.529 0.000 -7.500) 7.518 3.591 ( -0.076 0.000 -11.556) 11.556 4.010 ( -15.681 0.000 -5.968) 16.778 4.207 ( 8.181 0.000 4.168) 9.182 4.387 ( 2.097 0.000 -5.285) 5.686 4.424 ( -4.874 0.000 0.644) 4.916 4.586 ( 4.572 0.000 11.926) 12.772 5.437 ( 2.178 0.000 15.471) 15.624 5.874 ( -9.475 0.000 -11.045) 14.552 5.958 ( 21.708 0.000 -16.020) 26.979 6.093 ( -7.677 0.000 11.640) 13.943 6.458 ( 6.926 0.000 11.119) 13.100 6.625 ( -10.518 0.000 -0.521) 10.531 6.861 ( -6.693 0.000 0.870) 6.749 7.166 ( -10.046 0.000 0.454) 10.057 7.410 ( 2.719 0.000 -9.208) 9.601 7.415 ( -3.138 0.000 -4.580) 5.551 7.623 ( 4.845 0.000 -5.639) 7.435 7.744 ( 5.819 0.000 -0.269) 5.825 7.966 ( 9.228 0.000 4.866) 10.433 8.194 ( 4.242 0.000 -14.672) 15.273 8.381 ( 10.053 0.000 -6.333) 11.882 8.828 ( -14.010 0.000 12.951) 19.079 8.904 ( -2.428 0.000 17.306) 17.475 9.322 ( -4.285 0.000 3.359) 5.445 9.357 ( -7.553 0.000 1.805) 7.765 9.695 ( -0.693 0.000 -2.320) 2.421 9.700 ( -0.140 0.000 4.460) 4.463 9.926 ( 1.733 0.000 4.409) 4.737 10.049 ( 1.631 0.000 -2.689) 3.145 10.147 ( 1.440 0.000 1.903) 2.387 10.200 ( 3.294 0.000 1.069) 3.464 10.350 ( 1.563 0.000 -6.158) 6.353 10.441 ( 2.985 0.000 1.222) 3.226 10.579 ( 11.313 0.000 10.336) 15.324 10.607 ( -8.862 0.000 -0.646) 8.886 10.793 ( 11.743 0.000 12.239) 16.961 10.811 ( -3.345 0.000 -11.020) 11.517 10.912 ( -1.262 0.000 -3.665) 3.877 11.087 ( 6.449 0.000 -4.147) 7.668 11.269 ( 1.166 0.000 -15.958) 16.000 11.561 ( -0.001 0.000 0.887) 0.887 11.698 ( 9.693 0.000 -7.547) 12.284 11.834 ( -0.250 0.000 4.589) 4.596 11.904 ( 1.650 0.000 4.839) 5.112 12.007 ( -4.194 0.000 9.148) 10.063 12.128 ( -0.370 0.000 -2.244) 2.274 12.186 ( 1.158 0.000 -6.345) 6.450 12.598 ( 2.032 0.000 -2.936) 3.571 12.625 ( 2.005 0.000 5.080) 5.462 12.646 ( 8.015 0.000 -4.293) 9.093 12.732 ( 1.243 0.000 -0.915) 1.544 12.865 ( -1.448 0.000 -15.509) 15.576 12.994 ( -1.517 0.000 -6.673) 6.843 13.319 ( -4.342 0.000 1.672) 4.653 13.469 ( -0.386 0.000 13.951) 13.956 13.609 ( 11.377 0.000 8.804) 14.385 13.752 ( 1.416 0.000 -0.580) 1.530 13.756 ( -5.005 0.000 3.280) 5.984 14.063 ( -2.138 0.000 -7.014) 7.332 14.217 ( -4.532 0.000 -7.236) 8.538 14.552 ( -4.434 0.000 -8.029) 9.172 14.678 ( -3.552 0.000 5.514) 6.559 14.794 ( 3.661 0.000 15.389) 15.818 15.147 ( 0.861 0.000 -0.068) 0.864 15.178 ( -9.007 0.000 -10.382) 13.744 15.253 ( -2.385 0.000 10.849) 11.108 15.426 ( -6.439 0.000 17.578) 18.720 15.482 ( -7.128 0.000 -10.439) 12.640 15.589 ( 4.073 0.000 4.337) 5.949 15.679 ( 0.552 0.000 4.862) 4.893 15.896 ( 6.808 0.000 1.699) 7.017 16.112 ( 6.698 0.000 3.041) 7.356 16.754 ( -0.970 0.000 -14.823) 14.855 17.054 ( 1.210 0.000 -7.502) 7.599 17.679 ( 17.416 0.000 -18.359) 25.306 18.618 ( -3.633 0.000 14.073) 14.535 19.014 ( -0.704 0.000 0.225) 0.739 19.025 ( -0.471 0.000 -0.740) 0.878 19.297 ( 3.616 0.000 -2.812) 4.581 21.818 ( 2.697 0.000 16.413) 16.633 22.304 ( -9.760 0.000 -16.100) 18.827 23.999 ( 9.889 0.000 15.074) 18.028 24.434 ( -2.282 0.000 -11.355) 11.582 ======================= Grid point 106 (38/130) ======================= q-point: (-0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.851 ( -23.431 0.000 4.425) 23.846 2.126 ( -27.194 0.000 -2.643) 27.323 2.212 ( -26.826 0.000 -10.807) 28.921 2.952 ( -1.780 0.000 3.778) 4.176 3.091 ( -34.315 0.000 -12.132) 36.397 3.344 ( -2.308 0.000 -1.758) 2.901 3.401 ( -1.138 0.000 -7.357) 7.445 3.714 ( 9.719 0.000 19.483) 21.773 3.997 ( 9.129 0.000 5.203) 10.508 4.353 ( -0.830 0.000 1.517) 1.729 4.402 ( 3.481 0.000 -6.134) 7.053 4.418 ( 9.785 0.000 4.521) 10.779 4.816 ( 8.644 0.000 14.218) 16.640 5.544 ( -1.122 0.000 13.247) 13.295 5.573 ( -12.745 0.000 -12.887) 18.125 5.966 ( -11.555 0.000 6.226) 13.126 6.315 ( 23.658 0.000 -18.071) 29.770 6.435 ( -8.540 0.000 3.080) 9.078 6.654 ( 3.826 0.000 7.703) 8.601 6.774 ( -1.563 0.000 3.509) 3.841 7.022 ( -4.010 0.000 -3.404) 5.260 7.169 ( -11.418 0.000 -8.351) 14.145 7.341 ( -2.050 0.000 -14.881) 15.021 7.695 ( -8.243 0.000 0.888) 8.290 7.810 ( 12.050 0.000 0.790) 12.076 8.108 ( 8.018 0.000 2.161) 8.304 8.364 ( 14.523 0.000 -7.739) 16.457 8.505 ( 8.921 0.000 -10.495) 13.774 8.637 ( -14.288 0.000 10.147) 17.525 9.006 ( -0.271 0.000 19.004) 19.006 9.243 ( -5.240 0.000 1.268) 5.391 9.254 ( -5.244 0.000 2.967) 6.025 9.621 ( -4.376 0.000 -2.596) 5.088 9.766 ( 2.483 0.000 4.704) 5.319 9.960 ( -2.825 0.000 8.906) 9.343 10.065 ( 1.215 0.000 -0.404) 1.281 10.216 ( 4.684 0.000 1.470) 4.909 10.249 ( 0.553 0.000 -1.420) 1.524 10.349 ( 5.794 0.000 -12.054) 13.374 10.426 ( -7.987 0.000 -5.262) 9.565 10.483 ( 2.041 0.000 -1.619) 2.605 10.694 ( -2.930 0.000 1.066) 3.118 10.832 ( -2.055 0.000 -3.633) 4.174 10.893 ( 11.473 0.000 10.404) 15.488 11.173 ( 16.530 0.000 15.825) 22.884 11.197 ( 10.043 0.000 -10.037) 14.199 11.257 ( 5.913 0.000 -10.028) 11.642 11.575 ( 0.921 0.000 0.895) 1.285 11.801 ( 7.188 0.000 -9.907) 12.240 11.835 ( 0.356 0.000 -3.958) 3.974 11.952 ( -1.707 0.000 9.370) 9.524 12.043 ( -0.429 0.000 11.087) 11.095 12.138 ( 2.002 0.000 3.100) 3.690 12.180 ( 1.684 0.000 -2.130) 2.715 12.565 ( -2.186 0.000 -18.749) 18.876 12.679 ( 0.776 0.000 1.378) 1.581 12.712 ( 0.019 0.000 -0.825) 0.825 12.747 ( 1.077 0.000 0.239) 1.103 12.886 ( 1.697 0.000 -3.953) 4.301 12.955 ( 13.077 0.000 -0.843) 13.104 13.325 ( 5.784 0.000 -1.023) 5.874 13.526 ( -1.860 0.000 11.247) 11.399 13.719 ( -5.661 0.000 8.739) 10.412 13.747 ( 1.897 0.000 0.977) 2.134 13.919 ( 11.858 0.000 0.824) 11.886 13.940 ( -5.602 0.000 -6.927) 8.909 14.058 ( -5.245 0.000 -8.332) 9.845 14.395 ( -6.304 0.000 -5.711) 8.506 14.612 ( -7.067 0.000 6.279) 9.454 14.886 ( -12.202 0.000 -13.867) 18.471 14.962 ( 2.012 0.000 12.426) 12.588 15.145 ( -1.701 0.000 0.499) 1.773 15.223 ( -10.188 0.000 -13.563) 16.963 15.251 ( -7.059 0.000 10.428) 12.593 15.383 ( -6.089 0.000 17.687) 18.705 15.737 ( 2.377 0.000 2.606) 3.528 15.745 ( 6.214 0.000 4.665) 7.770 16.054 ( 8.854 0.000 -3.904) 9.676 16.264 ( 5.532 0.000 5.425) 7.748 16.573 ( -6.752 0.000 -10.192) 12.226 17.104 ( 8.945 0.000 -7.394) 11.605 17.947 ( 24.933 0.000 -21.551) 32.956 18.674 ( -1.442 0.000 15.708) 15.774 19.001 ( -0.791 0.000 0.320) 0.853 19.011 ( -0.566 0.000 -0.717) 0.913 19.347 ( 3.016 0.000 -1.168) 3.235 21.995 ( -11.615 0.000 -14.964) 18.943 22.034 ( 5.004 0.000 27.315) 27.769 24.285 ( -3.342 0.000 -17.724) 18.037 24.298 ( 11.009 0.000 12.834) 16.909 ======================= Grid point 107 (39/130) ======================= q-point: (-0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.364 ( -30.736 0.000 8.067) 31.777 1.482 ( -36.754 0.000 0.651) 36.760 1.703 ( -18.913 0.000 -11.623) 22.199 2.237 ( -48.974 0.000 2.112) 49.019 2.946 ( 1.049 0.000 -2.472) 2.685 3.274 ( -3.814 0.000 -13.142) 13.684 3.292 ( -1.899 0.000 -2.038) 2.786 3.898 ( -3.864 0.000 17.052) 17.484 4.236 ( 11.216 0.000 3.943) 11.889 4.427 ( 3.374 0.000 -5.878) 6.777 4.470 ( 7.319 0.000 7.173) 10.247 4.625 ( 8.354 0.000 4.747) 9.608 5.019 ( -0.173 0.000 6.192) 6.195 5.290 ( -3.940 0.000 -6.841) 7.894 5.559 ( -7.187 0.000 9.996) 12.312 5.780 ( -8.830 0.000 3.174) 9.384 6.295 ( -8.319 0.000 10.241) 13.194 6.531 ( 7.584 0.000 -16.603) 18.253 6.663 ( -1.538 0.000 1.263) 1.990 6.788 ( -9.499 0.000 -19.216) 21.436 6.860 ( 2.643 0.000 1.862) 3.233 7.155 ( -5.876 0.000 -9.326) 11.022 7.192 ( 15.940 0.000 -4.314) 16.513 7.598 ( -2.386 0.000 1.415) 2.774 8.051 ( 10.601 0.000 6.294) 12.329 8.253 ( -8.887 0.000 6.746) 11.158 8.317 ( -4.029 0.000 4.914) 6.354 8.570 ( 7.396 0.000 -15.485) 17.161 8.647 ( 13.739 0.000 -13.676) 19.386 9.147 ( 1.110 0.000 18.586) 18.619 9.167 ( -4.174 0.000 0.080) 4.175 9.167 ( -5.405 0.000 1.692) 5.663 9.485 ( -7.969 0.000 -3.526) 8.715 9.845 ( 2.209 0.000 4.035) 4.600 9.954 ( -4.896 0.000 10.521) 11.605 10.085 ( 0.373 0.000 1.350) 1.400 10.188 ( -3.608 0.000 -3.714) 5.178 10.242 ( -6.218 0.000 -6.525) 9.013 10.330 ( 5.208 0.000 1.020) 5.307 10.397 ( 8.084 0.000 -12.102) 14.554 10.504 ( 3.126 0.000 -5.296) 6.150 10.773 ( 5.922 0.000 8.405) 10.281 10.848 ( 3.833 0.000 6.065) 7.174 11.116 ( 4.912 0.000 8.550) 9.861 11.301 ( 5.242 0.000 -12.552) 13.602 11.323 ( 11.269 0.000 -12.222) 16.624 11.561 ( 11.116 0.000 9.986) 14.943 11.611 ( 2.784 0.000 0.756) 2.885 11.796 ( -0.050 0.000 -7.048) 7.048 11.858 ( 7.137 0.000 -7.286) 10.199 11.987 ( -2.985 0.000 15.079) 15.371 12.097 ( 1.877 0.000 1.598) 2.465 12.221 ( 3.021 0.000 0.335) 3.040 12.235 ( 3.970 0.000 -9.682) 10.464 12.404 ( -1.681 0.000 9.244) 9.396 12.682 ( -2.692 0.000 -1.125) 2.917 12.728 ( 2.283 0.000 2.182) 3.157 12.804 ( -3.757 0.000 -1.935) 4.226 12.817 ( 2.538 0.000 4.477) 5.147 13.274 ( 14.042 0.000 3.522) 14.477 13.485 ( 9.205 0.000 -2.418) 9.517 13.564 ( -0.307 0.000 6.167) 6.175 13.581 ( -10.385 0.000 -1.392) 10.478 13.801 ( 4.190 0.000 -3.678) 5.575 13.803 ( -6.685 0.000 3.485) 7.539 13.950 ( 1.127 0.000 -9.534) 9.601 14.037 ( 2.305 0.000 -12.042) 12.261 14.257 ( -5.018 0.000 -0.073) 5.018 14.506 ( -8.316 0.000 5.918) 10.207 14.550 ( -12.137 0.000 -13.824) 18.396 14.824 ( -12.485 0.000 -15.109) 19.599 15.059 ( -11.952 0.000 11.890) 16.858 15.128 ( -0.091 0.000 8.885) 8.885 15.191 ( -1.782 0.000 0.318) 1.810 15.438 ( -0.502 0.000 12.624) 12.634 15.794 ( 1.783 0.000 2.097) 2.753 15.863 ( 2.833 0.000 4.764) 5.543 16.105 ( 1.287 0.000 -12.267) 12.335 16.370 ( 0.464 0.000 6.949) 6.964 16.456 ( 0.742 0.000 -2.423) 2.534 17.290 ( 14.127 0.000 -0.581) 14.139 18.285 ( 24.191 0.000 -21.954) 32.668 18.797 ( 4.473 0.000 14.615) 15.284 18.994 ( -0.631 0.000 -0.543) 0.832 18.995 ( -0.070 0.000 1.610) 1.611 19.394 ( 1.904 0.000 1.114) 2.207 21.658 ( -13.650 0.000 -12.248) 18.340 22.437 ( 13.536 0.000 43.315) 45.381 24.023 ( -8.941 0.000 -29.352) 30.684 24.571 ( 9.042 0.000 9.014) 12.767 ======================= Grid point 108 (40/130) ======================= q-point: (-0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.853 ( -30.604 0.000 15.930) 34.502 0.881 ( -27.903 0.000 22.688) 35.963 1.353 ( -30.375 0.000 27.543) 41.003 1.445 ( -21.520 0.000 3.966) 21.882 2.965 ( 5.884 0.000 -12.593) 13.899 3.086 ( -6.085 0.000 -11.960) 13.419 3.245 ( -1.030 0.000 -3.337) 3.493 3.906 ( -5.231 0.000 14.989) 15.875 4.429 ( 6.095 0.000 -0.812) 6.149 4.454 ( 3.463 0.000 -2.390) 4.208 4.540 ( -4.629 0.000 -4.466) 6.432 4.710 ( -2.020 0.000 -2.262) 3.033 4.989 ( 5.823 0.000 0.387) 5.836 5.371 ( 3.085 0.000 11.481) 11.888 5.430 ( -9.891 0.000 9.047) 13.404 5.703 ( -3.554 0.000 1.758) 3.965 6.282 ( 0.866 0.000 18.779) 18.799 6.431 ( -4.615 0.000 -11.784) 12.656 6.569 ( -1.708 0.000 -8.046) 8.225 6.661 ( -0.177 0.000 2.473) 2.480 6.839 ( 2.000 0.000 -13.406) 13.555 7.055 ( -2.976 0.000 0.206) 2.983 7.471 ( 18.016 0.000 -18.518) 25.836 7.575 ( -5.738 0.000 5.892) 8.224 7.917 ( -17.871 0.000 4.538) 18.438 8.279 ( 6.792 0.000 7.635) 10.219 8.454 ( 7.225 0.000 0.885) 7.279 8.588 ( 5.959 0.000 -13.576) 14.826 8.777 ( 10.678 0.000 -16.607) 19.743 8.989 ( -15.996 0.000 -12.130) 20.075 9.078 ( -3.871 0.000 -0.831) 3.959 9.266 ( -7.522 0.000 -1.243) 7.624 9.315 ( -0.282 0.000 14.642) 14.644 9.884 ( -1.093 0.000 1.691) 2.013 9.911 ( -7.488 0.000 10.092) 12.566 10.093 ( -0.309 0.000 0.803) 0.861 10.112 ( -2.314 0.000 -1.768) 2.912 10.132 ( -1.634 0.000 -1.192) 2.022 10.385 ( 0.892 0.000 -1.738) 1.953 10.465 ( 7.020 0.000 -11.688) 13.634 10.574 ( 7.334 0.000 -2.395) 7.715 10.809 ( -20.659 0.000 -26.478) 33.584 10.899 ( 1.371 0.000 -0.749) 1.563 11.205 ( -0.433 0.000 5.794) 5.810 11.354 ( 13.725 0.000 -1.909) 13.858 11.460 ( 11.518 0.000 -8.866) 14.535 11.642 ( 1.967 0.000 -2.594) 3.256 11.683 ( 2.360 0.000 -8.830) 9.140 11.758 ( 0.330 0.000 -3.311) 3.327 11.962 ( 2.976 0.000 -3.406) 4.523 12.042 ( -4.382 0.000 16.534) 17.105 12.145 ( 2.651 0.000 -3.709) 4.559 12.208 ( 3.718 0.000 0.267) 3.727 12.313 ( 5.963 0.000 3.534) 6.932 12.601 ( -4.922 0.000 1.107) 5.045 12.609 ( 3.238 0.000 25.808) 26.011 12.741 ( -2.044 0.000 0.681) 2.155 12.783 ( 2.308 0.000 2.458) 3.371 12.884 ( 1.005 0.000 3.903) 4.031 13.325 ( -8.837 0.000 -3.736) 9.594 13.517 ( 5.379 0.000 3.453) 6.392 13.619 ( 0.929 0.000 -2.738) 2.891 13.677 ( 9.032 0.000 12.737) 15.614 13.724 ( 0.144 0.000 -7.879) 7.880 13.739 ( -1.627 0.000 4.734) 5.005 13.982 ( 4.094 0.000 -0.125) 4.096 13.985 ( 9.377 0.000 -9.651) 13.457 14.229 ( 2.722 0.000 4.835) 5.549 14.292 ( -4.731 0.000 -8.747) 9.945 14.387 ( -7.929 0.000 4.909) 9.325 14.551 ( -6.526 0.000 -5.932) 8.819 14.885 ( -15.424 0.000 14.256) 21.003 15.155 ( -2.734 0.000 5.225) 5.897 15.178 ( 0.777 0.000 -2.092) 2.232 15.510 ( -0.140 0.000 8.311) 8.313 15.827 ( 0.440 0.000 1.006) 1.098 15.925 ( 0.991 0.000 3.075) 3.231 16.014 ( -0.120 0.000 -9.411) 9.412 16.365 ( -6.011 0.000 6.883) 9.138 16.508 ( 3.637 0.000 -0.594) 3.685 17.686 ( 26.804 0.000 8.625) 28.157 18.471 ( 7.516 0.000 -11.350) 13.613 18.960 ( 1.944 0.000 0.192) 1.954 18.983 ( -0.219 0.000 -0.071) 0.230 19.141 ( 15.215 0.000 7.175) 16.822 19.435 ( 0.619 0.000 3.723) 3.774 21.346 ( -9.764 0.000 -8.377) 12.866 22.954 ( -19.819 0.000 -24.136) 31.230 23.642 ( 16.397 0.000 19.590) 25.546 24.738 ( 2.962 0.000 4.340) 5.254 ======================= Grid point 109 (41/130) ======================= q-point: ( 0.00 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.004 ( 0.439 23.931 21.012) 31.849 1.054 ( 3.739 19.045 27.961) 34.036 1.777 ( 3.335 38.106 32.801) 50.389 2.029 ( 4.968 40.964 6.448) 41.765 2.872 ( 1.309 0.291 -27.862) 27.895 3.239 ( 3.512 6.794 -9.325) 12.060 3.477 ( -1.093 27.183 -1.962) 27.276 3.917 ( -5.452 -0.177 13.930) 14.960 4.291 ( -3.831 1.318 -10.332) 11.097 4.429 ( -2.147 -1.652 -3.048) 4.077 4.553 ( 3.094 2.580 -0.322) 4.042 4.672 ( -3.853 1.199 -2.703) 4.857 5.170 ( 1.998 2.534 5.195) 6.116 5.358 ( -0.767 2.452 3.828) 4.610 5.624 ( -2.633 -0.463 -1.071) 2.880 5.738 ( -0.197 17.570 8.596) 19.561 6.291 ( -1.861 -2.384 8.801) 9.306 6.480 ( 8.202 -4.582 -14.402) 17.196 6.747 ( 11.252 3.923 10.627) 15.967 6.919 ( 0.147 6.679 -6.319) 9.195 7.024 ( -2.643 4.568 -6.140) 8.096 7.123 ( 39.390 1.868 3.537) 39.592 7.337 ( -7.236 -1.147 0.261) 7.331 7.534 ( -3.411 -3.040 -13.448) 14.203 7.766 ( 4.622 -0.976 -5.577) 7.308 7.886 ( -36.802 -14.718 19.752) 44.285 8.333 ( 0.341 -1.147 -4.701) 4.851 8.525 ( -2.378 -3.055 1.583) 4.182 8.603 ( -1.761 -3.364 1.597) 4.119 8.858 ( 9.793 0.829 -13.765) 16.914 9.012 ( 4.516 -7.554 -6.389) 10.876 9.128 ( 2.287 2.471 -5.164) 6.164 9.429 ( 1.443 -3.749 16.690) 17.167 9.661 ( -8.565 -7.247 7.235) 13.350 9.711 ( -12.063 -6.696 16.600) 21.585 9.969 ( -0.481 -6.461 -2.737) 7.033 10.067 ( 1.649 -1.193 -1.781) 2.704 10.146 ( -2.433 6.571 -0.073) 7.008 10.233 ( -0.117 8.374 3.600) 9.116 10.493 ( -5.013 8.291 -3.475) 10.293 10.705 ( 4.255 3.414 3.056) 6.253 10.743 ( 6.473 7.859 2.749) 10.546 10.865 ( -2.685 -2.446 -1.007) 3.769 11.224 ( 1.569 -1.526 4.951) 5.413 11.307 ( 1.904 -1.610 -1.003) 2.687 11.377 ( 3.011 -12.254 -11.097) 16.804 11.459 ( -3.284 -9.524 1.322) 10.161 11.569 ( 7.265 -4.917 -11.049) 14.108 11.807 ( -1.104 2.392 5.054) 5.699 11.909 ( 2.695 5.243 -4.650) 7.508 12.127 ( -0.678 6.406 7.432) 9.835 12.195 ( -4.011 3.396 4.575) 6.968 12.389 ( 2.335 0.021 1.726) 2.904 12.492 ( -1.951 4.858 -1.833) 5.547 12.664 ( -0.628 6.522 -0.236) 6.556 12.701 ( -5.034 -1.375 8.122) 9.654 12.826 ( -3.293 -1.337 2.008) 4.082 12.984 ( 7.272 4.804 12.403) 15.159 13.192 ( 5.042 -4.349 2.834) 7.237 13.269 ( -7.395 17.812 -18.220) 26.532 13.491 ( -2.295 -1.711 -0.106) 2.864 13.594 ( -2.769 2.474 -1.595) 4.041 13.686 ( -3.577 7.587 -5.230) 9.885 13.835 ( -1.162 6.521 3.133) 7.327 13.952 ( 3.326 5.008 -1.087) 6.109 14.048 ( 7.391 -3.715 -9.531) 12.621 14.069 ( 3.764 -4.248 -10.081) 11.569 14.151 ( 6.649 -9.100 -3.384) 11.767 14.329 ( -2.876 3.464 0.134) 4.504 14.448 ( 1.704 2.611 -6.870) 7.544 14.582 ( -14.853 -7.621 10.082) 19.502 14.917 ( 1.982 -10.064 0.011) 10.258 15.117 ( -2.114 -5.951 1.611) 6.517 15.430 ( 27.992 7.679 -5.171) 29.483 15.572 ( 8.062 3.141 1.065) 8.718 15.797 ( 1.900 -3.514 1.261) 4.189 15.931 ( -1.355 -1.421 2.212) 2.958 16.081 ( 11.146 0.247 -6.956) 13.141 16.258 ( -7.811 0.531 2.677) 8.274 16.478 ( 0.025 -6.838 1.752) 7.059 17.761 ( -32.657 -48.344 45.400) 73.924 18.291 ( 12.175 -0.152 -6.599) 13.849 18.342 ( -7.305 -13.561 -3.903) 15.890 18.772 ( 11.440 -12.854 -6.664) 18.453 19.423 ( -0.634 1.790 6.040) 6.332 19.448 ( -4.608 0.100 5.026) 6.819 21.564 ( 8.098 22.572 1.174) 24.010 22.268 ( -37.245 49.458 -40.439) 73.950 24.308 ( 24.354 -21.209 16.611) 36.316 24.637 ( -5.696 -8.103 -1.423) 10.007 ======================= Grid point 110 (42/130) ======================= q-point: ( 0.10 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.331 ( 17.317 17.901 18.194) 30.844 1.446 ( 14.487 21.352 21.566) 33.629 2.167 ( 13.276 28.569 3.410) 31.687 2.383 ( 22.914 17.374 27.890) 40.060 2.728 ( 3.855 -0.072 -24.135) 24.441 3.277 ( 9.089 6.580 -13.212) 17.333 3.440 ( -1.551 28.587 3.987) 28.905 3.884 ( -5.729 2.396 5.249) 8.131 4.147 ( -2.487 7.795 -6.930) 10.722 4.322 ( -6.070 1.479 -2.015) 6.565 4.544 ( -6.602 -0.059 -4.500) 7.990 4.615 ( 1.391 2.175 1.397) 2.936 5.202 ( -3.582 -1.351 6.490) 7.535 5.383 ( 0.510 1.225 0.793) 1.546 5.568 ( -2.183 2.720 0.805) 3.579 5.829 ( 0.702 12.465 16.118) 20.388 6.369 ( 2.278 -0.720 12.586) 12.811 6.536 ( 7.719 -3.961 -15.187) 17.490 6.817 ( -6.362 3.398 -3.718) 8.115 6.865 ( -3.183 8.682 -2.881) 9.685 6.903 ( 0.870 0.244 -5.210) 5.288 7.260 ( 5.412 5.592 -6.163) 9.927 7.341 ( -3.443 1.645 -21.087) 21.429 7.509 ( -12.638 -0.691 18.288) 22.240 7.788 ( 5.476 -5.073 0.404) 7.475 8.148 ( 34.776 -19.117 -9.878) 40.895 8.266 ( -0.366 -0.723 -3.319) 3.417 8.411 ( -6.690 -4.624 -0.782) 8.170 8.514 ( -6.883 -0.907 -0.612) 6.970 8.952 ( 6.552 0.001 -7.545) 9.993 9.123 ( 3.611 2.948 -1.525) 4.904 9.200 ( 11.081 -7.798 -3.739) 14.057 9.533 ( -3.332 -5.017 2.447) 6.501 9.591 ( 2.545 -4.517 0.572) 5.216 9.663 ( -6.435 -6.914 26.367) 28.008 9.974 ( 1.566 -9.037 0.453) 9.182 10.068 ( -5.052 7.405 0.568) 8.982 10.151 ( 7.390 -3.325 0.579) 8.125 10.282 ( 2.161 10.778 2.746) 11.330 10.403 ( -3.112 7.374 -0.038) 8.004 10.718 ( -4.209 -2.235 -1.576) 5.020 10.804 ( -1.822 2.165 1.156) 3.056 10.861 ( 3.345 12.607 1.705) 13.154 11.132 ( -6.707 3.718 -5.199) 9.265 11.293 ( -6.579 -4.742 -8.277) 11.588 11.324 ( -2.255 -9.221 -12.378) 15.599 11.369 ( -0.664 -7.617 0.269) 7.651 11.708 ( 8.650 -8.205 -1.876) 12.069 11.801 ( -3.034 4.710 3.117) 6.412 11.920 ( -0.116 5.672 1.136) 5.786 11.992 ( -8.292 10.341 1.202) 13.309 12.315 ( 2.986 -2.796 13.132) 13.755 12.411 ( -3.675 0.769 -0.938) 3.870 12.433 ( 0.919 7.585 0.792) 7.681 12.654 ( -4.167 -3.062 4.343) 6.753 12.689 ( 0.541 4.074 5.356) 6.751 12.771 ( -2.262 0.028 2.401) 3.299 12.997 ( -6.253 12.506 -8.268) 16.244 13.235 ( 5.927 -0.910 2.801) 6.619 13.322 ( 3.263 2.075 12.856) 13.425 13.483 ( -0.730 -1.330 -0.618) 1.638 13.517 ( -5.558 4.535 -0.271) 7.179 13.601 ( 1.661 3.940 -2.629) 5.019 13.778 ( -7.257 2.462 1.433) 7.796 13.895 ( -6.901 1.420 -4.250) 8.229 14.054 ( 4.914 0.386 -7.102) 8.645 14.133 ( 1.473 -2.728 -10.238) 10.697 14.190 ( 3.651 -4.274 -10.238) 11.680 14.251 ( 0.203 -0.256 -7.787) 7.794 14.473 ( -1.478 -2.121 8.823) 9.193 14.566 ( 10.753 -0.242 1.415) 10.849 14.879 ( -6.591 -4.711 1.434) 8.228 15.113 ( 2.797 -10.230 0.031) 10.605 15.483 ( -5.217 2.040 4.575) 7.233 15.669 ( -2.098 -1.462 -1.766) 3.108 15.875 ( -6.488 -0.872 2.843) 7.138 15.913 ( 3.541 2.329 1.820) 4.613 16.147 ( -2.443 0.345 -3.251) 4.082 16.386 ( 11.034 -6.927 -12.000) 17.713 16.510 ( 11.715 -8.120 -5.860) 15.412 17.227 ( -38.967 -27.906 36.795) 60.424 18.134 ( -8.774 -17.108 -10.318) 21.821 18.620 ( 13.902 -10.851 0.344) 17.639 18.878 ( 2.834 -8.139 -1.291) 8.715 19.381 ( -7.665 3.937 7.475) 11.407 19.413 ( -2.172 0.969 2.562) 3.495 21.666 ( -5.969 49.224 -19.376) 53.235 21.890 ( 20.185 17.837 9.643) 28.611 24.415 ( -13.579 -7.879 -7.129) 17.242 24.611 ( 2.565 -16.228 8.470) 18.484 ======================= Grid point 111 (43/130) ======================= q-point: ( 0.20 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.824 ( 19.162 14.484 13.908) 27.756 1.831 ( 16.518 21.248 8.627) 28.262 2.411 ( 12.631 19.852 -2.797) 23.695 2.570 ( 3.010 -1.023 -22.113) 22.340 2.986 ( 13.655 4.490 4.382) 15.027 3.399 ( 11.947 8.762 -11.188) 18.565 3.604 ( 13.003 20.620 20.118) 31.607 3.813 ( -0.403 9.888 -0.616) 9.915 4.117 ( -0.438 2.673 2.447) 3.650 4.202 ( -5.150 4.599 2.071) 7.209 4.381 ( -6.658 0.870 -3.715) 7.674 4.613 ( -2.458 1.460 1.541) 3.248 5.108 ( -9.773 1.131 4.579) 10.851 5.271 ( -10.508 5.449 -1.654) 11.952 5.690 ( 10.448 -1.517 6.801) 12.559 5.947 ( 0.638 5.940 12.453) 13.811 6.464 ( -6.000 -8.784 -17.809) 20.744 6.546 ( 4.862 0.677 14.250) 15.072 6.567 ( -7.664 -1.982 -12.020) 14.392 6.860 ( 2.189 2.167 -2.427) 3.921 6.913 ( -0.597 9.725 3.675) 10.413 7.147 ( 4.201 7.719 -19.215) 21.129 7.401 ( 7.712 6.740 -7.485) 12.686 7.503 ( 1.630 1.068 8.465) 8.686 7.889 ( 6.568 -4.681 -1.478) 8.199 8.140 ( -4.406 1.262 -4.788) 6.628 8.190 ( -9.980 -6.368 0.346) 11.843 8.357 ( -6.170 1.402 -5.009) 8.070 8.684 ( 15.497 -9.811 -4.127) 18.800 8.965 ( -3.835 0.223 6.350) 7.422 9.165 ( 1.992 -0.008 2.829) 3.460 9.397 ( 10.956 -8.146 -4.627) 14.416 9.504 ( -0.391 -4.095 2.094) 4.616 9.592 ( -1.427 -2.899 4.438) 5.490 9.841 ( 8.682 -7.017 4.224) 11.935 9.967 ( -5.988 7.703 3.304) 10.301 10.013 ( 0.585 -12.866 1.501) 12.966 10.266 ( 1.564 2.623 -4.057) 5.077 10.356 ( 2.979 12.193 6.357) 14.069 10.437 ( 6.058 -2.639 5.615) 8.671 10.601 ( -4.524 -2.043 -3.930) 6.331 10.769 ( -3.193 4.441 2.034) 5.836 10.863 ( -5.526 4.890 -0.326) 7.386 10.948 ( -4.558 7.733 -10.373) 13.717 11.033 ( -12.234 -1.346 -2.895) 12.643 11.248 ( 3.670 -3.675 -14.870) 15.751 11.330 ( -2.164 -3.028 -1.101) 3.881 11.724 ( -3.963 6.288 0.165) 7.434 11.806 ( 0.864 -1.500 -2.408) 2.966 11.873 ( -6.688 4.141 2.525) 8.262 11.932 ( -0.762 5.187 4.640) 7.001 12.311 ( -4.021 5.868 0.312) 7.120 12.432 ( 0.861 -4.426 5.357) 7.002 12.503 ( 2.201 3.671 6.674) 7.929 12.599 ( -3.463 0.676 1.915) 4.015 12.686 ( -5.095 -1.866 8.021) 9.684 12.810 ( -0.337 2.299 3.662) 4.337 12.905 ( 1.461 2.760 0.401) 3.148 13.200 ( -4.180 3.538 -5.972) 8.103 13.333 ( -9.589 2.922 1.037) 10.078 13.396 ( -5.157 5.808 -7.258) 10.630 13.506 ( -6.734 -6.785 10.549) 14.235 13.648 ( -0.492 3.265 3.000) 4.461 13.693 ( -3.862 0.384 -2.675) 4.714 13.779 ( 8.400 -5.291 2.272) 10.184 14.001 ( -4.188 3.158 -8.945) 10.370 14.103 ( 3.851 -3.360 -4.916) 7.091 14.214 ( 7.892 -1.587 -6.937) 10.626 14.324 ( 9.605 -0.436 -10.795) 14.456 14.514 ( 0.018 3.503 4.226) 5.489 14.739 ( -6.239 -3.711 0.159) 7.261 14.810 ( 11.742 -2.376 0.394) 11.987 15.202 ( 4.442 -10.061 2.865) 11.365 15.396 ( -7.943 3.960 8.512) 12.297 15.604 ( -4.327 -3.294 3.314) 6.368 15.759 ( -6.169 0.911 1.645) 6.449 15.939 ( -3.679 -0.937 6.024) 7.120 16.105 ( 0.409 0.083 -5.538) 5.554 16.325 ( -7.634 -6.005 1.272) 9.796 16.669 ( 5.330 -1.799 -9.588) 11.116 16.989 ( -2.978 -19.941 9.391) 22.241 17.881 ( -8.324 -16.130 -14.220) 23.058 18.779 ( 2.528 -8.893 1.688) 9.398 18.877 ( -2.281 -7.538 3.012) 8.432 19.280 ( -7.375 9.076 6.914) 13.585 19.384 ( -1.900 1.783 -0.550) 2.663 21.593 ( 4.915 30.736 -8.828) 32.355 22.371 ( 18.789 11.086 16.269) 27.214 24.046 ( -16.880 -6.831 -12.425) 22.045 24.649 ( -2.637 -10.643 6.230) 12.612 ======================= Grid point 112 (44/130) ======================= q-point: ( 0.30 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.087 ( 10.180 26.485 1.069) 28.394 2.309 ( 20.461 6.803 5.163) 22.171 2.465 ( 4.593 0.125 -15.377) 16.049 2.635 ( 11.682 16.563 -5.452) 20.989 3.119 ( 2.706 12.670 3.431) 13.402 3.541 ( 9.190 9.768 -7.417) 15.326 3.779 ( 2.825 5.453 -3.326) 6.984 3.940 ( -5.986 -0.906 6.146) 8.627 4.120 ( -3.292 -0.168 7.086) 7.815 4.243 ( 5.140 2.292 0.975) 5.711 4.388 ( 10.881 8.282 15.331) 20.543 4.560 ( -2.964 1.428 1.459) 3.600 4.915 ( -13.687 5.721 8.357) 17.026 5.063 ( -6.793 8.091 -7.678) 13.059 5.948 ( 10.330 -2.746 5.429) 11.989 6.004 ( -1.964 -0.861 2.497) 3.291 6.173 ( -11.304 -7.446 -6.839) 15.166 6.303 ( -9.427 -1.344 -10.053) 13.847 6.734 ( 4.324 1.277 11.081) 11.963 6.925 ( 4.917 0.243 1.265) 5.083 6.982 ( 6.329 12.597 0.491) 14.106 7.199 ( 10.292 5.155 -12.328) 16.867 7.421 ( 1.008 0.384 -6.782) 6.867 7.598 ( 4.396 3.614 -3.529) 6.696 7.925 ( -4.769 -2.892 -0.893) 5.648 7.968 ( -9.637 -0.077 -2.379) 9.927 8.170 ( 9.035 0.900 -2.777) 9.495 8.226 ( -1.118 2.613 -9.846) 10.248 8.809 ( -0.217 -3.988 4.843) 6.278 8.952 ( -4.847 0.468 16.293) 17.005 9.251 ( 3.400 -3.018 4.478) 6.381 9.501 ( -0.934 -2.840 5.592) 6.341 9.553 ( 6.385 -6.244 -2.095) 9.173 9.636 ( 5.237 -1.967 -4.119) 6.947 9.873 ( -3.724 8.146 1.688) 9.114 9.996 ( 1.445 -6.680 0.364) 6.844 10.002 ( -0.246 -8.248 0.601) 8.273 10.246 ( 0.699 6.270 -3.975) 7.457 10.379 ( -6.950 -3.465 3.261) 8.423 10.463 ( -4.855 3.120 -4.023) 7.035 10.567 ( 3.177 9.416 4.729) 11.005 10.716 ( -5.877 1.781 0.226) 6.145 10.735 ( -7.862 -2.949 -2.403) 8.734 10.872 ( 6.764 -4.723 -1.755) 8.434 10.915 ( 0.306 9.592 -1.978) 9.798 11.256 ( 5.230 -1.545 -8.083) 9.750 11.314 ( 2.220 -0.610 -1.044) 2.528 11.658 ( -3.331 6.755 0.234) 7.536 11.688 ( -10.379 6.107 0.814) 12.069 11.798 ( -1.581 4.130 -4.069) 6.010 11.928 ( -1.846 1.504 0.087) 2.383 12.254 ( -2.728 2.796 0.676) 3.964 12.442 ( -1.962 0.393 -2.979) 3.589 12.520 ( -6.124 0.316 9.497) 11.305 12.561 ( -1.359 2.673 0.664) 3.072 12.648 ( -4.475 -3.450 5.222) 7.694 12.764 ( -4.643 1.934 2.065) 5.438 12.988 ( 2.072 1.508 2.424) 3.527 13.058 ( -5.239 6.227 -0.409) 8.148 13.215 ( -3.192 0.247 0.420) 3.229 13.240 ( -5.587 3.176 -4.989) 8.136 13.372 ( -6.223 -2.087 4.127) 7.753 13.447 ( -8.723 -0.429 -9.774) 13.108 13.814 ( -2.770 2.134 -0.735) 3.573 13.873 ( 5.816 -6.345 5.833) 10.397 14.035 ( 7.374 -3.661 2.797) 8.695 14.152 ( 4.222 -6.188 -1.815) 7.707 14.361 ( 11.225 -1.649 -6.884) 13.271 14.396 ( 0.848 -3.939 -1.018) 4.156 14.525 ( 2.714 3.006 -3.328) 5.242 14.733 ( 6.692 2.319 -0.003) 7.083 14.990 ( 7.601 -1.499 -2.280) 8.076 15.281 ( -1.068 -5.315 6.649) 8.579 15.330 ( -3.657 -0.244 7.317) 8.184 15.567 ( -2.879 -3.669 6.271) 7.815 15.684 ( -3.357 2.475 2.872) 5.064 15.854 ( -8.873 -5.348 4.961) 11.487 16.070 ( -0.388 1.139 -4.868) 5.014 16.166 ( -9.752 -2.825 2.588) 10.478 16.691 ( 5.525 0.050 -9.192) 10.725 17.070 ( 5.810 -12.874 -2.649) 14.371 17.643 ( -5.638 -13.433 -14.988) 20.902 18.737 ( -7.685 -5.468 6.016) 11.187 18.887 ( 0.581 -8.441 1.758) 8.642 19.212 ( -3.804 10.504 4.185) 11.929 19.334 ( -2.083 2.266 -2.083) 3.717 21.656 ( 4.887 19.956 -2.103) 20.653 22.765 ( 9.441 7.086 15.940) 19.835 23.661 ( -12.468 -5.858 -12.802) 18.806 24.619 ( -3.467 -8.044 2.451) 9.096 ======================= Grid point 113 (45/130) ======================= q-point: ( 0.40 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.265 ( 7.879 27.750 2.504) 28.955 2.462 ( 7.886 1.529 -3.457) 8.745 2.737 ( 14.736 10.313 -1.015) 18.015 2.818 ( 12.655 9.132 -0.979) 15.637 3.196 ( 1.722 14.294 6.550) 15.817 3.624 ( 4.484 5.431 -8.023) 10.676 3.733 ( -12.897 2.781 3.975) 13.779 3.819 ( -1.776 5.685 -0.421) 5.971 4.021 ( -6.138 -1.152 1.562) 6.437 4.340 ( 1.662 -3.385 -2.048) 4.291 4.521 ( 2.372 0.815 0.750) 2.618 4.568 ( -10.531 1.071 13.670) 17.289 4.807 ( -3.369 7.597 -11.299) 14.026 5.036 ( 8.326 14.582 14.386) 22.112 5.803 ( -6.163 -7.862 -16.389) 19.194 6.080 ( -4.454 -2.437 7.941) 9.426 6.119 ( 2.347 -2.464 0.507) 3.440 6.167 ( -0.230 -1.149 3.848) 4.023 6.837 ( 0.122 -0.081 5.009) 5.011 7.043 ( 6.355 0.064 0.648) 6.388 7.125 ( 5.943 12.550 3.267) 14.265 7.315 ( 7.397 0.454 -6.075) 9.583 7.389 ( 1.716 -2.658 -7.030) 7.709 7.626 ( 2.160 0.827 -4.509) 5.068 7.780 ( -6.936 6.116 -1.726) 9.407 7.816 ( -4.211 0.748 -0.929) 4.377 8.168 ( 3.552 1.990 -10.866) 11.604 8.326 ( 7.300 3.109 -6.746) 10.415 8.814 ( -3.813 -3.769 10.156) 11.484 9.003 ( -3.325 0.999 17.076) 17.426 9.315 ( -1.032 -4.736 5.961) 7.683 9.527 ( -0.105 1.192 4.487) 4.644 9.640 ( 3.711 -4.620 -1.552) 6.126 9.704 ( 4.054 -0.669 -3.454) 5.368 9.847 ( 0.616 6.982 0.176) 7.012 9.936 ( -2.920 -6.985 -0.679) 7.602 10.028 ( 1.289 -5.589 -1.570) 5.947 10.222 ( -1.677 1.692 -4.252) 4.874 10.280 ( -2.444 5.254 3.589) 6.817 10.359 ( -3.030 4.889 -0.740) 5.799 10.528 ( -8.181 -6.342 0.484) 10.363 10.627 ( -3.797 1.646 2.824) 5.010 10.743 ( 7.161 10.491 -1.385) 12.777 10.936 ( 0.116 -4.393 2.223) 4.925 10.954 ( 3.712 6.951 -2.318) 8.214 11.320 ( 2.788 0.717 -4.543) 5.378 11.370 ( 1.741 2.880 -2.545) 4.220 11.523 ( -2.386 -1.256 3.346) 4.297 11.616 ( -1.702 4.313 0.082) 4.637 11.727 ( -2.100 10.471 -7.204) 12.882 11.878 ( -1.168 -0.731 -3.359) 3.631 12.203 ( -3.202 0.322 -0.547) 3.265 12.275 ( -11.229 -1.598 -2.588) 11.634 12.482 ( -2.382 3.733 1.959) 4.843 12.553 ( -0.483 2.530 1.935) 3.222 12.562 ( -4.409 0.534 -1.727) 4.765 12.685 ( -4.280 -2.798 -0.013) 5.114 12.968 ( -1.851 11.118 0.033) 11.271 13.067 ( 2.676 1.501 -2.633) 4.043 13.122 ( -5.256 5.329 -7.588) 10.658 13.186 ( -0.203 -1.321 2.367) 2.718 13.254 ( -2.001 -4.519 1.035) 5.050 13.385 ( -1.622 1.398 12.655) 12.835 13.755 ( -2.418 0.106 -0.109) 2.423 13.971 ( 1.072 -6.743 0.741) 6.868 14.155 ( 5.115 -7.900 -2.891) 9.845 14.246 ( 4.433 -7.390 4.779) 9.854 14.323 ( -5.013 0.832 -2.226) 5.547 14.525 ( 10.054 -3.999 -8.267) 13.617 14.588 ( 1.719 -7.343 5.509) 9.340 14.951 ( 14.032 5.648 -0.368) 15.131 15.075 ( 3.527 -0.728 -2.304) 4.275 15.282 ( -3.339 4.127 11.790) 12.930 15.325 ( -1.465 -10.064 -0.665) 10.192 15.574 ( -1.800 -3.920 7.097) 8.305 15.661 ( -3.167 3.311 7.178) 8.516 15.708 ( -6.879 -5.123 -0.363) 8.585 15.998 ( -9.374 -0.230 3.938) 10.170 16.038 ( -0.534 2.877 -2.870) 4.099 16.744 ( 7.899 -0.313 -13.926) 16.013 17.128 ( 2.047 -7.721 -3.315) 8.649 17.478 ( -0.642 -11.079 -14.152) 17.984 18.628 ( -8.103 -4.209 7.642) 11.907 18.897 ( -0.213 -8.809 0.035) 8.811 19.187 ( -1.519 9.995 2.522) 10.420 19.292 ( -0.346 2.344 -2.189) 3.226 21.737 ( 3.313 14.897 2.947) 15.542 22.863 ( -5.205 5.453 -2.239) 7.864 23.509 ( 1.493 -4.989 3.980) 6.554 24.557 ( -3.156 -6.802 -1.920) 7.741 ======================= Grid point 114 (46/130) ======================= q-point: (-0.50 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.398 ( 1.462 24.059 6.498) 24.964 2.694 ( 11.992 0.414 11.914) 16.910 2.849 ( 2.118 15.545 -3.550) 16.086 3.067 ( 7.583 1.617 0.668) 7.782 3.262 ( -4.661 11.064 7.316) 14.059 3.446 ( -9.798 11.786 2.601) 15.546 3.630 ( 1.800 -1.026 -10.054) 10.265 3.785 ( -2.152 11.819 -1.966) 12.174 3.941 ( -2.826 -3.313 -1.901) 4.751 4.313 ( -0.176 -5.591 -4.469) 7.160 4.473 ( -6.064 0.390 11.277) 12.810 4.567 ( 0.229 5.837 -2.529) 6.365 4.610 ( -6.794 10.999 -8.597) 15.526 5.310 ( 5.985 7.515 15.763) 18.460 5.691 ( 6.905 -7.716 -15.318) 18.489 6.031 ( -3.432 -3.013 -3.972) 6.052 6.108 ( -5.027 -1.367 10.289) 11.533 6.260 ( 4.166 -2.347 7.693) 9.058 6.804 ( -4.740 0.418 -0.443) 4.779 7.110 ( -2.169 11.528 0.838) 11.760 7.231 ( 0.148 -7.088 7.260) 10.148 7.337 ( 1.421 0.493 -6.657) 6.825 7.409 ( 2.858 3.585 -2.148) 5.063 7.647 ( 4.549 2.355 -0.478) 5.145 7.734 ( -3.319 0.498 -4.087) 5.288 7.804 ( 11.366 7.148 -5.323) 14.443 8.211 ( 7.699 -0.863 -7.962) 11.109 8.337 ( -0.667 4.540 -7.619) 8.895 8.824 ( -3.417 -3.159 13.566) 14.342 8.979 ( -10.527 0.288 11.099) 15.300 9.295 ( -4.635 -6.020 4.999) 9.094 9.527 ( -3.356 4.825 2.355) 6.332 9.679 ( 1.931 -3.333 -1.416) 4.104 9.728 ( -0.297 1.996 1.671) 2.620 9.867 ( 0.426 0.010 0.694) 0.814 9.957 ( 5.828 -4.761 -0.550) 7.546 10.081 ( 5.498 -5.830 -2.155) 8.298 10.154 ( -2.966 2.499 -1.379) 4.116 10.282 ( -0.647 2.393 0.253) 2.492 10.347 ( 1.194 0.832 1.616) 2.174 10.451 ( 0.142 -0.374 4.530) 4.548 10.596 ( -1.160 0.356 2.802) 3.054 10.787 ( -0.205 5.600 -2.625) 6.188 10.990 ( 1.915 7.051 -2.969) 7.887 11.002 ( 3.000 -0.026 3.925) 4.941 11.180 ( -6.419 13.915 -4.788) 16.055 11.465 ( 8.644 -4.304 -5.590) 11.158 11.567 ( -0.819 -4.200 3.807) 5.728 11.614 ( -1.242 13.673 -10.746) 17.435 11.650 ( 3.220 1.122 4.116) 5.345 11.867 ( 2.340 0.568 -2.986) 3.836 12.027 ( -9.168 -3.173 -2.171) 9.942 12.171 ( -0.633 -0.434 -2.683) 2.790 12.445 ( -1.385 2.159 -2.244) 3.408 12.472 ( -2.771 1.853 -5.452) 6.390 12.566 ( 0.361 0.247 1.441) 1.505 12.630 ( -0.447 -1.134 0.509) 1.321 12.894 ( -4.087 12.678 -4.136) 13.948 12.979 ( -1.062 -1.452 -7.796) 8.001 13.084 ( 1.152 3.576 -5.096) 6.331 13.290 ( 3.324 -2.326 10.384) 11.148 13.333 ( 5.684 1.483 9.184) 10.902 13.457 ( -0.353 2.565 12.421) 12.688 13.715 ( -1.560 -1.184 -0.951) 2.177 13.922 ( -4.057 -2.566 -4.550) 6.615 14.172 ( -3.602 3.503 -3.394) 6.064 14.199 ( 0.130 -9.572 -6.347) 11.486 14.417 ( 5.047 -11.322 13.008) 17.969 14.599 ( 3.297 -4.491 -8.516) 10.177 14.643 ( -0.595 -5.939 6.667) 8.948 15.102 ( 1.132 -1.463 -1.737) 2.538 15.166 ( 5.704 -3.206 1.124) 6.639 15.249 ( -4.141 -8.626 -3.196) 10.088 15.348 ( 1.910 4.876 11.414) 12.558 15.566 ( -0.897 -5.066 -3.823) 6.410 15.634 ( -3.582 -2.310 6.903) 8.113 15.640 ( -5.345 2.944 9.390) 11.199 15.872 ( -5.216 1.350 4.240) 6.857 16.048 ( 3.500 4.265 -1.366) 5.684 16.780 ( 6.365 -1.412 -16.236) 17.496 17.101 ( -1.675 -3.556 -4.149) 5.715 17.439 ( 6.748 -10.458 -13.286) 18.205 18.549 ( -5.654 -4.138 7.547) 10.298 18.880 ( -1.193 -9.981 -1.061) 10.108 19.181 ( -0.740 9.765 1.873) 9.970 19.303 ( 2.720 2.854 -1.211) 4.124 21.828 ( 2.697 12.749 7.688) 15.130 22.647 ( -8.729 5.304 -13.840) 17.201 23.681 ( 7.272 -4.379 14.465) 16.772 24.475 ( -2.559 -6.180 -6.247) 9.152 ======================= Grid point 115 (47/130) ======================= q-point: (-0.40 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.345 ( -12.225 16.572 4.672) 21.117 2.736 ( -10.790 15.436 -4.161) 19.287 2.862 ( -23.701 6.898 1.243) 24.716 2.989 ( 2.295 1.711 10.717) 11.093 3.241 ( 6.791 6.541 8.886) 12.956 3.547 ( 5.287 6.633 -5.584) 10.155 3.582 ( 1.237 3.978 -7.664) 8.723 3.708 ( -2.167 21.144 -3.310) 21.511 3.873 ( -2.298 -5.557 -0.808) 6.068 4.298 ( 1.872 -4.694 -4.316) 6.646 4.394 ( -4.042 7.738 1.649) 8.884 4.501 ( -3.599 4.806 -0.609) 6.035 4.622 ( 5.851 5.099 8.840) 11.764 5.469 ( 0.675 2.943 13.592) 13.924 5.810 ( 5.119 -6.769 -13.447) 15.901 5.906 ( 6.140 -3.605 -11.514) 13.538 6.076 ( -6.643 -1.012 11.063) 12.944 6.437 ( 7.208 -2.340 10.397) 12.865 6.677 ( -7.996 4.371 0.384) 9.121 7.010 ( -6.556 13.285 -0.348) 14.818 7.153 ( -8.208 -2.386 4.590) 9.703 7.339 ( -2.189 -4.057 -5.157) 6.917 7.443 ( 0.777 1.920 -7.582) 7.860 7.651 ( 5.183 3.692 -5.324) 8.297 7.817 ( 8.503 4.607 1.627) 9.807 8.039 ( 11.165 5.846 2.140) 12.783 8.202 ( -2.627 2.280 -13.967) 14.393 8.331 ( 9.188 -4.097 -7.424) 12.503 8.798 ( -14.404 -2.533 11.492) 18.600 8.881 ( -1.889 -2.261 15.748) 16.022 9.230 ( -5.072 -5.700 4.502) 8.859 9.426 ( -8.035 3.615 1.343) 8.913 9.674 ( -1.724 -3.302 -1.921) 4.191 9.757 ( 2.072 4.935 3.065) 6.168 9.889 ( 0.047 -3.953 2.521) 4.688 10.053 ( 3.029 -6.378 0.857) 7.113 10.104 ( -1.347 1.730 0.369) 2.223 10.152 ( 1.075 -1.916 0.080) 2.198 10.277 ( 5.398 -5.644 -9.193) 12.063 10.394 ( 1.858 -2.448 -0.136) 3.076 10.590 ( 6.994 3.773 8.315) 11.502 10.606 ( -1.570 -0.781 0.743) 1.904 10.755 ( -0.733 6.848 1.900) 7.145 10.974 ( 0.352 5.253 -1.545) 5.487 11.061 ( 1.290 0.500 3.921) 4.158 11.133 ( 3.945 11.490 -4.831) 13.074 11.477 ( 0.609 16.433 -14.858) 22.162 11.577 ( 0.054 0.749 1.088) 1.322 11.617 ( 7.173 -4.964 -3.157) 9.277 11.741 ( 0.698 -0.565 7.119) 7.175 11.893 ( 0.982 -0.421 -3.551) 3.709 11.942 ( 1.964 -1.543 0.874) 2.646 12.187 ( 4.038 1.612 -0.472) 4.373 12.359 ( -3.044 -11.889 -11.219) 16.628 12.408 ( -1.141 8.893 -1.363) 9.069 12.615 ( 3.367 0.557 2.570) 4.272 12.689 ( 5.750 1.415 2.130) 6.293 12.829 ( 1.022 10.724 -3.763) 11.411 12.934 ( 0.500 -0.746 -5.014) 5.094 13.057 ( 0.123 5.021 -6.355) 8.100 13.388 ( -0.791 1.962 9.094) 9.337 13.440 ( -1.143 1.929 6.782) 7.143 13.608 ( 5.906 -1.987 7.178) 9.505 13.697 ( 1.948 0.439 -0.096) 1.999 13.844 ( 0.323 3.410 1.339) 3.678 14.055 ( -4.899 -0.754 -5.885) 7.695 14.144 ( -2.439 -5.818 -5.592) 8.430 14.534 ( -2.829 -1.828 -6.627) 7.434 14.609 ( 2.850 -13.836 15.298) 20.823 14.658 ( -1.931 -1.901 6.399) 6.950 15.062 ( -8.072 -9.809 -8.576) 15.327 15.087 ( -0.305 -5.407 -6.720) 8.631 15.261 ( -1.835 -1.391 9.599) 9.871 15.434 ( -5.842 1.178 15.163) 16.292 15.476 ( -4.730 -2.211 -5.750) 7.767 15.616 ( 0.369 1.497 5.094) 5.322 15.654 ( 1.451 -1.393 4.726) 5.136 15.898 ( 4.788 0.040 2.122) 5.238 16.148 ( 6.233 3.430 1.576) 7.287 16.728 ( -1.286 -2.585 -14.632) 14.914 17.053 ( 1.953 -0.319 -6.367) 6.667 17.550 ( 14.641 -11.889 -13.897) 23.427 18.516 ( -3.309 -5.385 6.848) 9.319 18.841 ( -2.167 -11.730 -0.864) 11.960 19.188 ( 0.078 10.546 1.953) 10.725 19.366 ( 4.007 3.818 -0.229) 5.540 21.959 ( 3.839 12.228 13.576) 18.670 22.380 ( -8.678 7.055 -15.236) 18.900 23.945 ( 9.459 -4.968 15.005) 18.420 24.370 ( -2.499 -5.925 -10.700) 12.483 ======================= Grid point 116 (48/130) ======================= q-point: (-0.30 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.018 ( -23.523 13.915 2.623) 27.456 2.271 ( -31.093 10.310 -1.825) 32.808 2.488 ( -13.826 23.383 -9.713) 28.849 2.998 ( -10.097 6.709 0.617) 12.138 3.214 ( -14.067 4.640 -6.990) 16.379 3.437 ( -2.902 4.815 -4.680) 7.315 3.515 ( -3.957 15.028 -0.863) 15.564 3.809 ( 6.087 11.549 12.992) 18.418 3.985 ( 10.156 0.170 4.132) 10.965 4.331 ( 3.160 -1.188 1.157) 3.568 4.417 ( 1.318 0.482 -2.741) 3.080 4.458 ( 3.646 1.855 3.380) 5.307 4.871 ( 11.106 6.317 10.741) 16.691 5.545 ( -1.744 0.139 11.806) 11.935 5.583 ( -10.668 1.047 -10.695) 15.142 5.971 ( -9.805 0.701 6.109) 11.573 6.193 ( 22.580 -10.496 -17.952) 30.696 6.505 ( -8.946 5.932 4.427) 11.611 6.674 ( 7.263 0.342 10.859) 13.069 6.905 ( -3.896 13.087 0.435) 13.662 7.045 ( -5.965 1.474 -6.215) 8.740 7.139 ( -9.423 -1.870 -1.117) 9.672 7.394 ( 2.961 2.313 -13.867) 14.367 7.760 ( -6.062 8.364 -3.715) 10.978 7.849 ( 4.592 2.934 0.647) 5.487 8.112 ( 6.941 0.439 2.273) 7.317 8.339 ( 13.277 -1.972 -5.553) 14.526 8.438 ( 7.218 -5.437 -9.623) 13.201 8.607 ( -11.663 -2.817 8.146) 14.502 8.972 ( 0.032 -3.677 14.326) 14.791 9.182 ( -3.538 -3.058 5.929) 7.551 9.266 ( -9.916 -1.055 2.772) 10.350 9.592 ( -5.521 -4.035 -2.146) 7.167 9.828 ( 2.489 4.633 2.711) 5.917 9.881 ( -3.210 -5.982 4.167) 7.966 10.078 ( 0.193 -5.336 0.695) 5.384 10.131 ( 2.559 -1.876 0.306) 3.188 10.164 ( 0.575 -3.611 3.565) 5.107 10.319 ( 5.792 -1.647 -13.474) 14.758 10.398 ( -0.974 -5.668 -2.182) 6.151 10.513 ( -3.032 5.489 -4.693) 7.832 10.731 ( 1.999 3.389 5.464) 6.733 10.798 ( 1.287 3.344 4.408) 5.681 11.040 ( 5.420 1.874 -0.093) 5.736 11.134 ( 3.575 -4.067 -1.356) 5.583 11.231 ( 5.616 2.541 8.749) 10.702 11.415 ( 3.920 17.272 -13.875) 22.499 11.593 ( 1.431 1.512 0.244) 2.096 11.717 ( 5.383 -5.008 -4.268) 8.501 11.788 ( 1.588 1.826 1.816) 3.025 11.910 ( 2.437 3.882 1.531) 4.833 12.018 ( 2.816 -0.864 4.293) 5.206 12.205 ( -2.165 -13.135 -13.970) 19.297 12.307 ( 6.302 5.689 2.286) 8.793 12.406 ( 1.085 7.518 2.406) 7.968 12.684 ( 1.307 -0.878 4.236) 4.519 12.800 ( 2.438 2.993 -0.281) 3.871 12.926 ( 4.303 0.745 -1.171) 4.521 12.969 ( 9.743 8.767 -3.655) 13.606 12.998 ( 2.189 8.835 -4.703) 10.245 13.402 ( 2.660 7.113 -0.100) 7.595 13.502 ( 0.943 -1.488 8.046) 8.236 13.638 ( -1.885 -6.978 -2.291) 7.583 13.748 ( -0.918 -1.307 6.647) 6.836 13.903 ( -5.930 -2.736 -3.097) 7.228 13.983 ( 4.544 3.193 -2.353) 6.032 14.068 ( 3.023 3.877 -2.800) 5.658 14.414 ( -4.697 1.149 -4.619) 6.688 14.612 ( -6.098 -0.246 7.001) 9.288 14.777 ( -2.937 -11.044 3.285) 11.891 14.805 ( -5.449 -9.273 -2.831) 11.122 15.007 ( -3.128 -8.879 -8.567) 12.729 15.208 ( -9.418 -0.320 5.729) 11.028 15.337 ( -7.724 1.567 1.575) 8.038 15.417 ( -3.976 1.829 14.239) 14.896 15.688 ( 2.671 -4.089 2.470) 5.473 15.754 ( 5.036 0.408 4.152) 6.540 16.029 ( 7.781 -2.434 -2.191) 8.442 16.278 ( 4.854 1.378 3.929) 6.395 16.554 ( -6.013 -1.662 -10.966) 12.616 17.103 ( 7.476 -0.434 -5.553) 9.323 17.794 ( 21.806 -14.796 -15.848) 30.750 18.507 ( -2.535 -7.621 5.875) 9.951 18.785 ( -3.632 -14.116 0.242) 14.578 19.213 ( 0.872 11.889 2.803) 12.245 19.438 ( 3.174 4.440 0.732) 5.507 22.100 ( -9.449 9.765 -12.423) 18.411 22.190 ( 7.376 12.887 20.791) 25.549 24.217 ( -2.450 -6.011 -13.080) 14.602 24.237 ( 8.996 -5.771 9.339) 14.193 ======================= Grid point 117 (49/130) ======================= q-point: (-0.20 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.542 ( -28.064 16.122 4.732) 32.710 1.651 ( -31.370 15.059 -2.041) 34.857 2.177 ( -11.267 34.576 -7.959) 37.226 2.446 ( -38.537 20.540 3.624) 43.819 3.093 ( 2.624 7.104 -11.246) 13.558 3.319 ( -5.251 3.965 -3.788) 7.592 3.475 ( -1.013 18.273 -0.956) 18.326 3.926 ( -3.546 3.832 13.676) 14.638 4.216 ( 10.551 -1.172 3.128) 11.067 4.361 ( 0.381 -4.464 -1.720) 4.799 4.517 ( 7.071 3.091 1.832) 7.931 4.608 ( 6.853 -1.750 6.379) 9.524 5.083 ( 0.943 5.699 3.454) 6.730 5.379 ( 1.220 8.201 -5.558) 9.982 5.573 ( -4.334 1.282 10.473) 11.407 5.795 ( -10.119 1.737 2.894) 10.667 6.377 ( -4.535 4.706 5.140) 8.315 6.401 ( 7.309 -8.230 -13.711) 17.583 6.732 ( -11.989 -1.171 -16.279) 20.251 6.827 ( 0.492 11.876 -0.144) 11.887 6.932 ( 5.438 5.400 5.239) 9.283 7.148 ( 2.621 -1.847 6.364) 7.127 7.335 ( 0.535 11.743 -15.239) 19.245 7.576 ( -0.603 -0.159 -5.010) 5.049 8.034 ( 7.327 -2.001 5.721) 9.508 8.209 ( -13.573 -4.265 8.163) 16.403 8.316 ( 1.630 0.093 3.652) 4.000 8.524 ( 8.405 -4.010 -14.457) 17.196 8.626 ( 12.259 -1.620 -12.170) 17.350 9.050 ( -2.104 -7.328 3.796) 8.517 9.075 ( -10.506 -8.392 3.771) 13.965 9.197 ( -2.352 0.925 14.561) 14.779 9.429 ( -9.702 -6.200 -3.014) 11.902 9.815 ( -5.860 -7.737 6.862) 11.886 9.895 ( 2.026 3.312 -0.615) 3.931 10.081 ( -1.048 -8.011 0.920) 8.132 10.140 ( 0.533 2.018 -4.283) 4.765 10.240 ( -1.356 -1.464 7.243) 7.513 10.290 ( -2.932 -5.509 2.405) 6.688 10.368 ( 5.628 -2.536 -9.327) 11.185 10.508 ( 4.514 3.508 -2.828) 6.378 10.803 ( 1.337 2.508 6.900) 7.463 10.848 ( 0.364 0.793 6.080) 6.142 11.017 ( -4.568 -6.765 -11.007) 13.704 11.214 ( 6.580 -1.857 -2.733) 7.363 11.364 ( 3.144 -0.409 -0.438) 3.201 11.431 ( 2.107 4.951 0.020) 5.381 11.639 ( 2.868 -0.139 -3.226) 4.319 11.751 ( 3.048 -0.900 -6.964) 7.655 11.824 ( 2.859 3.459 -2.360) 5.071 12.016 ( 2.809 -4.609 -0.158) 5.400 12.061 ( 5.708 4.769 -0.814) 7.483 12.184 ( 3.454 -1.482 6.438) 7.455 12.445 ( 5.025 5.011 3.576) 7.946 12.488 ( 3.693 7.871 7.931) 11.768 12.739 ( 1.434 -2.510 4.758) 5.568 12.795 ( -2.047 2.484 -0.750) 3.305 12.893 ( -2.353 9.993 -4.463) 11.195 13.086 ( 13.441 16.438 3.097) 21.458 13.268 ( 13.389 0.790 0.296) 13.415 13.433 ( -6.066 -7.610 -6.583) 11.749 13.548 ( 1.636 0.275 0.004) 1.659 13.578 ( 4.275 1.209 2.022) 4.881 13.782 ( -0.129 0.646 5.649) 5.687 13.850 ( 2.087 -0.343 -0.868) 2.286 13.919 ( -0.507 -1.225 -8.245) 8.351 14.162 ( 2.502 8.401 -12.242) 15.056 14.334 ( -1.781 3.933 3.414) 5.505 14.472 ( -9.467 -1.440 -10.351) 14.101 14.532 ( -8.347 1.160 3.741) 9.220 14.820 ( -6.101 -0.674 -10.842) 12.459 14.910 ( -1.738 -12.851 7.967) 15.220 15.054 ( -9.825 -0.734 5.567) 11.316 15.223 ( -5.692 -0.401 4.170) 7.067 15.462 ( -0.726 0.456 9.998) 10.034 15.745 ( 1.618 -4.972 2.210) 5.677 15.863 ( 2.696 -0.095 4.641) 5.368 16.108 ( 3.329 -0.649 -9.285) 9.885 16.364 ( 0.508 -0.623 5.102) 5.165 16.422 ( -1.067 -2.457 -3.203) 4.176 17.261 ( 10.907 -2.980 1.411) 11.395 18.146 ( 26.355 -17.886 -16.401) 35.826 18.489 ( -3.389 -10.421 4.328) 11.782 18.698 ( -6.638 -17.335 1.856) 18.655 19.261 ( 1.842 12.061 4.150) 12.888 19.488 ( 0.836 3.602 2.180) 4.293 21.815 ( -10.953 13.878 -10.469) 20.546 22.610 ( 18.041 13.159 32.476) 39.412 23.959 ( -9.545 -5.447 -25.589) 27.849 24.497 ( 8.591 -6.830 8.682) 13.994 ======================= Grid point 118 (50/130) ======================= q-point: (-0.10 0.12 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.074 ( -22.374 19.124 9.246) 30.851 1.145 ( -23.887 22.914 14.318) 36.064 1.839 ( -28.425 36.633 20.210) 50.581 1.999 ( -4.384 43.153 -0.035) 43.375 3.032 ( 3.065 1.583 -26.775) 26.996 3.241 ( -0.650 7.715 0.185) 7.744 3.468 ( 1.494 22.842 -1.066) 22.916 3.924 ( -5.546 2.238 13.721) 14.968 4.347 ( 1.544 -6.193 -3.928) 7.495 4.405 ( 5.266 -3.344 0.920) 6.305 4.573 ( -1.024 2.460 -2.250) 3.488 4.717 ( -0.818 0.612 3.365) 3.516 5.072 ( 4.243 6.763 -1.451) 8.114 5.409 ( -5.449 4.953 2.379) 7.739 5.618 ( 6.285 13.876 8.892) 17.638 5.690 ( -3.555 -0.690 1.122) 3.791 6.333 ( -4.501 0.677 6.730) 8.125 6.394 ( 0.500 -1.006 -6.324) 6.423 6.475 ( 0.684 -3.861 -8.393) 9.264 6.847 ( 2.313 15.343 0.970) 15.546 6.979 ( -0.857 8.696 -2.646) 9.130 7.124 ( -4.749 7.958 -3.231) 9.814 7.362 ( 5.871 -7.689 -1.916) 9.863 7.651 ( 9.871 4.252 -11.631) 15.836 7.838 ( -20.926 -6.219 5.683) 22.558 8.247 ( 7.326 -3.700 5.325) 9.783 8.408 ( -1.878 -6.022 1.083) 6.400 8.542 ( 2.668 -5.975 -13.494) 14.997 8.712 ( -21.762 -14.787 3.454) 26.537 8.762 ( 8.302 -1.426 -12.778) 15.305 9.062 ( -0.130 -3.621 -4.823) 6.033 9.208 ( -8.884 -5.617 -3.824) 11.184 9.295 ( -0.556 -0.939 19.010) 19.041 9.749 ( -6.819 -8.318 8.720) 13.847 9.872 ( -6.603 -4.520 0.505) 8.017 10.031 ( -4.842 -10.002 1.406) 11.201 10.106 ( -4.553 -2.699 -1.314) 5.454 10.157 ( -1.585 1.128 0.941) 2.161 10.259 ( -3.559 5.534 2.359) 6.990 10.527 ( 10.120 2.275 2.868) 10.762 10.599 ( 4.639 2.149 -3.045) 5.951 10.697 ( -9.579 1.850 -3.464) 10.353 10.880 ( 1.072 -1.648 0.500) 2.029 11.029 ( 6.796 -0.829 11.054) 13.003 11.309 ( 4.646 -1.849 -2.602) 5.637 11.368 ( 2.108 1.050 -9.071) 9.372 11.464 ( 0.053 -6.652 2.507) 7.109 11.600 ( 1.402 -5.727 -14.365) 15.528 11.782 ( 1.037 2.185 2.481) 3.464 11.874 ( 4.608 5.372 -5.155) 8.755 12.036 ( 2.514 -6.483 1.736) 7.166 12.219 ( 2.288 12.085 7.144) 14.224 12.306 ( 3.903 -0.106 5.276) 6.564 12.507 ( 1.262 2.841 -1.103) 3.299 12.646 ( 3.251 3.685 11.655) 12.648 12.719 ( -3.970 6.052 3.188) 7.909 12.824 ( 1.066 -2.239 6.150) 6.631 12.847 ( 0.205 6.510 -0.162) 6.515 13.200 ( -6.607 -7.728 -4.764) 11.228 13.375 ( 10.767 15.157 -12.782) 22.562 13.506 ( 4.534 -2.322 2.540) 5.692 13.617 ( 4.460 1.348 1.467) 4.885 13.694 ( 7.149 2.131 3.541) 8.257 13.836 ( 3.459 4.852 3.212) 6.769 13.877 ( 2.583 2.231 -11.579) 12.071 13.954 ( 6.720 -2.864 -5.160) 8.944 14.011 ( -0.102 8.045 -12.743) 15.070 14.193 ( -5.771 -7.204 -8.759) 12.724 14.410 ( -7.295 2.285 4.481) 8.862 14.456 ( 4.640 8.728 -2.212) 10.129 14.695 ( 6.896 17.537 -2.973) 19.077 14.821 ( -13.519 -4.669 10.220) 17.578 14.986 ( 0.684 -6.903 2.969) 7.546 15.180 ( -2.070 -2.940 2.674) 4.481 15.516 ( 0.197 -0.340 6.553) 6.565 15.779 ( 0.459 -5.095 1.992) 5.490 15.918 ( 0.492 -0.486 3.100) 3.176 16.060 ( 0.741 3.090 -9.573) 10.086 16.361 ( -5.213 -0.377 5.675) 7.715 16.443 ( 2.542 -5.879 0.271) 6.411 17.552 ( 13.288 -12.535 16.421) 24.563 18.420 ( -6.714 -12.825 0.291) 14.479 18.520 ( 20.471 -21.939 -10.285) 31.720 18.534 ( -11.287 -16.433 1.138) 19.969 19.344 ( 3.308 8.193 5.240) 10.273 19.493 ( -2.801 0.996 4.207) 5.151 21.579 ( -6.477 19.505 -5.720) 21.333 23.187 ( -1.553 13.867 -18.043) 22.809 23.578 ( 9.151 -5.604 10.950) 15.331 24.654 ( 2.722 -7.686 3.895) 9.036 ======================= Grid point 119 (51/130) ======================= q-point: ( 0.00 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.474 ( 4.721 22.164 9.856) 24.712 1.575 ( 1.121 27.420 5.664) 28.021 2.647 ( 0.774 36.194 10.352) 37.653 2.806 ( 2.175 25.383 2.074) 25.560 2.863 ( -0.600 1.351 -24.805) 24.849 3.336 ( 3.342 7.603 -12.143) 14.711 3.892 ( -2.448 4.050 12.465) 13.333 4.114 ( -3.165 23.910 6.110) 24.881 4.317 ( 2.832 1.335 4.725) 5.668 4.373 ( 1.060 -3.658 2.023) 4.313 4.582 ( -1.345 -1.462 1.058) 2.250 4.825 ( -5.126 16.162 -2.970) 17.214 5.229 ( -0.666 2.551 -0.104) 2.639 5.478 ( -2.052 7.396 -3.610) 8.482 5.621 ( 0.171 1.056 0.384) 1.137 6.128 ( 1.491 18.640 3.103) 18.955 6.226 ( 2.205 -3.893 7.965) 9.135 6.342 ( 10.502 -8.371 -17.582) 22.125 6.797 ( 13.230 2.071 16.277) 21.077 6.969 ( -6.718 -3.220 5.568) 9.301 7.175 ( -11.332 5.432 -8.149) 14.977 7.275 ( 0.272 7.095 -2.371) 7.486 7.372 ( 11.566 6.860 -5.730) 14.618 7.451 ( -0.121 0.649 0.224) 0.697 7.758 ( -10.354 1.895 2.089) 10.732 7.824 ( -10.132 5.657 1.031) 11.650 8.280 ( 6.030 -4.681 -3.665) 8.467 8.394 ( 7.794 -11.565 -9.133) 16.670 8.457 ( -7.040 -6.679 0.325) 9.710 8.853 ( -7.143 -2.173 2.754) 7.958 8.903 ( 12.589 1.367 -12.677) 17.919 9.196 ( 7.028 3.121 -4.737) 9.032 9.355 ( -0.907 -2.926 18.535) 18.786 9.527 ( -8.624 -5.306 6.336) 11.944 9.596 ( -10.327 -5.086 11.075) 15.975 9.878 ( -0.125 -3.561 -8.945) 9.628 10.062 ( 1.646 1.441 -4.112) 4.658 10.315 ( -0.101 6.069 3.637) 7.076 10.391 ( -1.271 5.216 4.933) 7.291 10.650 ( 1.526 -0.219 2.283) 2.755 10.739 ( 0.915 -2.137 8.328) 8.646 10.757 ( 2.013 -2.210 1.624) 3.402 10.824 ( -0.692 4.397 1.421) 4.672 11.154 ( 3.332 -2.318 -4.318) 5.926 11.200 ( 4.583 -1.216 -0.053) 4.742 11.364 ( -2.900 2.889 2.851) 4.988 11.380 ( 2.416 -0.835 -17.627) 17.811 11.546 ( 0.120 1.428 -2.779) 3.127 11.868 ( 0.635 3.134 4.590) 5.594 11.988 ( 2.309 6.852 -1.671) 7.421 12.219 ( 1.239 5.193 9.588) 10.974 12.292 ( -0.447 -2.047 6.059) 6.411 12.481 ( -2.426 7.901 1.419) 8.386 12.546 ( -1.033 1.143 -2.479) 2.919 12.577 ( -2.490 -8.809 3.711) 9.878 12.787 ( -2.372 0.547 -0.041) 2.434 12.821 ( -1.499 2.959 -3.897) 5.118 13.020 ( 5.237 -1.546 5.904) 8.042 13.113 ( 4.500 -3.074 3.115) 6.277 13.414 ( -7.029 1.540 -6.741) 9.860 13.488 ( -1.852 1.083 1.516) 2.627 13.642 ( -0.981 -1.164 -2.315) 2.770 13.824 ( 2.799 2.954 -5.634) 6.949 13.854 ( -0.001 -3.433 -5.308) 6.322 13.957 ( 7.495 -2.840 -2.772) 8.481 14.004 ( -1.121 2.299 -6.897) 7.356 14.096 ( -0.303 4.838 -0.845) 4.921 14.150 ( 3.370 9.744 -3.713) 10.958 14.392 ( 0.454 2.204 0.009) 2.251 14.463 ( 1.167 -0.852 -4.604) 4.826 14.480 ( -10.514 -0.428 4.938) 11.624 14.694 ( 0.849 -9.367 1.359) 9.504 14.975 ( -4.730 -6.971 5.669) 10.154 15.469 ( 3.638 -3.614 -0.494) 5.152 15.563 ( 2.984 -6.969 -0.363) 7.590 15.765 ( 17.318 2.387 -5.000) 18.183 15.889 ( -1.953 -2.415 2.240) 3.829 16.059 ( 3.200 -4.151 -7.214) 8.917 16.271 ( -5.687 0.291 -0.282) 5.701 16.291 ( -2.537 -8.937 2.846) 9.716 17.178 ( -24.306 -13.332 29.308) 40.342 17.841 ( -6.589 -26.276 1.444) 27.129 18.360 ( 11.147 3.423 -8.690) 14.542 18.620 ( 13.850 -3.682 -12.736) 19.173 19.457 ( -3.794 0.853 6.505) 7.579 19.464 ( -3.046 1.871 6.691) 7.586 22.076 ( 5.987 24.345 4.316) 25.439 22.927 ( -19.013 18.434 -25.351) 36.660 23.930 ( 17.133 -14.245 15.416) 27.095 24.411 ( -5.335 -12.779 -2.804) 14.129 ======================= Grid point 120 (52/130) ======================= q-point: ( 0.10 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.763 ( 14.258 19.839 6.741) 25.344 1.815 ( 17.346 17.334 14.418) 28.447 2.664 ( 0.071 -2.737 -22.593) 22.758 2.771 ( 7.487 23.954 -7.470) 26.185 2.983 ( 10.851 30.187 11.709) 34.149 3.346 ( 7.892 3.516 -13.787) 16.271 3.940 ( -2.038 4.994 12.531) 13.643 4.092 ( -4.258 25.530 10.082) 27.777 4.272 ( -5.153 2.532 -2.362) 6.208 4.459 ( 0.365 9.184 4.490) 10.230 4.529 ( -4.112 -0.695 1.104) 4.314 4.715 ( -3.098 10.368 -3.744) 11.450 5.210 ( -0.826 1.849 2.027) 2.865 5.429 ( -0.841 3.402 -2.491) 4.299 5.630 ( 0.620 3.959 -2.381) 4.661 6.141 ( -5.635 13.122 11.702) 18.462 6.336 ( 5.592 -7.285 -10.362) 13.846 6.392 ( 4.236 -1.539 2.478) 5.143 6.816 ( -14.877 -1.001 -3.162) 15.242 6.897 ( -3.984 -0.865 0.361) 4.093 7.114 ( 4.815 3.635 6.786) 9.080 7.357 ( 6.843 -2.542 -7.593) 10.533 7.430 ( 5.332 10.869 -11.034) 16.380 7.547 ( -4.328 11.449 8.770) 15.057 7.698 ( 7.417 -0.300 1.290) 7.535 7.914 ( 21.327 -2.602 -3.872) 21.831 8.242 ( -4.461 -4.063 -5.993) 8.504 8.318 ( -0.619 -2.728 -10.148) 10.527 8.462 ( -3.512 -4.907 3.765) 7.112 8.854 ( 7.447 -10.201 -2.188) 12.818 9.039 ( 7.373 -0.057 -4.906) 8.856 9.210 ( -3.722 2.257 3.939) 5.871 9.419 ( -3.678 -5.782 0.417) 6.865 9.509 ( -10.091 -7.759 20.558) 24.179 9.527 ( 9.574 -1.292 1.783) 9.824 9.841 ( 0.336 -3.308 -1.612) 3.695 10.104 ( 5.434 -0.888 -2.737) 6.149 10.267 ( -4.580 7.613 -0.697) 8.911 10.434 ( -1.671 2.030 9.903) 10.246 10.633 ( -0.273 12.372 -2.524) 12.630 10.675 ( -2.991 -0.077 -3.284) 4.443 10.839 ( -0.536 0.582 3.775) 3.857 10.890 ( -0.624 -6.804 7.232) 9.949 11.153 ( 0.985 0.864 -7.066) 7.186 11.266 ( 0.705 -1.802 0.808) 2.097 11.282 ( -7.364 4.965 1.663) 9.036 11.315 ( 2.416 4.352 -13.492) 14.381 11.582 ( 5.499 -3.052 -1.331) 6.428 11.914 ( 0.356 3.937 2.781) 4.833 11.996 ( -0.980 3.188 0.088) 3.336 12.208 ( -4.370 5.002 0.636) 6.672 12.338 ( -1.637 8.020 7.203) 10.903 12.413 ( -1.846 -0.384 2.311) 2.982 12.537 ( -1.602 -0.744 -0.045) 1.767 12.582 ( -0.112 -2.765 8.833) 9.256 12.710 ( -5.295 -2.887 1.831) 6.303 12.819 ( 2.064 5.186 -2.112) 5.968 13.078 ( -6.873 -4.909 -8.275) 11.824 13.196 ( 5.925 -3.747 4.734) 8.459 13.291 ( 1.840 -2.467 2.525) 3.981 13.442 ( -4.491 -0.871 0.539) 4.607 13.591 ( -4.959 1.355 -1.467) 5.346 13.738 ( -2.707 6.628 -6.089) 9.399 13.789 ( -7.286 0.003 1.187) 7.382 13.887 ( -3.641 -1.010 -5.526) 6.694 14.066 ( 3.626 -1.415 -7.328) 8.298 14.157 ( -0.979 3.900 -3.014) 5.025 14.177 ( 6.949 5.996 -4.473) 10.210 14.264 ( 0.506 1.908 -3.359) 3.895 14.503 ( 2.850 5.145 2.089) 6.242 14.543 ( 7.953 -1.787 -0.240) 8.155 14.765 ( 1.663 -5.997 4.732) 7.818 14.908 ( -3.019 -7.740 2.063) 8.560 15.478 ( -3.380 -3.900 4.459) 6.820 15.554 ( -3.307 -8.539 1.424) 9.267 15.858 ( -3.306 -0.423 2.150) 3.966 15.933 ( -3.969 -2.123 5.192) 6.872 16.142 ( 2.127 -2.551 -8.638) 9.255 16.192 ( 8.452 -6.557 -11.962) 16.048 16.278 ( 4.185 -12.776 1.582) 13.537 16.881 ( -21.326 -5.836 21.111) 30.571 17.672 ( -9.087 -23.853 -3.974) 25.833 18.544 ( 10.523 0.531 -3.548) 11.118 18.757 ( 6.294 -3.804 -5.642) 9.269 19.439 ( -2.215 1.743 4.588) 5.385 19.451 ( -3.310 2.483 6.678) 7.856 22.315 ( 12.661 21.062 10.672) 26.791 22.466 ( -12.227 27.626 -18.242) 35.291 24.196 ( -10.591 -12.376 -6.631) 17.587 24.245 ( 5.012 -17.206 8.872) 19.997 ======================= Grid point 121 (53/130) ======================= q-point: ( 0.20 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.127 ( 19.163 15.323 4.024) 24.864 2.244 ( 15.665 14.659 12.829) 24.998 2.525 ( 2.341 -0.882 -21.529) 21.674 2.886 ( 9.882 20.076 -7.855) 23.715 3.287 ( 13.088 20.555 3.631) 24.637 3.446 ( 10.897 -0.519 -10.825) 15.369 3.978 ( -1.447 7.347 6.119) 9.670 4.111 ( -2.392 16.382 13.200) 21.173 4.143 ( -5.842 3.369 -1.271) 6.863 4.395 ( -5.576 5.874 0.056) 8.099 4.527 ( 1.261 19.750 5.166) 20.453 4.637 ( -4.292 0.664 1.114) 4.483 5.190 ( -3.146 6.704 -0.127) 7.406 5.383 ( -4.905 4.944 -0.933) 7.027 5.677 ( 7.019 0.975 2.560) 7.534 6.065 ( -6.446 -2.667 -3.037) 7.609 6.237 ( -7.764 -4.294 0.850) 8.913 6.503 ( -9.431 -3.773 -7.399) 12.567 6.595 ( 5.946 4.552 7.310) 10.465 6.873 ( -1.473 -0.504 4.020) 4.311 7.162 ( 3.099 6.964 -9.290) 12.017 7.355 ( 1.284 2.526 -4.896) 5.657 7.467 ( 0.050 13.721 4.004) 14.294 7.706 ( 13.019 15.454 -7.547) 21.571 7.773 ( 5.880 -6.201 -0.556) 8.564 8.022 ( -5.884 -8.341 -1.914) 10.386 8.192 ( 0.411 3.497 -7.201) 8.016 8.368 ( -5.362 0.224 -0.508) 5.391 8.505 ( 21.246 -6.379 -3.973) 22.536 8.952 ( -0.979 -3.913 5.901) 7.148 9.141 ( 5.103 -8.276 1.328) 9.813 9.163 ( -1.891 -3.065 3.853) 5.274 9.415 ( -0.291 -5.146 4.550) 6.875 9.484 ( -0.038 -6.820 5.631) 8.844 9.739 ( 10.348 -2.059 2.244) 10.787 9.866 ( 1.379 -1.808 3.077) 3.826 10.156 ( -5.228 6.480 -0.808) 8.365 10.217 ( 6.182 -4.114 -2.491) 7.832 10.430 ( -5.512 0.614 8.577) 10.214 10.584 ( -2.216 0.034 -5.625) 6.046 10.649 ( 2.355 13.094 -1.949) 13.446 10.800 ( -7.533 -4.427 3.087) 9.267 10.854 ( -2.900 2.049 0.241) 3.560 11.069 ( -6.543 9.839 -4.243) 12.555 11.140 ( -2.825 6.498 -4.062) 8.167 11.279 ( -0.593 0.502 0.099) 0.783 11.296 ( 4.402 4.459 -9.401) 11.298 11.693 ( 5.625 -4.992 -0.227) 7.524 11.887 ( -2.945 6.317 -2.691) 7.471 11.959 ( -3.896 -1.352 3.688) 5.532 12.139 ( -3.375 12.426 0.757) 12.898 12.328 ( -3.566 2.335 5.316) 6.814 12.396 ( -3.597 0.101 2.558) 4.414 12.546 ( 2.425 -2.398 1.407) 3.689 12.615 ( -8.521 -3.467 9.369) 13.130 12.619 ( -1.015 -2.863 1.531) 3.401 12.823 ( -1.743 -1.381 -3.305) 3.983 12.955 ( 0.308 2.687 1.928) 3.321 13.296 ( -4.400 -5.264 0.318) 6.868 13.321 ( 1.404 -1.567 -3.647) 4.211 13.335 ( -5.478 -3.245 2.565) 6.864 13.470 ( -1.107 -3.381 -4.383) 5.645 13.604 ( -5.145 3.982 -3.366) 7.325 13.701 ( -6.864 2.940 -2.879) 8.003 13.818 ( 0.102 3.251 6.189) 6.992 14.043 ( 0.448 0.195 -7.354) 7.370 14.087 ( -1.002 1.602 -4.732) 5.096 14.231 ( 3.841 2.861 -6.052) 7.718 14.365 ( 5.002 5.253 -6.707) 9.879 14.531 ( 0.737 0.091 3.011) 3.101 14.739 ( 6.312 -1.091 3.854) 7.475 14.767 ( 2.970 1.570 4.018) 5.237 14.975 ( 5.795 -10.164 1.447) 11.789 15.421 ( -7.015 -2.301 8.569) 11.311 15.485 ( -5.490 -7.918 4.504) 10.636 15.789 ( -5.908 -0.110 3.374) 6.805 15.808 ( -10.844 -10.045 7.956) 16.787 16.112 ( 2.972 0.720 -8.687) 9.210 16.169 ( -3.687 -7.620 1.282) 8.562 16.511 ( 18.472 -13.035 -16.776) 28.152 16.735 ( -5.300 -1.327 9.774) 11.197 17.473 ( -7.414 -20.570 -6.881) 22.923 18.672 ( 3.928 -1.849 0.076) 4.342 18.775 ( -1.716 -2.840 0.116) 3.320 19.415 ( -3.309 3.748 3.509) 6.108 19.438 ( -1.804 3.422 2.634) 4.680 22.209 ( -4.998 25.941 -10.092) 28.280 22.660 ( 12.739 15.283 15.200) 25.037 23.859 ( -15.062 -10.302 -12.733) 22.251 24.365 ( 0.855 -15.622 6.776) 17.050 ======================= Grid point 122 (54/130) ======================= q-point: ( 0.30 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.445 ( 7.782 4.914 -11.593) 14.802 2.540 ( 16.298 7.369 -1.080) 17.919 2.563 ( 11.236 16.798 6.994) 21.385 3.028 ( 9.667 18.688 -5.842) 21.836 3.491 ( 8.112 14.076 -1.826) 16.348 3.560 ( 6.012 1.660 -6.103) 8.726 3.932 ( -4.310 0.251 -3.980) 5.872 4.066 ( -1.481 15.815 6.199) 17.051 4.172 ( -4.649 4.726 6.288) 9.138 4.301 ( -0.740 3.236 1.522) 3.651 4.502 ( -5.210 0.086 0.616) 5.247 4.710 ( 2.917 15.348 12.327) 19.901 5.105 ( -3.876 13.178 1.289) 13.796 5.272 ( -3.101 10.051 -2.849) 10.898 5.843 ( -8.381 -12.693 -13.759) 20.510 5.882 ( 9.043 -3.807 4.333) 10.726 6.138 ( -9.113 3.820 14.280) 17.366 6.249 ( -8.549 -3.427 -8.534) 12.556 6.773 ( 4.442 2.044 7.608) 9.044 6.884 ( -0.021 -2.803 3.809) 4.729 7.199 ( 8.859 5.708 -9.753) 14.359 7.303 ( -3.173 -7.291 -4.857) 9.318 7.517 ( 3.004 20.240 1.936) 20.553 7.720 ( -0.058 4.513 -6.892) 8.238 7.902 ( 1.122 2.592 -3.562) 4.546 7.993 ( 1.526 1.897 -4.436) 5.060 8.208 ( 8.952 4.370 -3.619) 10.599 8.288 ( -0.491 3.567 -4.282) 5.595 8.728 ( 2.360 -3.442 2.129) 4.685 8.974 ( -2.988 1.309 15.750) 16.085 9.164 ( 0.303 -4.726 5.345) 7.141 9.276 ( 7.100 -14.535 -3.938) 16.649 9.449 ( 0.239 -5.605 11.118) 12.453 9.589 ( 8.870 -2.747 -5.128) 10.607 9.911 ( 1.348 -0.695 3.383) 3.707 9.919 ( 4.613 0.245 0.126) 4.621 10.053 ( -4.278 5.691 -0.659) 7.150 10.244 ( -2.592 -6.069 -0.870) 6.657 10.383 ( -1.543 0.906 1.256) 2.186 10.492 ( -4.682 -3.246 -3.602) 6.740 10.638 ( -5.804 2.889 -1.173) 6.588 10.697 ( -0.641 2.240 0.787) 2.459 10.827 ( 0.706 7.085 -0.108) 7.121 10.966 ( -0.899 15.679 -0.466) 15.712 11.087 ( 0.367 6.810 -4.146) 7.981 11.279 ( 1.195 2.386 -0.264) 2.682 11.329 ( 3.944 3.289 -5.009) 7.174 11.779 ( 4.527 -2.862 -2.792) 6.040 11.800 ( -3.482 6.571 -2.887) 7.978 11.882 ( -7.257 3.593 3.585) 8.856 12.066 ( -4.354 7.988 -2.284) 9.380 12.261 ( -5.054 1.758 0.060) 5.352 12.317 ( -5.705 -3.075 -0.115) 6.482 12.514 ( -7.748 -4.040 10.023) 13.297 12.600 ( -1.127 -4.378 1.416) 4.738 12.617 ( 0.913 0.222 3.360) 3.489 12.739 ( -4.295 -3.574 -1.013) 5.678 13.015 ( 2.120 0.347 1.337) 2.530 13.154 ( -4.982 -4.149 -5.457) 8.474 13.256 ( -3.839 -1.083 5.906) 7.127 13.297 ( -3.543 9.684 -3.579) 10.915 13.423 ( -0.011 5.148 -5.005) 7.180 13.498 ( -5.862 5.895 -4.458) 9.433 13.638 ( 2.766 -11.363 2.884) 12.045 13.882 ( -0.194 -0.124 6.455) 6.459 13.956 ( -4.143 1.641 -4.287) 6.183 14.075 ( 1.500 -1.376 -2.244) 3.030 14.258 ( 0.195 -4.245 -1.451) 4.490 14.340 ( 3.697 -0.395 -6.143) 7.180 14.575 ( -2.140 0.534 4.633) 5.131 14.857 ( 9.668 4.272 -1.460) 10.670 14.956 ( 8.331 -1.967 2.195) 8.837 15.078 ( 4.248 -6.927 0.554) 8.145 15.346 ( -6.771 -2.162 9.116) 11.560 15.426 ( -5.785 -10.392 9.274) 15.082 15.643 ( -7.860 -13.182 2.698) 15.583 15.752 ( -2.330 3.290 3.971) 5.659 16.088 ( -5.883 -3.612 3.639) 7.803 16.123 ( 2.979 3.167 -7.475) 8.648 16.654 ( 9.463 -5.903 -16.758) 20.130 16.816 ( 7.592 -6.955 2.394) 10.570 17.307 ( -4.712 -16.738 -7.337) 18.874 18.671 ( -4.526 -1.270 1.612) 4.969 18.749 ( -1.099 -4.221 2.261) 4.913 19.372 ( -2.601 4.174 1.148) 5.050 19.409 ( -2.402 4.923 0.933) 5.556 22.108 ( -1.195 21.370 -3.636) 21.710 22.970 ( 7.569 11.670 15.552) 20.865 23.496 ( -12.056 -9.132 -13.561) 20.314 24.388 ( -1.492 -13.534 2.769) 13.895 ======================= Grid point 123 (55/130) ======================= q-point: ( 0.40 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.528 ( 8.347 5.126 -2.023) 10.002 2.759 ( 6.225 14.671 4.105) 16.457 2.875 ( 16.278 7.507 -1.293) 17.973 3.155 ( 6.586 17.281 -3.569) 18.835 3.580 ( 4.528 -4.860 -11.869) 13.602 3.586 ( -1.510 16.064 6.829) 17.521 3.829 ( -2.590 5.213 -4.243) 7.203 3.982 ( -10.447 12.392 0.313) 16.211 4.154 ( 0.845 8.463 8.302) 11.885 4.286 ( -3.960 -1.586 -1.651) 4.574 4.510 ( 3.387 -0.743 3.555) 4.966 4.699 ( -7.406 11.428 6.262) 14.988 5.069 ( -1.817 17.933 -9.354) 20.308 5.319 ( 5.940 10.168 10.056) 15.485 5.600 ( -5.749 -9.794 -12.909) 17.194 6.022 ( -1.758 -3.674 -2.066) 4.566 6.054 ( -0.054 -3.596 6.433) 7.370 6.141 ( -3.829 -0.322 8.065) 8.934 6.837 ( -1.095 -1.510 3.049) 3.574 6.929 ( 0.836 -5.296 6.347) 8.308 7.227 ( -0.628 -8.877 -3.124) 9.431 7.358 ( 12.580 1.841 -6.178) 14.136 7.573 ( -0.414 21.197 2.916) 21.400 7.696 ( 4.596 5.614 -8.158) 10.917 7.853 ( -2.799 3.622 -4.290) 6.274 7.926 ( -3.219 7.206 -2.922) 8.416 8.245 ( 1.662 5.873 -6.372) 8.824 8.400 ( 7.773 3.769 -3.344) 9.263 8.730 ( -3.168 -3.727 7.329) 8.811 9.048 ( -1.188 3.256 12.818) 13.278 9.183 ( -3.515 -7.073 7.741) 11.059 9.369 ( 5.476 -13.511 -1.731) 14.681 9.586 ( 7.063 -1.827 3.944) 8.293 9.715 ( 7.698 0.442 -4.920) 9.147 9.874 ( -5.949 -2.740 -3.155) 7.270 9.929 ( -1.008 2.217 1.194) 2.712 9.981 ( -2.671 3.434 -0.386) 4.368 10.249 ( 0.660 -0.937 2.306) 2.575 10.310 ( -6.211 -8.026 -0.117) 10.149 10.406 ( -0.908 0.398 -2.915) 3.079 10.563 ( -0.491 11.084 -1.442) 11.188 10.672 ( -2.390 2.710 1.939) 4.101 10.837 ( -0.295 4.659 1.201) 4.820 11.030 ( 4.533 13.693 3.092) 14.752 11.106 ( 3.496 6.010 -2.236) 7.304 11.312 ( 3.191 1.628 -4.536) 5.779 11.378 ( 3.257 1.289 -0.337) 3.519 11.727 ( -3.894 7.736 0.221) 8.664 11.743 ( -6.054 9.151 -0.060) 10.973 11.840 ( 4.468 2.148 -4.264) 6.540 11.934 ( -6.838 0.301 -3.421) 7.652 12.163 ( -4.053 -1.146 -2.596) 4.948 12.196 ( -4.895 -2.641 -3.767) 6.718 12.425 ( -7.934 0.728 5.064) 9.441 12.577 ( -0.834 -2.111 -0.414) 2.308 12.636 ( -1.161 0.640 2.293) 2.649 12.688 ( -1.915 -2.485 2.466) 3.990 13.004 ( -1.586 -3.372 -6.815) 7.767 13.058 ( -0.702 -5.313 -5.035) 7.353 13.222 ( -1.835 3.864 -1.920) 4.688 13.253 ( -2.744 4.164 2.102) 5.412 13.332 ( -0.487 10.049 1.807) 10.222 13.498 ( 1.210 11.428 6.489) 13.197 13.716 ( 2.667 -14.915 1.670) 15.243 13.835 ( -4.097 5.103 -1.482) 6.710 13.922 ( -0.435 -8.914 4.721) 10.097 14.111 ( 2.274 -3.826 2.245) 4.985 14.253 ( -1.219 -4.893 3.743) 6.280 14.419 ( 7.529 -5.792 -7.842) 12.318 14.536 ( -3.345 -0.203 2.991) 4.492 14.965 ( 1.951 -10.074 -2.130) 10.480 15.079 ( 2.889 1.508 -0.757) 3.345 15.172 ( 5.771 1.452 -3.123) 6.720 15.316 ( -1.848 -3.363 9.110) 9.885 15.386 ( -3.882 -13.532 6.660) 15.574 15.561 ( -2.600 -7.795 1.868) 8.426 15.745 ( -2.876 4.114 6.886) 8.522 15.988 ( -7.541 -0.675 5.790) 9.531 16.137 ( 3.723 6.626 -6.806) 10.202 16.701 ( 7.498 -4.492 -15.698) 17.967 16.957 ( 5.965 -6.849 -1.529) 9.210 17.199 ( -1.316 -13.834 -6.739) 15.445 18.581 ( -5.681 -0.455 2.640) 6.281 18.735 ( -1.894 -5.826 1.108) 6.226 19.343 ( -0.437 3.134 -0.484) 3.201 19.372 ( -1.916 6.137 1.100) 6.523 22.096 ( 0.627 18.029 1.169) 18.078 23.030 ( -6.905 9.768 -7.280) 14.003 23.366 ( 3.285 -7.798 8.871) 12.259 24.356 ( -2.199 -12.087 -1.319) 12.356 ======================= Grid point 124 (56/130) ======================= q-point: (-0.50 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.730 ( 9.122 3.505 9.779) 13.825 2.820 ( -3.399 12.907 2.630) 13.604 3.122 ( 9.419 5.729 -0.977) 11.067 3.205 ( 0.538 13.528 -1.919) 13.674 3.482 ( -13.009 9.845 2.676) 16.533 3.576 ( 4.275 -2.281 -14.641) 15.422 3.767 ( 0.635 -3.012 -4.451) 5.412 3.899 ( 0.361 28.821 6.046) 29.451 4.197 ( -0.497 0.291 0.753) 0.948 4.212 ( -2.333 6.019 2.236) 6.832 4.543 ( -1.425 4.550 1.409) 4.972 4.660 ( -1.676 8.800 6.173) 10.879 4.910 ( -5.768 17.392 -11.727) 21.755 5.456 ( 3.705 -3.984 -2.773) 6.106 5.529 ( 4.054 2.705 -0.088) 4.875 5.955 ( -3.080 -4.062 -2.642) 5.742 6.078 ( -3.727 -1.747 8.833) 9.745 6.188 ( 2.903 -3.996 7.983) 9.387 6.812 ( -1.467 -0.005 -0.776) 1.660 6.996 ( -0.480 -9.093 10.863) 14.175 7.233 ( 2.127 -6.539 -1.793) 7.106 7.487 ( 0.607 4.464 -2.157) 4.994 7.556 ( -1.894 14.579 -2.808) 14.967 7.763 ( 6.014 9.550 -0.939) 11.325 7.776 ( 1.286 5.846 -5.631) 8.218 7.930 ( 8.090 5.124 -6.130) 11.370 8.234 ( 1.690 4.267 -5.691) 7.311 8.444 ( -0.999 4.638 -1.388) 4.943 8.746 ( -1.219 -4.073 9.639) 10.535 9.012 ( -10.090 3.138 4.058) 11.320 9.149 ( -5.468 -7.309 8.183) 12.259 9.470 ( 3.921 -11.921 2.349) 12.767 9.662 ( -5.290 5.965 -0.176) 7.975 9.783 ( 3.836 -2.974 -2.923) 5.666 9.822 ( 5.414 -1.448 -0.704) 5.648 9.870 ( -2.618 -2.685 -3.030) 4.821 10.028 ( 6.300 0.679 1.225) 6.454 10.149 ( -7.958 -4.737 2.654) 9.634 10.259 ( -3.176 -1.159 -1.860) 3.859 10.389 ( 1.629 0.395 -3.826) 4.178 10.605 ( 4.003 11.521 2.395) 12.430 10.648 ( -1.163 5.271 1.582) 5.625 10.880 ( 2.863 6.071 5.073) 8.414 11.082 ( -2.057 7.652 1.585) 8.081 11.141 ( 0.420 6.651 -2.474) 7.109 11.328 ( 1.485 1.252 -4.532) 4.931 11.428 ( 2.660 0.246 -0.409) 2.702 11.648 ( -0.745 11.987 2.204) 12.211 11.751 ( 2.542 7.011 2.368) 7.825 11.794 ( -3.099 -2.577 -3.823) 5.556 11.909 ( 4.860 3.944 -2.728) 6.828 12.067 ( -1.671 5.753 -9.891) 11.563 12.112 ( -0.341 -3.364 -3.682) 4.998 12.271 ( -8.771 -0.135 -2.079) 9.015 12.583 ( 1.576 -0.669 0.351) 1.748 12.634 ( -0.567 0.496 1.882) 2.027 12.672 ( -0.929 0.778 1.630) 2.032 12.899 ( -2.932 -4.268 -8.778) 10.191 13.044 ( 1.552 -7.558 -4.071) 8.723 13.123 ( -3.359 8.951 -2.049) 9.778 13.289 ( 3.075 4.361 4.698) 7.110 13.437 ( 4.131 1.466 6.695) 8.002 13.555 ( 0.335 8.976 5.597) 10.584 13.741 ( -1.358 -8.052 1.403) 8.286 13.792 ( 0.283 1.039 1.281) 1.674 13.963 ( 1.466 -6.364 3.547) 7.431 14.186 ( 0.244 -5.245 8.136) 9.683 14.231 ( -1.630 -2.100 1.076) 2.868 14.479 ( 4.024 -6.924 -7.618) 11.053 14.535 ( 0.554 -3.528 5.615) 6.654 14.929 ( -2.394 -14.298 -5.035) 15.347 15.084 ( -1.338 -1.069 -2.443) 2.983 15.175 ( -1.029 -3.634 -2.026) 4.286 15.386 ( 0.832 -8.754 1.311) 8.890 15.392 ( 1.781 -3.440 4.093) 5.636 15.550 ( -2.362 -4.618 7.157) 8.839 15.725 ( -4.859 4.328 8.572) 10.762 15.904 ( -4.630 1.407 4.853) 6.853 16.177 ( 4.786 7.790 -4.571) 10.222 16.713 ( 4.807 -4.976 -15.721) 17.176 17.015 ( 2.127 -4.218 -2.683) 5.432 17.173 ( 3.386 -13.205 -6.142) 14.952 18.506 ( -3.944 -0.143 2.134) 4.486 18.693 ( -2.779 -6.813 -0.005) 7.358 19.349 ( 0.645 3.774 0.128) 3.831 19.368 ( 1.397 4.981 0.865) 5.245 22.146 ( 2.349 16.353 5.091) 17.288 22.801 ( -7.158 8.573 -13.972) 17.887 23.563 ( 6.423 -6.091 15.373) 17.740 24.291 ( -2.282 -11.128 -5.146) 12.471 ======================= Grid point 125 (57/130) ======================= q-point: (-0.40 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.661 ( -13.700 12.639 0.941) 18.663 2.939 ( -0.124 3.718 9.760) 10.445 3.030 ( -18.595 6.407 0.669) 19.679 3.127 ( -3.210 11.383 -1.786) 11.961 3.396 ( 5.890 6.529 -4.242) 9.763 3.533 ( 1.113 -0.826 -14.402) 14.469 3.812 ( 3.687 2.004 1.685) 4.522 3.993 ( 3.206 25.636 7.330) 26.855 4.189 ( -1.691 5.757 0.893) 6.067 4.228 ( 5.290 6.966 -0.993) 8.803 4.485 ( -4.701 4.686 -2.385) 7.053 4.607 ( -9.206 9.988 3.201) 13.955 4.844 ( 7.436 13.437 -0.613) 15.369 5.539 ( 1.638 0.860 4.351) 4.728 5.621 ( 10.864 -7.274 -9.085) 15.921 5.837 ( -5.044 -2.785 -5.950) 8.283 6.070 ( -4.257 0.383 10.008) 10.883 6.347 ( 6.930 -6.348 9.149) 13.116 6.777 ( -2.744 4.541 0.912) 5.383 7.050 ( -2.345 -6.117 12.534) 14.143 7.235 ( -0.726 -1.076 -5.739) 5.884 7.408 ( -7.345 14.818 -1.790) 16.635 7.439 ( -1.375 -0.811 -7.722) 7.885 7.816 ( 5.359 11.709 -3.056) 13.235 7.937 ( 8.686 7.846 2.536) 11.976 8.095 ( 13.026 0.727 -9.273) 16.006 8.248 ( 5.594 -2.114 -9.328) 11.080 8.358 ( -7.439 8.586 0.826) 11.391 8.760 ( -15.558 0.468 5.308) 16.445 8.805 ( -1.697 -5.005 8.755) 10.226 9.112 ( -4.691 -5.195 10.695) 12.782 9.476 ( -12.859 0.039 1.208) 12.915 9.502 ( -2.501 -11.438 1.859) 11.855 9.811 ( -0.006 -5.704 -4.473) 7.249 9.869 ( 4.104 3.678 -0.499) 5.533 9.909 ( 2.932 -3.395 -2.187) 4.990 10.044 ( -4.494 -2.848 4.046) 6.684 10.175 ( 4.131 -0.231 -0.627) 4.185 10.197 ( 2.866 -2.525 -2.237) 4.427 10.385 ( 0.344 0.363 -4.716) 4.742 10.632 ( -0.005 3.119 -0.155) 3.123 10.735 ( 4.523 9.923 5.359) 12.151 10.962 ( -0.674 11.577 1.845) 11.743 11.009 ( -2.039 1.406 2.313) 3.389 11.122 ( 1.375 5.596 -3.572) 6.780 11.302 ( -2.895 5.239 2.382) 6.442 11.496 ( 4.216 -2.691 -0.241) 5.008 11.674 ( 0.461 -2.483 0.236) 2.536 11.747 ( 2.526 6.814 -4.438) 8.515 11.890 ( 6.747 9.449 4.907) 12.605 11.945 ( 1.199 11.273 -11.263) 15.981 12.016 ( 5.051 8.670 -4.951) 11.189 12.080 ( -5.437 -4.017 -1.490) 6.923 12.172 ( 5.565 -4.085 -2.913) 7.493 12.604 ( -1.734 2.368 -1.506) 3.299 12.641 ( 1.879 0.076 1.454) 2.377 12.701 ( 3.302 -0.285 1.645) 3.700 12.802 ( -1.038 -6.266 -5.740) 8.561 13.043 ( 1.112 -4.939 -2.517) 5.653 13.117 ( 3.209 10.880 0.030) 11.344 13.396 ( 4.308 3.213 4.394) 6.942 13.481 ( -1.064 -9.835 -2.457) 10.193 13.627 ( 1.912 10.093 6.685) 12.257 13.698 ( -3.179 -3.509 0.812) 4.803 13.844 ( 1.474 -1.462 4.001) 4.508 14.034 ( 4.411 3.320 3.727) 6.661 14.128 ( -3.705 3.158 -3.006) 5.722 14.329 ( 3.249 -11.118 11.535) 16.347 14.468 ( 0.032 -4.602 -5.447) 7.131 14.610 ( 1.225 -2.223 8.294) 8.673 14.811 ( -4.945 -12.851 -9.469) 16.711 14.984 ( -4.279 -4.161 -7.466) 9.559 15.171 ( -1.058 -6.767 4.740) 8.330 15.386 ( -1.153 -5.265 -2.143) 5.800 15.424 ( -2.865 -4.074 8.693) 10.018 15.547 ( -3.593 -5.077 7.679) 9.881 15.710 ( -0.831 3.932 5.629) 6.916 15.893 ( 0.683 -0.588 2.591) 2.743 16.250 ( 5.001 6.103 -2.107) 8.167 16.650 ( -0.465 -4.473 -14.492) 15.174 17.028 ( 2.164 -2.287 -3.148) 4.452 17.244 ( 8.575 -15.222 -6.401) 18.607 18.460 ( -2.003 -0.352 0.456) 2.084 18.631 ( -3.582 -7.254 -0.352) 8.098 19.371 ( 1.170 6.123 1.499) 6.412 19.427 ( 3.599 2.337 0.640) 4.339 22.264 ( 5.277 15.641 9.078) 18.839 22.580 ( -6.282 11.225 -13.502) 18.648 23.807 ( 8.234 -7.698 14.624) 18.464 24.197 ( -2.738 -10.334 -8.789) 13.839 ======================= Grid point 126 (58/130) ======================= q-point: (-0.30 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.346 ( -19.205 16.623 -0.102) 25.400 2.515 ( -25.412 11.899 -5.994) 28.693 2.942 ( -3.974 16.777 -4.501) 17.819 3.136 ( -0.736 2.390 6.290) 6.769 3.344 ( -9.000 10.062 -6.686) 15.065 3.444 ( -3.220 -0.606 -5.707) 6.580 3.907 ( 4.079 9.299 4.487) 11.102 4.066 ( -0.603 16.083 1.885) 16.204 4.165 ( 0.459 11.537 0.849) 11.577 4.352 ( -1.784 4.449 -1.372) 4.986 4.422 ( 5.543 1.271 5.223) 7.721 4.499 ( 0.277 8.147 1.111) 8.227 5.068 ( 11.449 10.599 4.469) 16.229 5.553 ( -3.254 0.963 7.031) 7.807 5.630 ( -3.432 3.716 -5.252) 7.291 5.906 ( 16.068 -12.344 -12.563) 23.841 6.032 ( -4.362 1.366 4.099) 6.140 6.547 ( 5.573 -5.407 8.648) 11.622 6.711 ( -4.472 4.248 4.930) 7.896 7.072 ( -8.831 1.341 -4.562) 10.030 7.082 ( -4.524 0.635 6.699) 8.108 7.301 ( -2.261 18.760 -0.710) 18.909 7.425 ( 7.584 2.234 -12.437) 14.738 7.894 ( 1.930 3.403 -3.183) 5.043 8.029 ( -3.080 11.774 -8.783) 15.009 8.138 ( -0.383 2.694 1.524) 3.119 8.306 ( 6.406 -1.383 -1.450) 6.712 8.329 ( 3.672 -3.452 -4.904) 7.032 8.551 ( -5.932 -0.258 4.622) 7.524 8.844 ( 0.660 -8.224 2.861) 8.732 9.129 ( -3.694 -2.683 16.040) 16.677 9.207 ( -17.064 -3.953 4.320) 18.041 9.410 ( -8.136 -11.779 1.846) 14.435 9.791 ( -0.498 -3.801 -1.857) 4.259 9.874 ( -1.333 -6.087 0.015) 6.231 9.926 ( 0.813 -2.453 -2.920) 3.899 10.066 ( 3.123 1.282 3.923) 5.176 10.179 ( 0.784 -0.945 0.039) 1.229 10.300 ( 1.833 -1.127 -4.503) 4.991 10.331 ( 0.750 0.119 -4.005) 4.077 10.620 ( 0.249 4.625 -3.866) 6.033 10.827 ( 1.118 5.589 4.944) 7.545 10.933 ( -0.262 7.420 1.790) 7.637 11.040 ( 0.918 4.335 0.081) 4.432 11.134 ( 1.970 1.690 -4.450) 5.151 11.281 ( -2.190 4.330 7.178) 8.664 11.559 ( 2.604 -2.528 -1.911) 4.102 11.678 ( 1.767 -11.411 -4.526) 12.402 11.776 ( 2.836 10.278 -4.479) 11.565 11.872 ( 2.523 15.134 -11.846) 19.384 11.975 ( -3.234 2.147 1.422) 4.135 12.082 ( 5.567 6.652 2.981) 9.172 12.123 ( 7.429 8.530 4.025) 12.006 12.319 ( 8.946 -3.554 -0.716) 9.653 12.557 ( -0.854 2.652 -0.877) 2.921 12.666 ( 0.388 -0.450 0.784) 0.984 12.789 ( 2.332 -3.722 -0.643) 4.439 12.848 ( 9.752 -5.114 2.713) 11.341 13.046 ( 1.048 -3.024 -2.333) 3.961 13.244 ( 9.404 12.568 0.048) 15.697 13.392 ( -4.345 -12.040 -6.249) 14.244 13.503 ( 3.314 2.002 2.675) 4.706 13.621 ( -1.564 4.938 -2.006) 5.555 13.724 ( 1.819 2.589 6.118) 6.887 13.856 ( -2.218 0.424 3.531) 4.191 14.038 ( -1.948 4.151 -6.349) 7.832 14.187 ( 6.861 3.798 2.591) 8.259 14.387 ( -2.965 -5.222 -3.537) 6.969 14.497 ( 2.686 -8.698 11.026) 14.298 14.625 ( -5.347 -6.765 -10.873) 13.877 14.672 ( -0.830 1.106 6.912) 7.049 14.860 ( -3.144 -3.949 -6.146) 7.954 15.160 ( -5.719 -4.454 8.150) 10.907 15.323 ( -5.017 -2.279 1.356) 5.675 15.400 ( -4.898 -3.946 9.489) 11.385 15.549 ( 0.046 -9.346 2.910) 9.789 15.771 ( 3.128 1.162 3.940) 5.163 15.953 ( 4.186 -4.541 0.127) 6.178 16.324 ( 3.144 2.897 0.065) 4.276 16.513 ( -3.520 -2.021 -11.970) 12.639 17.072 ( 4.106 -2.732 -1.118) 5.057 17.407 ( 13.388 -19.189 -6.804) 24.367 18.430 ( -0.618 -0.936 -2.353) 2.606 18.553 ( -4.425 -7.100 -0.411) 8.376 19.409 ( 1.240 6.628 2.529) 7.202 19.494 ( 2.279 1.336 1.448) 3.012 22.366 ( -6.552 14.677 -10.970) 19.460 22.491 ( 10.174 14.440 13.393) 22.168 24.054 ( -2.739 -9.095 -9.428) 13.384 24.071 ( 7.539 -9.550 8.572) 14.884 ======================= Grid point 127 (59/130) ======================= q-point: (-0.20 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.940 ( -20.547 20.511 -7.113) 29.892 2.026 ( -23.145 19.486 1.816) 30.310 2.835 ( -4.359 24.649 -4.443) 25.422 3.011 ( -18.083 28.809 3.119) 34.156 3.146 ( 2.011 -1.368 -15.970) 16.155 3.347 ( -5.511 -0.736 6.214) 8.339 3.964 ( -1.681 22.342 -1.890) 22.485 4.054 ( 0.162 5.421 6.068) 8.138 4.231 ( 4.165 4.479 -0.860) 6.176 4.264 ( -3.409 -3.492 1.094) 5.002 4.505 ( 2.658 -3.022 3.819) 5.549 4.712 ( 10.748 13.298 6.659) 18.350 5.212 ( -0.142 5.488 1.546) 5.704 5.549 ( 2.587 3.675 -0.063) 4.495 5.653 ( 5.867 9.597 4.287) 12.037 5.863 ( -9.798 3.965 1.369) 10.658 6.151 ( 14.281 -12.371 -16.448) 25.050 6.490 ( -9.451 2.220 -1.409) 9.810 6.792 ( -10.156 7.930 -3.033) 13.237 6.894 ( 9.062 -7.241 12.988) 17.414 7.087 ( -2.619 2.222 7.030) 7.824 7.269 ( -1.166 21.509 -0.288) 21.543 7.538 ( 10.811 6.052 -16.338) 20.504 7.671 ( -9.444 5.674 -10.436) 15.176 8.002 ( -4.400 1.583 4.609) 6.565 8.101 ( -8.535 -4.181 4.329) 10.444 8.294 ( 0.431 -3.482 4.765) 5.918 8.429 ( 7.284 -4.071 -13.020) 15.464 8.606 ( 8.971 0.758 -7.699) 11.846 8.845 ( -14.254 -10.222 1.774) 17.630 8.909 ( -3.846 -6.265 4.904) 8.836 9.194 ( -3.384 -2.893 15.380) 16.012 9.245 ( -10.041 -8.001 5.589) 14.003 9.730 ( -5.866 -0.797 4.024) 7.158 9.875 ( -5.011 -5.623 0.584) 7.555 9.914 ( 5.802 -7.312 -6.444) 11.342 10.161 ( -3.485 -0.944 -2.481) 4.381 10.188 ( 5.293 -1.929 7.908) 9.710 10.235 ( 0.196 1.352 0.160) 1.375 10.386 ( 3.360 2.265 -2.264) 4.642 10.608 ( 2.015 4.824 -4.272) 6.752 10.849 ( -1.656 0.829 3.120) 3.628 10.945 ( -2.006 8.564 3.553) 9.486 11.030 ( 0.959 5.450 -4.730) 7.280 11.134 ( 2.681 -3.216 -6.780) 7.968 11.317 ( -0.230 1.927 8.163) 8.391 11.566 ( 2.471 -2.105 -10.121) 10.629 11.635 ( -1.069 -7.585 -10.369) 12.891 11.803 ( 3.675 7.562 -3.506) 9.109 11.877 ( 2.647 9.948 -2.102) 10.507 11.989 ( 1.158 8.035 7.432) 11.006 12.175 ( 3.057 0.476 3.904) 4.981 12.314 ( 7.156 8.270 5.409) 12.201 12.444 ( 4.387 -4.368 -1.123) 6.292 12.590 ( 2.178 1.623 6.049) 6.631 12.701 ( 3.091 -0.075 1.253) 3.336 12.824 ( 0.837 -0.893 0.238) 1.247 13.035 ( 2.063 3.815 -1.897) 4.734 13.136 ( 12.781 -7.354 4.971) 15.562 13.223 ( -6.006 -8.497 -8.893) 13.687 13.441 ( 9.363 9.684 -0.214) 13.472 13.535 ( 0.233 -5.036 0.796) 5.104 13.633 ( 3.791 5.696 -1.090) 6.929 13.814 ( 5.036 1.448 -0.488) 5.263 13.846 ( -0.708 3.550 2.610) 4.463 13.977 ( 1.372 7.089 -6.112) 9.460 14.228 ( -5.820 -5.369 -4.008) 8.875 14.273 ( -0.885 2.087 -6.994) 7.352 14.509 ( -0.336 -3.693 -6.816) 7.760 14.558 ( -5.823 -0.882 9.336) 11.038 14.685 ( -1.765 -5.553 2.810) 6.469 14.828 ( 2.239 1.509 0.465) 2.739 15.059 ( -11.144 -0.976 11.508) 16.049 15.244 ( -0.560 4.136 -4.609) 6.218 15.403 ( -0.735 -6.332 6.570) 9.154 15.575 ( 0.444 -11.348 2.852) 11.709 15.857 ( 2.362 -0.516 4.005) 4.678 16.030 ( 4.228 -6.910 -2.779) 8.564 16.351 ( -0.685 0.015 -2.226) 2.329 16.393 ( -1.852 -0.399 -3.234) 3.748 17.170 ( 4.344 -5.175 5.676) 8.824 17.646 ( 14.896 -24.244 -3.991) 28.734 18.395 ( -0.761 -2.466 -5.594) 6.160 18.467 ( -2.356 -4.363 -3.287) 5.949 19.445 ( 0.084 5.877 3.803) 7.000 19.522 ( -1.123 0.425 3.108) 3.331 22.170 ( -6.572 18.605 -7.718) 21.188 22.868 ( 17.752 10.026 18.734) 27.687 23.830 ( -8.683 -6.092 -18.247) 21.106 24.304 ( 7.557 -11.088 7.787) 15.515 ======================= Grid point 128 (60/130) ======================= q-point: (-0.10 0.25 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.551 ( -13.776 24.639 -3.363) 28.428 1.677 ( -15.344 26.280 5.647) 30.951 2.673 ( -11.266 36.875 9.071) 39.611 2.815 ( -3.497 28.923 -0.342) 29.136 3.037 ( 1.254 -1.768 -25.352) 25.445 3.340 ( 0.260 5.921 2.405) 6.396 3.894 ( -3.611 9.351 2.066) 10.235 4.104 ( -0.713 18.579 7.201) 19.939 4.228 ( 1.096 -4.504 2.478) 5.256 4.333 ( 3.558 -2.262 0.837) 4.298 4.570 ( 1.340 -2.525 2.395) 3.730 4.875 ( 0.839 15.886 5.131) 16.715 5.206 ( 2.058 4.739 -1.771) 5.462 5.561 ( -2.777 8.134 -0.866) 8.639 5.661 ( -5.528 0.012 -0.787) 5.584 5.925 ( 13.178 11.268 6.153) 18.398 6.260 ( 9.392 -9.266 -16.321) 20.987 6.282 ( -6.649 0.384 -7.035) 9.687 6.631 ( -6.422 12.460 11.340) 18.030 7.050 ( -4.986 -5.085 7.287) 10.189 7.196 ( 10.603 0.025 4.929) 11.693 7.256 ( 0.358 18.513 -1.075) 18.547 7.375 ( -5.339 11.218 -10.066) 15.990 7.622 ( -10.556 -6.394 -0.231) 12.344 7.820 ( -0.621 5.609 -10.354) 11.792 8.123 ( 5.511 -6.926 2.886) 9.310 8.222 ( -23.990 -6.121 9.942) 26.680 8.371 ( 4.715 -8.975 -14.697) 17.855 8.568 ( -7.875 -4.047 4.560) 9.959 8.754 ( 12.133 0.707 -13.272) 17.996 8.974 ( -0.708 -2.800 0.552) 2.940 9.086 ( -0.557 -4.937 -0.934) 5.055 9.277 ( -3.597 -1.179 19.862) 20.220 9.639 ( -7.947 -2.740 7.268) 11.113 9.741 ( -10.157 -4.446 4.997) 12.161 9.939 ( 2.707 -4.083 -12.041) 13.000 10.085 ( -1.198 1.513 -3.752) 4.220 10.258 ( 1.429 3.342 4.056) 5.447 10.392 ( 0.305 4.641 8.573) 9.754 10.441 ( 8.625 -8.819 6.887) 14.128 10.646 ( 4.077 2.325 -2.329) 5.239 10.816 ( -3.222 -2.182 1.304) 4.104 10.875 ( -4.451 11.264 -0.858) 12.142 11.075 ( 4.387 3.293 0.975) 5.571 11.150 ( 3.881 -4.550 -6.914) 9.141 11.362 ( -0.452 1.367 5.459) 5.646 11.483 ( 2.222 -3.263 -23.447) 23.777 11.574 ( -1.689 0.671 0.099) 1.820 11.840 ( 0.848 4.566 0.951) 4.741 11.934 ( 4.134 7.699 -1.425) 8.854 12.095 ( 2.606 8.081 11.393) 14.209 12.251 ( 1.248 -2.989 5.335) 6.241 12.452 ( 3.571 2.812 2.928) 5.406 12.502 ( 3.357 -4.249 0.684) 5.458 12.637 ( -2.308 -1.401 3.466) 4.393 12.798 ( 3.123 3.953 -3.013) 5.870 12.844 ( 2.049 0.948 6.771) 7.137 12.984 ( -4.841 1.938 -6.036) 7.976 13.063 ( -2.009 -1.013 0.212) 2.260 13.415 ( 8.331 -5.479 1.634) 10.105 13.513 ( -0.463 0.673 0.591) 1.008 13.634 ( 6.985 -4.180 -2.009) 8.385 13.718 ( 6.365 1.472 -2.664) 7.056 13.849 ( 2.846 2.593 -3.891) 5.474 13.883 ( 3.999 -0.713 -3.991) 5.695 14.052 ( 7.438 10.885 -2.566) 13.431 14.078 ( -4.163 0.087 -3.879) 5.691 14.185 ( -2.425 6.776 -9.915) 12.252 14.443 ( -9.408 0.487 6.849) 11.648 14.473 ( -0.138 -3.149 -3.863) 4.986 14.641 ( -4.441 -7.948 0.873) 9.146 14.784 ( -9.483 -2.256 1.793) 9.911 14.992 ( -3.640 -5.244 10.825) 12.567 15.311 ( 13.823 12.183 -10.834) 21.375 15.460 ( 3.040 -4.367 4.113) 6.725 15.611 ( 1.499 -10.235 3.621) 10.960 15.899 ( -0.548 -1.506 2.953) 3.360 16.061 ( 2.497 -5.347 -6.374) 8.686 16.309 ( -0.970 -3.751 -1.036) 4.011 16.358 ( -3.588 -0.582 2.263) 4.281 17.278 ( -4.306 -10.776 19.508) 22.699 17.852 ( 4.975 -27.931 2.651) 28.494 18.319 ( -0.724 -1.056 -6.877) 6.996 18.472 ( 9.681 -1.066 -13.883) 16.958 19.463 ( -1.523 3.692 5.254) 6.600 19.498 ( -4.093 0.180 5.482) 6.844 22.040 ( -2.513 22.732 -2.317) 22.988 23.403 ( 21.984 -4.011 20.389) 30.251 23.452 ( -14.699 5.193 -24.883) 29.363 24.439 ( 2.234 -12.287 2.716) 12.781 ======================= Grid point 129 (61/130) ======================= q-point: ( 0.00 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.941 ( 1.670 21.833 -3.301) 22.144 2.118 ( 3.364 23.896 -4.830) 24.610 2.681 ( -3.591 -11.422 -14.238) 18.603 2.856 ( 8.070 -9.533 -22.552) 25.779 3.444 ( -0.137 27.798 12.736) 30.578 3.702 ( -4.232 19.359 -3.502) 20.123 3.986 ( -2.934 5.228 11.742) 13.184 4.215 ( 3.190 -4.355 9.355) 10.801 4.288 ( 3.354 -3.569 6.676) 8.279 4.451 ( 1.764 -4.043 3.003) 5.336 4.727 ( -1.688 19.313 3.816) 19.759 5.160 ( -5.237 4.646 -6.739) 9.717 5.322 ( -1.370 14.471 0.514) 14.544 5.579 ( -2.334 2.975 -3.168) 4.933 5.691 ( 1.815 2.442 -2.177) 3.741 6.076 ( 3.802 -12.954 -14.024) 19.466 6.249 ( 6.657 4.898 6.927) 10.784 6.491 ( 3.605 15.281 2.003) 15.828 6.820 ( -3.124 -9.338 7.138) 12.162 6.857 ( -0.113 1.749 10.566) 10.710 7.115 ( -13.782 -6.215 -0.414) 15.124 7.209 ( 1.715 -9.920 -1.379) 10.161 7.591 ( 5.781 12.723 -6.333) 15.343 7.694 ( 2.661 12.323 -2.733) 12.899 7.872 ( -3.452 6.956 -7.652) 10.902 8.040 ( -4.663 7.171 3.862) 9.385 8.107 ( 8.339 -3.574 -3.644) 9.777 8.251 ( 3.878 1.584 -12.460) 13.146 8.305 ( -5.130 -8.788 -4.683) 11.202 8.867 ( -6.280 -1.718 6.209) 8.996 8.949 ( 7.680 5.599 -6.387) 11.451 9.232 ( 3.957 -1.124 3.073) 5.135 9.328 ( 2.993 1.523 17.208) 17.533 9.436 ( -10.813 -3.316 2.234) 11.528 9.488 ( -10.443 -4.811 2.765) 11.826 9.741 ( 1.395 -11.167 0.124) 11.255 10.119 ( 0.233 3.313 -5.012) 6.012 10.309 ( 1.152 -9.403 -3.571) 10.124 10.376 ( 1.667 0.799 8.908) 9.098 10.535 ( 3.067 -3.272 10.193) 11.136 10.689 ( -1.774 -1.514 5.259) 5.752 10.735 ( 3.199 -1.018 1.628) 3.731 11.122 ( 0.445 11.777 -0.815) 11.813 11.172 ( 3.154 2.539 -5.452) 6.791 11.230 ( 1.558 8.733 -4.149) 9.794 11.405 ( 4.228 4.650 -11.391) 13.010 11.500 ( -1.465 7.723 5.183) 9.416 11.588 ( -0.597 5.248 -0.178) 5.285 11.895 ( -1.287 -2.319 2.485) 3.635 12.102 ( -2.015 -14.305 2.410) 14.646 12.137 ( -0.808 2.570 0.169) 2.699 12.294 ( 0.002 -6.325 2.347) 6.747 12.423 ( 1.929 1.380 4.331) 4.938 12.493 ( 1.999 1.245 5.586) 6.062 12.628 ( -0.836 -0.383 -0.876) 1.270 12.723 ( 0.220 -5.201 -1.479) 5.412 12.904 ( 1.923 4.679 -3.585) 6.200 12.979 ( -4.139 0.736 -0.367) 4.220 13.110 ( -0.092 3.067 -2.052) 3.692 13.370 ( -4.437 -5.342 -1.895) 7.198 13.479 ( 0.005 -5.490 -2.584) 6.068 13.542 ( 4.182 -5.275 -0.159) 6.734 13.775 ( 3.020 2.936 -3.376) 5.398 13.873 ( 1.728 -0.096 -5.313) 5.587 14.041 ( 4.888 7.710 0.268) 9.132 14.140 ( -8.747 7.330 -0.544) 11.425 14.217 ( 0.272 6.451 -2.620) 6.968 14.316 ( -1.231 2.627 -1.737) 3.382 14.351 ( 3.512 -4.418 -2.739) 6.274 14.421 ( -1.812 -2.143 -3.165) 4.230 14.503 ( 0.164 1.645 4.916) 5.187 14.687 ( -1.680 7.559 0.781) 7.783 14.869 ( -3.371 -1.337 6.150) 7.140 15.282 ( -0.041 -13.313 -0.268) 13.316 15.412 ( 0.923 -4.388 5.128) 6.812 15.779 ( 14.635 -8.118 -6.584) 17.984 15.843 ( 0.501 -1.496 0.281) 1.603 15.864 ( -0.428 -6.722 0.070) 6.736 16.201 ( -4.603 -0.168 -3.822) 5.986 16.265 ( -4.242 -1.161 -3.990) 5.938 17.051 ( -15.726 -0.623 18.043) 23.942 17.372 ( -7.291 -17.358 6.022) 19.767 18.434 ( 11.536 3.519 -10.896) 16.254 18.560 ( 12.707 -2.605 -13.269) 18.556 19.479 ( -3.572 1.162 7.668) 8.538 19.495 ( -3.600 0.884 7.499) 8.365 22.544 ( 4.557 20.242 5.163) 21.381 23.110 ( -7.492 -1.405 -7.451) 10.659 23.756 ( 7.451 -0.728 3.682) 8.343 24.132 ( -4.471 -13.290 -4.228) 14.645 ======================= Grid point 130 (62/130) ======================= q-point: ( 0.10 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.080 ( 12.717 13.675 0.421) 18.679 2.260 ( 13.918 21.285 -2.955) 25.602 2.548 ( 1.733 -7.728 -17.721) 19.410 2.921 ( 14.818 -6.996 -21.712) 27.202 3.520 ( -3.074 19.004 5.767) 20.097 3.629 ( 0.470 19.989 5.800) 20.819 4.008 ( -2.802 0.868 10.301) 10.711 4.165 ( -7.626 -5.741 3.936) 10.325 4.502 ( 4.512 2.626 4.948) 7.193 4.523 ( 3.501 1.604 7.615) 8.534 4.702 ( -2.591 18.311 4.667) 19.074 4.978 ( -7.708 8.103 -7.099) 13.247 5.303 ( -0.122 9.136 1.588) 9.274 5.529 ( -0.586 6.299 -2.794) 6.916 5.713 ( 2.035 2.246 -3.553) 4.670 5.981 ( -3.228 -17.403 -15.106) 23.270 6.379 ( -0.541 6.700 12.324) 14.037 6.560 ( -1.296 11.309 4.522) 12.248 6.804 ( -8.213 -4.013 10.779) 14.133 6.818 ( -6.907 -3.573 -9.197) 12.044 7.005 ( 6.462 -4.811 9.638) 12.562 7.305 ( 9.964 -5.299 -5.345) 12.487 7.646 ( 2.525 7.049 -11.319) 13.572 7.781 ( 2.800 8.855 -0.862) 9.327 7.877 ( 12.915 6.627 -6.062) 15.731 7.979 ( -3.251 7.851 0.252) 8.501 8.165 ( 2.009 3.653 -5.188) 6.656 8.265 ( 5.724 -3.499 -9.829) 11.900 8.297 ( 8.443 -6.487 -2.711) 10.987 8.772 ( -5.790 1.479 5.469) 8.101 9.066 ( 6.129 1.373 -2.872) 6.906 9.224 ( -8.037 -0.934 9.418) 12.417 9.285 ( -5.048 -6.801 1.601) 8.620 9.332 ( -10.022 -9.062 15.930) 20.889 9.549 ( 10.460 3.391 -0.380) 11.003 9.780 ( 1.877 -3.871 3.476) 5.531 10.110 ( 2.579 1.072 -4.194) 5.039 10.261 ( -1.960 -7.641 -6.248) 10.063 10.444 ( -1.466 1.151 8.271) 8.479 10.609 ( -0.935 -4.034 3.037) 5.135 10.728 ( 0.363 0.735 7.053) 7.101 10.811 ( 2.128 -1.002 2.332) 3.312 11.108 ( 0.067 20.250 -2.953) 20.464 11.194 ( 2.654 1.789 -4.425) 5.461 11.246 ( 1.784 0.673 -1.372) 2.349 11.420 ( 3.438 8.164 -6.608) 11.051 11.486 ( -3.734 10.132 4.451) 11.679 11.578 ( -0.314 4.074 1.089) 4.228 11.895 ( 0.975 -6.928 -2.172) 7.326 12.048 ( -5.187 -3.337 -0.581) 6.195 12.101 ( -0.867 -11.437 0.002) 11.470 12.295 ( -1.166 -10.852 -0.011) 10.914 12.478 ( -0.438 2.222 7.088) 7.441 12.545 ( -2.010 2.431 2.349) 3.933 12.584 ( -1.511 5.453 4.450) 7.198 12.730 ( -2.407 3.837 -0.648) 4.576 12.882 ( 0.687 0.285 -1.001) 1.247 12.894 ( -4.553 -8.629 -2.488) 10.068 13.124 ( 3.138 -0.464 -0.184) 3.178 13.262 ( -3.908 -0.181 -1.745) 4.284 13.403 ( -5.483 -4.150 -2.835) 7.438 13.535 ( -3.618 -6.543 -4.156) 8.554 13.817 ( 2.528 1.937 -2.344) 3.955 13.847 ( -0.339 3.150 -3.892) 5.019 13.966 ( -8.089 8.503 -0.283) 11.739 14.116 ( 1.351 7.042 -3.031) 7.784 14.210 ( -1.343 1.195 -1.128) 2.122 14.279 ( -4.480 0.318 -3.697) 5.817 14.352 ( 7.638 5.440 -0.739) 9.406 14.508 ( 10.078 -1.380 -0.509) 10.185 14.572 ( 2.853 -1.161 3.844) 4.926 14.720 ( 3.612 3.965 -1.128) 5.481 14.833 ( -4.709 1.574 6.726) 8.360 15.267 ( -1.134 -14.192 0.371) 14.243 15.412 ( -5.139 -3.877 7.778) 10.096 15.788 ( -8.470 -11.861 2.813) 14.843 15.870 ( -0.151 1.360 1.975) 2.402 16.021 ( 3.924 -8.059 3.181) 9.511 16.089 ( 5.402 -0.723 -12.844) 13.952 16.154 ( -0.088 -1.666 -8.772) 8.929 16.863 ( -12.530 2.557 10.845) 16.768 17.233 ( -8.735 -16.957 1.452) 19.129 18.582 ( 9.014 2.553 -5.982) 11.115 18.694 ( 7.703 -2.650 -7.280) 10.925 19.475 ( -2.075 1.542 6.155) 6.676 19.490 ( -2.272 1.125 6.709) 7.172 22.720 ( 7.788 16.820 9.639) 20.892 22.879 ( -9.061 12.524 -9.772) 18.288 23.917 ( 4.460 -12.131 5.593) 14.084 23.948 ( -9.139 -11.383 -7.900) 16.598 ======================= Grid point 131 (63/130) ======================= q-point: ( 0.20 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.366 ( 16.312 7.235 -0.686) 17.858 2.504 ( 6.425 0.078 -15.106) 16.415 2.566 ( 16.506 15.607 0.498) 22.722 3.103 ( 18.427 -3.171 -18.967) 26.634 3.456 ( -4.582 9.661 4.360) 11.547 3.744 ( 3.795 14.234 5.331) 15.666 3.964 ( -5.266 -3.837 2.536) 6.992 4.138 ( 1.786 -0.265 8.083) 8.283 4.454 ( -7.082 7.958 0.546) 10.667 4.617 ( -1.489 9.785 4.681) 10.949 4.648 ( -8.527 7.945 -2.002) 11.825 4.889 ( 2.849 10.943 4.137) 12.041 5.335 ( 0.527 4.591 2.704) 5.354 5.525 ( 1.132 10.369 -1.644) 10.559 5.726 ( 1.249 1.252 -2.469) 3.037 5.771 ( -6.331 -15.721 -11.546) 20.507 6.362 ( -10.532 8.572 15.077) 20.290 6.448 ( -11.054 -0.100 -3.442) 11.578 6.706 ( 3.019 2.035 1.052) 3.790 6.802 ( -2.362 -6.280 7.133) 9.792 7.143 ( 1.972 -1.467 0.393) 2.489 7.427 ( 3.666 7.464 -13.907) 16.203 7.600 ( 3.211 -10.789 0.535) 11.269 7.760 ( -1.538 -1.546 -5.565) 5.977 7.960 ( 6.488 9.521 -6.700) 13.328 8.066 ( 10.097 16.165 -5.654) 19.880 8.303 ( 5.757 5.852 -7.524) 11.136 8.371 ( 2.336 0.177 1.809) 2.960 8.426 ( 17.889 0.036 -3.393) 18.208 8.782 ( 4.793 -5.399 0.968) 7.284 9.095 ( -5.668 1.942 12.738) 14.077 9.130 ( -8.179 -2.743 10.007) 13.212 9.274 ( -3.736 -7.657 12.590) 15.202 9.321 ( 4.274 -9.521 1.504) 10.544 9.728 ( 9.262 0.951 -1.024) 9.367 9.861 ( 3.264 -0.648 4.517) 5.610 10.157 ( 4.126 -1.377 -3.438) 5.544 10.168 ( -2.517 -4.359 -6.120) 7.924 10.418 ( -6.063 -0.247 4.338) 7.460 10.545 ( -6.322 -3.726 -1.487) 7.487 10.770 ( 1.170 4.384 1.410) 4.751 10.831 ( -0.669 2.433 0.963) 2.701 11.096 ( 1.132 19.678 -3.706) 20.056 11.205 ( 2.021 3.899 -5.608) 7.123 11.263 ( 0.488 0.880 -1.938) 2.183 11.410 ( -3.808 14.572 5.002) 15.870 11.454 ( 1.370 9.548 -2.783) 10.039 11.610 ( 1.683 -0.879 3.101) 3.636 11.885 ( -0.389 -7.120 -4.273) 8.312 11.939 ( -4.653 -1.841 -0.702) 5.053 12.110 ( 0.289 -18.310 3.501) 18.644 12.245 ( -3.338 -10.384 -1.477) 11.007 12.473 ( -4.660 4.727 -0.052) 6.638 12.513 ( -5.472 -2.360 1.438) 6.130 12.554 ( -0.319 5.055 4.894) 7.043 12.643 ( -6.276 3.835 -0.601) 7.380 12.785 ( -1.014 0.053 -0.841) 1.318 12.972 ( 3.317 -1.740 2.701) 4.618 13.164 ( -3.279 -4.615 2.516) 6.195 13.191 ( -0.982 -1.678 -4.389) 4.801 13.325 ( 0.892 -4.166 2.617) 5.000 13.397 ( -5.803 -4.092 -5.595) 9.040 13.732 ( -7.774 5.673 -2.239) 9.881 13.805 ( -4.121 2.990 -3.677) 6.280 13.900 ( 1.517 6.338 -0.757) 6.560 14.062 ( -1.969 2.534 -3.562) 4.794 14.161 ( -2.666 4.873 -2.298) 6.011 14.233 ( 0.672 -3.058 -1.185) 3.348 14.522 ( 6.621 4.716 0.475) 8.143 14.569 ( -3.075 5.258 -3.603) 7.077 14.662 ( 2.223 -2.890 5.238) 6.382 14.842 ( 5.690 1.487 3.340) 6.763 14.847 ( 7.856 1.192 2.501) 8.330 15.248 ( -2.335 -13.636 2.910) 14.137 15.343 ( -7.960 -4.616 8.671) 12.643 15.541 ( -16.650 -10.999 4.009) 20.353 15.837 ( -3.847 2.056 3.867) 5.829 16.002 ( -2.638 -7.758 5.527) 9.884 16.143 ( 7.905 2.105 -11.463) 14.083 16.304 ( 16.717 -6.723 -15.137) 23.532 16.763 ( -3.626 3.061 4.661) 6.652 17.094 ( -5.710 -14.752 -1.119) 15.858 18.670 ( 2.778 1.062 -1.379) 3.278 18.733 ( -0.135 -1.617 -1.554) 2.246 19.471 ( -2.005 2.088 2.889) 4.090 19.494 ( -1.322 1.465 3.607) 4.111 22.661 ( -6.992 17.711 -7.530) 20.476 22.942 ( 6.962 9.367 11.521) 16.400 23.670 ( -11.296 -5.497 -10.636) 16.460 24.027 ( 2.027 -16.044 5.430) 17.058 ======================= Grid point 132 (64/130) ======================= q-point: ( 0.30 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.550 ( 8.022 5.379 -9.834) 13.784 2.662 ( 14.829 2.653 -1.616) 15.151 2.862 ( 12.957 13.534 1.350) 18.785 3.323 ( 16.766 1.517 -16.048) 23.258 3.424 ( -1.959 2.495 3.557) 4.766 3.741 ( -4.625 -1.995 2.001) 5.420 4.014 ( 6.726 9.581 0.283) 11.710 4.263 ( -1.093 2.852 7.222) 7.842 4.315 ( -1.713 3.414 3.154) 4.953 4.424 ( -10.467 1.201 -4.703) 11.537 4.552 ( -6.659 16.484 3.267) 18.076 5.017 ( 3.166 11.035 4.430) 12.306 5.326 ( -2.852 0.104 1.384) 3.172 5.451 ( -3.561 1.846 -8.063) 9.006 5.636 ( 0.400 3.490 -2.426) 4.270 5.828 ( 5.971 -1.572 2.808) 6.783 6.189 ( -11.441 0.497 -5.517) 12.711 6.254 ( -11.115 5.159 14.626) 19.080 6.731 ( -3.541 -5.058 5.785) 8.461 6.890 ( 5.505 -3.839 6.163) 9.112 7.073 ( -5.644 -2.160 -5.489) 8.164 7.332 ( -0.773 2.610 -7.258) 7.752 7.687 ( 6.390 -4.216 -9.301) 12.047 7.784 ( 5.070 -3.277 -2.573) 6.562 8.041 ( 5.328 14.214 -4.517) 15.838 8.168 ( 4.822 11.867 -11.752) 17.383 8.372 ( 0.380 3.010 2.507) 3.936 8.386 ( 5.664 10.283 0.072) 11.740 8.691 ( 6.827 3.011 -1.012) 7.530 8.923 ( 9.022 -6.420 -1.791) 11.217 9.058 ( -4.217 -5.264 8.240) 10.648 9.120 ( -3.219 1.763 16.692) 17.091 9.314 ( 0.303 -6.191 14.378) 15.657 9.471 ( 9.274 -10.457 -0.994) 14.013 9.886 ( 5.223 -1.940 0.419) 5.587 9.942 ( 3.650 -2.354 2.782) 5.158 10.086 ( -1.461 1.155 -4.576) 4.941 10.173 ( -2.772 0.673 -3.204) 4.290 10.312 ( -4.688 -4.795 -0.453) 6.721 10.382 ( -7.277 -5.032 -2.259) 9.131 10.794 ( 1.197 8.401 -1.742) 8.663 10.828 ( 0.797 7.142 -0.634) 7.215 11.099 ( 1.598 18.310 -2.938) 18.613 11.192 ( 1.386 4.876 -6.570) 8.298 11.241 ( 0.560 5.434 -3.914) 6.720 11.416 ( -1.518 13.860 10.200) 17.275 11.470 ( 1.893 9.134 -2.619) 9.689 11.654 ( 0.478 -5.130 1.513) 5.370 11.826 ( -2.619 -5.725 -1.185) 6.407 11.877 ( -1.250 -1.784 -1.674) 2.748 12.137 ( -3.093 -11.148 2.529) 11.842 12.172 ( -1.585 -17.142 2.824) 17.445 12.305 ( -8.379 4.281 -4.302) 10.346 12.407 ( -6.961 3.623 -0.765) 7.885 12.559 ( -0.270 -3.949 -1.124) 4.115 12.612 ( -0.434 3.093 5.929) 6.701 12.752 ( -1.500 5.565 -3.144) 6.566 12.990 ( -2.889 -2.912 -1.615) 4.409 13.093 ( -0.901 0.673 -6.848) 6.939 13.175 ( -0.660 -4.576 6.463) 7.946 13.277 ( -1.958 -6.592 -5.681) 8.919 13.421 ( 1.300 -6.864 8.067) 10.672 13.585 ( -4.870 5.006 -0.574) 7.007 13.673 ( -6.635 5.731 -1.989) 8.990 13.915 ( -0.103 3.782 -0.394) 3.804 14.019 ( -1.167 1.570 -1.802) 2.660 14.100 ( -2.409 3.561 -0.790) 4.371 14.236 ( 0.809 -1.169 -1.416) 2.007 14.441 ( -5.041 12.075 -2.199) 13.269 14.584 ( -1.691 1.595 3.356) 4.083 14.717 ( 1.184 -8.127 3.102) 8.779 15.013 ( 4.718 -2.210 1.900) 5.546 15.021 ( 9.382 0.617 1.772) 9.568 15.163 ( -10.045 -11.088 6.164) 16.181 15.252 ( -3.586 -5.848 3.229) 7.582 15.373 ( -1.858 -11.526 1.281) 11.745 15.819 ( -1.657 3.120 5.315) 6.382 15.992 ( -3.342 -4.989 6.765) 9.046 16.225 ( 8.362 5.774 -11.154) 15.089 16.482 ( 13.356 -7.785 -17.014) 22.988 16.780 ( 2.124 0.840 3.250) 3.972 17.004 ( -3.040 -11.511 -1.238) 11.969 18.666 ( -3.070 0.384 0.477) 3.130 18.697 ( -2.612 -1.303 1.609) 3.333 19.439 ( -2.311 2.626 0.250) 3.507 19.481 ( -1.698 1.534 0.974) 2.488 22.518 ( -3.936 17.828 -3.677) 18.624 23.108 ( 1.943 -5.454 7.553) 9.517 23.418 ( -6.956 8.476 -6.646) 12.822 24.073 ( -0.209 -16.298 2.898) 16.555 ======================= Grid point 133 (65/130) ======================= q-point: ( 0.40 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.668 ( 8.240 7.754 -0.961) 11.356 2.884 ( 8.645 0.647 0.013) 8.669 3.078 ( 9.914 9.581 -1.232) 13.842 3.406 ( -1.981 -0.249 0.258) 2.013 3.506 ( 13.523 4.135 -14.780) 20.455 3.699 ( -0.074 -0.878 0.749) 1.157 3.951 ( -10.171 6.586 -7.479) 14.239 4.209 ( -7.984 -3.120 -4.000) 9.459 4.288 ( 1.586 5.866 11.725) 13.206 4.438 ( 0.225 15.286 4.450) 15.922 4.486 ( -0.085 4.265 7.091) 8.275 5.010 ( -2.339 16.398 -1.530) 16.635 5.196 ( -3.914 -11.019 -9.586) 15.121 5.515 ( 5.375 0.110 2.460) 5.912 5.612 ( -0.816 19.924 -2.425) 20.088 5.941 ( 2.222 -3.975 0.857) 4.634 5.980 ( -5.997 -0.876 -0.129) 6.062 6.165 ( -7.521 1.600 11.619) 13.933 6.708 ( -3.643 -6.547 9.600) 12.177 6.933 ( -3.100 -8.456 -4.677) 10.148 7.017 ( 1.686 1.274 6.910) 7.226 7.343 ( 4.897 -3.693 -3.022) 6.838 7.754 ( 8.787 0.932 -12.404) 15.230 7.824 ( 3.055 -0.503 -7.135) 7.778 8.065 ( 1.097 15.231 -5.744) 16.315 8.131 ( -1.402 11.616 -4.800) 12.646 8.402 ( -0.327 4.509 3.928) 5.989 8.491 ( 4.647 3.909 0.112) 6.074 8.713 ( -3.332 7.876 4.419) 9.626 9.035 ( -2.923 -6.041 6.967) 9.674 9.056 ( 4.256 -6.160 -2.301) 7.833 9.217 ( 1.047 3.050 15.114) 15.454 9.483 ( 8.710 -6.124 4.437) 11.535 9.616 ( 4.661 -13.247 0.879) 14.071 9.878 ( -1.585 1.604 -3.825) 4.440 9.977 ( -6.214 0.852 -4.132) 7.511 10.018 ( -2.088 4.298 1.543) 5.021 10.160 ( 5.516 -7.271 3.469) 9.763 10.210 ( -3.974 -1.773 -0.330) 4.364 10.298 ( -2.494 -5.630 -3.766) 7.218 10.783 ( -0.983 8.154 -1.267) 8.310 10.859 ( 3.890 12.072 -4.010) 13.302 11.111 ( 1.174 17.104 -1.478) 17.208 11.180 ( 1.976 2.847 -5.653) 6.630 11.252 ( 2.422 5.577 -2.307) 6.503 11.450 ( -0.593 12.546 1.974) 12.714 11.497 ( 0.855 9.131 4.531) 10.229 11.630 ( -4.053 -6.741 2.127) 8.148 11.799 ( 2.074 -3.172 -3.280) 5.012 11.876 ( 0.926 -2.521 0.685) 2.772 12.039 ( -5.271 -2.109 -0.175) 5.680 12.136 ( -5.967 6.369 -2.760) 9.153 12.203 ( 0.012 -18.432 1.912) 18.531 12.285 ( -5.427 3.936 2.503) 7.156 12.541 ( -0.309 -2.455 -2.739) 3.692 12.617 ( -2.472 -0.073 2.294) 3.374 12.721 ( 1.963 4.614 -5.039) 7.109 12.913 ( -2.021 -5.678 -3.283) 6.864 12.994 ( -3.549 0.933 -9.747) 10.415 13.211 ( -0.121 -4.827 -1.310) 5.003 13.258 ( 0.736 -2.753 7.137) 7.685 13.419 ( -2.302 -4.566 0.286) 5.122 13.565 ( -3.445 4.369 1.680) 5.812 13.578 ( -1.096 -2.587 6.998) 7.541 13.904 ( -0.998 5.146 2.547) 5.828 13.990 ( -1.809 4.495 2.791) 5.592 14.080 ( 0.642 0.688 0.736) 1.195 14.251 ( 1.764 -2.556 -1.807) 3.593 14.380 ( -0.718 10.359 -0.283) 10.387 14.547 ( -3.865 3.688 3.486) 6.379 14.739 ( -0.292 -7.354 -1.109) 7.443 14.987 ( -6.011 -18.251 3.672) 19.563 15.041 ( -2.217 -6.409 2.721) 7.307 15.212 ( 0.459 -9.047 3.780) 9.816 15.267 ( 7.153 3.769 -4.845) 9.426 15.402 ( 2.914 -5.974 0.818) 6.697 15.826 ( -2.463 3.655 6.746) 8.058 15.963 ( -4.427 -2.003 6.459) 8.083 16.299 ( 7.054 8.148 -10.053) 14.738 16.576 ( 8.773 -6.248 -15.962) 19.256 16.861 ( 3.842 -2.767 1.496) 4.966 16.957 ( -1.240 -8.622 -0.591) 8.731 18.592 ( -4.523 1.119 1.313) 4.841 18.654 ( -3.280 -2.327 1.724) 4.375 19.401 ( -0.952 2.592 -0.980) 2.930 19.452 ( -1.224 1.479 -0.156) 1.926 22.460 ( -0.949 16.561 0.098) 16.588 23.061 ( -4.491 -10.217 -7.729) 13.576 23.390 ( 1.194 13.260 8.997) 16.068 24.065 ( -1.417 -15.505 -0.188) 15.571 ======================= Grid point 134 (66/130) ======================= q-point: (-0.50 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.838 ( 6.585 6.461 7.714) 12.026 2.975 ( -0.024 3.433 1.365) 3.694 3.212 ( 4.159 2.646 0.032) 4.929 3.343 ( -3.170 -1.127 -3.871) 5.129 3.610 ( 7.106 5.322 -14.846) 17.297 3.672 ( -10.933 5.620 -11.057) 16.534 3.758 ( 5.747 4.292 0.005) 7.173 4.084 ( -0.973 -6.344 -4.083) 7.607 4.338 ( -4.366 5.045 12.883) 14.508 4.474 ( 1.605 22.442 4.036) 22.858 4.537 ( -2.587 -2.953 7.503) 8.468 4.988 ( 2.089 17.135 -1.835) 17.359 5.124 ( 2.017 -5.816 -8.653) 10.619 5.397 ( -6.106 7.106 -10.074) 13.757 5.727 ( 3.633 13.101 4.690) 14.382 5.876 ( -3.138 -2.588 -0.972) 4.182 5.994 ( -0.155 -5.961 5.066) 7.824 6.140 ( -2.453 -0.963 8.555) 8.952 6.746 ( 0.525 -5.189 10.125) 11.389 6.894 ( -0.093 -4.206 1.749) 4.556 7.087 ( 1.654 -2.972 5.765) 6.694 7.391 ( -0.055 -8.419 -2.369) 8.746 7.814 ( 3.427 6.098 -9.002) 11.400 7.872 ( 11.259 2.395 -12.028) 16.649 8.054 ( 3.230 13.177 -5.788) 14.750 8.077 ( 0.707 9.774 -5.652) 11.312 8.400 ( -4.202 4.839 7.374) 9.770 8.552 ( 0.525 8.379 0.529) 8.413 8.662 ( -4.348 0.399 4.354) 6.166 9.013 ( -5.282 -4.030 11.409) 13.203 9.065 ( -2.897 -1.870 -2.452) 4.231 9.313 ( -1.218 0.125 9.612) 9.690 9.572 ( -4.915 -14.164 -2.312) 15.170 9.629 ( -1.968 -11.526 1.079) 11.742 9.845 ( 1.976 6.244 -2.657) 7.068 9.904 ( 4.705 3.048 -3.418) 6.566 10.047 ( 2.683 3.068 5.168) 6.582 10.130 ( -3.881 0.249 -0.939) 4.001 10.199 ( -4.581 -4.339 -3.311) 7.126 10.291 ( 4.420 -7.031 1.128) 8.381 10.752 ( -0.758 7.399 -2.132) 7.737 10.910 ( 3.962 11.118 -3.947) 12.446 11.118 ( 0.319 10.118 -2.152) 10.350 11.190 ( 2.280 1.850 -4.202) 5.126 11.269 ( 0.329 9.206 -0.532) 9.228 11.430 ( -0.349 9.384 -2.980) 9.852 11.534 ( -1.884 9.426 6.031) 11.347 11.562 ( -4.234 -4.578 3.659) 7.230 11.863 ( 4.151 -1.177 -0.998) 4.428 11.890 ( 1.546 -1.827 1.394) 2.769 11.973 ( -1.261 -4.004 0.143) 4.200 12.070 ( 1.196 8.126 -2.753) 8.662 12.172 ( -1.295 4.388 -2.101) 5.035 12.257 ( -1.350 -9.010 2.859) 9.549 12.512 ( -0.216 -2.828 -2.853) 4.023 12.594 ( -0.610 -2.766 1.403) 3.161 12.719 ( 0.655 5.588 -5.001) 7.528 12.840 ( -1.839 -4.166 -13.289) 14.047 12.891 ( 0.152 -2.582 -0.894) 2.737 13.214 ( 2.047 -3.819 -2.638) 5.073 13.309 ( -1.710 -2.066 6.290) 6.838 13.400 ( 0.760 -0.417 2.062) 2.237 13.578 ( 2.345 -0.003 4.379) 4.968 13.591 ( -2.440 -4.988 6.873) 8.836 13.922 ( 0.551 5.597 3.859) 6.821 14.016 ( 1.191 4.592 6.991) 8.448 14.123 ( 2.170 -1.676 2.036) 3.415 14.266 ( 0.513 -2.500 -1.075) 2.769 14.387 ( 0.880 9.081 -0.067) 9.124 14.519 ( -0.752 3.099 4.107) 5.200 14.689 ( -2.555 -6.030 -3.933) 7.639 14.939 ( -1.368 -15.662 -1.323) 15.778 15.004 ( -2.766 -7.854 2.014) 8.567 15.216 ( -1.116 -11.284 3.899) 11.991 15.334 ( 2.260 1.079 -4.488) 5.139 15.462 ( 1.796 -3.820 0.414) 4.241 15.811 ( -4.093 3.880 7.337) 9.254 15.917 ( -4.339 -0.418 4.856) 6.525 16.353 ( 5.445 8.337 -8.524) 13.107 16.600 ( 4.878 -5.101 -14.437) 16.070 16.922 ( 1.728 -4.824 0.182) 5.127 16.954 ( 1.282 -6.662 0.044) 6.784 18.524 ( -3.308 1.501 0.747) 3.708 18.599 ( -3.470 -2.715 0.992) 4.517 19.400 ( 1.532 2.134 -0.786) 2.742 19.444 ( 0.687 1.450 -0.421) 1.658 22.481 ( 1.961 15.369 3.082) 15.797 22.921 ( -3.253 -0.172 -10.262) 10.767 23.507 ( 3.053 3.490 11.876) 12.749 24.022 ( -1.866 -14.316 -3.022) 14.749 ======================= Grid point 135 (67/130) ======================= q-point: (-0.40 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.887 ( -8.103 9.268 0.610) 12.326 3.005 ( 1.774 3.188 11.595) 12.155 3.144 ( -13.573 3.696 -2.648) 14.314 3.240 ( -3.263 -0.604 -6.269) 7.093 3.498 ( 3.418 3.422 -7.500) 8.925 3.553 ( -1.488 1.806 -14.301) 14.491 3.895 ( 7.408 5.617 -0.111) 9.297 4.122 ( 5.910 -4.238 -3.747) 8.181 4.344 ( -3.944 3.779 9.666) 11.103 4.493 ( -5.960 -2.049 5.046) 8.074 4.539 ( 2.669 22.498 5.543) 23.324 5.012 ( -7.126 16.632 -4.114) 18.556 5.086 ( 7.884 7.720 -3.576) 11.600 5.367 ( 10.087 -7.619 -7.863) 14.887 5.715 ( -4.985 9.251 1.433) 10.606 5.815 ( -2.833 2.148 -1.157) 3.739 6.056 ( 0.686 -3.629 7.519) 8.378 6.189 ( 2.765 -7.555 5.782) 9.908 6.836 ( 1.377 0.406 4.217) 4.455 6.933 ( -0.875 -4.634 11.693) 12.609 7.168 ( 3.062 -2.566 3.716) 5.457 7.331 ( -0.291 -6.155 -5.199) 8.062 7.770 ( -2.314 15.253 -5.624) 16.421 8.037 ( 13.250 0.582 -15.313) 20.258 8.084 ( 4.136 11.639 -4.800) 13.252 8.132 ( 10.575 1.264 -12.089) 16.112 8.333 ( -9.140 2.703 8.678) 12.891 8.482 ( -8.307 14.219 5.310) 17.303 8.650 ( 1.207 -8.896 -1.918) 9.180 8.883 ( -13.143 7.845 2.635) 15.531 9.026 ( -4.477 -2.776 15.929) 16.777 9.292 ( -6.358 -6.192 6.247) 10.853 9.412 ( -13.238 -6.261 1.987) 14.778 9.519 ( -4.005 -18.962 -1.254) 19.421 9.935 ( 5.515 5.183 -4.470) 8.790 9.961 ( -1.285 3.753 -0.958) 4.080 10.066 ( 3.397 2.676 -3.851) 5.791 10.114 ( -1.540 -3.872 -0.143) 4.169 10.181 ( 5.152 0.195 4.359) 6.751 10.333 ( 0.344 -4.737 -1.313) 4.927 10.729 ( -0.009 6.219 -2.641) 6.757 10.943 ( 1.754 6.387 -2.011) 6.922 11.071 ( -1.881 2.761 -4.968) 5.987 11.179 ( -0.963 1.047 -4.731) 4.940 11.288 ( 1.005 14.598 2.415) 14.831 11.413 ( 1.241 4.388 -4.489) 6.399 11.516 ( -3.237 6.939 4.113) 8.692 11.541 ( -0.746 2.350 5.168) 5.726 11.874 ( -0.493 -1.568 1.963) 2.561 11.991 ( 3.014 1.798 4.464) 5.679 12.016 ( 6.080 -6.945 -2.516) 9.568 12.100 ( 2.408 -1.258 -1.471) 3.089 12.171 ( 3.125 9.214 -2.459) 10.036 12.249 ( 1.603 3.012 -2.895) 4.475 12.505 ( 0.652 -6.938 -0.752) 7.009 12.610 ( 1.117 -0.254 2.592) 2.834 12.690 ( 0.120 2.851 -2.787) 3.989 12.741 ( 0.786 -2.963 -12.589) 12.957 12.916 ( 2.691 -3.353 -0.879) 4.388 13.222 ( 0.659 -10.205 -7.255) 12.539 13.316 ( 0.966 5.322 6.862) 8.737 13.484 ( 3.897 3.012 4.495) 6.668 13.584 ( -2.162 -4.797 4.150) 6.702 13.678 ( 4.204 -1.627 3.892) 5.956 13.979 ( 2.214 6.451 4.101) 7.958 14.115 ( 3.394 1.578 7.107) 8.032 14.165 ( 0.918 -1.885 0.150) 2.102 14.248 ( -1.408 0.999 0.288) 1.750 14.409 ( 2.035 6.333 -0.399) 6.663 14.586 ( 0.635 -2.395 2.023) 3.198 14.611 ( 0.011 -0.090 0.201) 0.220 14.882 ( -1.621 -6.210 -5.600) 8.517 14.992 ( -0.335 -10.103 3.351) 10.649 15.227 ( -1.095 -13.922 3.873) 14.493 15.312 ( -1.576 -1.048 -2.106) 2.831 15.442 ( -5.209 -5.199 2.800) 7.874 15.788 ( -2.597 3.425 5.802) 7.220 15.876 ( -2.550 -0.964 2.863) 3.954 16.386 ( 3.592 6.320 -6.904) 10.026 16.562 ( 1.410 -3.638 -13.428) 13.983 16.953 ( 1.721 -4.692 0.665) 5.042 16.994 ( 3.028 -7.347 0.101) 7.947 18.475 ( -1.897 1.336 -1.073) 2.556 18.537 ( -3.327 -2.397 -0.123) 4.103 19.442 ( 2.786 1.835 0.269) 3.347 19.472 ( 2.308 1.320 -0.216) 2.668 22.578 ( 5.192 13.734 5.241) 15.590 22.794 ( -2.816 7.246 -10.249) 12.864 23.670 ( 5.474 -3.655 11.800) 13.511 23.954 ( -2.223 -12.329 -5.243) 13.581 ======================= Grid point 136 (68/130) ======================= q-point: (-0.30 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.688 ( -12.039 15.400 -1.410) 19.598 2.756 ( -18.674 11.319 -7.763) 23.176 3.090 ( -1.774 -3.238 6.107) 7.136 3.142 ( -2.173 -1.484 -7.664) 8.103 3.431 ( -1.324 4.088 -7.086) 8.287 3.565 ( 3.216 4.771 -1.882) 6.054 3.997 ( 1.130 3.687 4.925) 6.256 4.169 ( -1.401 -1.921 3.148) 3.945 4.331 ( 0.216 2.034 -0.385) 2.081 4.385 ( -5.475 -0.261 -3.510) 6.509 4.664 ( 3.198 20.943 6.476) 22.154 4.886 ( 0.060 17.649 -0.417) 17.654 5.241 ( 6.534 5.388 1.102) 8.540 5.561 ( 10.788 -8.932 -5.329) 14.985 5.650 ( 2.473 2.904 -2.937) 4.814 5.787 ( 0.844 6.945 2.354) 7.382 6.055 ( -3.723 -1.324 0.057) 3.952 6.339 ( 7.555 -12.777 8.239) 16.977 6.776 ( -8.341 3.155 0.846) 8.958 7.013 ( -0.549 -4.528 11.353) 12.235 7.223 ( -0.674 8.257 4.453) 9.405 7.407 ( 10.826 -1.339 -5.211) 12.089 7.682 ( -1.767 13.410 -4.154) 14.149 8.016 ( -2.410 7.080 -18.492) 19.948 8.142 ( -9.610 -3.685 -1.057) 10.346 8.188 ( 6.637 4.465 -7.180) 10.749 8.238 ( 3.753 -5.047 -10.425) 12.175 8.400 ( -2.928 11.738 7.654) 14.316 8.660 ( 3.180 -6.947 -6.130) 9.795 8.706 ( -8.120 12.419 9.603) 17.674 9.060 ( -7.167 -3.040 18.245) 19.837 9.119 ( -17.010 -5.216 7.235) 19.207 9.196 ( -8.969 -6.964 9.561) 14.845 9.487 ( 1.087 -20.996 -0.692) 21.036 9.867 ( -6.006 2.633 0.132) 6.559 9.923 ( -2.376 1.454 -4.030) 4.899 10.149 ( 5.808 2.882 -4.588) 7.942 10.155 ( 4.888 0.818 -2.379) 5.497 10.269 ( -0.494 -1.140 1.609) 2.033 10.320 ( 1.398 -1.963 0.258) 2.424 10.710 ( 0.175 4.398 -3.624) 5.702 10.940 ( -3.089 2.184 2.229) 4.391 11.028 ( 1.241 2.725 -4.109) 5.085 11.104 ( -1.086 -2.286 -6.385) 6.868 11.318 ( 0.500 15.142 0.619) 15.163 11.412 ( 0.918 3.906 -1.802) 4.399 11.483 ( -1.177 3.226 -0.093) 3.436 11.585 ( 1.855 5.195 1.077) 5.620 11.894 ( 0.119 1.102 4.938) 5.061 12.043 ( -0.489 3.022 -0.112) 3.064 12.093 ( 3.692 -2.629 -1.815) 4.882 12.125 ( 1.918 -7.812 -0.662) 8.071 12.245 ( 5.743 5.273 -2.593) 8.216 12.309 ( 4.418 3.692 -0.271) 5.764 12.533 ( 2.218 -3.028 2.244) 4.373 12.668 ( 1.640 3.353 -2.753) 4.638 12.693 ( 4.494 -5.818 -1.652) 7.535 12.737 ( 5.013 -3.143 -0.301) 5.924 12.985 ( 5.715 -0.409 -0.854) 5.793 13.164 ( -0.669 -7.730 -6.480) 10.109 13.428 ( 5.253 3.669 3.744) 7.421 13.504 ( -4.592 -3.595 3.047) 6.580 13.636 ( 5.670 3.036 0.766) 6.477 13.768 ( 3.525 -1.017 0.213) 3.675 14.032 ( -0.302 9.991 3.284) 10.521 14.145 ( -0.043 4.251 -3.874) 5.752 14.222 ( 2.844 -0.159 4.930) 5.694 14.255 ( 0.451 -3.116 1.914) 3.685 14.455 ( 2.285 1.555 -2.726) 3.882 14.498 ( -2.307 1.969 -3.299) 4.482 14.712 ( 0.185 0.499 6.421) 6.443 14.840 ( 1.783 0.977 -3.133) 3.735 15.028 ( -0.143 -7.371 5.566) 9.237 15.215 ( -3.097 -13.772 4.508) 14.818 15.265 ( -1.356 -3.838 -1.270) 4.264 15.334 ( -7.267 -9.020 5.383) 12.773 15.801 ( 0.228 1.551 4.172) 4.457 15.868 ( 0.060 -2.978 1.358) 3.273 16.392 ( 1.308 3.326 -4.891) 6.058 16.478 ( -0.845 -1.309 -11.425) 11.531 17.000 ( 2.038 -3.491 3.038) 5.057 17.086 ( 6.748 -10.464 -0.026) 12.451 18.431 ( -1.086 0.719 -3.884) 4.097 18.473 ( -2.431 -1.582 -2.151) 3.611 19.495 ( 1.674 1.970 1.795) 3.148 19.514 ( 1.551 0.804 0.716) 1.888 22.667 ( -3.337 12.820 -8.766) 15.884 22.751 ( 8.475 9.546 6.516) 14.332 23.863 ( -1.952 -8.268 -5.179) 9.950 23.870 ( 6.283 -8.675 8.229) 13.508 ======================= Grid point 137 (69/130) ======================= q-point: (-0.20 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.358 ( -14.374 19.124 -11.994) 26.762 2.440 ( -14.414 19.413 1.090) 24.203 3.011 ( -6.321 -8.911 -2.774) 11.272 3.043 ( -0.055 -6.963 -16.681) 18.076 3.470 ( 4.335 13.112 8.601) 16.269 3.525 ( -6.464 18.669 2.215) 19.880 4.047 ( 1.020 -3.884 6.694) 7.806 4.141 ( -5.233 -4.807 7.737) 10.505 4.239 ( -3.745 5.569 -11.274) 13.121 4.361 ( 3.105 -0.893 -1.137) 3.425 4.694 ( -0.791 20.856 3.092) 21.098 5.042 ( 9.803 12.990 6.592) 17.558 5.303 ( -0.111 5.268 0.944) 5.353 5.602 ( 0.911 3.406 1.110) 3.696 5.817 ( 9.218 -6.012 -6.628) 12.847 5.902 ( 9.021 -2.023 -0.024) 9.246 5.947 ( -1.853 4.216 -7.040) 8.412 6.568 ( 8.882 -14.561 10.703) 20.136 6.598 ( -8.867 7.255 -1.446) 11.548 7.030 ( -6.093 2.253 6.933) 9.500 7.175 ( -6.594 9.482 8.416) 14.291 7.590 ( 7.597 -1.359 -3.934) 8.662 7.627 ( -5.757 5.705 -6.019) 10.096 7.767 ( -2.119 8.415 -11.272) 14.225 8.003 ( -5.121 1.531 -4.445) 6.952 8.170 ( 1.783 -3.447 -13.036) 13.601 8.192 ( -2.289 4.263 -6.269) 7.920 8.402 ( -5.136 1.569 5.011) 7.345 8.653 ( -6.458 -3.365 -2.063) 7.568 8.706 ( 4.292 6.736 -1.109) 8.064 8.853 ( -4.904 0.027 6.734) 8.331 9.048 ( -7.849 -5.806 12.203) 15.628 9.177 ( -5.028 -2.980 20.973) 21.772 9.557 ( 5.618 -23.027 1.763) 23.768 9.751 ( -6.893 2.207 1.623) 7.417 9.828 ( -5.437 -0.775 -1.981) 5.838 10.188 ( 0.475 2.823 -3.505) 4.526 10.207 ( 3.622 1.816 -4.408) 5.987 10.247 ( 0.115 0.650 0.663) 0.935 10.379 ( 2.355 -3.092 2.460) 4.600 10.686 ( 0.202 2.487 -3.790) 4.537 10.847 ( -7.739 -2.673 3.790) 9.023 11.053 ( 3.355 2.539 -3.006) 5.171 11.091 ( 3.554 0.334 -5.565) 6.611 11.307 ( -1.037 16.711 -2.296) 16.900 11.423 ( 1.941 2.153 -3.223) 4.335 11.467 ( -0.231 3.005 -0.879) 3.139 11.608 ( 1.421 5.639 -3.315) 6.694 11.934 ( 0.084 1.501 2.584) 2.989 12.016 ( -1.533 0.717 4.705) 5.000 12.117 ( 0.540 -4.490 0.143) 4.525 12.193 ( 3.989 -0.124 1.160) 4.156 12.314 ( 2.805 -2.888 -2.293) 4.633 12.377 ( 3.414 3.836 0.007) 5.136 12.575 ( 1.143 -3.958 -0.675) 4.174 12.735 ( 4.261 -0.335 3.185) 5.330 12.765 ( 3.831 -2.028 -0.701) 4.391 12.899 ( 8.780 -7.430 1.694) 11.626 13.116 ( 5.755 0.846 -1.930) 6.128 13.156 ( 6.953 1.213 -2.159) 7.380 13.404 ( -5.333 -4.521 0.192) 6.994 13.533 ( 2.754 -1.573 0.555) 3.220 13.738 ( 4.441 3.536 -1.945) 6.000 13.814 ( 3.014 -1.117 -3.908) 5.060 14.011 ( -2.883 9.347 2.544) 10.107 14.156 ( 4.182 7.828 -4.022) 9.744 14.261 ( -0.806 8.557 3.421) 9.250 14.300 ( 2.784 -1.638 1.532) 3.574 14.369 ( -1.884 -4.452 -10.823) 11.853 14.541 ( 0.755 4.416 4.009) 6.012 14.659 ( -7.250 -1.693 1.988) 7.706 14.870 ( -0.864 2.603 1.389) 3.074 14.977 ( -10.567 -5.570 9.901) 15.515 15.208 ( 1.128 -11.556 1.225) 11.675 15.286 ( 1.542 -10.047 -0.871) 10.202 15.325 ( 6.440 -3.717 3.092) 8.053 15.843 ( 0.933 -0.738 3.016) 3.242 15.884 ( 0.531 -4.985 0.606) 5.050 16.365 ( -0.967 0.942 -5.115) 5.290 16.389 ( -1.563 -0.194 -5.457) 5.680 17.076 ( 1.677 -3.001 8.060) 8.762 17.242 ( 8.280 -13.579 2.163) 16.050 18.376 ( -0.687 0.727 -6.470) 6.547 18.429 ( 1.616 -0.977 -7.519) 7.753 19.522 ( -0.856 1.828 3.575) 4.106 19.529 ( -1.467 0.454 3.012) 3.381 22.550 ( -3.183 17.005 -5.701) 18.216 22.983 ( 10.185 -0.067 7.152) 12.446 23.751 ( -3.351 -0.161 -8.000) 8.675 24.060 ( 6.259 -11.683 6.107) 14.593 ======================= Grid point 138 (70/130) ======================= q-point: (-0.10 0.38 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.060 ( -8.876 23.549 -8.497) 26.562 2.201 ( -8.797 23.173 -2.685) 24.931 2.855 ( -6.100 -10.646 -7.691) 14.481 2.918 ( 1.876 -10.335 -21.401) 23.839 3.421 ( -6.137 27.026 9.529) 29.306 3.670 ( 7.207 19.308 7.885) 22.066 4.023 ( -4.944 3.028 -6.732) 8.885 4.098 ( -1.926 -5.088 11.787) 12.981 4.215 ( 2.392 -3.122 4.796) 6.203 4.412 ( 1.864 -3.423 0.750) 3.969 4.712 ( -0.058 19.494 3.733) 19.849 5.226 ( 3.025 -1.582 1.449) 3.709 5.299 ( 1.251 20.517 0.470) 20.561 5.625 ( 0.088 1.040 0.302) 1.086 5.737 ( -5.372 1.067 -4.616) 7.163 6.040 ( 10.472 -11.998 -13.767) 21.051 6.065 ( 8.283 8.776 2.558) 12.336 6.469 ( -2.284 13.363 -1.704) 13.663 6.777 ( 3.519 -15.808 10.380) 19.236 6.888 ( -10.796 10.288 9.867) 17.882 7.171 ( -0.189 -6.543 2.860) 7.144 7.354 ( -10.859 -6.750 -0.396) 12.792 7.639 ( -4.867 8.923 -3.455) 10.735 7.724 ( -0.073 17.210 -8.162) 19.047 7.936 ( 7.089 3.418 -10.167) 12.857 8.044 ( -6.632 -0.429 -5.236) 8.461 8.173 ( 3.431 -7.909 -13.536) 16.048 8.265 ( -10.588 8.759 10.713) 17.424 8.456 ( -7.725 -5.086 -3.231) 9.797 8.804 ( 8.663 2.663 -7.477) 11.749 8.975 ( -5.964 2.028 11.050) 12.720 9.018 ( 11.918 -0.449 -1.315) 11.999 9.236 ( -5.303 -2.679 23.392) 24.135 9.615 ( -9.479 0.206 3.718) 10.184 9.662 ( -4.144 -10.130 2.174) 11.159 9.702 ( 0.188 -12.639 -3.154) 13.028 10.155 ( -0.389 4.337 -4.447) 6.224 10.258 ( 3.487 -3.314 0.950) 4.903 10.287 ( 1.955 0.070 5.058) 5.424 10.436 ( 1.968 -2.687 3.485) 4.820 10.680 ( 1.487 0.321 -1.692) 2.275 10.739 ( -5.925 -3.402 4.566) 8.217 11.097 ( 2.876 3.354 -2.086) 4.886 11.136 ( 4.368 1.880 -4.793) 6.751 11.258 ( -1.113 17.928 -4.270) 18.463 11.419 ( 3.712 -0.089 -13.253) 13.763 11.478 ( -0.848 6.949 6.504) 9.555 11.601 ( 0.223 5.619 -2.454) 6.136 11.914 ( -2.324 -0.145 1.985) 3.060 12.080 ( 1.047 -2.585 8.965) 9.388 12.124 ( -0.009 -5.193 0.611) 5.229 12.268 ( 1.655 -0.700 2.585) 3.148 12.352 ( 3.114 -3.200 -0.042) 4.465 12.434 ( 2.371 3.807 0.533) 4.517 12.600 ( 1.834 -4.685 0.473) 5.054 12.769 ( -0.459 -6.365 -3.228) 7.151 12.844 ( 4.186 0.244 -0.525) 4.226 13.014 ( 2.708 4.306 0.486) 5.110 13.156 ( -3.103 4.043 -0.510) 5.122 13.318 ( 8.230 -1.916 1.566) 8.594 13.405 ( 7.456 -7.403 -2.574) 10.817 13.537 ( -1.894 -5.629 -1.266) 6.072 13.761 ( 1.208 3.505 -3.775) 5.291 13.849 ( 3.594 -0.377 -4.212) 5.550 13.991 ( 0.004 7.246 0.780) 7.288 14.229 ( 1.968 8.273 -0.545) 8.521 14.242 ( 0.897 5.076 -8.369) 9.829 14.316 ( 1.605 4.337 -0.495) 4.651 14.347 ( 1.462 -2.772 -1.754) 3.591 14.479 ( -9.483 2.130 5.693) 11.264 14.538 ( -4.728 -0.940 0.572) 4.854 14.793 ( -7.397 1.304 -0.001) 7.512 14.884 ( -4.527 -2.413 8.772) 10.162 15.259 ( 2.664 -12.017 -0.113) 12.309 15.332 ( 2.775 -7.597 3.586) 8.847 15.532 ( 14.189 -1.812 -4.279) 14.931 15.856 ( -0.973 -2.850 0.914) 3.147 15.883 ( -0.886 -6.476 -0.083) 6.537 16.292 ( -2.202 0.710 -5.168) 5.663 16.341 ( -2.005 -1.165 -1.645) 2.843 17.139 ( -5.430 -2.659 15.950) 17.057 17.383 ( 1.897 -16.228 6.487) 17.579 18.347 ( 4.867 2.584 -10.570) 11.920 18.445 ( 8.321 -1.608 -13.516) 15.953 19.504 ( -3.757 0.890 5.757) 6.932 19.516 ( -3.240 1.043 6.050) 6.941 22.489 ( -0.321 19.900 -0.603) 19.912 23.178 ( 3.853 -13.078 3.037) 13.968 23.662 ( 0.999 10.786 -5.392) 12.100 24.167 ( 1.873 -13.228 1.049) 13.401 ======================= Grid point 139 (71/130) ======================= q-point: ( 0.00 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.364 ( -1.518 -18.212 -10.178) 20.919 2.364 ( -1.518 18.212 -10.178) 20.919 2.558 ( 6.112 -17.999 -14.536) 23.929 2.558 ( 6.112 17.999 -14.536) 23.929 3.845 ( -2.172 -9.097 4.925) 10.570 3.845 ( -2.172 9.097 4.925) 10.570 4.101 ( -4.469 -6.612 7.497) 10.950 4.101 ( -4.469 6.612 7.497) 10.950 4.312 ( 7.056 -6.765 7.717) 12.454 4.312 ( 7.056 6.765 7.717) 12.454 5.055 ( -1.945 -10.907 -0.965) 11.121 5.055 ( -1.945 10.907 -0.965) 11.121 5.645 ( 0.058 -4.838 -0.631) 4.879 5.645 ( 0.058 4.838 -0.631) 4.879 5.739 ( -0.817 -17.653 -10.055) 20.332 5.739 ( -0.817 17.653 -10.055) 20.332 6.498 ( 4.323 -14.915 5.075) 16.337 6.498 ( 4.323 14.915 5.075) 16.337 6.812 ( -1.265 -9.513 5.539) 11.081 6.812 ( -1.265 9.513 5.539) 11.081 7.041 ( -5.314 -2.145 3.237) 6.582 7.041 ( -5.314 2.145 3.237) 6.582 7.797 ( 1.728 -5.536 -7.259) 9.291 7.797 ( 1.728 5.536 -7.259) 9.291 8.009 ( 5.959 -4.638 -9.363) 12.028 8.009 ( 5.959 4.638 -9.363) 12.028 8.092 ( -2.227 -7.325 -6.034) 9.748 8.092 ( -2.227 7.325 -6.034) 9.748 8.629 ( -1.593 -20.370 -0.024) 20.432 8.629 ( -1.593 20.370 -0.024) 20.432 9.126 ( -0.641 -8.303 9.184) 12.398 9.126 ( -0.641 8.303 9.184) 12.398 9.387 ( -9.120 -2.000 3.215) 9.875 9.387 ( -9.120 2.000 3.215) 9.875 9.493 ( 3.788 -8.355 6.353) 11.159 9.493 ( 3.788 8.355 6.353) 11.159 10.183 ( -0.537 -3.291 -4.920) 5.944 10.183 ( -0.537 3.291 -4.920) 5.944 10.438 ( 2.677 -4.795 7.496) 9.293 10.438 ( 2.677 4.795 7.496) 9.293 10.701 ( 1.697 -1.870 3.208) 4.083 10.701 ( 1.697 1.870 3.208) 4.083 11.181 ( 3.744 -0.793 -4.746) 6.097 11.181 ( 3.744 0.793 -4.746) 6.097 11.514 ( 2.200 -1.382 -0.523) 2.650 11.514 ( 2.200 1.382 -0.523) 2.650 11.689 ( -0.769 -16.497 -2.473) 16.699 11.689 ( -0.769 16.497 -2.473) 16.699 11.778 ( -2.579 -5.816 -0.097) 6.363 11.778 ( -2.579 5.816 -0.097) 6.363 12.146 ( -2.831 -2.257 3.437) 4.992 12.146 ( -2.831 2.257 3.437) 4.992 12.521 ( 3.660 -5.164 5.568) 8.431 12.521 ( 3.660 5.164 5.568) 8.431 12.610 ( 0.212 -4.612 -1.806) 4.958 12.610 ( 0.212 4.612 -1.806) 4.958 13.003 ( -3.245 -1.677 -2.745) 4.570 13.003 ( -3.245 1.677 -2.745) 4.570 13.212 ( 1.187 -7.651 -2.491) 8.134 13.212 ( 1.187 7.651 -2.491) 8.134 13.437 ( 0.029 -3.390 -3.388) 4.793 13.437 ( 0.029 3.390 -3.388) 4.793 13.859 ( 1.649 -2.468 -1.560) 3.353 13.859 ( 1.649 2.468 -1.560) 3.353 14.187 ( 5.608 -6.215 0.650) 8.396 14.187 ( 5.608 6.215 0.650) 8.396 14.277 ( -5.422 -5.644 1.230) 7.923 14.277 ( -5.422 5.644 1.230) 7.923 14.349 ( -1.713 -4.071 -3.410) 5.580 14.349 ( -1.713 4.071 -3.410) 5.580 14.671 ( -0.657 -8.787 0.435) 8.823 14.671 ( -0.657 8.787 0.435) 8.823 15.004 ( -1.244 -11.734 3.576) 12.330 15.004 ( -1.244 11.734 3.576) 12.330 15.484 ( 3.453 -12.068 1.332) 12.622 15.484 ( 3.453 12.068 1.332) 12.622 15.836 ( 3.311 -0.224 -1.163) 3.517 15.836 ( 3.311 0.224 -1.163) 3.517 16.228 ( -3.869 -2.029 -6.135) 7.532 16.228 ( -3.869 2.029 -6.135) 7.532 17.120 ( -10.621 -7.248 11.653) 17.353 17.120 ( -10.621 7.248 11.653) 17.353 18.502 ( 12.016 -2.989 -12.522) 17.610 18.502 ( 12.016 2.989 -12.522) 17.610 19.499 ( -3.617 -0.499 7.981) 8.777 19.499 ( -3.617 0.499 7.981) 8.777 22.915 ( 1.953 -14.820 3.305) 15.309 22.915 ( 1.953 14.820 3.305) 15.309 23.878 ( -1.872 -10.303 -4.214) 11.287 23.878 ( -1.872 10.303 -4.214) 11.287 ======================= Grid point 141 (72/130) ======================= q-point: ( 0.10 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.346 ( 6.908 -11.452 -9.823) 16.594 2.346 ( 6.908 11.452 -9.823) 16.594 2.659 ( 14.374 -16.470 -13.283) 25.580 2.659 ( 14.374 16.470 -13.283) 25.580 3.817 ( -4.635 -7.470 1.709) 8.956 3.817 ( -4.635 7.470 1.709) 8.956 4.029 ( -5.953 -6.324 10.815) 13.871 4.029 ( -5.953 6.324 10.815) 13.871 4.532 ( 7.148 -0.719 7.361) 10.286 4.532 ( 7.148 0.719 7.361) 10.286 4.978 ( -4.072 -6.782 -2.130) 8.192 4.978 ( -4.072 6.782 -2.130) 8.192 5.603 ( -5.253 -17.518 -7.584) 19.799 5.603 ( -5.253 17.518 -7.584) 19.799 5.672 ( 2.351 -5.793 -1.044) 6.338 5.672 ( 2.351 5.793 -1.044) 6.338 6.583 ( 1.456 -11.713 4.613) 12.673 6.583 ( 1.456 11.713 4.613) 12.673 6.735 ( -11.738 -6.041 5.249) 14.207 6.735 ( -11.738 6.041 5.249) 14.207 7.113 ( 10.696 -11.127 1.954) 15.557 7.113 ( 10.696 11.127 1.954) 15.557 7.784 ( -3.073 -6.910 -10.255) 12.742 7.784 ( -3.073 6.910 -10.255) 12.742 8.014 ( 9.859 -6.636 -8.966) 14.887 8.014 ( 9.859 6.636 -8.966) 14.887 8.139 ( 7.993 -4.478 -5.453) 10.662 8.139 ( 7.993 4.478 -5.453) 10.662 8.629 ( 0.944 -18.941 2.324) 19.106 8.629 ( 0.944 18.941 2.324) 19.106 9.140 ( -4.396 -7.396 6.498) 10.782 9.140 ( -4.396 7.396 6.498) 10.782 9.209 ( -9.790 -0.587 10.640) 14.471 9.209 ( -9.790 0.587 10.640) 14.471 9.659 ( 7.353 -6.631 2.616) 10.241 9.659 ( 7.353 6.631 2.616) 10.241 10.141 ( 0.090 -2.588 -5.036) 5.663 10.141 ( 0.090 2.588 -5.036) 5.663 10.508 ( -0.727 -4.791 5.174) 7.089 10.508 ( -0.727 4.791 5.174) 7.089 10.775 ( 2.887 -2.513 3.586) 5.245 10.775 ( 2.887 2.513 3.586) 5.245 11.220 ( 3.196 -0.940 -2.890) 4.410 11.220 ( 3.196 0.940 -2.890) 4.410 11.546 ( 1.322 -5.581 -0.544) 5.761 11.546 ( 1.322 5.581 -0.544) 5.761 11.665 ( -0.148 -12.907 -1.461) 12.991 11.665 ( -0.148 12.907 -1.461) 12.991 11.720 ( -2.928 -5.504 -0.159) 6.237 11.720 ( -2.928 5.504 -0.159) 6.237 12.082 ( -4.668 -4.943 -0.768) 6.842 12.082 ( -4.668 4.943 -0.768) 6.842 12.562 ( -0.526 -3.854 -0.229) 3.896 12.562 ( -0.526 3.854 -0.229) 3.896 12.678 ( 2.039 -6.079 7.811) 10.106 12.678 ( 2.039 6.079 7.811) 10.106 12.856 ( -6.368 -1.861 -2.008) 6.931 12.856 ( -6.368 1.861 -2.008) 6.931 13.227 ( 0.835 -7.151 -3.807) 8.144 13.227 ( 0.835 7.151 -3.807) 8.144 13.369 ( -3.340 -6.484 -4.326) 8.480 13.369 ( -3.340 6.484 -4.326) 8.480 13.865 ( -0.338 -1.485 -0.608) 1.640 13.865 ( -0.338 1.485 -0.608) 1.640 14.135 ( -6.801 -6.294 -0.775) 9.299 14.135 ( -6.801 6.294 -0.775) 9.299 14.279 ( -0.188 -3.242 -4.919) 5.895 14.279 ( -0.188 3.242 -4.919) 5.895 14.398 ( 8.316 -5.123 2.639) 10.118 14.398 ( 8.316 5.123 2.639) 10.118 14.700 ( 4.262 -7.122 0.762) 8.335 14.700 ( 4.262 7.122 0.762) 8.335 14.977 ( -3.759 -11.622 3.576) 12.727 14.977 ( -3.759 11.622 3.576) 12.727 15.496 ( -4.443 -12.256 4.315) 13.732 15.496 ( -4.443 12.256 4.315) 13.732 15.918 ( 0.865 -3.152 3.169) 4.552 15.918 ( 0.865 3.152 3.169) 4.552 16.111 ( 1.874 -2.099 -11.791) 12.122 16.111 ( 1.874 2.099 -11.791) 12.122 16.973 ( -9.808 -8.339 6.162) 14.273 16.973 ( -9.808 8.339 6.162) 14.273 18.639 ( 8.400 -2.694 -7.240) 11.412 18.639 ( 8.400 2.694 -7.240) 11.412 19.497 ( -2.093 -0.432 6.771) 7.101 19.497 ( -2.093 0.432 6.771) 7.101 22.967 ( 0.426 -4.900 2.854) 5.686 22.967 ( 0.426 4.900 2.854) 5.686 23.792 ( -3.364 -1.603 -3.773) 5.303 23.792 ( -3.364 1.603 -3.773) 5.303 ======================= Grid point 143 (73/130) ======================= q-point: ( 0.20 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.469 ( 11.661 -3.043 -7.963) 14.445 2.469 ( 11.661 3.043 -7.963) 14.445 2.893 ( 17.466 -14.049 -9.887) 24.499 2.893 ( 17.466 14.049 -9.887) 24.499 3.699 ( -7.344 -10.967 1.768) 13.317 3.699 ( -7.344 10.967 1.768) 13.317 4.066 ( 1.946 -6.927 9.133) 11.627 4.066 ( 1.946 6.927 9.133) 11.627 4.578 ( -5.810 -4.355 -0.647) 7.290 4.578 ( -5.810 4.355 -0.647) 7.290 4.944 ( 1.076 -6.934 1.950) 7.283 4.944 ( 1.076 6.934 1.950) 7.283 5.450 ( -5.753 -9.879 -4.393) 12.246 5.450 ( -5.753 9.879 -4.393) 12.246 5.721 ( 3.407 -4.770 -0.992) 5.945 5.721 ( 3.407 4.770 -0.992) 5.945 6.504 ( -14.947 -1.378 9.011) 17.508 6.504 ( -14.947 1.378 9.011) 17.508 6.651 ( 2.299 -2.309 0.675) 3.328 6.651 ( 2.299 2.309 0.675) 3.328 7.316 ( 4.695 -14.064 0.326) 14.831 7.316 ( 4.695 14.064 0.326) 14.831 7.611 ( -1.226 -8.894 -10.915) 14.133 7.611 ( -1.226 8.894 -10.915) 14.133 8.188 ( 9.706 -8.712 -7.227) 14.911 8.188 ( 9.706 8.712 -7.227) 14.911 8.292 ( 13.305 -5.907 -9.729) 17.509 8.292 ( 13.305 5.907 -9.729) 17.509 8.706 ( 4.508 -11.226 5.907) 13.462 8.706 ( 4.508 11.226 5.907) 13.462 9.085 ( -3.276 -4.467 5.974) 8.147 9.085 ( -3.276 4.467 5.974) 8.147 9.172 ( -6.436 -4.603 17.740) 19.424 9.172 ( -6.436 4.603 17.740) 19.424 9.789 ( 5.512 -4.680 -0.901) 7.287 9.789 ( 5.512 4.680 -0.901) 7.287 10.131 ( 2.356 -1.242 -3.532) 4.423 10.131 ( 2.356 1.242 -3.532) 4.423 10.457 ( -6.720 -3.936 0.025) 7.788 10.457 ( -6.720 3.936 0.025) 7.788 10.847 ( 2.871 -1.431 1.521) 3.551 10.847 ( 2.871 1.431 1.521) 3.551 11.255 ( 2.501 -1.875 -3.569) 4.744 11.255 ( 2.501 1.875 -3.569) 4.744 11.558 ( 1.410 -14.814 -2.668) 15.118 11.558 ( 1.410 14.814 -2.668) 15.118 11.647 ( -1.672 -9.423 -0.056) 9.571 11.647 ( -1.672 9.423 -0.057) 9.571 11.694 ( -0.637 -9.598 3.451) 10.220 11.694 ( -0.637 9.599 3.451) 10.220 11.980 ( -4.752 -9.712 -0.878) 10.847 11.980 ( -4.752 9.712 -0.878) 10.847 12.529 ( -4.451 -1.612 0.209) 4.738 12.529 ( -4.451 1.612 0.209) 4.738 12.622 ( -4.427 -0.360 -2.174) 4.945 12.622 ( -4.427 0.360 -2.174) 4.945 12.885 ( 2.762 -5.486 6.568) 8.993 12.885 ( 2.762 5.486 6.568) 8.993 13.191 ( -1.599 -6.498 -0.695) 6.728 13.191 ( -1.599 6.498 -0.695) 6.728 13.272 ( -3.169 -6.960 -6.000) 9.721 13.272 ( -3.169 6.960 -6.000) 9.721 13.812 ( -5.169 -1.734 -1.067) 5.556 13.812 ( -5.169 1.734 -1.067) 5.556 14.031 ( -2.699 -5.694 -1.083) 6.394 14.031 ( -2.699 5.694 -1.083) 6.394 14.232 ( -1.609 -1.153 -3.073) 3.656 14.232 ( -1.609 1.153 -3.073) 3.656 14.527 ( 3.376 -3.367 2.053) 5.191 14.527 ( 3.376 3.367 2.053) 5.191 14.856 ( 9.907 -4.375 -0.029) 10.830 14.856 ( 9.907 4.375 -0.029) 10.830 14.932 ( -3.359 -12.437 4.506) 13.648 14.932 ( -3.359 12.437 4.506) 13.648 15.350 ( -13.142 -6.309 4.662) 15.305 15.350 ( -13.142 6.309 4.662) 15.305 15.886 ( -3.108 -3.278 5.434) 7.066 15.886 ( -3.108 3.278 5.434) 7.066 16.202 ( 12.868 -3.572 -13.421) 18.933 16.202 ( 12.868 3.572 -13.421) 18.933 16.866 ( -4.437 -7.348 2.559) 8.957 16.866 ( -4.437 7.348 2.559) 8.957 18.700 ( 1.418 -1.582 -1.935) 2.874 18.700 ( 1.418 1.582 -1.935) 2.874 19.501 ( -1.491 -0.647 3.324) 3.700 19.501 ( -1.491 0.647 3.324) 3.700 22.948 ( -3.224 -8.661 -0.732) 9.270 22.948 ( -3.224 8.661 -0.732) 9.270 23.730 ( -1.578 -10.832 0.071) 10.947 23.730 ( -1.578 10.832 0.071) 10.947 ======================= Grid point 145 (74/130) ======================= q-point: ( 0.30 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.649 ( 11.506 -3.370 -5.192) 13.066 2.649 ( 11.506 3.370 -5.192) 13.066 3.135 ( 13.088 -12.158 -6.935) 19.163 3.135 ( 13.088 12.158 -6.935) 19.163 3.611 ( -2.067 -8.578 0.469) 8.836 3.611 ( -2.067 8.578 0.469) 8.836 4.204 ( 5.152 -7.195 6.610) 11.045 4.204 ( 5.152 7.195 6.610) 11.045 4.384 ( -10.644 -2.893 -2.176) 11.243 4.384 ( -10.644 2.893 -2.176) 11.243 4.955 ( -2.499 -16.675 -0.112) 16.862 4.955 ( -2.499 16.675 -0.112) 16.862 5.353 ( -1.448 -6.635 -1.524) 6.960 5.353 ( -1.448 6.635 -1.524) 6.960 5.791 ( 4.210 -3.471 0.013) 5.456 5.791 ( 4.210 3.471 0.013) 5.456 6.290 ( -12.826 -4.610 6.458) 15.082 6.290 ( -12.826 4.610 6.458) 15.082 6.689 ( -0.549 -4.936 3.311) 5.969 6.689 ( -0.549 4.936 3.311) 5.969 7.247 ( -5.627 -10.426 -0.300) 11.852 7.247 ( -5.627 10.426 -0.300) 11.852 7.673 ( 10.689 -4.223 -11.468) 16.236 7.673 ( 10.689 4.223 -11.468) 16.236 8.285 ( 4.808 -6.914 -3.838) 9.255 8.285 ( 4.808 6.914 -3.838) 9.255 8.401 ( 4.408 -5.520 -8.168) 10.799 8.401 ( 4.408 5.520 -8.168) 10.799 8.869 ( 7.224 -1.990 2.911) 8.039 8.869 ( 7.224 1.990 2.911) 8.039 9.109 ( -0.611 -16.535 9.297) 18.979 9.109 ( -0.611 16.535 9.297) 18.979 9.216 ( -0.530 -5.673 16.384) 17.347 9.216 ( -0.530 5.673 16.384) 17.347 9.869 ( 4.933 -1.693 -2.469) 5.771 9.869 ( 4.933 1.693 -2.469) 5.771 10.171 ( 2.351 -4.589 -1.808) 5.464 10.171 ( 2.351 4.589 -1.808) 5.464 10.279 ( -9.283 -4.239 -2.926) 10.617 10.279 ( -9.283 4.239 -2.926) 10.617 10.904 ( 2.749 -1.689 -0.883) 3.345 10.904 ( 2.749 1.689 -0.883) 3.345 11.260 ( 1.419 -1.094 -5.927) 6.192 11.260 ( 1.419 1.094 -5.927) 6.192 11.571 ( 2.057 -18.271 -3.781) 18.771 11.571 ( 2.057 18.271 -3.781) 18.771 11.611 ( -1.057 -12.278 -0.644) 12.341 11.611 ( -1.057 12.278 -0.644) 12.341 11.728 ( -0.364 -13.541 8.443) 15.962 11.728 ( -0.364 13.541 8.443) 15.962 11.904 ( -3.373 -13.478 1.188) 13.944 11.904 ( -3.373 13.478 1.188) 13.944 12.394 ( -6.456 -4.226 -2.695) 8.173 12.394 ( -6.456 4.226 -2.695) 8.173 12.583 ( -1.241 -5.343 1.367) 5.653 12.583 ( -1.241 5.343 1.367) 5.653 12.906 ( -1.168 -6.334 -5.298) 8.340 12.906 ( -1.168 6.334 -5.298) 8.340 13.164 ( -3.064 -4.571 -5.951) 8.105 13.164 ( -3.064 4.571 -5.951) 8.105 13.214 ( 0.154 -9.344 9.201) 13.115 13.214 ( 0.154 9.344 9.201) 13.115 13.688 ( -5.737 -3.520 -1.481) 6.891 13.688 ( -5.737 3.520 -1.481) 6.891 13.999 ( -1.145 -3.597 0.485) 3.806 13.999 ( -1.145 3.597 0.485) 3.806 14.181 ( -2.070 -3.727 -0.974) 4.373 14.181 ( -2.070 3.727 -0.974) 4.373 14.578 ( 1.035 -2.046 1.435) 2.704 14.578 ( 1.035 2.046 1.435) 2.704 14.863 ( -6.503 -15.163 4.349) 17.062 14.863 ( -6.503 15.163 4.349) 17.062 14.988 ( -0.591 -3.725 1.421) 4.031 14.988 ( -0.591 3.725 1.421) 4.031 15.224 ( 2.429 -3.159 0.229) 3.992 15.224 ( 2.429 3.159 0.229) 3.992 15.893 ( -1.369 -4.182 6.403) 7.769 15.893 ( -1.369 4.182 6.403) 7.769 16.346 ( 11.810 -5.757 -13.717) 18.994 16.346 ( 11.810 5.757 -13.717) 18.994 16.835 ( -0.968 -4.890 2.190) 5.445 16.835 ( -0.968 4.890 2.190) 5.445 18.678 ( -2.863 -0.700 0.854) 3.069 18.678 ( -2.863 0.700 0.854) 3.069 19.481 ( -1.867 -1.240 0.374) 2.272 19.481 ( -1.867 1.240 0.374) 2.272 22.859 ( -4.038 -14.866 -2.346) 15.582 22.859 ( -4.038 14.866 -2.346) 15.582 23.722 ( -0.667 -16.810 2.291) 16.979 23.722 ( -0.667 16.810 2.291) 16.979 ======================= Grid point 147 (75/130) ======================= q-point: ( 0.40 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.821 ( 8.550 -6.044 -0.271) 10.474 2.821 ( 8.550 6.044 -0.271) 10.474 3.268 ( 5.075 -8.562 -4.914) 11.100 3.268 ( 5.075 8.562 -4.914) 11.100 3.637 ( 5.946 -4.759 -4.879) 9.045 3.637 ( 5.946 4.759 -4.879) 9.045 4.098 ( -10.464 -6.813 -5.925) 13.821 4.098 ( -10.464 6.813 -5.925) 13.821 4.397 ( 1.675 -4.546 12.081) 13.017 4.397 ( 1.675 4.546 12.081) 13.017 4.868 ( -3.113 -17.285 -3.429) 17.895 4.868 ( -3.113 17.285 -3.429) 17.895 5.362 ( 1.911 -13.428 -1.295) 13.625 5.362 ( 1.911 13.428 -1.295) 13.625 5.859 ( 1.904 -4.277 0.403) 4.699 5.859 ( 1.904 4.277 0.403) 4.699 6.122 ( -7.955 -8.335 3.945) 12.178 6.122 ( -7.955 8.335 3.945) 12.178 6.684 ( -2.324 -6.870 6.685) 9.863 6.684 ( -2.324 6.870 6.685) 9.863 7.197 ( -0.842 -9.676 1.530) 9.833 7.197 ( -0.842 9.676 1.530) 9.833 7.777 ( 9.620 -2.049 -13.367) 16.596 7.777 ( 9.620 2.049 -13.367) 16.596 8.285 ( -2.140 -2.174 -2.316) 3.831 8.285 ( -2.140 2.174 -2.316) 3.831 8.427 ( 3.225 -4.139 -3.265) 6.180 8.427 ( 3.225 4.139 -3.265) 6.180 8.964 ( 1.061 -0.958 4.189) 4.426 8.964 ( 1.061 0.958 4.189) 4.426 9.138 ( -3.595 -22.109 8.253) 23.871 9.138 ( -3.595 22.109 8.253) 23.871 9.376 ( 6.027 -4.208 8.878) 11.526 9.376 ( 6.027 4.208 8.878) 11.526 9.946 ( 3.440 -4.937 -4.119) 7.293 9.946 ( 3.440 4.937 -4.119) 7.293 10.077 ( -5.035 -2.413 0.621) 5.617 10.077 ( -5.035 2.413 0.621) 5.617 10.209 ( -0.404 -2.825 -1.858) 3.406 10.209 ( -0.404 2.825 -1.858) 3.406 10.933 ( 1.653 -4.798 -3.162) 5.980 10.933 ( 1.653 4.798 -3.162) 5.980 11.230 ( 0.658 -0.931 -7.577) 7.662 11.230 ( 0.658 0.931 -7.577) 7.662 11.557 ( -0.803 -7.966 -0.519) 8.023 11.557 ( -0.803 7.966 -0.519) 8.023 11.640 ( 4.029 -2.733 -2.338) 5.401 11.640 ( 4.029 2.733 -2.338) 5.401 11.784 ( -0.675 -14.231 9.236) 16.979 11.784 ( -0.675 14.231 9.236) 16.979 11.857 ( -3.006 -13.171 2.189) 13.686 11.857 ( -3.006 13.171 2.189) 13.686 12.288 ( -2.683 -5.423 -1.700) 6.284 12.288 ( -2.683 5.423 -1.700) 6.284 12.565 ( -1.826 -5.121 1.330) 5.597 12.565 ( -1.826 5.121 1.330) 5.597 12.810 ( -1.804 -5.153 -11.038) 12.314 12.810 ( -1.804 5.153 -11.038) 12.314 13.086 ( -1.079 -5.932 -4.272) 7.390 13.086 ( -1.079 5.932 -4.272) 7.390 13.282 ( -1.013 -5.298 11.307) 12.528 13.282 ( -1.013 5.298 11.307) 12.528 13.597 ( -3.222 -1.848 0.044) 3.715 13.597 ( -3.222 1.848 0.044) 3.715 13.991 ( -0.515 -3.317 2.319) 4.080 13.991 ( -0.515 3.317 2.319) 4.080 14.147 ( -0.966 -5.120 -0.158) 5.212 14.147 ( -0.966 5.120 -0.158) 5.212 14.593 ( -0.190 -9.178 1.403) 9.287 14.593 ( -0.190 9.178 1.403) 9.287 14.766 ( -5.418 -3.640 4.026) 7.669 14.766 ( -5.418 3.640 4.026) 7.669 14.956 ( -2.590 -9.088 2.003) 9.660 14.956 ( -2.590 9.088 2.003) 9.660 15.331 ( 7.044 -2.315 -4.435) 8.640 15.331 ( 7.044 2.315 -4.436) 8.640 15.902 ( -2.568 -3.578 6.413) 7.780 15.902 ( -2.568 3.578 6.413) 7.780 16.451 ( 8.893 -6.243 -13.153) 17.060 16.451 ( 8.893 6.243 -13.153) 17.060 16.847 ( 0.286 -1.966 2.487) 3.183 16.847 ( 0.286 1.966 2.487) 3.183 18.619 ( -3.946 -1.358 1.577) 4.461 18.619 ( -3.946 1.358 1.577) 4.461 19.447 ( -1.037 -1.564 -1.032) 2.142 19.447 ( -1.037 1.564 -1.032) 2.142 22.787 ( -1.811 -14.707 -1.473) 14.892 22.787 ( -1.811 14.707 -1.473) 14.892 23.722 ( -1.009 -16.864 2.083) 17.022 23.722 ( -1.009 16.864 2.083) 17.022 ======================= Grid point 149 (76/130) ======================= q-point: (-0.50 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.964 ( 4.288 -4.408 5.374) 8.167 2.964 ( 4.288 4.408 5.374) 8.167 3.272 ( -0.679 -3.868 -4.679) 6.108 3.272 ( -0.679 3.868 -4.679) 6.108 3.691 ( 2.051 -1.669 -13.286) 13.547 3.691 ( 2.051 1.669 -13.286) 13.547 3.927 ( -0.607 -8.602 -2.374) 8.945 3.927 ( -0.607 8.602 -2.374) 8.945 4.448 ( -4.487 -5.193 11.956) 13.786 4.448 ( -4.487 5.193 11.956) 13.786 4.850 ( 3.516 -14.748 -3.197) 15.495 4.850 ( 3.516 14.748 -3.197) 15.495 5.353 ( -1.669 -11.883 -3.385) 12.468 5.353 ( -1.669 11.883 -3.385) 12.468 5.869 ( -0.500 -3.128 1.913) 3.700 5.869 ( -0.500 3.128 1.913) 3.700 6.050 ( -2.737 -9.927 1.803) 10.454 6.050 ( -2.737 9.927 1.803) 10.454 6.733 ( 1.455 -5.716 10.168) 11.755 6.733 ( 1.455 5.716 10.168) 11.755 7.193 ( -0.946 -9.404 1.112) 9.516 7.193 ( -0.946 9.404 1.112) 9.516 7.879 ( 11.665 -1.178 -14.367) 18.544 7.879 ( 11.665 1.178 -14.367) 18.544 8.222 ( -3.050 -2.669 -0.267) 4.062 8.222 ( -3.050 2.669 -0.267) 4.062 8.450 ( 0.914 -7.133 -2.551) 7.631 8.450 ( 0.914 7.133 -2.551) 7.631 8.988 ( -2.852 -3.434 6.519) 7.901 8.988 ( -2.852 3.434 6.519) 7.901 9.092 ( -5.624 -24.018 6.077) 25.406 9.092 ( -5.624 24.018 6.077) 25.406 9.456 ( -4.344 -7.169 4.066) 9.316 9.456 ( -4.344 7.169 4.066) 9.316 9.937 ( 3.918 -1.064 -3.351) 5.264 9.937 ( 3.918 1.064 -3.351) 5.264 10.107 ( 0.418 -2.843 1.499) 3.241 10.107 ( 0.418 2.843 1.499) 3.241 10.171 ( -0.021 -4.108 -0.701) 4.168 10.171 ( -0.021 4.108 -0.701) 4.168 10.924 ( 0.555 -7.600 -4.810) 9.011 10.924 ( 0.555 7.600 -4.810) 9.011 11.182 ( -0.224 -0.730 -8.309) 8.344 11.182 ( -0.224 0.730 -8.309) 8.344 11.549 ( -0.761 -6.643 1.383) 6.828 11.549 ( -0.761 6.643 1.383) 6.828 11.704 ( 3.763 -7.018 -1.144) 8.045 11.704 ( 3.763 7.018 -1.144) 8.045 11.802 ( -2.469 -7.360 3.894) 8.685 11.802 ( -2.469 7.360 3.894) 8.685 11.843 ( -0.685 -2.109 6.111) 6.501 11.843 ( -0.685 2.109 6.111) 6.501 12.272 ( 1.399 -4.761 -0.255) 4.969 12.272 ( 1.399 4.761 -0.255) 4.969 12.527 ( -1.629 -3.733 -2.318) 4.686 12.527 ( -1.629 3.733 -2.318) 4.686 12.732 ( 1.346 -0.812 -8.522) 8.666 12.732 ( 1.346 0.812 -8.522) 8.666 13.048 ( -0.161 -9.556 -4.852) 10.718 13.048 ( -0.161 9.556 -4.852) 10.718 13.349 ( -0.069 -3.453 12.206) 12.685 13.349 ( -0.069 3.453 12.206) 12.685 13.565 ( -0.136 -1.539 0.170) 1.554 13.565 ( -0.136 1.539 0.170) 1.554 14.016 ( 0.688 -3.683 4.231) 5.652 14.016 ( 0.688 3.683 4.231) 5.652 14.145 ( 1.160 -4.205 -0.620) 4.406 14.145 ( 1.160 4.205 -0.620) 4.406 14.600 ( -0.576 -8.032 2.306) 8.376 14.600 ( -0.576 8.032 2.306) 8.376 14.724 ( -1.176 -2.998 2.251) 3.929 14.724 ( -1.176 2.998 2.251) 3.929 14.922 ( -2.312 -11.588 1.822) 11.956 14.922 ( -2.312 11.588 1.822) 11.956 15.389 ( 2.444 -3.224 -5.621) 6.925 15.389 ( 2.444 3.224 -5.621) 6.925 15.883 ( -3.793 -2.769 5.697) 7.384 15.883 ( -3.793 2.769 5.697) 7.384 16.498 ( 5.372 -5.364 -12.201) 14.370 16.498 ( 5.372 5.364 -12.201) 14.370 16.873 ( 0.556 -1.138 2.688) 2.972 16.873 ( 0.556 1.138 2.688) 2.972 18.558 ( -3.391 -1.616 1.031) 3.895 18.558 ( -3.391 1.616 1.031) 3.895 19.439 ( 1.171 -1.413 -1.171) 2.177 19.439 ( 1.171 1.413 -1.171) 2.177 22.773 ( 0.921 -11.927 -0.632) 11.979 22.773 ( 0.921 11.927 -0.632) 11.979 23.715 ( -0.868 -14.075 1.606) 14.192 23.715 ( -0.868 14.075 1.606) 14.192 ======================= Grid point 151 (77/130) ======================= q-point: (-0.40 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.029 ( -2.975 -2.889 7.039) 8.169 3.029 ( -2.975 2.889 7.039) 8.169 3.190 ( -4.297 -2.056 -6.372) 7.956 3.190 ( -4.297 2.056 -6.372) 7.956 3.553 ( -2.180 -1.778 -11.607) 11.943 3.553 ( -2.180 1.778 -11.607) 11.943 4.019 ( 7.598 -5.676 -2.316) 9.763 4.019 ( 7.598 5.676 -2.316) 9.763 4.426 ( -5.325 -3.924 8.647) 10.887 4.426 ( -5.325 3.924 8.647) 10.887 4.926 ( 5.662 -14.321 -1.666) 15.489 4.926 ( 5.662 14.321 -1.666) 15.489 5.287 ( -1.080 -5.303 -2.982) 6.179 5.287 ( -1.080 5.303 -2.982) 6.179 5.881 ( -1.194 -7.261 3.624) 8.202 5.881 ( -1.194 7.261 3.624) 8.203 6.022 ( -0.045 -9.781 -0.501) 9.794 6.022 ( -0.045 9.781 -0.501) 9.794 6.847 ( 1.112 -2.633 11.143) 11.504 6.847 ( 1.112 2.633 11.143) 11.504 7.203 ( 3.255 -5.214 0.177) 6.150 7.203 ( 3.255 5.214 0.177) 6.150 8.008 ( 10.751 -5.260 -13.590) 18.109 8.008 ( 10.751 5.260 -13.590) 18.109 8.161 ( -2.739 -5.027 -2.726) 6.340 8.161 ( -2.739 5.027 -2.726) 6.340 8.418 ( -2.160 -11.317 -3.196) 11.956 8.418 ( -2.160 11.317 -3.196) 11.956 8.921 ( -7.477 -11.082 6.221) 14.745 8.921 ( -7.477 11.082 6.221) 14.745 9.057 ( -3.121 -14.983 7.413) 17.006 9.057 ( -3.121 14.983 7.413) 17.006 9.304 ( -13.308 -5.537 5.967) 15.601 9.304 ( -13.308 5.537 5.967) 15.601 10.029 ( -3.175 -3.376 -1.115) 4.767 10.029 ( -3.175 3.376 -1.115) 4.767 10.058 ( 7.208 -3.462 -4.513) 9.182 10.058 ( 7.208 3.462 -4.513) 9.182 10.230 ( 2.351 -4.397 2.905) 5.771 10.230 ( 2.351 4.397 2.905) 5.771 10.894 ( -0.398 -8.767 -4.559) 9.889 10.894 ( -0.398 8.767 -4.559) 9.889 11.110 ( -0.839 -1.628 -7.892) 8.102 11.110 ( -0.839 1.628 -7.892) 8.102 11.527 ( -1.878 -2.699 -0.475) 3.322 11.527 ( -1.878 2.699 -0.475) 3.322 11.744 ( 0.238 -14.549 -0.179) 14.552 11.744 ( 0.238 14.549 -0.179) 14.552 11.805 ( 0.418 -15.992 4.094) 16.513 11.805 ( 0.418 15.992 4.094) 16.513 11.899 ( 2.188 -1.610 6.610) 7.146 11.899 ( 2.188 1.610 6.610) 7.146 12.324 ( 4.022 -3.877 -0.017) 5.586 12.324 ( 4.022 3.877 -0.017) 5.586 12.484 ( 0.325 -7.486 -6.384) 9.844 12.484 ( 0.325 7.486 -6.384) 9.844 12.734 ( 2.598 -2.792 -3.300) 5.043 12.734 ( 2.598 2.792 -3.300) 5.043 13.015 ( 0.855 -10.002 -5.008) 11.218 13.015 ( 0.855 10.002 -5.008) 11.218 13.427 ( -0.435 -5.215 8.924) 10.346 13.427 ( -0.435 5.215 8.924) 10.346 13.607 ( 4.505 -4.384 0.498) 6.306 13.607 ( 4.505 4.384 0.498) 6.306 14.072 ( 1.912 -3.989 4.693) 6.449 14.072 ( 1.912 3.989 4.693) 6.449 14.180 ( 2.944 -3.137 -1.107) 4.442 14.180 ( 2.944 3.137 -1.107) 4.442 14.588 ( -2.432 -3.484 2.314) 4.838 14.588 ( -2.432 3.484 2.314) 4.838 14.766 ( 3.897 -5.280 2.114) 6.894 14.766 ( 3.897 5.280 2.114) 6.894 14.894 ( -1.774 -13.169 1.344) 13.356 14.894 ( -1.774 13.169 1.344) 13.356 15.344 ( -3.844 -3.633 -3.234) 6.199 15.344 ( -3.844 3.633 -3.234) 6.199 15.847 ( -3.277 -2.035 4.328) 5.797 15.847 ( -3.277 2.035 4.328) 5.797 16.492 ( 2.642 -3.708 -11.236) 12.124 16.492 ( 2.642 3.708 -11.236) 12.124 16.907 ( 1.067 -1.383 3.184) 3.632 16.907 ( 1.067 1.383 3.184) 3.632 18.503 ( -2.558 -1.303 -0.576) 2.928 18.503 ( -2.558 1.303 -0.576) 2.928 19.472 ( 2.644 -0.973 -0.519) 2.864 19.472 ( 2.644 0.973 -0.519) 2.864 22.803 ( 2.580 -6.518 -1.200) 7.113 22.803 ( 2.580 6.518 -1.200) 7.113 23.721 ( 0.351 -8.430 2.094) 8.693 23.721 ( 0.351 8.430 2.094) 8.693 ======================= Grid point 153 (78/130) ======================= q-point: (-0.30 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.946 ( -9.635 -8.052 4.417) 13.311 2.946 ( -9.635 8.052 4.417) 13.311 3.001 ( -7.164 -9.555 -12.766) 17.481 3.001 ( -7.164 9.555 -12.766) 17.481 3.547 ( 5.901 -5.009 -2.492) 8.131 3.547 ( 5.901 5.009 -2.492) 8.131 4.093 ( -2.201 -4.864 5.381) 7.581 4.093 ( -2.201 4.864 5.381) 7.581 4.368 ( -2.083 -1.505 -2.771) 3.779 4.368 ( -2.083 1.505 -2.771) 3.779 5.008 ( 1.964 -7.783 2.411) 8.381 5.008 ( 1.964 7.783 2.411) 8.381 5.338 ( 8.948 -6.798 -2.527) 11.518 5.338 ( 8.948 6.798 -2.527) 11.518 5.837 ( -4.541 -8.522 0.677) 9.680 5.837 ( -4.541 8.522 0.677) 9.680 6.078 ( 5.583 -9.801 1.106) 11.334 6.078 ( 5.583 9.801 1.106) 11.334 6.886 ( -3.740 -6.823 8.817) 11.759 6.886 ( -3.740 6.823 8.817) 11.759 7.353 ( 10.454 -4.088 1.586) 11.336 7.353 ( 10.454 4.088 1.586) 11.336 7.940 ( -13.684 -11.783 0.701) 18.071 7.940 ( -13.684 11.783 0.701) 18.071 8.142 ( 9.789 -3.842 -23.967) 26.172 8.142 ( 9.789 3.842 -23.967) 26.172 8.360 ( -1.069 -10.375 -2.341) 10.690 8.360 ( -1.069 10.375 -2.341) 10.690 8.857 ( -3.312 -8.918 5.240) 10.861 8.857 ( -3.312 8.918 5.240) 10.861 9.031 ( -9.489 -8.612 8.924) 15.616 9.031 ( -9.489 8.612 8.924) 15.616 9.107 ( -9.422 -0.671 13.676) 16.621 9.107 ( -9.422 0.671 13.676) 16.621 9.924 ( -5.185 -1.995 -1.993) 5.902 9.924 ( -5.185 1.995 -1.993) 5.902 10.178 ( 6.968 -1.242 -5.896) 9.212 10.178 ( 6.968 1.242 -5.896) 9.212 10.274 ( 0.168 -1.577 3.188) 3.561 10.274 ( 0.168 1.577 3.188) 3.561 10.835 ( -3.108 -7.900 -2.959) 8.990 10.835 ( -3.108 7.900 -2.959) 8.990 11.067 ( 1.897 -1.192 -6.258) 6.646 11.067 ( 1.897 1.192 -6.258) 6.646 11.486 ( -0.633 -0.838 -3.341) 3.502 11.486 ( -0.633 0.838 -3.341) 3.502 11.743 ( -0.120 -10.015 0.759) 10.044 11.743 ( -0.120 10.015 0.759) 10.044 11.832 ( 0.019 -11.357 1.429) 11.447 11.832 ( 0.019 11.357 1.429) 11.447 12.004 ( 2.567 -3.629 8.278) 9.395 12.004 ( 2.567 3.629 8.278) 9.395 12.417 ( 4.104 -6.536 -1.972) 7.966 12.417 ( 4.104 6.536 -1.972) 7.966 12.456 ( 3.247 -9.475 -5.037) 11.211 12.456 ( 3.247 9.475 -5.037) 11.211 12.772 ( 2.184 -0.524 0.462) 2.293 12.772 ( 2.184 0.524 0.462) 2.293 13.034 ( 4.872 -5.003 -3.982) 8.039 13.034 ( 4.872 5.003 -3.982) 8.039 13.450 ( -1.227 -0.683 3.151) 3.450 13.450 ( -1.227 0.683 3.151) 3.450 13.713 ( 5.307 -3.413 0.144) 6.312 13.713 ( 5.307 3.413 0.144) 6.312 14.139 ( 1.587 -3.384 3.482) 5.108 14.139 ( 1.587 3.384 3.482) 5.108 14.235 ( 3.734 -4.127 -1.762) 5.838 14.235 ( 3.734 4.127 -1.762) 5.838 14.555 ( -2.468 -9.107 2.839) 9.853 14.555 ( -2.468 9.107 2.839) 9.853 14.833 ( -0.615 -13.836 -0.207) 13.851 14.833 ( -0.615 13.836 -0.207) 13.851 14.916 ( 4.495 -1.625 1.964) 5.168 14.916 ( 4.495 1.625 1.964) 5.168 15.223 ( -6.584 -1.128 1.532) 6.853 15.223 ( -6.584 1.128 1.532) 6.853 15.829 ( -1.247 -1.213 3.268) 3.702 15.829 ( -1.247 1.213 3.268) 3.702 16.448 ( 0.333 -1.886 -9.287) 9.482 16.448 ( 0.333 1.886 -9.287) 9.482 16.968 ( 2.856 -1.441 4.148) 5.238 16.968 ( 2.856 1.441 4.148) 5.238 18.451 ( -1.562 -0.949 -3.340) 3.807 18.451 ( -1.562 0.949 -3.340) 3.807 19.518 ( 1.647 -0.511 0.871) 1.932 19.518 ( 1.647 0.511 0.871) 1.932 22.840 ( 2.326 -2.240 -2.565) 4.124 22.840 ( 2.326 2.240 -2.565) 4.124 23.764 ( 2.407 -0.167 2.954) 3.814 23.764 ( 2.407 0.167 2.954) 3.814 ======================= Grid point 155 (79/130) ======================= q-point: (-0.20 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.731 ( -9.150 -16.215 -8.614) 20.515 2.731 ( -9.150 16.215 -8.614) 20.515 2.806 ( -7.594 -15.002 -6.339) 17.969 2.806 ( -7.594 15.002 -6.339) 17.969 3.695 ( 8.808 -4.624 2.547) 10.269 3.695 ( 8.808 4.624 2.547) 10.269 4.020 ( -8.974 -4.427 9.597) 13.865 4.020 ( -8.974 4.427 9.597) 13.865 4.326 ( 0.454 -2.544 -6.460) 6.958 4.326 ( 0.454 2.544 -6.460) 6.958 5.045 ( 0.207 -10.387 3.479) 10.956 5.045 ( 0.207 10.387 3.479) 10.956 5.540 ( 12.755 -13.542 -3.847) 18.997 5.540 ( 12.755 13.542 -3.847) 18.997 5.752 ( -3.831 -7.438 -0.521) 8.383 5.752 ( -3.831 7.438 -0.521) 8.383 6.220 ( 7.162 -15.594 2.517) 17.343 6.220 ( 7.162 15.594 2.517) 17.343 6.859 ( -3.972 -13.258 5.893) 15.042 6.859 ( -3.972 13.258 5.893) 15.042 7.444 ( -11.460 -11.904 5.461) 17.403 7.444 ( -11.460 11.904 5.461) 17.402 7.747 ( 4.450 -7.146 -6.352) 10.546 7.747 ( 4.450 7.146 -6.352) 10.546 8.105 ( 1.849 -3.895 -19.668) 20.135 8.105 ( 1.849 3.895 -19.668) 20.135 8.309 ( -2.956 -7.875 -4.501) 9.540 8.309 ( -2.956 7.875 -4.501) 9.540 8.792 ( -9.421 -7.423 7.178) 13.977 8.792 ( -9.421 7.423 7.178) 13.977 8.944 ( 1.166 -12.753 4.070) 13.437 8.944 ( 1.166 12.753 4.070) 13.437 9.138 ( -2.634 -5.819 19.769) 20.775 9.138 ( -2.634 5.819 19.769) 20.775 9.804 ( -6.488 -2.142 -1.455) 6.985 9.804 ( -6.488 2.142 -1.455) 6.985 10.226 ( 2.719 -0.654 -5.773) 6.415 10.226 ( 2.719 0.654 -5.773) 6.415 10.297 ( 0.521 -3.835 2.547) 4.633 10.297 ( 0.521 3.835 2.547) 4.633 10.748 ( -4.045 -4.450 -1.182) 6.129 10.748 ( -4.045 4.450 -1.182) 6.129 11.090 ( 4.305 -1.043 -5.326) 6.927 11.090 ( 4.305 1.043 -5.326) 6.927 11.466 ( 1.101 -1.799 -3.622) 4.192 11.466 ( 1.101 1.799 -3.622) 4.192 11.742 ( -0.111 -10.538 -1.251) 10.613 11.742 ( -0.111 10.538 -1.251) 10.613 11.831 ( -0.819 -6.507 0.840) 6.612 11.831 ( -0.819 6.507 0.840) 6.612 12.093 ( 0.537 -4.216 8.572) 9.568 12.093 ( 0.537 4.216 8.572) 9.568 12.406 ( 1.215 -8.475 -4.657) 9.747 12.406 ( 1.215 8.475 -4.657) 9.747 12.575 ( 6.107 -9.269 -0.057) 11.100 12.575 ( 6.107 9.269 -0.057) 11.100 12.825 ( 3.766 -4.284 0.952) 5.783 12.825 ( 3.766 4.284 0.952) 5.783 13.147 ( 8.659 -2.387 -2.473) 9.316 13.147 ( 8.659 2.387 -2.473) 9.316 13.430 ( -2.447 -5.694 1.377) 6.349 13.430 ( -2.447 5.694 1.377) 6.349 13.790 ( 3.893 -1.628 -3.243) 5.322 13.790 ( 3.893 1.628 -3.243) 5.322 14.163 ( -0.936 -6.466 1.240) 6.650 14.163 ( -0.936 6.466 1.240) 6.650 14.294 ( 4.024 -4.101 -2.802) 6.393 14.294 ( 4.024 4.101 -2.802) 6.393 14.528 ( -3.662 -10.209 3.683) 11.454 14.528 ( -3.662 10.209 3.683) 11.454 14.778 ( -4.095 -13.112 -1.330) 13.801 14.778 ( -4.095 13.112 -1.330) 13.801 14.961 ( -2.089 -6.705 4.740) 8.473 14.961 ( -2.090 6.705 4.740) 8.473 15.223 ( 5.757 -4.976 0.949) 7.668 15.223 ( 5.757 4.976 0.949) 7.668 15.837 ( -0.366 -0.574 2.289) 2.388 15.837 ( -0.366 0.574 2.289) 2.388 16.381 ( -1.453 -0.583 -6.272) 6.465 16.381 ( -1.453 0.583 -6.272) 6.465 17.073 ( 3.688 -3.292 6.944) 8.524 17.073 ( 3.688 3.292 6.944) 8.524 18.404 ( 0.928 -1.475 -7.615) 7.812 18.404 ( 0.928 1.475 -7.615) 7.812 19.537 ( -1.225 -0.173 3.199) 3.430 19.537 ( -1.225 0.173 3.199) 3.430 22.855 ( 1.229 -11.372 -2.260) 11.660 22.855 ( 1.229 11.372 -2.260) 11.660 23.843 ( 3.507 -8.300 1.981) 9.226 23.843 ( 3.507 8.300 1.981) 9.226 ======================= Grid point 157 (80/130) ======================= q-point: (-0.10 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.518 ( -6.531 -19.762 -9.636) 22.936 2.518 ( -6.531 19.763 -9.636) 22.936 2.628 ( -3.531 -17.245 -11.304) 20.920 2.628 ( -3.531 17.245 -11.304) 20.920 3.848 ( 0.071 -14.004 6.132) 15.288 3.848 ( 0.071 14.004 6.132) 15.288 3.990 ( 4.108 -9.901 6.423) 12.497 3.990 ( 4.108 9.901 6.423) 12.497 4.281 ( -3.131 -7.454 1.211) 8.175 4.281 ( -3.131 7.454 1.211) 8.175 5.067 ( 0.167 -12.704 1.214) 12.763 5.067 ( 0.167 12.704 1.214) 12.763 5.664 ( -0.274 -2.577 -1.405) 2.948 5.664 ( -0.274 2.577 -1.405) 2.948 5.740 ( 6.310 -14.537 -6.561) 17.152 5.740 ( 6.310 14.537 -6.561) 17.152 6.364 ( 5.644 -17.214 4.375) 18.636 6.364 ( 5.644 17.214 4.375) 18.636 6.826 ( -3.008 -14.112 3.508) 14.850 6.826 ( -3.008 14.112 3.508) 14.850 7.185 ( -13.659 -8.584 5.421) 17.019 7.185 ( -13.659 8.584 5.421) 17.019 7.850 ( 3.830 -9.258 -6.528) 11.958 7.850 ( 3.830 9.258 -6.528) 11.958 7.977 ( 0.735 -7.713 -13.302) 15.394 7.977 ( 0.735 7.713 -13.302) 15.394 8.201 ( -4.206 -9.386 -4.858) 11.375 8.201 ( -4.206 9.386 -4.858) 11.375 8.684 ( -4.769 -15.581 1.579) 16.370 8.684 ( -4.769 15.581 1.579) 16.370 9.045 ( 3.964 -2.859 4.938) 6.948 9.045 ( 3.964 2.859 4.938) 6.948 9.268 ( 2.563 -12.169 17.986) 21.867 9.268 ( 2.563 12.169 17.986) 21.867 9.641 ( -9.923 -1.758 -1.316) 10.163 9.641 ( -9.923 1.758 -1.316) 10.163 10.219 ( 0.378 -1.615 -4.530) 4.825 10.219 ( 0.378 1.615 -4.530) 4.825 10.342 ( 2.187 -4.843 4.500) 6.963 10.342 ( 2.187 4.843 4.500) 6.963 10.687 ( -1.820 -1.398 0.893) 2.463 10.687 ( -1.820 1.398 0.893) 2.463 11.139 ( 4.475 -1.243 -5.495) 7.194 11.139 ( 4.475 1.243 -5.495) 7.194 11.479 ( 2.209 -2.555 -2.027) 3.939 11.479 ( 2.209 2.555 -2.027) 3.939 11.721 ( -0.615 -13.664 -2.588) 13.921 11.721 ( -0.615 13.664 -2.588) 13.921 11.814 ( -1.578 -3.627 0.797) 4.035 11.814 ( -1.578 3.627 0.797) 4.035 12.144 ( -1.110 -3.233 7.416) 8.166 12.144 ( -1.110 3.233 7.416) 8.166 12.430 ( 2.946 -6.774 0.520) 7.405 12.430 ( 2.946 6.774 0.520) 7.405 12.625 ( 0.870 -6.663 -2.799) 7.279 12.625 ( 0.870 6.663 -2.799) 7.279 12.947 ( 7.041 -7.657 0.961) 10.447 12.947 ( 7.041 7.657 0.961) 10.447 13.249 ( 1.423 -4.590 -4.221) 6.396 13.249 ( 1.423 4.590 -4.221) 6.396 13.410 ( 1.370 -5.061 1.137) 5.365 13.410 ( 1.370 5.061 1.137) 5.365 13.828 ( 3.141 -2.138 -3.693) 5.298 13.828 ( 3.141 2.138 -3.693) 5.298 14.141 ( -0.572 -7.206 -0.440) 7.242 14.141 ( -0.572 7.206 -0.440) 7.242 14.332 ( 1.643 -3.203 -3.895) 5.304 14.332 ( 1.643 3.203 -3.895) 5.304 14.440 ( -7.612 -4.344 3.622) 9.483 14.440 ( -7.612 4.344 3.622) 9.483 14.701 ( -2.946 -10.752 0.677) 11.169 14.701 ( -2.946 10.752 0.677) 11.169 14.979 ( 0.343 -11.273 4.447) 12.123 14.979 ( 0.343 11.273 4.447) 12.123 15.364 ( 7.903 -9.373 -0.651) 12.278 15.364 ( 7.903 9.373 -0.651) 12.278 15.831 ( -1.045 -1.060 -0.005) 1.488 15.831 ( -1.045 1.060 -0.005) 1.488 16.314 ( -1.805 -1.286 -4.659) 5.159 16.314 ( -1.805 1.286 -4.659) 5.159 17.165 ( -2.194 -5.341 11.698) 13.046 17.165 ( -2.194 5.341 11.698) 13.046 18.402 ( 6.961 -2.471 -12.502) 14.521 18.402 ( 6.961 2.471 -12.502) 14.521 19.521 ( -3.580 -0.489 6.125) 7.111 19.521 ( -3.580 0.489 6.125) 7.111 22.869 ( 1.293 -16.473 0.507) 16.532 22.869 ( 1.293 16.473 0.507) 16.532 23.900 ( 1.691 -12.107 -1.243) 12.287 23.900 ( 1.691 12.107 -1.243) 12.287 ======================= Grid point 189 (81/130) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.352 ( -5.932 0.000 19.595) 20.473 1.443 ( -3.884 0.000 35.564) 35.776 1.556 ( 11.282 0.000 -0.161) 11.283 2.187 ( 3.763 0.000 -35.019) 35.220 2.582 ( 9.464 0.000 50.250) 51.134 2.988 ( -1.920 0.000 -0.988) 2.160 3.123 ( 2.587 0.000 -1.299) 2.895 3.634 ( -11.739 0.000 -37.472) 39.267 4.193 ( -0.302 0.000 8.793) 8.798 4.340 ( -2.196 0.000 -5.670) 6.081 4.534 ( 5.053 0.000 1.174) 5.187 4.580 ( -4.414 0.000 -3.111) 5.400 5.315 ( 8.227 0.000 7.870) 11.386 5.453 ( -8.629 0.000 -4.919) 9.932 5.830 ( -5.338 0.000 20.384) 21.071 5.875 ( -1.172 0.000 20.299) 20.333 6.289 ( 6.563 0.000 -16.201) 17.480 6.388 ( 4.042 0.000 -22.454) 22.815 6.553 ( 1.995 0.000 12.809) 12.963 6.796 ( -1.133 0.000 -1.272) 1.703 6.840 ( -3.254 0.000 -1.910) 3.773 7.057 ( 7.321 0.000 -14.234) 16.007 7.316 ( 31.898 0.000 4.350) 32.194 7.402 ( -25.532 0.000 -1.572) 25.581 7.855 ( 0.832 0.000 6.486) 6.540 8.075 ( 1.046 0.000 -14.010) 14.049 8.309 ( -24.539 0.000 5.960) 25.252 8.492 ( 19.612 0.000 -11.653) 22.813 8.757 ( -1.975 0.000 8.814) 9.033 8.763 ( -7.301 0.000 8.615) 11.293 8.930 ( -1.681 0.000 -5.433) 5.687 8.982 ( 8.796 0.000 -9.613) 13.030 9.707 ( 3.504 0.000 7.457) 8.240 9.830 ( -8.683 0.000 -3.413) 9.330 9.980 ( -1.530 0.000 6.621) 6.795 10.069 ( -0.324 0.000 -2.310) 2.333 10.180 ( -2.686 0.000 4.901) 5.588 10.235 ( 3.227 0.000 4.057) 5.184 10.284 ( 0.428 0.000 -4.410) 4.431 10.324 ( 5.032 0.000 -6.305) 8.067 10.440 ( -9.816 0.000 23.474) 25.443 10.745 ( 5.473 0.000 1.588) 5.699 10.844 ( -5.473 0.000 -2.268) 5.925 11.037 ( 3.577 0.000 -25.825) 26.071 11.248 ( -4.559 0.000 1.956) 4.960 11.335 ( 5.214 0.000 -6.318) 8.192 11.571 ( -9.634 0.000 -1.945) 9.829 11.576 ( 13.425 0.000 -2.630) 13.681 11.837 ( 4.538 0.000 3.654) 5.826 11.893 ( -6.820 0.000 -1.309) 6.945 12.217 ( -5.946 0.000 5.466) 8.076 12.246 ( -0.275 0.000 1.374) 1.401 12.368 ( 7.354 0.000 2.491) 7.764 12.381 ( -1.256 0.000 -0.659) 1.419 12.708 ( 4.636 0.000 5.980) 7.567 12.778 ( 0.668 0.000 2.705) 2.786 12.780 ( -0.469 0.000 -0.061) 0.473 12.823 ( -7.881 0.000 -1.777) 8.079 13.266 ( 4.300 0.000 4.936) 6.547 13.395 ( -4.938 0.000 -6.680) 8.307 13.482 ( 2.382 0.000 20.434) 20.573 13.591 ( -1.972 0.000 4.972) 5.349 13.622 ( -3.463 0.000 1.896) 3.948 13.814 ( 2.967 0.000 3.220) 4.379 13.820 ( 4.822 0.000 -14.140) 14.940 13.902 ( -1.572 0.000 -0.881) 1.802 13.938 ( 6.032 0.000 -4.984) 7.825 14.066 ( -5.184 0.000 -16.973) 17.747 14.306 ( 12.382 0.000 0.267) 12.385 14.307 ( -9.363 0.000 0.417) 9.372 14.942 ( -15.812 0.000 9.971) 18.693 15.047 ( 3.827 0.000 -0.866) 3.924 15.171 ( 2.514 0.000 -0.215) 2.523 15.221 ( 17.055 0.000 -4.183) 17.560 15.665 ( -7.822 0.000 7.690) 10.969 15.812 ( 8.077 0.000 -4.834) 9.413 15.965 ( -0.595 0.000 -0.162) 0.616 15.968 ( 4.944 0.000 -2.073) 5.361 16.376 ( -11.951 0.000 7.335) 14.023 16.513 ( 6.735 0.000 -4.711) 8.219 18.191 ( 7.969 0.000 -0.327) 7.976 18.271 ( -3.645 0.000 -7.450) 8.294 18.985 ( -0.066 0.000 0.568) 0.572 18.992 ( 0.251 0.000 -0.045) 0.255 19.503 ( 4.173 0.000 3.260) 5.296 19.520 ( -4.680 0.000 1.679) 4.972 21.162 ( -40.940 0.000 3.555) 41.094 21.234 ( 22.039 0.000 -3.116) 22.258 24.664 ( 17.361 0.000 1.666) 17.441 24.698 ( -11.506 0.000 -1.524) 11.606 ======================= Grid point 190 (82/130) ======================= q-point: ( 0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.412 ( 2.055 0.000 5.859) 6.209 1.706 ( 9.656 0.000 18.118) 20.530 1.814 ( 14.273 0.000 4.019) 14.828 2.082 ( 9.399 0.000 -32.850) 34.168 2.993 ( 3.153 0.000 -0.154) 3.156 3.048 ( 9.760 0.000 6.129) 11.525 3.241 ( -0.546 0.000 -36.487) 36.492 3.384 ( 18.621 0.000 37.224) 41.621 4.236 ( -1.961 0.000 8.738) 8.955 4.254 ( -2.924 0.000 -3.203) 4.337 4.448 ( -6.798 0.000 -3.208) 7.517 4.611 ( 1.828 0.000 1.547) 2.395 5.245 ( -9.274 0.000 -7.049) 11.649 5.530 ( 7.147 0.000 10.132) 12.399 5.804 ( -11.279 0.000 19.509) 22.535 5.989 ( 0.901 0.000 9.297) 9.341 6.296 ( 4.579 0.000 -10.658) 11.600 6.341 ( 9.268 0.000 -27.586) 29.101 6.645 ( -7.851 0.000 -10.257) 12.917 6.712 ( 3.986 0.000 14.629) 15.162 6.847 ( -1.107 0.000 5.346) 5.460 6.960 ( -3.019 0.000 -12.253) 12.619 7.052 ( -4.156 0.000 -9.379) 10.258 7.809 ( -4.139 0.000 11.389) 12.118 7.920 ( 0.949 0.000 6.958) 7.022 7.988 ( 0.416 0.000 -11.539) 11.547 8.203 ( 23.730 0.000 -7.647) 24.931 8.587 ( -12.051 0.000 5.261) 13.149 8.598 ( -14.743 0.000 4.420) 15.391 8.812 ( 18.227 0.000 -3.256) 18.515 9.032 ( 9.400 0.000 0.955) 9.448 9.176 ( 13.068 0.000 -6.042) 14.397 9.635 ( -8.370 0.000 -2.717) 8.800 9.770 ( -2.805 0.000 10.014) 10.399 9.962 ( -5.110 0.000 6.443) 8.224 10.054 ( 0.306 0.000 -2.946) 2.962 10.220 ( 3.507 0.000 2.360) 4.227 10.220 ( -2.175 0.000 -3.217) 3.883 10.330 ( 3.370 0.000 2.900) 4.446 10.400 ( 4.920 0.000 -8.234) 9.592 10.516 ( -1.075 0.000 24.420) 24.444 10.705 ( -5.956 0.000 0.050) 5.956 10.798 ( 1.617 0.000 -3.781) 4.113 10.973 ( 3.762 0.000 -13.150) 13.678 11.113 ( -11.845 0.000 0.256) 11.848 11.306 ( -13.519 0.000 -2.058) 13.674 11.348 ( 0.591 0.000 -4.119) 4.161 11.729 ( 4.543 0.000 -4.142) 6.147 11.755 ( -6.319 0.000 -0.625) 6.350 11.944 ( 2.692 0.000 4.563) 5.298 12.106 ( -9.260 0.000 3.445) 9.880 12.247 ( -0.720 0.000 3.019) 3.104 12.368 ( 0.976 0.000 -2.420) 2.609 12.504 ( 4.776 0.000 -1.912) 5.145 12.662 ( -5.251 0.000 -2.225) 5.703 12.784 ( 1.431 0.000 1.342) 1.962 12.797 ( 0.153 0.000 0.335) 0.368 12.908 ( 7.094 0.000 8.560) 11.117 13.243 ( -5.429 0.000 -6.934) 8.806 13.347 ( -1.649 0.000 9.756) 9.895 13.534 ( -7.644 0.000 3.375) 8.356 13.598 ( -1.588 0.000 6.120) 6.323 13.651 ( 6.567 0.000 5.027) 8.271 13.731 ( -9.426 0.000 -17.909) 20.238 13.814 ( 2.668 0.000 -9.948) 10.300 13.904 ( 1.362 0.000 12.907) 12.979 13.953 ( 2.919 0.000 -4.701) 5.534 14.027 ( 6.733 0.000 -5.750) 8.854 14.161 ( -4.066 0.000 -3.587) 5.422 14.558 ( 13.574 0.000 -2.065) 13.730 14.658 ( -16.800 0.000 1.758) 16.892 14.973 ( -5.835 0.000 3.703) 6.911 15.259 ( 5.764 0.000 0.274) 5.770 15.482 ( 12.329 0.000 -10.625) 16.275 15.586 ( -5.275 0.000 7.887) 9.488 15.920 ( 3.636 0.000 0.133) 3.639 15.939 ( -2.876 0.000 0.344) 2.897 16.111 ( 14.306 0.000 -15.312) 20.956 16.184 ( -12.335 0.000 7.706) 14.544 16.576 ( 1.983 0.000 -1.349) 2.399 17.978 ( -29.430 0.000 10.462) 31.234 18.026 ( -12.721 0.000 -12.616) 17.916 18.983 ( -0.215 0.000 0.209) 0.299 18.990 ( 0.215 0.000 -0.471) 0.518 19.392 ( -5.053 0.000 -2.223) 5.521 19.465 ( -8.612 0.000 4.318) 9.634 20.952 ( 5.878 0.000 9.639) 11.290 21.890 ( 37.664 0.000 12.330) 39.631 24.349 ( -21.090 0.000 -8.181) 22.621 24.837 ( 2.340 0.000 -0.305) 2.360 ======================= Grid point 191 (83/130) ======================= q-point: ( 0.20 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.510 ( 7.874 0.000 -2.372) 8.224 1.984 ( 16.384 0.000 -8.541) 18.476 2.054 ( 9.361 0.000 -25.755) 27.403 2.163 ( 13.219 0.000 18.486) 22.726 3.057 ( 0.407 0.000 5.563) 5.578 3.209 ( 20.681 0.000 -28.214) 34.982 3.209 ( 8.127 0.000 -0.613) 8.150 4.075 ( 20.144 0.000 30.094) 36.214 4.216 ( 2.957 0.000 4.457) 5.348 4.237 ( -2.893 0.000 5.497) 6.212 4.296 ( -7.083 0.000 -1.306) 7.202 4.612 ( -2.775 0.000 0.482) 2.817 4.995 ( -11.005 0.000 -9.451) 14.506 5.553 ( -19.161 0.000 23.940) 30.664 5.843 ( 8.583 0.000 4.208) 9.559 5.971 ( -2.075 0.000 -15.582) 15.719 6.281 ( -0.721 0.000 -19.577) 19.590 6.334 ( 0.922 0.000 8.032) 8.084 6.519 ( 7.684 0.000 -11.694) 13.993 6.796 ( -0.580 0.000 -0.518) 0.778 6.884 ( 3.048 0.000 1.489) 3.393 6.949 ( 3.336 0.000 10.914) 11.413 7.041 ( 7.485 0.000 -12.728) 14.766 7.667 ( -8.384 0.000 1.440) 8.507 7.936 ( -0.796 0.000 -3.073) 3.174 7.993 ( 2.098 0.000 5.620) 5.999 8.319 ( -15.703 0.000 0.466) 15.710 8.376 ( -12.229 0.000 5.681) 13.485 8.670 ( 21.560 0.000 -7.416) 22.800 9.097 ( 9.504 0.000 6.754) 11.659 9.231 ( 8.472 0.000 5.555) 10.131 9.359 ( 10.450 0.000 -6.159) 12.129 9.505 ( -2.090 0.000 -4.833) 5.266 9.769 ( -4.109 0.000 10.047) 10.854 9.907 ( -4.677 0.000 5.662) 7.344 10.030 ( -0.563 0.000 -3.603) 3.647 10.173 ( -0.645 0.000 -2.079) 2.176 10.300 ( 2.788 0.000 2.926) 4.042 10.353 ( -2.631 0.000 -9.966) 10.308 10.357 ( -4.079 0.000 3.340) 5.272 10.546 ( 1.695 0.000 -4.544) 4.850 10.795 ( -3.796 0.000 -2.620) 4.613 10.822 ( -14.184 0.000 4.714) 14.947 10.849 ( 9.128 0.000 20.664) 22.590 10.952 ( -1.859 0.000 -3.965) 4.379 11.118 ( -3.453 0.000 -2.079) 4.031 11.319 ( -0.930 0.000 -1.925) 2.138 11.657 ( -3.881 0.000 0.685) 3.941 11.722 ( -1.515 0.000 -4.045) 4.319 11.904 ( -11.453 0.000 1.386) 11.536 11.983 ( -2.004 0.000 -0.348) 2.034 12.248 ( -1.326 0.000 1.752) 2.197 12.329 ( -3.013 0.000 -6.542) 7.203 12.502 ( -1.444 0.000 -4.847) 5.058 12.598 ( -1.360 0.000 0.584) 1.480 12.779 ( -2.129 0.000 -0.953) 2.333 12.812 ( 0.163 0.000 -0.782) 0.799 13.012 ( -0.204 0.000 -2.751) 2.759 13.185 ( -1.232 0.000 6.818) 6.929 13.340 ( -8.067 0.000 11.314) 13.895 13.357 ( -10.032 0.000 -7.519) 12.537 13.449 ( -5.677 0.000 -6.567) 8.681 13.552 ( -4.997 0.000 0.662) 5.041 13.801 ( 1.198 0.000 -4.048) 4.222 13.827 ( 9.457 0.000 -1.069) 9.518 14.035 ( 7.937 0.000 -3.417) 8.642 14.077 ( 11.846 0.000 -9.169) 14.979 14.115 ( 2.020 0.000 18.801) 18.909 14.138 ( 4.539 0.000 -2.649) 5.255 14.405 ( -6.740 0.000 -4.397) 8.047 14.769 ( 10.946 0.000 -5.025) 12.045 14.915 ( -4.002 0.000 6.638) 7.751 15.366 ( 4.768 0.000 -0.321) 4.779 15.582 ( -3.553 0.000 13.502) 13.962 15.594 ( 6.360 0.000 -5.997) 8.742 15.839 ( -8.757 0.000 5.523) 10.354 15.964 ( 0.628 0.000 0.126) 0.640 16.065 ( -4.212 0.000 2.779) 5.046 16.211 ( 8.060 0.000 -18.231) 19.933 16.556 ( -3.301 0.000 -2.480) 4.129 17.500 ( -25.403 0.000 14.412) 29.206 17.685 ( -11.127 0.000 -17.146) 20.440 18.983 ( 0.070 0.000 0.150) 0.166 18.998 ( 1.047 0.000 -0.884) 1.370 19.300 ( -2.550 0.000 -5.732) 6.274 19.305 ( -11.515 0.000 7.027) 13.489 21.225 ( 13.190 0.000 7.089) 14.974 22.626 ( 24.100 0.000 19.793) 31.186 23.849 ( -20.456 0.000 -14.067) 24.826 24.805 ( -4.257 0.000 -1.313) 4.455 ======================= Grid point 192 (84/130) ======================= q-point: ( 0.30 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.713 ( 13.603 0.000 2.924) 13.914 2.150 ( 14.982 0.000 -9.007) 17.481 2.232 ( 16.511 0.000 -9.905) 19.254 2.538 ( 14.074 0.000 14.353) 20.102 3.127 ( 1.850 0.000 6.803) 7.050 3.354 ( 7.180 0.000 -1.571) 7.350 3.447 ( 16.896 0.000 -17.040) 23.997 4.149 ( -6.695 0.000 8.249) 10.624 4.173 ( -5.127 0.000 1.447) 5.327 4.238 ( 1.943 0.000 -0.759) 2.086 4.478 ( -5.497 0.000 -7.247) 9.096 4.666 ( -3.910 0.000 -5.128) 6.449 4.814 ( 13.361 0.000 17.674) 22.156 5.290 ( -24.512 0.000 24.748) 34.833 5.722 ( -7.218 0.000 -24.262) 25.313 6.001 ( 5.122 0.000 -5.144) 7.259 6.183 ( 1.956 0.000 -2.480) 3.159 6.433 ( -1.343 0.000 19.358) 19.405 6.693 ( 16.029 0.000 -9.612) 18.690 6.842 ( 6.193 0.000 -1.515) 6.376 6.999 ( 8.857 0.000 0.360) 8.864 7.022 ( -3.848 0.000 5.099) 6.389 7.097 ( 7.610 0.000 -13.703) 15.674 7.612 ( 2.610 0.000 1.351) 2.939 7.893 ( -3.199 0.000 -0.828) 3.305 7.952 ( -12.960 0.000 -2.051) 13.122 8.147 ( 1.469 0.000 3.513) 3.808 8.174 ( -11.477 0.000 3.903) 12.122 8.921 ( 8.292 0.000 -0.069) 8.292 9.256 ( 0.235 0.000 12.020) 12.022 9.394 ( 3.843 0.000 5.234) 6.493 9.486 ( 7.446 0.000 -6.151) 9.658 9.504 ( 6.933 0.000 -7.732) 10.385 9.755 ( -4.640 0.000 9.805) 10.847 9.866 ( -4.045 0.000 6.272) 7.463 9.983 ( -1.221 0.000 -4.390) 4.557 10.174 ( 0.838 0.000 0.869) 1.207 10.226 ( -2.777 0.000 -5.689) 6.331 10.242 ( -5.664 0.000 -0.162) 5.667 10.400 ( 5.759 0.000 -1.788) 6.030 10.547 ( -12.214 0.000 3.979) 12.846 10.598 ( 5.988 0.000 -5.564) 8.174 10.754 ( -5.869 0.000 5.128) 7.794 10.814 ( -8.721 0.000 -0.193) 8.723 11.082 ( -0.623 0.000 8.135) 8.159 11.159 ( 6.552 0.000 -3.088) 7.243 11.332 ( 2.370 0.000 3.252) 4.024 11.615 ( -1.823 0.000 2.180) 2.842 11.628 ( -5.239 0.000 -3.131) 6.103 11.713 ( -7.515 0.000 4.050) 8.537 11.899 ( -4.114 0.000 -6.501) 7.693 12.198 ( -3.203 0.000 -8.632) 9.207 12.216 ( -2.227 0.000 -0.793) 2.364 12.426 ( -2.003 0.000 -6.156) 6.474 12.604 ( 0.086 0.000 4.144) 4.144 12.705 ( -5.639 0.000 1.078) 5.741 12.761 ( -3.049 0.000 -2.611) 4.014 12.939 ( -8.168 0.000 -7.929) 11.383 13.014 ( -3.922 0.000 -8.542) 9.399 13.134 ( -14.772 0.000 -2.284) 14.947 13.234 ( -3.829 0.000 -1.553) 4.132 13.488 ( 4.132 0.000 12.719) 13.373 13.517 ( -1.233 0.000 7.207) 7.311 13.802 ( 0.015 0.000 0.489) 0.489 13.962 ( 5.874 0.000 -5.257) 7.883 14.112 ( 2.687 0.000 -8.094) 8.528 14.193 ( 10.900 0.000 -5.626) 12.267 14.246 ( -3.274 0.000 1.546) 3.620 14.287 ( 9.863 0.000 4.935) 11.028 14.536 ( 18.169 0.000 10.958) 21.217 14.906 ( -2.635 0.000 8.174) 8.588 14.907 ( 7.874 0.000 -6.026) 9.915 15.414 ( 1.385 0.000 -3.599) 3.857 15.598 ( -7.258 0.000 19.064) 20.399 15.659 ( 3.538 0.000 -1.303) 3.770 15.765 ( -2.161 0.000 6.617) 6.961 15.915 ( -6.114 0.000 -1.867) 6.392 16.026 ( -2.261 0.000 2.170) 3.134 16.175 ( -1.410 0.000 -9.250) 9.356 16.436 ( -2.806 0.000 -9.620) 10.021 17.258 ( -9.106 0.000 6.341) 11.096 17.396 ( -6.021 0.000 -17.976) 18.957 18.981 ( -1.120 0.000 1.086) 1.560 19.015 ( 1.195 0.000 -0.696) 1.383 19.147 ( -10.194 0.000 8.663) 13.377 19.208 ( -2.128 0.000 -7.371) 7.672 21.500 ( 10.066 0.000 7.896) 12.793 22.896 ( -6.266 0.000 -1.927) 6.556 23.585 ( 1.848 0.000 4.100) 4.497 24.681 ( -6.239 0.000 -4.387) 7.627 ======================= Grid point 193 (85/130) ======================= q-point: ( 0.40 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.040 ( 14.119 0.000 10.896) 17.835 2.454 ( 11.982 0.000 -7.058) 13.906 2.509 ( 21.886 0.000 9.077) 23.694 2.891 ( 14.498 0.000 8.731) 16.924 3.190 ( -0.683 0.000 6.642) 6.677 3.424 ( 1.295 0.000 -4.306) 4.497 3.534 ( 2.750 0.000 -11.326) 11.655 3.934 ( -21.321 0.000 3.454) 21.599 4.126 ( -1.818 0.000 4.726) 5.064 4.315 ( 7.986 0.000 -7.666) 11.070 4.330 ( -1.952 0.000 -9.958) 10.147 4.443 ( -7.837 0.000 -7.130) 10.595 5.014 ( -20.811 0.000 23.397) 31.313 5.264 ( 13.584 0.000 17.576) 22.214 5.449 ( -2.411 0.000 -22.758) 22.886 5.977 ( -0.326 0.000 -9.957) 9.963 6.294 ( 6.201 0.000 5.652) 8.390 6.519 ( -5.962 0.000 22.886) 23.649 6.908 ( -5.956 0.000 -3.677) 7.000 6.925 ( 11.274 0.000 -3.564) 11.824 6.985 ( 9.792 0.000 -3.727) 10.478 7.134 ( 5.279 0.000 -10.470) 11.726 7.241 ( 17.099 0.000 -2.754) 17.319 7.673 ( -4.607 0.000 5.187) 6.938 7.687 ( -10.071 0.000 -3.024) 10.516 7.783 ( -6.920 0.000 -0.107) 6.921 8.067 ( 1.004 0.000 0.394) 1.079 8.213 ( 1.516 0.000 1.021) 1.827 9.027 ( 2.307 0.000 4.611) 5.156 9.267 ( -5.176 0.000 5.784) 7.762 9.468 ( 0.410 0.000 4.770) 4.788 9.558 ( 4.210 0.000 -5.007) 6.542 9.622 ( 9.443 0.000 -5.897) 11.133 9.724 ( -5.605 0.000 8.232) 9.960 9.834 ( -4.201 0.000 6.666) 7.880 9.942 ( 0.595 0.000 -4.683) 4.721 10.165 ( -2.156 0.000 0.278) 2.174 10.173 ( 0.406 0.000 3.801) 3.823 10.244 ( 1.915 0.000 1.839) 2.655 10.435 ( -3.556 0.000 10.850) 11.418 10.491 ( 7.405 0.000 -8.166) 11.023 10.657 ( -6.712 0.000 1.406) 6.858 10.673 ( 6.515 0.000 -7.489) 9.926 10.702 ( -3.606 0.000 5.392) 6.487 10.977 ( -8.502 0.000 -5.165) 9.948 11.264 ( 7.200 0.000 -5.178) 8.869 11.272 ( -10.036 0.000 3.475) 10.621 11.422 ( -10.761 0.000 -9.505) 14.358 11.609 ( -1.079 0.000 3.434) 3.600 11.794 ( -0.147 0.000 -8.170) 8.171 11.823 ( 6.499 0.000 15.294) 16.617 12.121 ( -0.359 0.000 -4.513) 4.527 12.161 ( -2.237 0.000 -2.175) 3.120 12.346 ( -3.746 0.000 -1.239) 3.946 12.571 ( -8.170 0.000 -1.070) 8.239 12.647 ( 0.349 0.000 6.262) 6.272 12.671 ( -7.033 0.000 -9.608) 11.907 12.719 ( -1.889 0.000 -4.500) 4.880 12.880 ( -6.140 0.000 -8.312) 10.334 12.944 ( 0.015 0.000 -7.331) 7.331 13.219 ( 3.093 0.000 2.870) 4.220 13.559 ( -1.705 0.000 8.708) 8.873 13.655 ( 2.086 0.000 15.834) 15.971 13.800 ( -1.324 0.000 2.279) 2.636 13.917 ( -5.023 0.000 -8.123) 9.551 14.103 ( 3.136 0.000 -11.163) 11.595 14.203 ( -2.402 0.000 3.971) 4.641 14.333 ( 9.788 0.000 -11.804) 15.335 14.550 ( 10.110 0.000 12.782) 16.297 14.919 ( -2.278 0.000 8.939) 9.225 14.946 ( 14.029 0.000 1.608) 14.121 15.004 ( 8.941 0.000 0.307) 8.947 15.361 ( -2.779 0.000 -7.872) 8.348 15.599 ( -6.489 0.000 20.272) 21.285 15.710 ( -11.907 0.000 -3.522) 12.417 15.721 ( 3.074 0.000 1.532) 3.434 15.823 ( 2.340 0.000 7.608) 7.960 15.999 ( -3.496 0.000 4.897) 6.017 16.057 ( -7.380 0.000 0.796) 7.423 16.365 ( 5.753 0.000 -19.818) 20.637 17.165 ( -4.627 0.000 0.348) 4.640 17.224 ( 0.823 0.000 -16.351) 16.372 18.940 ( -5.801 0.000 6.886) 9.004 19.029 ( 0.461 0.000 -0.467) 0.656 19.062 ( -3.820 0.000 4.757) 6.101 19.135 ( 0.806 0.000 -8.312) 8.351 21.724 ( 7.224 0.000 10.665) 12.881 22.595 ( -12.571 0.000 -16.239) 20.536 23.797 ( 7.710 0.000 16.136) 17.884 24.519 ( -5.992 0.000 -8.307) 10.243 ======================= Grid point 194 (86/130) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.314 ( 4.079 0.000 11.583) 12.281 2.529 ( -0.214 0.000 -8.482) 8.485 3.022 ( 16.005 0.000 15.517) 22.292 3.190 ( 11.782 0.000 2.729) 12.094 3.220 ( 3.621 0.000 10.013) 10.648 3.292 ( -16.765 0.000 -3.047) 17.040 3.448 ( -1.973 0.000 -10.599) 10.781 3.507 ( -13.662 0.000 -10.006) 16.934 4.173 ( 2.790 0.000 5.936) 6.559 4.220 ( -7.580 0.000 2.204) 7.894 4.305 ( -2.253 0.000 -5.763) 6.188 4.380 ( 3.971 0.000 -8.548) 9.426 4.872 ( -9.840 0.000 22.231) 24.311 5.356 ( 10.671 0.000 -23.079) 25.426 5.569 ( 6.487 0.000 14.914) 16.263 5.851 ( -5.167 0.000 -12.190) 13.240 6.479 ( 7.761 0.000 9.429) 12.213 6.487 ( -11.457 0.000 14.921) 18.812 6.798 ( -4.713 0.000 2.331) 5.258 7.000 ( -2.431 0.000 -1.021) 2.637 7.132 ( 6.731 0.000 -5.556) 8.728 7.135 ( 3.622 0.000 -14.507) 14.952 7.532 ( -8.229 0.000 5.127) 9.695 7.572 ( 15.443 0.000 -1.830) 15.551 7.607 ( -10.753 0.000 -4.635) 11.709 7.621 ( 8.590 0.000 -2.960) 9.086 8.179 ( 7.305 0.000 -0.026) 7.305 8.187 ( -4.432 0.000 -1.063) 4.558 9.103 ( 1.517 0.000 8.113) 8.254 9.163 ( -8.116 0.000 3.090) 8.684 9.472 ( -3.508 0.000 5.880) 6.848 9.564 ( -3.325 0.000 0.845) 3.430 9.655 ( -3.580 0.000 0.848) 3.679 9.769 ( 10.209 0.000 -6.156) 11.922 9.809 ( -2.845 0.000 6.577) 7.166 9.940 ( 2.744 0.000 -5.512) 6.157 10.166 ( 1.603 0.000 0.934) 1.855 10.177 ( -1.812 0.000 0.558) 1.896 10.350 ( 2.426 0.000 9.484) 9.789 10.504 ( -0.638 0.000 10.887) 10.905 10.573 ( 6.972 0.000 -8.823) 11.245 10.584 ( -0.279 0.000 4.792) 4.801 10.727 ( -6.959 0.000 -11.123) 13.120 10.748 ( 3.838 0.000 -9.741) 10.470 10.777 ( 7.300 0.000 11.225) 13.390 11.038 ( -11.337 0.000 -10.854) 15.695 11.225 ( -5.678 0.000 2.131) 6.064 11.364 ( 8.593 0.000 -8.687) 12.219 11.618 ( -0.887 0.000 4.427) 4.515 11.751 ( 1.271 0.000 -7.688) 7.792 12.033 ( 2.915 0.000 12.076) 12.423 12.109 ( -1.457 0.000 -2.082) 2.541 12.131 ( 2.953 0.000 4.467) 5.354 12.271 ( -6.755 0.000 9.352) 11.537 12.437 ( 0.372 0.000 -13.322) 13.327 12.487 ( -1.934 0.000 -10.010) 10.195 12.695 ( 0.101 0.000 5.007) 5.008 12.711 ( 0.719 0.000 -0.418) 0.832 12.776 ( -1.713 0.000 -2.600) 3.114 12.894 ( 0.104 0.000 -8.216) 8.217 13.406 ( 12.519 0.000 5.181) 13.549 13.478 ( -10.597 0.000 -0.455) 10.607 13.769 ( -1.894 0.000 13.585) 13.716 13.784 ( -1.765 0.000 4.508) 4.841 13.816 ( 0.554 0.000 -1.489) 1.588 14.055 ( -1.303 0.000 -8.273) 8.375 14.181 ( -2.898 0.000 2.089) 3.572 14.387 ( 4.888 0.000 -13.195) 14.071 14.787 ( 3.581 0.000 11.397) 11.946 14.961 ( 0.659 0.000 12.066) 12.084 15.006 ( 2.458 0.000 -9.058) 9.386 15.198 ( -4.957 0.000 -9.643) 10.842 15.326 ( 12.801 0.000 5.770) 14.041 15.467 ( -9.386 0.000 -7.342) 11.916 15.614 ( -6.217 0.000 17.398) 18.475 15.796 ( 2.975 0.000 2.271) 3.743 15.919 ( -7.547 0.000 2.552) 7.967 15.923 ( -7.036 0.000 18.080) 19.401 15.983 ( 6.485 0.000 -2.209) 6.851 16.358 ( 8.423 0.000 -22.870) 24.372 17.065 ( -5.496 0.000 -0.435) 5.513 17.206 ( 7.870 0.000 -13.695) 15.795 18.893 ( -5.038 0.000 11.137) 12.223 19.019 ( -0.380 0.000 -1.652) 1.695 19.038 ( -1.470 0.000 1.573) 2.153 19.138 ( 4.776 0.000 -7.148) 8.596 21.940 ( 6.813 0.000 14.728) 16.228 22.268 ( -9.876 0.000 -16.243) 19.009 24.049 ( 7.383 0.000 15.482) 17.152 24.342 ( -5.246 0.000 -12.193) 13.274 ======================= Grid point 195 (87/130) ======================= q-point: (-0.40 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.295 ( -12.794 0.000 7.948) 15.062 2.305 ( -14.269 0.000 -13.101) 19.371 2.739 ( -30.441 0.000 -9.451) 31.874 3.042 ( -7.195 0.000 -2.158) 7.512 3.315 ( 0.402 0.000 -4.890) 4.907 3.367 ( -1.519 0.000 -1.966) 2.485 3.372 ( -3.864 0.000 1.183) 4.041 3.698 ( 22.203 0.000 20.546) 30.251 4.098 ( -7.521 0.000 10.021) 12.529 4.260 ( 1.607 0.000 -6.284) 6.486 4.303 ( 5.365 0.000 3.001) 6.148 4.356 ( 0.763 0.000 -3.689) 3.767 4.958 ( 2.123 0.000 21.824) 21.927 5.520 ( 22.555 0.000 -23.680) 32.703 5.610 ( -10.590 0.000 -14.360) 17.842 5.736 ( 1.412 0.000 12.725) 12.803 6.318 ( -12.912 0.000 5.576) 14.065 6.706 ( 7.402 0.000 11.882) 13.999 6.734 ( -8.003 0.000 11.705) 14.180 6.889 ( -6.111 0.000 -0.437) 6.127 7.061 ( 1.148 0.000 -19.845) 19.878 7.063 ( -8.605 0.000 -6.137) 10.569 7.316 ( -12.709 0.000 -5.873) 14.000 7.607 ( 10.024 0.000 3.651) 10.668 7.735 ( 5.948 0.000 -0.731) 5.993 7.895 ( 14.875 0.000 -9.374) 17.582 8.074 ( -2.552 0.000 0.358) 2.577 8.279 ( 4.332 0.000 -4.135) 5.989 9.025 ( -9.545 0.000 5.088) 10.816 9.201 ( 1.884 0.000 10.114) 10.288 9.428 ( -5.460 0.000 6.323) 8.354 9.452 ( -8.943 0.000 6.066) 10.806 9.616 ( -0.704 0.000 -4.405) 4.461 9.824 ( -0.283 0.000 6.368) 6.374 9.900 ( 7.063 0.000 -7.024) 9.961 9.975 ( 5.680 0.000 -5.883) 8.178 10.170 ( 1.400 0.000 0.059) 1.402 10.215 ( 1.973 0.000 0.157) 1.979 10.317 ( -7.191 0.000 6.150) 9.462 10.434 ( -7.846 0.000 -14.934) 16.869 10.525 ( -2.735 0.000 6.098) 6.683 10.660 ( 3.742 0.000 -1.985) 4.236 10.767 ( -2.107 0.000 -16.756) 16.888 10.803 ( 12.549 0.000 10.475) 16.346 10.833 ( 5.681 0.000 -6.990) 9.008 11.096 ( 14.464 0.000 15.467) 21.176 11.184 ( -1.508 0.000 2.325) 2.772 11.469 ( 8.700 0.000 -9.218) 12.675 11.640 ( 0.059 0.000 4.797) 4.797 11.722 ( 1.097 0.000 -7.391) 7.472 12.083 ( -0.078 0.000 -0.987) 0.990 12.105 ( 1.562 0.000 4.177) 4.460 12.184 ( -5.051 0.000 -9.084) 10.394 12.217 ( -2.429 0.000 10.313) 10.595 12.426 ( 3.112 0.000 3.674) 4.815 12.566 ( 13.861 0.000 -2.313) 14.053 12.693 ( -0.698 0.000 0.085) 0.704 12.730 ( 1.866 0.000 0.420) 1.913 12.787 ( 0.515 0.000 6.929) 6.948 12.840 ( 0.415 0.000 -6.655) 6.668 13.287 ( -4.984 0.000 -3.130) 5.886 13.663 ( 6.825 0.000 0.160) 6.827 13.771 ( 1.373 0.000 4.927) 5.115 13.833 ( -1.652 0.000 13.668) 13.768 13.852 ( 2.138 0.000 -0.499) 2.195 13.932 ( -5.636 0.000 -8.493) 10.193 14.114 ( -6.360 0.000 4.266) 7.658 14.351 ( 0.305 0.000 -9.472) 9.477 14.820 ( -4.821 0.000 7.504) 8.919 14.866 ( -8.355 0.000 -15.922) 17.981 15.083 ( 0.203 0.000 -6.290) 6.293 15.104 ( 1.151 0.000 10.939) 10.999 15.231 ( -8.088 0.000 -9.655) 12.595 15.571 ( -2.193 0.000 13.313) 13.492 15.632 ( 6.894 0.000 5.744) 8.973 15.803 ( -3.925 0.000 5.324) 6.614 15.857 ( -10.172 0.000 17.992) 20.669 15.888 ( 4.599 0.000 -5.577) 7.229 16.159 ( 9.686 0.000 1.586) 9.815 16.339 ( 5.372 0.000 -22.295) 22.933 16.997 ( -1.357 0.000 3.875) 4.106 17.312 ( 13.097 0.000 -14.056) 19.212 18.911 ( -1.987 0.000 12.859) 13.012 19.005 ( -0.012 0.000 -1.348) 1.348 19.021 ( -1.010 0.000 0.476) 1.116 19.199 ( 6.372 0.000 -6.397) 9.029 21.986 ( -9.085 0.000 -14.199) 16.856 22.208 ( 9.460 0.000 19.780) 21.926 24.143 ( -5.802 0.000 -16.049) 17.065 24.295 ( 8.231 0.000 12.900) 15.302 ======================= Grid point 196 (88/130) ======================= q-point: (-0.30 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.882 ( -19.036 0.000 -12.648) 22.855 2.006 ( -22.214 0.000 10.139) 24.419 2.109 ( -29.338 0.000 -3.343) 29.528 2.850 ( -6.261 0.000 -13.325) 14.723 3.094 ( -26.467 0.000 9.962) 28.280 3.284 ( -2.555 0.000 -3.525) 4.354 3.310 ( -5.211 0.000 1.384) 5.391 4.136 ( 4.441 0.000 6.580) 7.938 4.156 ( 3.087 0.000 17.935) 18.199 4.272 ( 3.850 0.000 -5.673) 6.856 4.320 ( 10.841 0.000 -3.181) 11.298 4.519 ( 9.079 0.000 5.476) 10.602 5.165 ( -3.868 0.000 6.912) 7.921 5.297 ( -4.116 0.000 -2.621) 4.880 5.795 ( 5.855 0.000 1.521) 6.049 5.840 ( 17.201 0.000 -15.120) 22.901 6.098 ( -13.504 0.000 5.347) 14.523 6.643 ( -8.872 0.000 7.686) 11.738 6.746 ( -4.574 0.000 0.501) 4.602 6.795 ( -14.079 0.000 -2.484) 14.296 6.867 ( -4.498 0.000 -6.270) 7.716 7.005 ( 9.174 0.000 -4.101) 10.049 7.108 ( -5.099 0.000 -3.554) 6.216 7.679 ( -7.083 0.000 -2.946) 7.671 7.879 ( 14.254 0.000 4.578) 14.971 8.016 ( 9.669 0.000 -10.257) 14.096 8.236 ( 13.483 0.000 -2.450) 13.704 8.293 ( 2.716 0.000 -9.487) 9.868 8.841 ( -15.509 0.000 7.473) 17.215 9.296 ( -0.902 0.000 8.937) 8.983 9.344 ( -4.753 0.000 4.963) 6.872 9.351 ( -7.234 0.000 6.129) 9.481 9.539 ( -4.242 0.000 -5.112) 6.643 9.879 ( 1.411 0.000 5.496) 5.674 9.946 ( 3.954 0.000 -6.741) 7.815 10.042 ( 6.197 0.000 -10.934) 12.568 10.196 ( -2.214 0.000 -3.154) 3.854 10.233 ( 3.152 0.000 1.997) 3.731 10.245 ( -4.341 0.000 -6.772) 8.044 10.264 ( -1.682 0.000 8.019) 8.194 10.503 ( -3.040 0.000 3.215) 4.425 10.667 ( 5.001 0.000 -6.515) 8.213 10.786 ( 6.656 0.000 1.237) 6.770 10.930 ( 9.781 0.000 -10.805) 14.575 11.084 ( 9.672 0.000 6.689) 11.760 11.164 ( -1.134 0.000 -2.712) 2.940 11.452 ( 9.968 0.000 4.085) 10.773 11.557 ( 6.222 0.000 -2.461) 6.691 11.694 ( 0.968 0.000 -5.800) 5.880 11.700 ( 3.649 0.000 6.256) 7.242 11.972 ( -2.643 0.000 -19.213) 19.394 12.097 ( 1.257 0.000 1.650) 2.074 12.177 ( 3.027 0.000 3.516) 4.639 12.240 ( -1.744 0.000 10.726) 10.867 12.602 ( 6.150 0.000 19.253) 20.211 12.683 ( 0.031 0.000 -2.135) 2.135 12.716 ( 2.103 0.000 1.785) 2.758 12.768 ( 1.494 0.000 -5.835) 6.023 12.857 ( 1.449 0.000 6.878) 7.029 13.017 ( 18.585 0.000 6.449) 19.672 13.277 ( 5.448 0.000 -3.072) 6.254 13.658 ( -0.886 0.000 -4.674) 4.757 13.726 ( -9.392 0.000 -8.853) 12.907 13.796 ( -4.697 0.000 9.582) 10.671 13.857 ( -0.144 0.000 -4.349) 4.352 13.955 ( 2.735 0.000 4.048) 4.886 14.015 ( -7.966 0.000 7.903) 11.221 14.299 ( -0.609 0.000 -2.980) 3.042 14.554 ( -11.302 0.000 -16.469) 19.974 14.740 ( -8.284 0.000 3.691) 9.069 14.871 ( -12.931 0.000 -12.588) 18.047 15.060 ( 1.454 0.000 -6.211) 6.379 15.264 ( 0.646 0.000 10.199) 10.220 15.518 ( -9.128 0.000 11.431) 14.628 15.796 ( -6.580 0.000 19.600) 20.675 15.802 ( 0.496 0.000 2.511) 2.560 15.851 ( 4.339 0.000 6.311) 7.659 15.913 ( 3.213 0.000 -10.526) 11.006 16.271 ( 3.825 0.000 -17.873) 18.278 16.353 ( 8.650 0.000 2.777) 9.085 17.099 ( 7.409 0.000 8.539) 11.305 17.514 ( 20.380 0.000 -17.955) 27.161 18.969 ( -1.660 0.000 8.906) 9.059 18.996 ( -0.254 0.000 -0.651) 0.699 19.026 ( 1.085 0.000 4.776) 4.898 19.288 ( 6.906 0.000 -4.705) 8.356 21.712 ( -10.476 0.000 -12.128) 16.026 22.591 ( 15.099 0.000 23.537) 27.964 23.880 ( -9.457 0.000 -19.626) 21.785 24.534 ( 8.431 0.000 9.497) 12.699 ======================= Grid point 197 (89/130) ======================= q-point: (-0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 130 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.478 ( -16.324 0.000 0.123) 16.324 1.655 ( -19.558 0.000 9.493) 21.740 1.656 ( -23.393 0.000 17.640) 29.298 2.592 ( -35.922 0.000 26.997) 44.936 2.635 ( -3.489 0.000 -22.460) 22.730 3.191 ( -7.486 0.000 0.990) 7.552 3.207 ( -1.977 0.000 -5.972) 6.290 4.150 ( -4.275 0.000 6.520) 7.796 4.283 ( 7.208 0.000 -0.154) 7.210 4.328 ( 5.252 0.000 -3.025) 6.061 4.536 ( 1.158 0.000 -2.301) 2.575 4.698 ( -2.217 0.000 -5.453) 5.887 4.865 ( 2.239 0.000 -5.085) 5.556 5.520 ( 5.703 0.000 21.368) 22.116 5.824 ( -4.522 0.000 10.148) 11.110 5.850 ( -13.271 0.000 7.692) 15.338 6.104 ( 16.676 0.000 -21.575) 27.268 6.484 ( -4.831 0.000 -7.060) 8.555 6.627 ( -9.165 0.000 17.544) 19.794 6.653 ( -2.620 0.000 -14.811) 15.041 6.728 ( -2.911 0.000 1.571) 3.308 7.062 ( 3.578 0.000 -6.766) 7.654 7.104 ( -0.856 0.000 -0.605) 1.048 7.606 ( 2.091 0.000 1.377) 2.504 8.120 ( 10.509 0.000 -14.345) 17.782 8.135 ( 7.473 0.000 -3.192) 8.126 8.322 ( 10.084 0.000 -4.200) 10.923 8.458 ( 10.880 0.000 -2.030) 11.068 8.508 ( -24.980 0.000 7.499) 26.082 9.175 ( -11.694 0.000 -0.181) 11.696 9.236 ( -8.910 0.000 4.947) 10.191 9.369 ( -8.354 0.000 -6.111) 10.351 9.424 ( 3.536 0.000 4.939) 6.074 9.937 ( 0.613 0.000 4.748) 4.788 9.967 ( 2.874 0.000 -6.124) 6.765 10.078 ( 6.858 0.000 -12.327) 14.106 10.153 ( -2.075 0.000 -0.889) 2.258 10.168 ( -0.955 0.000 4.466) 4.567 10.241 ( -4.158 0.000 7.522) 8.595 10.391 ( 8.412 0.000 -0.166) 8.414 10.457 ( -3.095 0.000 2.329) 3.873 10.775 ( 5.796 0.000 -1.382) 5.958 10.881 ( -1.464 0.000 -2.437) 2.843 11.052 ( 11.430 0.000 -10.294) 15.382 11.143 ( 5.818 0.000 -4.004) 7.063 11.241 ( 4.040 0.000 1.235) 4.224 11.388 ( -3.044 0.000 -21.230) 21.447 11.646 ( 1.480 0.000 2.841) 3.203 11.689 ( 1.973 0.000 -2.911) 3.517 11.902 ( 7.498 0.000 5.859) 9.516 11.960 ( 8.256 0.000 -4.358) 9.336 12.176 ( 5.039 0.000 6.250) 8.028 12.245 ( 1.592 0.000 1.981) 2.541 12.319 ( 1.233 0.000 12.323) 12.384 12.642 ( -1.453 0.000 -2.692) 3.059 12.763 ( 0.299 0.000 -0.855) 0.906 12.772 ( 1.660 0.000 2.348) 2.875 12.877 ( 4.681 0.000 18.429) 19.014 12.940 ( 3.823 0.000 11.956) 12.552 13.367 ( 1.358 0.000 -8.072) 8.185 13.418 ( 16.197 0.000 6.006) 17.275 13.519 ( -1.462 0.000 -3.605) 3.890 13.613 ( 0.298 0.000 -4.318) 4.329 13.766 ( -2.643 0.000 5.032) 5.684 13.793 ( -2.950 0.000 -3.524) 4.596 13.921 ( -6.065 0.000 0.261) 6.070 13.935 ( -5.420 0.000 6.065) 8.134 14.257 ( -7.835 0.000 -12.456) 14.715 14.298 ( 0.715 0.000 4.121) 4.182 14.511 ( -7.192 0.000 -15.032) 16.664 14.652 ( -10.018 0.000 5.089) 11.237 15.050 ( 1.857 0.000 -5.643) 5.940 15.298 ( -3.100 0.000 6.123) 6.863 15.397 ( -11.997 0.000 12.073) 17.020 15.785 ( -8.189 0.000 19.519) 21.168 15.808 ( -0.332 0.000 -5.170) 5.181 15.893 ( 2.102 0.000 -4.367) 4.847 15.948 ( 1.746 0.000 2.993) 3.465 16.285 ( 9.055 0.000 -13.717) 16.436 16.493 ( 2.612 0.000 4.481) 5.187 17.381 ( 15.228 0.000 10.595) 18.551 17.847 ( 27.581 0.000 -19.244) 33.631 18.970 ( -1.095 0.000 2.322) 2.567 18.987 ( -0.335 0.000 -0.223) 0.402 19.126 ( 3.149 0.000 10.234) 10.707 19.393 ( 6.331 0.000 -1.722) 6.561 21.418 ( -11.854 0.000 -10.727) 15.987 22.965 ( -0.040 0.000 -2.361) 2.361 23.607 ( 1.739 0.000 0.541) 1.821 24.728 ( 5.797 0.000 5.830) 8.222 ======================= Grid point 198 (90/130) ======================= q-point: (-0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.343 ( -5.896 0.000 20.656) 21.481 1.410 ( -16.830 0.000 24.002) 29.314 1.478 ( -8.554 0.000 13.204) 15.733 2.288 ( -18.115 0.000 47.164) 50.523 2.403 ( -1.329 0.000 -30.927) 30.956 3.065 ( -5.768 0.000 0.349) 5.778 3.138 ( -0.451 0.000 -6.272) 6.288 4.124 ( -8.471 0.000 -7.807) 11.520 4.174 ( -9.777 0.000 -14.844) 17.774 4.379 ( 3.033 0.000 -4.875) 5.741 4.416 ( 6.151 0.000 -0.171) 6.153 4.649 ( -0.776 0.000 -2.101) 2.240 5.094 ( 10.235 0.000 7.148) 12.484 5.648 ( -10.171 0.000 -0.026) 10.171 5.729 ( 0.744 0.000 20.743) 20.756 5.808 ( -6.863 0.000 19.224) 20.413 6.236 ( 11.803 0.000 -17.165) 20.831 6.460 ( 1.492 0.000 5.055) 5.271 6.495 ( -0.696 0.000 -17.898) 17.912 6.696 ( 7.831 0.000 17.184) 18.884 6.751 ( 0.835 0.000 5.994) 6.052 6.991 ( -5.795 0.000 -7.796) 9.714 7.115 ( 8.181 0.000 -13.570) 15.846 7.706 ( 0.568 0.000 8.494) 8.513 8.010 ( -27.802 0.000 2.897) 27.953 8.137 ( 2.342 0.000 -13.131) 13.338 8.253 ( 15.055 0.000 -15.439) 21.564 8.589 ( 13.321 0.000 4.952) 14.211 8.636 ( 8.248 0.000 0.176) 8.250 8.816 ( -24.555 0.000 -3.833) 24.853 9.083 ( -9.675 0.000 2.123) 9.905 9.125 ( -10.619 0.000 -7.341) 12.909 9.559 ( 6.167 0.000 5.437) 8.222 9.956 ( -0.752 0.000 -5.429) 5.481 9.965 ( -1.245 0.000 5.465) 5.605 10.107 ( 0.623 0.000 -5.629) 5.664 10.155 ( 1.272 0.000 2.734) 3.015 10.197 ( -2.386 0.000 10.152) 10.429 10.219 ( 2.500 0.000 -1.550) 2.941 10.379 ( -3.175 0.000 -2.203) 3.864 10.587 ( 8.797 0.000 2.694) 9.200 10.601 ( -16.573 0.000 4.456) 17.161 10.902 ( 0.734 0.000 0.376) 0.825 11.181 ( 1.475 0.000 -29.097) 29.134 11.217 ( 12.127 0.000 -8.512) 14.817 11.285 ( -1.169 0.000 2.457) 2.721 11.329 ( 13.515 0.000 -3.635) 13.995 11.667 ( -1.572 0.000 1.794) 2.385 11.737 ( 3.966 0.000 0.631) 4.016 11.981 ( -1.334 0.000 1.051) 1.699 12.127 ( 9.963 0.000 0.789) 9.994 12.262 ( -2.026 0.000 3.738) 4.252 12.301 ( 1.211 0.000 4.378) 4.543 12.394 ( -1.031 0.000 5.970) 6.058 12.624 ( 0.901 0.000 1.362) 1.633 12.765 ( -0.347 0.000 1.615) 1.652 12.788 ( -1.003 0.000 0.922) 1.362 12.942 ( -2.222 0.000 3.982) 4.560 13.193 ( 0.432 0.000 12.271) 12.279 13.261 ( 2.628 0.000 9.761) 10.108 13.513 ( -3.232 0.000 -3.114) 4.489 13.595 ( 2.638 0.000 -0.548) 2.694 13.642 ( 0.887 0.000 -0.860) 1.236 13.746 ( 2.106 0.000 -2.594) 3.341 13.829 ( 3.693 0.000 -11.687) 12.256 13.871 ( 3.963 0.000 4.914) 6.313 13.897 ( -0.804 0.000 1.305) 1.533 14.150 ( 3.366 0.000 -3.517) 4.868 14.268 ( -5.004 0.000 -12.565) 13.525 14.487 ( -10.613 0.000 4.302) 11.452 14.570 ( 22.070 0.000 9.510) 24.032 15.051 ( 0.386 0.000 -1.933) 1.971 15.237 ( -5.967 0.000 2.502) 6.470 15.237 ( -12.649 0.000 11.325) 16.978 15.746 ( -8.069 0.000 13.446) 15.682 15.763 ( 1.956 0.000 -7.922) 8.160 15.921 ( 1.508 0.000 0.616) 1.629 15.972 ( -0.434 0.000 1.435) 1.500 16.396 ( 10.352 0.000 -9.810) 14.262 16.501 ( -5.363 0.000 5.592) 7.748 17.814 ( 22.595 0.000 7.300) 23.745 18.205 ( 18.024 0.000 -12.333) 21.839 18.975 ( 0.378 0.000 0.905) 0.981 18.984 ( 0.209 0.000 0.078) 0.223 19.299 ( 9.438 0.000 6.602) 11.518 19.495 ( 4.166 0.000 1.227) 4.343 21.158 ( -5.520 0.000 -9.646) 11.113 22.249 ( -51.226 0.000 -24.390) 56.736 24.128 ( 30.713 0.000 14.722) 34.059 24.809 ( -0.997 0.000 2.420) 2.617 ======================= Grid point 199 (91/130) ======================= q-point: ( 0.00 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.542 ( -2.418 11.707 28.829) 31.210 1.673 ( -0.862 17.515 26.592) 31.853 1.964 ( 5.770 29.770 -6.699) 31.055 2.236 ( 2.973 4.837 -31.108) 31.622 2.536 ( 4.529 8.487 27.598) 29.226 2.982 ( -0.561 -2.733 -16.294) 16.531 3.555 ( 1.297 33.691 11.034) 35.476 3.900 ( -7.461 20.955 -17.992) 28.609 4.211 ( -1.007 2.677 7.196) 7.744 4.344 ( -1.243 0.578 -5.067) 5.249 4.559 ( 5.358 1.868 1.003) 5.762 4.601 ( -4.876 1.679 -3.023) 5.977 5.310 ( 5.988 -0.533 6.477) 8.837 5.407 ( -7.093 -3.051 -1.812) 7.931 5.710 ( -4.311 -3.740 12.787) 14.003 6.042 ( 4.395 0.104 -4.766) 6.484 6.182 ( 2.581 4.652 8.548) 10.068 6.525 ( 2.801 -0.826 10.176) 10.587 6.650 ( 0.997 14.323 -17.045) 22.286 6.824 ( -2.957 0.850 -12.589) 12.959 6.923 ( 1.934 9.122 7.330) 11.861 7.099 ( 6.679 4.278 -9.461) 12.346 7.294 ( 23.231 -1.646 3.507) 23.552 7.378 ( -21.702 -2.054 -2.715) 21.968 7.810 ( 1.814 -3.576 7.470) 8.478 8.044 ( 0.356 -3.240 -13.702) 14.084 8.193 ( -22.436 -6.468 10.954) 25.791 8.438 ( 15.482 -3.578 -11.820) 19.804 8.704 ( -9.031 -6.551 5.809) 12.579 8.804 ( 8.763 -4.823 3.693) 10.663 8.879 ( -2.746 -0.188 -3.054) 4.111 8.997 ( 4.170 3.155 -7.105) 8.821 9.631 ( 1.591 -5.203 6.153) 8.214 9.730 ( -7.161 -6.342 -2.317) 9.842 9.923 ( 1.479 -9.625 4.137) 10.580 10.014 ( 0.998 -5.722 -3.311) 6.686 10.096 ( -3.599 3.125 7.205) 8.639 10.160 ( 0.555 4.763 -0.427) 4.814 10.404 ( -4.243 2.452 18.604) 19.239 10.533 ( -4.970 11.649 6.816) 14.382 10.694 ( 5.967 15.569 -7.363) 18.227 10.741 ( 1.713 0.452 -1.708) 2.461 10.836 ( -3.150 -0.492 -1.200) 3.407 10.981 ( 4.518 -3.679 -20.183) 21.007 11.230 ( -4.899 -1.544 0.713) 5.186 11.276 ( 5.023 -3.548 -3.117) 6.895 11.463 ( 9.916 -7.717 1.268) 12.628 11.505 ( -5.684 -5.724 -1.263) 8.165 11.900 ( 3.923 4.434 1.724) 6.167 11.912 ( -3.419 2.742 2.224) 4.915 12.197 ( -8.185 5.483 4.493) 10.828 12.290 ( 6.570 1.728 -1.692) 7.001 12.410 ( 2.181 3.085 2.258) 4.401 12.456 ( -2.558 5.117 -1.868) 6.018 12.699 ( 3.340 -0.964 4.252) 5.492 12.787 ( -6.582 -2.826 -1.848) 7.398 12.885 ( 0.980 4.774 4.817) 6.853 12.981 ( -2.944 10.716 -5.493) 12.396 13.234 ( 0.650 -1.327 5.527) 5.721 13.316 ( 3.871 -4.247 2.230) 6.164 13.557 ( -1.578 3.648 5.794) 7.026 13.599 ( 0.273 1.100 6.099) 6.203 13.674 ( -6.689 2.424 2.966) 7.709 13.813 ( 3.843 -1.239 -10.777) 11.509 13.839 ( 8.177 0.957 -4.657) 9.458 13.913 ( -1.425 2.016 0.979) 2.656 13.938 ( 0.738 3.275 -3.201) 4.639 14.000 ( 0.077 -4.142 -10.301) 11.103 14.322 ( -10.572 1.243 -0.752) 10.671 14.330 ( 10.870 1.781 -2.603) 11.318 14.767 ( -11.724 -11.076 7.333) 17.717 14.882 ( 7.462 -10.990 -3.686) 13.786 15.201 ( -11.527 0.262 5.992) 12.994 15.327 ( 20.758 4.178 -5.470) 21.869 15.671 ( -4.121 -0.013 6.765) 7.921 15.795 ( 4.154 -2.115 -3.238) 5.676 15.951 ( -0.375 -1.126 -0.377) 1.245 15.961 ( 4.076 -0.416 -2.771) 4.947 16.354 ( -10.866 -2.170 6.007) 12.604 16.463 ( 5.710 -4.761 -3.461) 8.200 18.187 ( 6.200 -1.373 -1.607) 6.550 18.215 ( -3.970 -8.891 -2.589) 10.076 18.387 ( -18.444 -35.823 14.775) 42.916 18.621 ( 15.458 -25.584 -8.266) 31.013 19.525 ( 1.526 1.880 2.956) 3.821 19.532 ( -3.807 1.257 2.231) 4.588 21.613 ( 16.703 28.863 3.963) 33.582 21.768 ( -26.292 40.071 -12.637) 49.565 24.504 ( 16.138 -13.587 5.545) 21.812 24.590 ( -10.931 -9.844 -3.063) 15.026 ======================= Grid point 200 (92/130) ======================= q-point: ( 0.10 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.776 ( 6.417 18.290 16.704) 25.588 1.860 ( 4.669 18.473 20.624) 28.079 2.056 ( 11.984 16.694 -15.229) 25.577 2.125 ( 6.415 6.571 -26.800) 28.329 2.868 ( 10.998 -0.891 13.757) 17.635 2.940 ( 10.770 -0.583 -18.486) 21.403 3.656 ( -1.990 27.598 -4.373) 28.013 3.788 ( 7.753 28.191 14.171) 32.491 4.236 ( -2.354 0.294 7.204) 7.585 4.277 ( -2.141 2.905 -2.324) 4.293 4.466 ( -6.460 1.444 -2.252) 6.992 4.637 ( 1.528 2.054 1.084) 2.780 5.236 ( -7.923 -0.410 -4.043) 8.904 5.500 ( 6.272 -2.475 8.807) 11.092 5.697 ( -5.669 -5.129 11.866) 14.115 6.046 ( 2.704 -3.576 -14.310) 14.996 6.288 ( 0.601 8.776 12.638) 15.398 6.524 ( 2.569 9.133 -23.843) 25.661 6.638 ( -9.203 -0.540 -10.168) 13.725 6.693 ( 3.618 -0.815 15.306) 15.749 6.965 ( 0.429 9.406 2.321) 9.698 7.003 ( -2.458 5.692 -10.178) 11.917 7.119 ( 0.455 6.727 -5.395) 8.635 7.816 ( -9.706 -0.346 7.494) 12.267 7.874 ( 1.560 -4.083 7.750) 8.897 7.962 ( 10.566 -3.311 -6.465) 12.822 8.069 ( 18.159 -8.141 -4.962) 20.510 8.475 ( -10.560 -8.430 4.166) 14.140 8.590 ( -7.673 -2.205 1.504) 8.124 8.847 ( 11.536 2.748 -1.686) 11.978 9.050 ( 12.272 -5.547 -4.868) 14.320 9.109 ( 8.767 -0.391 -2.839) 9.224 9.568 ( -7.544 -4.345 -0.217) 8.708 9.667 ( -1.744 -6.549 6.402) 9.323 9.973 ( 0.529 -4.237 2.880) 5.150 10.034 ( -0.144 -6.546 3.263) 7.316 10.109 ( 1.712 1.879 -1.031) 2.743 10.158 ( -0.745 2.578 0.897) 2.830 10.475 ( -0.556 1.352 14.162) 14.238 10.524 ( -2.768 13.125 13.991) 19.383 10.635 ( -4.567 -4.853 -4.765) 8.192 10.743 ( 3.089 15.055 -10.425) 18.571 10.826 ( 1.166 1.934 -2.395) 3.291 10.952 ( 3.772 -2.216 -11.371) 12.183 11.079 ( -11.633 -1.136 -0.304) 11.692 11.243 ( -12.339 -3.615 -2.506) 13.099 11.321 ( 0.610 -2.677 -2.861) 3.966 11.667 ( 6.935 -6.086 -2.371) 9.526 11.819 ( -5.506 5.117 -0.581) 7.539 11.970 ( 1.362 3.163 1.248) 3.663 12.087 ( -7.746 4.241 5.301) 10.300 12.376 ( -3.197 4.337 -0.963) 5.473 12.414 ( 6.436 5.109 -2.730) 8.659 12.465 ( 1.845 -0.296 2.259) 2.932 12.663 ( -4.078 -0.308 -1.586) 4.387 12.833 ( 3.798 -2.589 8.286) 9.475 12.891 ( -2.142 6.227 -3.049) 7.257 12.942 ( -0.053 3.953 6.531) 7.635 13.212 ( -4.079 -0.018 -0.945) 4.188 13.370 ( 1.285 0.325 -2.684) 2.993 13.534 ( -5.276 -1.073 1.142) 5.504 13.564 ( -4.833 -2.995 1.733) 5.944 13.722 ( 5.593 3.656 3.999) 7.788 13.767 ( -5.048 -1.377 -6.293) 8.184 13.808 ( -9.704 1.378 0.655) 9.823 13.865 ( 5.861 1.906 -4.303) 7.517 13.947 ( 3.875 -1.213 -4.483) 6.048 14.021 ( 5.388 2.064 -3.660) 6.833 14.136 ( -5.207 -0.296 -1.177) 5.347 14.560 ( 12.733 0.065 -1.172) 12.787 14.663 ( -5.379 -1.845 6.792) 8.859 14.926 ( -8.191 -2.380 2.202) 8.810 15.090 ( 5.237 -10.632 -2.335) 12.080 15.541 ( 7.060 1.502 -5.802) 9.261 15.649 ( -2.656 3.402 6.066) 7.445 15.901 ( 4.414 -2.073 -2.540) 5.498 15.927 ( 0.853 -0.856 -0.851) 1.478 16.060 ( 10.669 -4.487 -11.944) 16.632 16.169 ( -12.009 -1.482 6.695) 13.829 16.517 ( 1.238 -5.517 -0.181) 5.657 17.776 ( -35.198 -19.438 18.784) 44.379 17.918 ( -15.686 -11.086 -9.457) 21.410 18.594 ( 13.305 -17.557 -2.200) 22.138 18.805 ( 7.826 -14.298 -5.227) 17.117 19.460 ( -4.619 3.693 1.312) 6.058 19.518 ( -4.683 3.004 4.261) 7.008 21.464 ( -2.097 36.604 -2.699) 36.763 22.135 ( 28.311 20.052 14.511) 37.605 24.247 ( -19.764 -9.154 -9.214) 23.650 24.707 ( 3.413 -11.681 1.875) 12.313 ======================= Grid point 201 (93/130) ======================= q-point: ( 0.20 0.12 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.927 ( 7.464 27.180 -2.792) 28.324 2.063 ( 7.954 6.353 -14.621) 17.816 2.176 ( 13.045 10.797 3.810) 17.357 2.266 ( 14.727 12.097 -0.601) 19.068 3.065 ( 13.292 2.923 -8.377) 15.982 3.149 ( 11.757 4.901 -0.562) 12.751 3.611 ( 3.686 23.287 -7.295) 24.680 4.074 ( 1.254 0.498 8.441) 8.548 4.231 ( -1.568 0.716 6.168) 6.404 4.272 ( 0.851 4.458 2.495) 5.179 4.416 ( 4.819 10.408 11.081) 15.948 4.632 ( -2.082 2.004 1.650) 3.328 5.030 ( -9.330 3.559 -7.479) 12.476 5.505 ( -15.703 -3.344 18.661) 24.617 5.800 ( 10.007 -3.321 1.887) 10.711 5.927 ( -3.294 -5.270 -17.484) 18.556 6.311 ( -7.369 0.614 -16.060) 17.681 6.388 ( -0.742 6.194 15.063) 16.304 6.543 ( 8.798 2.947 -14.253) 17.006 6.854 ( 1.899 3.407 9.813) 10.560 6.943 ( 1.243 4.124 2.743) 5.107 7.040 ( 6.158 11.680 -1.558) 13.295 7.160 ( 6.347 10.456 -8.840) 15.092 7.616 ( -8.411 -4.839 -2.562) 10.036 7.923 ( -0.298 -3.138 3.212) 4.500 7.980 ( 0.811 1.745 2.574) 3.214 8.242 ( -10.503 -6.712 2.047) 12.631 8.398 ( -12.442 1.332 3.517) 12.997 8.597 ( 22.274 -6.365 -4.773) 23.652 9.100 ( 10.109 0.155 5.504) 11.511 9.216 ( 7.568 -3.058 -0.153) 8.164 9.255 ( 8.894 -8.103 -4.637) 12.894 9.475 ( -1.327 -1.749 -0.628) 2.284 9.683 ( -0.422 -5.020 4.751) 6.924 9.968 ( -2.936 4.203 3.973) 6.486 10.042 ( -1.818 -7.493 2.175) 8.012 10.094 ( -3.906 -4.040 2.586) 6.186 10.152 ( 1.339 4.323 -4.254) 6.211 10.474 ( -2.822 0.780 -2.589) 3.908 10.559 ( 0.010 13.127 6.611) 14.697 10.653 ( -0.198 3.954 -9.430) 10.227 10.736 ( -4.188 -0.769 10.271) 11.119 10.782 ( -3.574 -5.674 1.571) 6.888 10.830 ( -2.617 1.988 1.459) 3.596 10.972 ( -0.191 1.964 -4.446) 4.864 11.054 ( -3.066 -2.185 -2.083) 4.303 11.313 ( -0.306 -0.162 -0.382) 0.515 11.717 ( 0.563 -1.487 -3.238) 3.607 11.724 ( -2.837 3.989 -1.341) 5.075 11.937 ( -9.475 5.306 1.215) 10.927 11.950 ( -3.939 1.623 -3.033) 5.230 12.309 ( -3.098 3.157 -0.660) 4.472 12.434 ( -2.077 7.126 -3.539) 8.223 12.533 ( 3.005 -1.238 -2.560) 4.137 12.609 ( -1.675 1.539 1.242) 2.592 12.833 ( -2.297 3.275 1.768) 4.374 12.902 ( -4.556 6.319 5.816) 9.722 12.982 ( 0.870 -3.087 -0.393) 3.231 13.120 ( -1.958 -0.379 -0.303) 2.018 13.321 ( -7.022 -2.020 -4.654) 8.663 13.379 ( -10.014 2.905 3.472) 10.990 13.404 ( -6.777 -4.203 -8.824) 11.894 13.607 ( -8.571 -0.946 4.774) 9.856 13.753 ( 3.868 -3.980 -1.505) 5.751 13.799 ( 3.925 0.766 -2.772) 4.866 13.990 ( 3.775 -3.487 -1.725) 5.421 14.064 ( 10.619 0.504 -2.530) 10.928 14.102 ( 5.740 1.789 -3.481) 6.947 14.176 ( 8.078 0.994 10.974) 13.663 14.574 ( -7.043 12.254 -0.453) 14.141 14.767 ( 10.281 -0.107 -3.684) 10.922 14.809 ( -3.185 -6.951 6.025) 9.734 15.219 ( 6.609 -11.339 -1.696) 13.234 15.599 ( 2.556 -0.664 -1.002) 2.824 15.656 ( -2.945 3.827 10.531) 11.585 15.837 ( -6.836 -0.110 3.952) 7.897 15.976 ( 0.102 0.697 -0.383) 0.802 16.043 ( -4.002 -1.884 1.795) 4.774 16.155 ( 9.090 -6.046 -17.843) 20.917 16.500 ( -2.735 -5.253 -1.785) 6.185 17.316 ( -23.996 -15.405 18.016) 33.730 17.582 ( -10.851 -9.497 -13.941) 20.057 18.749 ( 5.898 -12.042 -3.964) 13.982 18.861 ( 1.958 -10.646 -3.403) 11.346 19.379 ( -4.599 5.702 0.327) 7.333 19.433 ( -6.987 6.322 5.198) 10.761 21.531 ( 6.903 24.455 1.728) 25.469 22.741 ( 19.657 10.216 19.122) 29.264 23.772 ( -19.145 -7.049 -13.946) 24.713 24.705 ( -3.242 -9.155 -0.428) 9.722 ======================= Grid point 202 (94/130) ======================= q-point: ( 0.30 0.12 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.107 ( 13.296 23.960 0.839) 27.414 2.187 ( 12.748 10.027 -4.245) 16.765 2.426 ( 15.527 15.499 -8.959) 23.698 2.588 ( 13.417 4.377 11.641) 18.294 3.234 ( 5.787 9.113 3.447) 11.332 3.345 ( 10.782 3.051 -7.554) 13.514 3.673 ( 5.896 16.356 -5.781) 18.322 4.025 ( -5.677 -5.703 3.382) 8.729 4.228 ( -3.821 0.847 3.014) 4.939 4.245 ( -1.920 1.980 -0.289) 2.773 4.500 ( -2.674 1.269 -3.631) 4.684 4.719 ( -3.289 5.972 -6.248) 9.248 4.923 ( 7.028 7.751 16.308) 19.376 5.291 ( -17.715 1.160 19.330) 26.246 5.662 ( -7.738 -5.287 -21.896) 23.818 5.976 ( 5.092 -2.251 -4.692) 7.281 6.159 ( 0.682 -2.258 -2.456) 3.405 6.457 ( -4.335 2.737 20.647) 21.275 6.721 ( 17.174 2.293 -10.641) 20.333 6.934 ( 4.158 6.987 2.071) 8.390 6.994 ( -2.407 -0.129 2.843) 3.727 7.146 ( 8.146 10.191 -8.287) 15.456 7.203 ( 3.687 10.223 -2.842) 11.233 7.538 ( 2.634 -5.634 -1.423) 6.380 7.890 ( -4.729 -1.819 -0.280) 5.075 7.973 ( -8.238 3.427 1.978) 9.140 8.105 ( -2.460 -1.224 2.016) 3.408 8.223 ( -5.187 2.463 2.313) 6.191 8.866 ( 8.407 -4.842 -0.005) 9.702 9.240 ( -0.024 -3.314 6.999) 7.744 9.345 ( 6.085 -4.214 1.369) 7.527 9.412 ( 9.059 -4.964 -0.408) 10.337 9.501 ( 4.690 -0.710 -3.574) 5.939 9.705 ( -1.318 -3.085 5.245) 6.226 9.933 ( -3.336 6.091 3.925) 7.977 9.997 ( -3.320 -8.020 -1.204) 8.764 10.025 ( -3.087 -3.728 1.194) 4.985 10.146 ( 1.148 4.628 -4.099) 6.288 10.387 ( -4.333 4.998 -1.656) 6.819 10.496 ( -9.193 -3.522 -0.135) 9.845 10.581 ( -1.917 -2.977 -7.248) 8.067 10.632 ( 3.312 14.007 3.096) 14.723 10.768 ( -5.272 1.799 4.065) 6.896 10.890 ( -1.828 6.332 -0.426) 6.604 11.003 ( 2.790 -6.628 13.064) 14.912 11.101 ( 6.697 -2.254 -4.654) 8.461 11.336 ( 3.397 -0.037 2.048) 3.967 11.663 ( -2.578 3.763 0.815) 4.634 11.681 ( -4.018 4.193 -2.860) 6.473 11.748 ( -9.105 6.040 1.431) 11.020 11.827 ( -3.559 -2.326 -8.987) 9.942 12.240 ( -3.299 1.227 -1.978) 4.037 12.316 ( -5.207 8.247 -9.080) 13.325 12.507 ( -2.082 -2.088 -5.470) 6.214 12.603 ( -1.012 1.318 2.880) 3.325 12.754 ( -5.312 2.748 -2.399) 6.444 12.784 ( -10.794 4.201 4.063) 12.274 12.979 ( 1.415 1.635 -3.785) 4.359 13.055 ( -8.164 7.422 -2.519) 11.318 13.122 ( -7.779 0.823 -10.959) 13.465 13.236 ( -0.607 -2.358 4.756) 5.343 13.315 ( -1.334 -6.263 4.658) 7.918 13.603 ( -0.815 0.867 12.627) 12.683 13.781 ( 0.153 0.202 -0.316) 0.405 13.884 ( 5.709 -7.170 -3.709) 9.887 14.041 ( 2.353 -5.706 -3.029) 6.875 14.193 ( 9.064 -0.900 -7.946) 12.087 14.228 ( 6.853 -1.967 6.731) 9.805 14.404 ( -2.898 2.027 -1.076) 3.697 14.532 ( 10.390 5.352 9.133) 14.832 14.852 ( 2.526 -2.628 7.626) 8.453 14.910 ( 7.355 0.860 -4.196) 8.511 15.280 ( 1.870 -11.243 -4.672) 12.318 15.629 ( -3.643 -0.094 10.176) 10.809 15.664 ( -1.685 0.616 7.611) 7.820 15.786 ( -0.838 2.031 4.794) 5.274 15.898 ( -8.604 -2.799 -0.602) 9.067 16.005 ( -1.351 -1.894 1.147) 2.594 16.150 ( -0.030 -2.286 -7.929) 8.251 16.411 ( -0.333 -2.584 -10.792) 11.102 17.131 ( -6.827 -10.510 8.140) 14.944 17.324 ( -5.651 -6.661 -14.560) 16.980 18.782 ( -0.037 -9.908 -1.511) 10.022 18.857 ( 0.590 -10.314 -3.547) 10.922 19.296 ( -4.142 7.641 0.892) 8.737 19.342 ( -5.681 7.546 3.995) 10.256 21.693 ( 7.019 16.441 5.142) 18.601 22.949 ( -7.878 5.046 -3.660) 10.046 23.538 ( 3.001 -4.377 5.895) 7.932 24.602 ( -5.548 -7.367 -3.924) 10.023 ======================= Grid point 203 (95/130) ======================= q-point: ( 0.40 0.12 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.383 ( 10.566 26.698 8.332) 29.897 2.528 ( 20.932 2.110 9.225) 22.972 2.639 ( 12.144 15.294 -7.296) 20.848 2.904 ( 12.051 0.840 8.183) 14.590 3.344 ( 2.607 13.589 6.350) 15.224 3.414 ( 2.740 -0.521 -9.795) 10.185 3.677 ( -3.240 11.725 -5.833) 13.491 3.947 ( -7.894 -4.742 9.244) 13.048 4.025 ( -13.006 4.120 -4.125) 14.253 4.228 ( 0.514 -4.302 -8.598) 9.628 4.473 ( 2.368 7.244 -3.979) 8.597 4.576 ( -1.802 9.388 -7.127) 11.924 4.954 ( -17.099 -3.785 21.588) 27.798 5.361 ( 6.623 4.952 3.893) 9.140 5.396 ( -0.719 -2.005 -10.837) 11.044 5.955 ( -0.034 -2.018 -9.176) 9.396 6.256 ( 5.431 -3.342 5.699) 8.552 6.504 ( -7.136 -0.656 21.993) 23.130 6.869 ( -4.982 -2.865 -3.923) 6.959 6.976 ( 13.160 3.187 -6.485) 15.014 7.094 ( 11.106 8.310 -3.460) 14.296 7.199 ( 4.072 4.186 -8.969) 10.703 7.321 ( 7.482 9.476 3.876) 12.681 7.598 ( 0.066 -4.139 1.541) 4.417 7.761 ( -6.297 1.507 -2.599) 6.977 7.787 ( -10.054 2.788 2.278) 10.679 8.081 ( 0.656 3.250 1.234) 3.537 8.244 ( 2.656 2.493 -1.683) 4.013 8.971 ( 2.412 -5.058 4.378) 7.111 9.231 ( -3.929 -3.894 1.776) 5.810 9.442 ( 0.373 -3.084 5.917) 6.683 9.531 ( 4.305 -2.732 -2.455) 5.659 9.602 ( 8.259 -0.718 -3.752) 9.099 9.698 ( -3.279 -1.170 4.942) 6.045 9.905 ( -2.399 5.900 4.356) 7.716 9.937 ( -1.741 -7.363 1.404) 7.695 10.010 ( 0.920 -4.572 -0.103) 4.664 10.140 ( 0.573 1.453 -3.551) 3.880 10.329 ( -1.332 5.019 2.113) 5.607 10.384 ( -2.756 -1.639 -0.397) 3.231 10.499 ( -1.690 -6.047 -2.593) 6.793 10.697 ( -4.335 0.991 4.589) 6.390 10.727 ( 3.436 12.352 2.739) 13.110 10.888 ( 1.878 10.222 -3.397) 10.934 11.030 ( -3.201 4.590 3.013) 6.355 11.195 ( 5.814 -3.969 -4.335) 8.267 11.356 ( -6.353 5.322 0.770) 8.324 11.539 ( -7.318 10.273 -9.972) 16.079 11.637 ( -1.462 1.009 3.143) 3.610 11.694 ( 3.782 -3.857 11.071) 12.318 11.766 ( 1.502 -2.160 -5.632) 6.216 12.130 ( -6.661 3.082 -7.372) 10.403 12.162 ( -3.156 -1.259 -4.055) 5.291 12.403 ( -3.542 -6.889 -8.630) 11.597 12.574 ( -5.036 4.420 0.039) 6.701 12.597 ( -7.668 4.167 0.519) 8.742 12.672 ( -1.699 0.736 2.036) 2.752 12.907 ( -4.189 3.909 -8.589) 10.325 12.927 ( -3.122 7.413 -2.631) 8.463 12.990 ( 0.476 6.099 -5.325) 8.110 13.286 ( 4.222 6.895 5.853) 9.982 13.430 ( 3.673 -10.287 11.692) 16.000 13.676 ( -1.688 -0.605 11.571) 11.709 13.761 ( -2.801 -0.731 0.819) 3.008 13.909 ( -0.524 -3.159 -4.461) 5.492 14.050 ( 2.654 -5.945 -6.669) 9.320 14.252 ( -5.755 5.084 -0.054) 7.680 14.303 ( 9.037 -2.876 -11.608) 14.990 14.488 ( 7.974 -6.180 13.912) 17.185 14.748 ( 3.472 -9.256 8.670) 13.149 14.962 ( 4.805 -0.418 -5.355) 7.207 15.046 ( 8.845 1.509 5.509) 10.529 15.229 ( -2.151 -10.542 -7.748) 13.258 15.618 ( -6.437 -1.496 11.051) 12.876 15.680 ( -9.973 -2.077 3.312) 10.712 15.718 ( 0.923 -1.178 3.864) 4.144 15.843 ( 2.648 1.797 5.470) 6.338 15.996 ( -2.073 -0.084 4.193) 4.679 16.059 ( -6.497 0.531 0.972) 6.591 16.366 ( 6.380 -0.501 -19.708) 20.721 17.089 ( -2.411 -6.372 1.075) 6.897 17.176 ( 0.230 -4.673 -13.052) 13.865 18.748 ( -3.741 -9.479 3.577) 10.800 18.840 ( 0.831 -10.262 -5.073) 11.477 19.248 ( -1.589 8.672 1.378) 8.924 19.277 ( -3.112 7.287 1.769) 8.119 21.862 ( 5.816 12.073 8.679) 15.965 22.642 ( -11.926 4.503 -15.556) 20.112 23.758 ( 7.374 -3.570 16.131) 18.092 24.453 ( -5.558 -6.153 -7.904) 11.456 ======================= Grid point 204 (96/130) ======================= q-point: (-0.50 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.566 ( 0.144 19.590 8.825) 21.486 2.736 ( 1.618 16.767 -6.985) 18.236 3.001 ( 14.013 -1.497 15.249) 20.764 3.145 ( 9.718 -0.854 5.592) 11.244 3.316 ( -16.074 0.951 -7.400) 17.721 3.366 ( -0.291 1.005 -7.780) 7.850 3.523 ( 1.750 17.185 5.447) 18.112 3.718 ( -8.643 19.852 -9.380) 23.596 3.959 ( -1.222 -8.502 8.305) 11.948 4.167 ( 0.632 -6.445 -9.337) 11.363 4.473 ( -1.429 11.806 0.855) 11.923 4.538 ( -0.580 8.232 -3.520) 8.972 4.838 ( -8.417 -2.356 20.267) 22.072 5.288 ( 9.475 -5.846 -21.794) 24.473 5.606 ( 4.865 3.138 12.743) 13.996 5.849 ( -4.276 -0.376 -10.636) 11.469 6.410 ( -0.211 -4.405 11.831) 12.626 6.469 ( -3.212 -2.816 9.349) 10.279 6.800 ( -2.191 0.424 3.449) 4.108 7.059 ( 2.309 2.454 -12.770) 13.207 7.187 ( -3.713 8.172 -0.878) 9.019 7.259 ( 8.002 8.606 -5.568) 13.004 7.443 ( -2.081 -3.661 8.049) 9.085 7.614 ( -3.358 0.409 -7.278) 8.025 7.642 ( 1.372 3.041 1.187) 3.541 7.702 ( 8.568 6.579 -3.970) 11.509 8.161 ( 4.773 -0.055 1.817) 5.107 8.225 ( -2.900 3.934 -3.853) 6.224 9.049 ( 1.571 -5.052 7.653) 9.303 9.122 ( -7.942 -3.784 1.459) 8.918 9.439 ( -4.828 -3.136 7.869) 9.750 9.563 ( -0.075 -0.349 -1.787) 1.822 9.646 ( -3.409 -0.247 0.796) 3.510 9.719 ( 6.233 -1.799 -3.549) 7.395 9.901 ( -0.794 3.364 3.771) 5.115 9.969 ( 3.599 -4.343 -0.311) 5.649 10.049 ( 2.656 -2.746 0.304) 3.832 10.102 ( -1.454 -2.206 -3.235) 4.177 10.317 ( -4.039 -3.087 3.074) 5.941 10.369 ( 1.770 -5.430 -0.728) 5.757 10.559 ( 6.877 1.867 5.737) 9.149 10.644 ( -4.027 -0.665 -0.237) 4.088 10.785 ( 0.164 9.312 1.897) 9.505 10.882 ( 1.198 8.170 -6.717) 10.644 11.030 ( 3.299 14.339 3.335) 15.086 11.157 ( -6.027 6.031 -0.813) 8.566 11.313 ( -1.175 7.989 -6.564) 10.407 11.369 ( 3.607 5.899 -7.975) 10.555 11.639 ( -1.116 0.973 4.100) 4.359 11.757 ( 1.440 0.403 -6.610) 6.777 11.880 ( 3.151 -7.888 13.406) 15.870 12.008 ( -2.377 -4.411 1.088) 5.127 12.110 ( 1.778 -2.297 -2.328) 3.722 12.247 ( -4.742 -11.184 -13.643) 18.268 12.472 ( -3.850 11.942 2.964) 12.892 12.542 ( 1.539 4.049 -3.031) 5.287 12.693 ( 0.764 0.396 4.498) 4.579 12.798 ( -1.915 2.609 -5.567) 6.439 12.892 ( -0.746 8.090 0.626) 8.148 12.965 ( 0.812 6.041 -5.461) 8.184 13.485 ( 10.452 6.361 7.451) 14.326 13.547 ( -2.688 0.758 7.409) 7.918 13.629 ( -4.240 -3.527 2.024) 5.875 13.704 ( -2.485 -6.453 -0.403) 6.927 13.884 ( -0.304 1.663 3.665) 4.036 14.031 ( 0.379 -3.267 -8.632) 9.237 14.163 ( -5.268 -0.016 4.149) 6.706 14.359 ( 5.451 -2.682 -12.440) 13.844 14.731 ( 5.843 -7.094 14.430) 17.108 14.825 ( -0.949 -8.618 10.365) 13.513 14.967 ( 0.818 -3.150 -8.841) 9.421 15.060 ( -4.998 -11.237 -10.631) 16.256 15.302 ( 9.576 -2.568 6.263) 11.727 15.441 ( -7.342 -3.508 -6.649) 10.508 15.650 ( -4.959 1.523 14.106) 15.030 15.776 ( 1.288 -2.225 3.743) 4.541 15.915 ( -6.673 0.443 8.760) 11.021 15.960 ( -6.132 2.611 10.560) 12.487 15.998 ( 6.868 1.587 -3.513) 7.876 16.361 ( 7.632 -0.228 -22.005) 23.292 17.033 ( -3.499 -2.801 -0.211) 4.487 17.155 ( 6.414 -4.719 -11.568) 14.044 18.705 ( -4.304 -9.629 6.835) 12.569 18.823 ( 0.993 -10.486 -4.359) 11.399 19.231 ( -1.799 9.529 2.515) 10.018 19.275 ( 2.790 6.486 -1.635) 7.247 22.046 ( 6.169 9.456 12.709) 17.000 22.338 ( -8.926 6.537 -14.988) 18.629 24.001 ( 6.974 -4.426 15.199) 17.299 24.286 ( -4.989 -5.272 -11.699) 13.768 ======================= Grid point 205 (97/130) ======================= q-point: (-0.40 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.472 ( -15.078 14.340 7.184) 22.013 2.582 ( -10.398 21.055 -9.040) 25.163 2.771 ( -28.452 3.176 -10.949) 30.651 3.076 ( -4.693 2.053 -3.834) 6.398 3.276 ( -0.923 -1.706 -1.050) 2.206 3.443 ( 0.910 6.217 -0.191) 6.287 3.586 ( 0.205 16.436 0.045) 16.437 3.789 ( 15.211 12.510 14.715) 24.585 4.009 ( -0.501 -4.459 10.634) 11.542 4.148 ( 4.977 -4.953 -8.884) 11.324 4.462 ( -0.629 9.403 2.587) 9.773 4.471 ( -3.730 6.118 -0.388) 7.176 4.937 ( 3.665 -0.995 19.640) 20.003 5.421 ( 17.868 -7.186 -21.874) 29.144 5.654 ( -6.374 2.464 -12.033) 13.838 5.737 ( 0.424 0.035 11.267) 11.275 6.289 ( -11.004 -2.293 5.088) 12.338 6.654 ( 7.112 -3.735 10.151) 12.945 6.789 ( -4.375 3.407 10.042) 11.471 6.960 ( -1.847 3.831 -11.557) 12.314 7.072 ( -5.136 7.709 -3.242) 9.814 7.170 ( -9.991 4.497 -10.434) 15.130 7.367 ( -9.690 3.167 2.029) 10.394 7.601 ( 9.861 2.666 -0.325) 10.220 7.794 ( 7.767 2.857 -3.178) 8.865 7.893 ( 11.139 0.161 -8.753) 14.168 8.122 ( -1.207 6.216 -0.992) 6.410 8.241 ( 2.759 -2.941 -1.646) 4.356 8.973 ( -9.550 -4.759 4.449) 11.560 9.128 ( -0.151 -6.950 8.537) 11.010 9.403 ( -4.662 -0.477 9.618) 10.699 9.485 ( -7.496 1.735 3.677) 8.528 9.600 ( -1.065 -2.125 -4.662) 5.233 9.792 ( 3.432 -2.278 -1.883) 4.530 9.931 ( 1.946 -1.473 1.023) 2.646 10.023 ( 2.973 -5.861 -4.070) 7.730 10.052 ( 0.345 1.035 -3.335) 3.509 10.106 ( 1.568 -2.033 -2.244) 3.410 10.267 ( -2.178 -3.790 6.194) 7.581 10.401 ( 0.942 -5.697 0.366) 5.786 10.509 ( -5.389 3.804 -6.634) 9.355 10.727 ( 4.477 1.431 2.969) 5.559 10.814 ( 1.383 8.323 3.481) 9.127 10.886 ( 4.553 4.634 -7.444) 9.880 11.056 ( -0.206 7.385 -2.256) 7.725 11.175 ( 2.980 10.108 -2.268) 10.779 11.278 ( 5.646 12.237 7.656) 15.500 11.482 ( 8.943 1.442 -6.212) 10.984 11.641 ( -1.892 -1.526 4.061) 4.733 11.730 ( 0.796 0.243 -5.888) 5.947 11.965 ( 0.239 -0.988 7.182) 7.254 12.038 ( -3.443 -9.869 -15.762) 18.913 12.055 ( 1.677 -4.315 5.727) 7.365 12.231 ( 7.095 -2.719 5.656) 9.472 12.471 ( 0.315 6.214 6.154) 8.751 12.632 ( 9.330 5.170 -1.059) 10.719 12.747 ( 0.119 2.068 -3.669) 4.214 12.765 ( 3.644 0.816 4.744) 6.037 12.895 ( 0.360 7.076 1.418) 7.226 12.947 ( 0.480 9.224 -3.158) 9.762 13.396 ( -5.842 10.001 -4.218) 12.327 13.630 ( -3.165 -8.717 -5.426) 10.745 13.657 ( -0.271 -8.753 9.788) 13.134 13.757 ( 8.167 0.717 3.015) 8.735 13.927 ( 0.733 2.029 2.089) 3.003 13.953 ( -1.510 2.665 -2.915) 4.228 14.088 ( -6.346 -1.986 5.072) 8.363 14.348 ( 1.848 -0.380 -8.562) 8.768 14.793 ( -9.130 -7.255 -13.813) 18.077 14.805 ( -3.868 -1.315 6.287) 7.498 14.942 ( -1.220 -9.115 -1.471) 9.313 14.953 ( 1.984 -12.215 8.459) 14.990 15.253 ( -5.809 0.071 -9.272) 10.942 15.523 ( 4.080 -5.189 9.367) 11.460 15.667 ( 0.947 1.517 7.072) 7.294 15.785 ( -3.516 -1.788 6.217) 7.363 15.859 ( -5.562 0.396 10.198) 11.622 15.920 ( -1.106 2.196 2.613) 3.588 16.160 ( 9.193 0.184 0.183) 9.197 16.327 ( 4.250 -1.272 -21.372) 21.827 16.993 ( -0.239 -0.426 2.494) 2.541 17.241 ( 11.208 -6.587 -12.817) 18.256 18.682 ( -3.595 -10.835 7.950) 13.911 18.816 ( 0.317 -11.411 -1.627) 11.530 19.231 ( 0.402 10.244 1.872) 10.422 19.337 ( 5.001 6.747 -2.462) 8.751 22.086 ( -7.855 9.081 -12.610) 17.412 22.291 ( 9.238 7.493 17.218) 20.927 24.095 ( -5.615 -4.486 -15.313) 16.915 24.237 ( 7.777 -5.386 12.562) 15.726 ======================= Grid point 206 (98/130) ======================= q-point: (-0.30 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.141 ( -26.225 7.441 2.642) 27.388 2.173 ( -23.981 15.101 -0.438) 28.343 2.299 ( -12.700 26.753 -5.644) 30.147 2.897 ( -5.863 3.240 -14.883) 16.321 3.104 ( -18.848 4.501 5.852) 20.242 3.398 ( -3.018 10.149 -3.580) 11.177 3.551 ( -5.786 17.832 5.069) 19.420 4.060 ( 3.584 -3.625 3.981) 6.468 4.116 ( 4.977 -1.347 7.663) 9.236 4.326 ( 13.087 1.159 -0.273) 13.141 4.378 ( -1.515 6.319 2.290) 6.890 4.554 ( 5.910 2.364 5.640) 8.504 5.176 ( 2.379 1.071 13.126) 13.383 5.335 ( -5.326 4.015 -9.011) 11.211 5.731 ( 18.499 -6.602 -17.718) 26.453 5.801 ( 0.969 -1.915 6.484) 6.830 6.102 ( -11.847 0.258 4.347) 12.622 6.658 ( -10.293 0.857 1.782) 10.481 6.797 ( -3.872 4.003 -0.268) 5.576 6.893 ( -8.334 6.372 -0.489) 10.503 6.949 ( -2.632 9.595 2.931) 10.372 7.005 ( 9.135 1.647 -8.644) 12.684 7.230 ( -5.114 8.067 -0.371) 9.559 7.623 ( -7.293 -2.317 -7.624) 10.802 7.895 ( 9.916 -0.286 1.609) 10.050 8.047 ( 10.936 4.125 -6.433) 13.341 8.236 ( 7.027 -1.565 -8.303) 10.989 8.262 ( 6.565 -0.669 -2.018) 6.901 8.792 ( -14.946 -4.647 7.004) 17.148 9.147 ( -3.348 -10.570 6.915) 13.068 9.341 ( -9.289 -0.222 4.698) 10.411 9.418 ( -2.177 3.125 8.051) 8.906 9.509 ( -5.121 -3.539 -5.581) 8.361 9.818 ( 1.596 -3.919 -4.505) 6.181 9.964 ( -0.620 -6.764 2.201) 7.140 10.020 ( 2.013 -8.810 -4.434) 10.066 10.065 ( 1.819 2.624 -2.906) 4.318 10.115 ( 3.760 5.771 -3.511) 7.731 10.342 ( 3.211 0.168 8.398) 8.993 10.394 ( -0.454 1.404 0.684) 1.626 10.446 ( -0.397 -1.974 2.428) 3.154 10.767 ( 1.234 7.009 -3.044) 7.741 10.867 ( 2.747 6.124 1.765) 6.940 10.927 ( 7.196 0.425 -11.575) 13.636 11.043 ( -3.291 -4.625 -0.450) 5.694 11.222 ( 6.037 9.333 -4.019) 11.819 11.454 ( 1.436 -1.179 -3.461) 3.928 11.601 ( 5.049 -3.339 4.651) 7.634 11.622 ( 0.232 0.750 2.485) 2.606 11.719 ( 1.969 1.390 -4.231) 4.870 11.871 ( 1.883 -2.349 -10.670) 11.087 12.084 ( 4.236 8.859 11.736) 15.302 12.174 ( 4.513 -1.155 4.719) 6.631 12.391 ( 5.284 1.028 5.025) 7.364 12.565 ( 3.592 0.210 9.041) 9.730 12.740 ( 1.743 2.159 -2.493) 3.731 12.796 ( 4.886 -0.208 4.262) 6.487 12.898 ( 3.973 10.534 0.298) 11.262 12.930 ( 1.193 11.210 1.224) 11.339 13.016 ( 12.847 0.584 3.895) 13.437 13.344 ( 3.001 5.561 -4.358) 7.676 13.492 ( -5.099 -11.187 -9.962) 15.824 13.679 ( -3.148 -5.897 6.760) 9.507 13.817 ( -0.532 -0.062 -3.618) 3.658 13.855 ( -2.754 0.543 -0.306) 2.824 13.994 ( -5.356 -0.532 3.478) 6.409 14.033 ( 0.926 3.797 1.761) 4.286 14.352 ( 2.661 4.536 -0.990) 5.351 14.491 ( -11.595 -5.741 -13.512) 18.708 14.733 ( -6.338 -0.507 -0.579) 6.385 14.822 ( -6.535 -2.781 -4.309) 8.308 15.020 ( -2.462 -6.546 -0.966) 7.060 15.135 ( -1.744 -6.116 3.250) 7.142 15.537 ( -6.747 -0.746 9.890) 11.995 15.764 ( -0.376 -3.209 6.812) 7.539 15.790 ( -5.771 -1.877 13.837) 15.109 15.852 ( 2.801 0.486 6.517) 7.110 15.940 ( 3.320 1.414 -7.244) 8.093 16.242 ( 3.084 -2.508 -17.032) 17.490 16.337 ( 8.101 -1.407 0.821) 8.263 17.087 ( 7.006 -1.214 6.047) 9.334 17.411 ( 18.580 -9.487 -17.718) 27.371 18.670 ( -3.855 -12.832 7.941) 15.575 18.807 ( -1.466 -12.812 1.540) 12.987 19.272 ( 2.264 10.929 2.432) 11.423 19.421 ( 5.417 6.592 -2.480) 8.885 21.854 ( -8.492 12.535 -10.017) 18.154 22.652 ( 15.142 5.577 20.692) 26.240 23.842 ( -9.108 -3.431 -18.713) 21.093 24.464 ( 7.894 -6.480 9.081) 13.667 ======================= Grid point 207 (99/130) ======================= q-point: (-0.20 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.666 ( -22.335 7.493 10.020) 25.601 1.826 ( -21.420 18.320 16.057) 32.439 2.060 ( -8.786 33.949 -2.385) 35.149 2.671 ( -5.995 4.136 -19.027) 20.373 2.713 ( -25.703 12.170 13.973) 31.686 3.287 ( -5.250 7.208 -5.372) 10.411 3.490 ( -3.165 22.874 3.917) 23.421 4.110 ( 0.441 -2.992 2.952) 4.226 4.261 ( 4.785 -1.424 1.405) 5.187 4.310 ( 1.019 0.006 -1.707) 1.988 4.549 ( 3.081 0.978 0.124) 3.235 4.738 ( 2.885 3.633 1.983) 5.045 4.974 ( -2.602 9.140 -8.532) 12.771 5.512 ( 5.329 -0.168 16.001) 16.866 5.808 ( -5.057 -1.641 4.043) 6.679 5.868 ( -1.849 -0.547 3.955) 4.400 6.007 ( 7.941 -4.471 -9.864) 13.429 6.431 ( -8.212 -3.121 -4.611) 9.921 6.716 ( -7.856 9.246 13.439) 18.105 6.814 ( 3.236 10.390 -14.947) 18.488 6.888 ( -2.659 13.374 1.769) 13.750 7.122 ( 0.086 2.099 -3.989) 4.508 7.175 ( 0.541 9.774 -2.989) 10.235 7.510 ( 2.533 -7.840 1.522) 8.378 8.058 ( 7.614 -4.206 -6.001) 10.568 8.169 ( 5.062 0.679 -10.792) 11.940 8.284 ( 9.288 -2.485 -3.925) 10.385 8.447 ( 5.541 -1.241 0.217) 5.682 8.475 ( -17.878 -2.940 4.163) 18.590 9.100 ( -5.775 -10.148 4.079) 12.368 9.142 ( -14.864 -4.263 1.778) 15.565 9.332 ( -8.978 -3.754 -5.527) 11.191 9.454 ( 1.241 2.458 4.762) 5.501 9.807 ( 1.759 -6.259 -6.246) 9.015 9.949 ( -2.868 -6.414 4.643) 8.421 10.051 ( 1.191 -7.407 1.524) 7.656 10.090 ( 3.081 7.032 -2.160) 7.975 10.170 ( 2.627 3.882 -3.888) 6.090 10.392 ( -2.644 -4.896 5.334) 7.708 10.480 ( 4.289 4.168 3.657) 7.010 10.494 ( 3.048 7.960 8.722) 12.195 10.779 ( 2.101 2.003 -3.543) 4.580 10.870 ( -4.897 -0.265 -3.591) 6.078 10.999 ( 6.686 -1.677 2.336) 7.279 11.024 ( 6.997 -4.535 -8.111) 11.632 11.254 ( 1.603 -4.544 -20.963) 21.510 11.323 ( -2.194 1.531 -3.935) 4.759 11.616 ( -2.060 -5.594 6.166) 8.577 11.738 ( 3.462 2.606 -1.726) 4.664 11.804 ( 5.156 1.581 7.320) 9.092 11.954 ( 8.384 3.398 -0.083) 9.046 12.268 ( 5.140 8.154 8.921) 13.134 12.280 ( 4.085 4.443 4.781) 7.700 12.479 ( 1.232 1.490 1.710) 2.581 12.654 ( 1.267 0.422 -0.801) 1.557 12.812 ( 4.648 4.587 3.928) 7.620 12.876 ( -0.664 -2.405 4.223) 4.905 12.967 ( 2.055 5.565 16.980) 17.987 13.026 ( 8.178 17.544 -5.259) 20.059 13.240 ( -5.752 -10.370 -9.689) 15.313 13.346 ( 14.237 -4.851 3.690) 15.487 13.500 ( 9.345 0.730 -3.764) 10.101 13.665 ( 0.082 -1.593 2.898) 3.308 13.755 ( -2.969 0.436 -2.627) 3.988 13.821 ( 0.682 0.050 -4.104) 4.160 13.914 ( -5.681 1.757 2.661) 6.514 13.992 ( -4.597 2.730 0.932) 5.427 14.184 ( -9.669 -2.646 -11.673) 15.387 14.401 ( -0.693 2.763 -1.512) 3.225 14.599 ( -0.188 11.041 -6.022) 12.578 14.670 ( -9.430 2.088 4.008) 10.457 14.950 ( -0.084 -7.534 -6.211) 9.765 15.124 ( -5.787 -11.104 6.896) 14.295 15.454 ( -9.110 0.758 10.873) 14.205 15.748 ( -8.393 -3.798 16.865) 19.217 15.798 ( 0.301 -2.956 1.676) 3.412 15.908 ( 1.128 1.736 -6.372) 6.700 15.957 ( 1.732 0.754 1.594) 2.471 16.249 ( 8.539 -3.315 -12.724) 15.678 16.462 ( 2.755 -2.827 2.977) 4.944 17.338 ( 14.307 -4.052 8.145) 16.955 17.723 ( 28.256 -12.171 -20.949) 37.221 18.631 ( -6.002 -15.985 6.972) 18.443 18.774 ( -4.538 -15.127 4.450) 16.408 19.346 ( 3.296 10.098 3.275) 11.116 19.502 ( 4.197 5.171 -1.199) 6.767 21.630 ( -8.348 17.962 -7.180) 21.069 23.050 ( 5.376 7.402 0.081) 9.148 23.556 ( -1.128 -4.576 -2.718) 5.440 24.644 ( 5.239 -7.748 5.204) 10.703 ======================= Grid point 208 (100/130) ======================= q-point: (-0.10 0.12 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.487 ( -10.707 9.116 26.061) 29.613 1.609 ( -15.071 14.551 26.608) 33.865 1.947 ( -1.851 36.793 -1.174) 36.858 2.425 ( -9.977 14.029 7.824) 18.910 2.446 ( -6.838 7.810 -9.418) 14.016 3.134 ( -4.979 2.171 -9.909) 11.300 3.493 ( 0.142 29.274 4.537) 29.624 4.117 ( -3.063 0.201 0.484) 3.108 4.241 ( -4.426 6.346 -5.773) 9.653 4.366 ( 2.997 -1.192 -4.320) 5.391 4.485 ( 0.051 5.933 -4.750) 7.600 4.675 ( -1.124 2.815 -3.172) 4.387 5.128 ( 9.160 3.147 5.410) 11.094 5.560 ( -9.148 -4.260 7.091) 12.333 5.712 ( -3.355 -1.689 5.235) 6.443 5.946 ( 0.466 7.447 15.766) 17.443 6.095 ( 8.032 -6.234 -10.805) 14.836 6.393 ( 3.452 -3.742 6.671) 8.392 6.733 ( 1.210 6.298 14.506) 15.860 6.747 ( 2.637 14.924 -17.325) 23.018 6.908 ( 2.500 11.846 4.074) 12.774 6.990 ( -5.488 0.076 -10.079) 11.477 7.191 ( 4.435 7.299 -9.299) 12.626 7.659 ( 4.277 -4.034 8.963) 10.719 7.941 ( -28.879 -6.661 3.909) 29.894 8.098 ( 3.454 -3.463 -12.816) 13.718 8.237 ( 11.826 -0.464 -15.407) 19.428 8.542 ( 11.491 -6.037 -2.284) 13.180 8.546 ( -4.041 -6.687 4.006) 8.780 8.819 ( -14.088 -0.888 2.956) 14.422 8.991 ( -6.658 -6.356 -0.755) 9.235 9.118 ( -9.458 -1.242 -3.426) 10.136 9.534 ( 3.812 -1.257 4.091) 5.732 9.807 ( 2.137 -7.469 -6.039) 9.839 9.914 ( -4.835 -6.942 6.945) 10.946 10.053 ( -2.074 -5.198 0.176) 5.599 10.131 ( -2.252 5.263 3.198) 6.557 10.143 ( 0.735 0.253 -2.156) 2.292 10.375 ( -4.029 -0.704 11.447) 12.156 10.569 ( 1.219 6.809 1.535) 7.085 10.616 ( 5.037 15.108 1.486) 15.995 10.697 ( -3.849 5.496 3.384) 7.514 10.881 ( 1.439 -2.026 0.710) 2.585 11.065 ( 3.062 -8.961 -22.519) 24.429 11.156 ( 8.635 -3.730 -8.032) 12.369 11.194 ( 11.011 -7.614 0.754) 13.408 11.304 ( -0.401 2.106 -1.574) 2.660 11.604 ( -3.686 -6.060 4.161) 8.224 11.808 ( 4.643 4.307 -0.217) 6.337 11.906 ( 0.525 1.061 6.844) 6.946 12.129 ( 8.215 3.066 2.391) 9.089 12.344 ( -5.163 8.854 3.923) 10.975 12.351 ( 2.626 1.506 1.473) 3.367 12.487 ( 0.165 3.451 -0.527) 3.495 12.655 ( 0.791 1.944 -1.224) 2.429 12.842 ( -1.065 4.360 1.667) 4.787 12.906 ( -2.330 -3.006 3.840) 5.404 13.057 ( -0.608 6.369 -5.838) 8.661 13.147 ( 3.689 5.255 2.539) 6.904 13.186 ( 3.612 -4.342 13.383) 14.526 13.534 ( 1.589 -0.391 0.182) 1.647 13.602 ( 2.660 2.127 -0.549) 3.450 13.713 ( 4.382 -0.341 -4.436) 6.244 13.779 ( -3.854 -2.135 3.000) 5.330 13.817 ( 2.573 -0.222 -8.461) 8.846 13.830 ( 8.049 5.955 -2.157) 10.242 13.938 ( -2.413 4.051 3.202) 5.700 14.027 ( 0.329 -6.991 -5.279) 8.767 14.296 ( -1.379 1.860 -11.659) 11.887 14.508 ( -10.333 1.810 3.630) 11.101 14.731 ( 10.949 7.726 0.858) 13.427 14.959 ( -2.767 -6.480 -0.019) 7.046 15.012 ( -0.204 -8.192 4.145) 9.183 15.348 ( -10.121 0.761 10.590) 14.668 15.707 ( -6.134 -3.585 11.121) 13.196 15.790 ( 0.038 -0.429 -3.368) 3.396 15.907 ( 2.283 -0.068 -2.124) 3.119 15.974 ( -0.875 0.090 1.187) 1.478 16.356 ( 9.437 -3.836 -8.381) 13.192 16.469 ( -4.581 -2.964 4.188) 6.878 17.741 ( 22.330 -7.453 6.550) 24.435 18.142 ( 26.562 -8.604 -16.865) 32.619 18.532 ( -7.691 -24.591 3.857) 26.053 18.670 ( -11.709 -21.069 7.385) 25.210 19.440 ( 4.156 6.626 3.182) 8.444 19.552 ( 0.772 2.360 0.896) 2.640 21.481 ( -1.524 25.653 -3.329) 25.913 22.538 ( -33.928 21.641 -25.719) 47.759 24.004 ( 26.664 -10.496 15.401) 32.532 24.710 ( -1.334 -9.041 1.366) 9.241 ======================= Grid point 209 (101/130) ======================= q-point: ( 0.00 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.833 ( 0.377 14.866 19.017) 24.141 1.873 ( 2.443 4.855 25.804) 26.370 2.313 ( 1.374 5.528 -26.135) 26.748 2.422 ( 0.436 3.246 -23.179) 23.409 3.024 ( 1.130 31.189 8.804) 32.427 3.150 ( -0.322 22.781 -5.532) 23.445 4.118 ( 1.362 8.421 9.837) 13.021 4.256 ( -0.864 13.519 -0.761) 13.568 4.358 ( -2.972 10.620 7.526) 13.351 4.471 ( 3.611 12.391 2.420) 13.131 4.587 ( -0.074 0.277 0.175) 0.336 4.688 ( -4.735 11.440 -8.674) 15.117 5.295 ( -0.290 -0.107 5.427) 5.436 5.396 ( -2.056 2.453 -4.142) 5.234 5.666 ( -2.603 -0.892 6.202) 6.785 5.924 ( 7.050 -6.773 -17.473) 20.022 6.410 ( 2.423 11.508 19.291) 22.593 6.500 ( 3.149 -0.776 14.190) 14.556 6.831 ( -2.487 0.152 -13.462) 13.691 6.909 ( -1.633 8.055 -18.998) 20.700 7.082 ( 11.050 1.795 9.977) 14.995 7.239 ( -5.159 2.341 -3.827) 6.837 7.307 ( -7.267 7.920 2.137) 10.959 7.382 ( 3.310 6.546 -4.236) 8.470 7.759 ( 3.386 0.018 6.826) 7.620 7.967 ( -2.546 -2.546 -9.856) 10.494 8.151 ( -15.366 2.335 10.520) 18.767 8.349 ( 11.661 -8.415 -3.840) 14.884 8.470 ( -9.783 -13.890 1.328) 17.041 8.594 ( 14.805 -5.374 -12.680) 20.220 8.962 ( -8.980 4.287 5.663) 11.449 9.081 ( 9.241 4.125 -5.711) 11.620 9.548 ( -0.976 -2.897 4.197) 5.192 9.604 ( -6.240 -5.758 -0.645) 8.515 9.817 ( 0.341 -1.277 4.940) 5.114 9.951 ( 1.838 -0.351 -5.665) 5.966 10.000 ( -5.100 -8.411 18.223) 20.708 10.274 ( -0.076 0.519 -6.921) 6.941 10.565 ( 2.027 7.688 7.233) 10.748 10.661 ( -0.868 0.088 0.789) 1.176 10.728 ( -5.138 3.770 2.566) 6.870 10.845 ( 0.523 2.933 0.998) 3.142 10.892 ( 3.491 1.239 -2.710) 4.590 10.970 ( 3.665 1.741 -12.888) 13.512 11.174 ( 1.960 -1.764 3.072) 4.049 11.229 ( 3.154 -2.149 0.376) 3.835 11.419 ( 0.609 5.591 1.895) 5.935 11.484 ( -1.981 5.019 -3.178) 6.262 11.945 ( 2.433 0.496 2.599) 3.595 11.989 ( -1.151 2.210 -0.022) 2.492 12.310 ( -2.523 0.646 1.942) 3.249 12.371 ( 2.626 3.238 -0.166) 4.172 12.462 ( -2.431 4.752 2.183) 5.767 12.553 ( -0.441 4.399 -1.913) 4.817 12.667 ( -0.407 -4.502 3.543) 5.744 12.725 ( 1.235 -1.366 -3.285) 3.766 12.878 ( 0.318 -3.883 7.561) 8.506 13.049 ( -2.520 -3.846 -8.076) 9.293 13.175 ( 2.702 -3.697 8.548) 9.697 13.321 ( -2.749 2.940 -3.310) 5.211 13.558 ( -2.296 -3.531 3.369) 5.394 13.611 ( 0.958 -4.511 -2.353) 5.177 13.690 ( -1.033 2.781 -2.961) 4.191 13.731 ( 5.447 -4.116 -4.809) 8.351 13.879 ( 0.871 6.473 -1.323) 6.664 13.927 ( 1.620 2.460 -2.906) 4.138 14.088 ( -0.995 9.355 0.854) 9.447 14.116 ( 2.297 9.406 -1.263) 9.764 14.349 ( -10.661 1.001 -2.144) 10.921 14.359 ( 7.578 0.532 -3.682) 8.442 14.599 ( -6.048 -3.724 5.146) 8.770 14.680 ( 4.535 -7.060 -2.519) 8.761 15.145 ( -10.608 -4.682 9.762) 15.157 15.348 ( 13.299 -2.336 -9.061) 16.261 15.634 ( 0.190 -3.763 5.536) 6.697 15.721 ( 3.432 -4.258 -1.867) 5.779 15.917 ( -2.039 -2.426 0.305) 3.184 15.944 ( 2.844 -2.091 -3.385) 4.891 16.287 ( -7.940 -4.140 1.910) 9.156 16.320 ( 3.010 -8.314 -0.435) 8.853 17.688 ( -13.860 -22.208 17.722) 31.613 17.862 ( -7.967 -22.949 -0.761) 24.305 18.213 ( 3.921 0.530 -2.716) 4.799 18.336 ( 17.408 -4.069 -12.772) 21.971 19.569 ( -2.208 2.079 3.213) 4.418 19.573 ( -0.719 2.430 2.859) 3.820 22.217 ( 11.438 26.723 9.516) 30.586 22.486 ( -15.925 27.296 -16.765) 35.773 24.174 ( 13.899 -16.511 8.910) 23.349 24.323 ( -10.067 -14.742 -5.626) 18.717 ======================= Grid point 210 (102/130) ======================= q-point: ( 0.10 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.014 ( 6.800 10.075 16.357) 20.379 2.157 ( 2.237 2.195 -22.802) 23.016 2.216 ( 11.179 7.175 21.249) 25.059 2.399 ( 14.310 7.909 -24.404) 29.375 3.135 ( 5.392 22.671 0.278) 23.305 3.182 ( 7.620 24.029 -1.085) 25.232 4.108 ( -6.032 7.661 -0.143) 9.752 4.223 ( -2.294 3.910 0.926) 4.627 4.343 ( -5.136 20.226 6.710) 21.921 4.458 ( -2.963 6.247 -3.204) 7.620 4.569 ( 1.496 16.949 3.931) 17.463 4.678 ( 1.729 2.229 2.374) 3.686 5.259 ( -4.313 3.585 0.354) 5.620 5.449 ( 4.765 -1.760 5.156) 7.238 5.644 ( -2.796 -0.026 4.523) 5.317 5.898 ( 2.104 -8.761 -16.983) 19.225 6.488 ( -6.890 4.855 2.759) 8.869 6.621 ( 2.785 0.618 2.658) 3.899 6.647 ( -9.205 5.333 3.087) 11.077 6.754 ( 1.805 6.236 -8.209) 10.466 7.109 ( 0.963 4.032 0.426) 4.167 7.228 ( 3.285 13.389 -8.587) 16.242 7.336 ( 3.336 7.468 3.178) 8.775 7.685 ( 4.073 -4.994 0.774) 6.491 7.801 ( -0.118 -2.301 5.152) 5.644 7.912 ( 15.784 -0.430 -2.923) 16.059 8.055 ( -1.161 5.300 3.053) 6.225 8.238 ( -9.848 -12.738 0.602) 16.113 8.548 ( 1.974 -3.570 0.841) 4.165 8.773 ( 10.271 -11.269 -7.720) 17.091 8.912 ( 6.879 1.396 -1.419) 7.161 9.199 ( 5.570 5.519 -3.356) 8.529 9.490 ( -6.148 -3.134 4.287) 8.124 9.558 ( -0.941 -4.851 4.818) 6.902 9.875 ( 2.250 -1.384 3.884) 4.698 9.961 ( -1.446 -2.324 4.536) 5.298 10.061 ( 1.854 -7.586 9.239) 12.097 10.205 ( -2.175 -0.845 -6.189) 6.614 10.573 ( -4.745 0.490 -4.975) 6.892 10.619 ( 0.453 9.718 3.200) 10.242 10.686 ( -5.612 1.932 11.255) 12.724 10.852 ( -0.969 1.570 -4.594) 4.951 10.884 ( -0.440 -1.761 -4.995) 5.314 10.989 ( 5.565 6.662 -7.692) 11.598 11.132 ( -3.926 4.236 -2.442) 6.271 11.216 ( -6.779 0.783 -6.644) 9.524 11.325 ( -1.522 6.977 3.634) 8.013 11.585 ( 6.161 0.160 0.070) 6.163 11.909 ( -3.632 1.994 -2.649) 4.918 12.018 ( 1.352 -0.300 1.706) 2.197 12.239 ( -5.358 6.608 1.571) 8.652 12.403 ( -0.142 -1.514 -1.607) 2.213 12.486 ( -1.422 5.437 5.365) 7.769 12.517 ( 1.776 1.707 -0.146) 2.468 12.644 ( -2.033 -2.771 0.145) 3.440 12.764 ( 1.502 -4.445 -3.348) 5.764 12.884 ( -4.573 -5.408 2.725) 7.588 12.968 ( -0.318 -0.542 3.345) 3.404 13.272 ( 2.330 1.061 0.540) 2.617 13.294 ( 1.361 -3.147 -0.179) 3.434 13.460 ( -7.666 -6.850 -0.240) 10.283 13.555 ( -7.008 -4.822 -0.065) 8.507 13.652 ( -2.589 4.131 -1.536) 5.111 13.745 ( -1.159 -0.291 -6.383) 6.494 13.838 ( -0.808 0.995 1.635) 2.077 13.931 ( 1.856 3.831 -4.662) 6.313 14.095 ( 0.373 11.715 -0.441) 11.729 14.150 ( 0.642 6.835 0.683) 6.899 14.182 ( -1.403 5.130 -1.888) 5.644 14.550 ( 9.941 -2.140 0.644) 10.189 14.588 ( 1.818 -1.599 4.680) 5.269 14.810 ( 8.846 -8.450 -0.875) 12.264 15.001 ( -10.012 1.064 6.405) 11.933 15.472 ( 5.301 -8.030 -5.379) 11.023 15.665 ( -1.331 -2.362 6.582) 7.119 15.816 ( 10.240 -6.723 -12.598) 17.571 15.888 ( 1.036 -2.543 -2.524) 3.730 15.976 ( 1.032 -2.583 -0.424) 2.813 16.124 ( -10.360 -2.585 3.793) 11.332 16.355 ( -0.245 -9.533 2.861) 9.956 17.348 ( -29.318 -16.294 21.729) 39.965 17.596 ( -14.568 -17.174 -3.228) 22.750 18.410 ( 14.707 -2.954 -7.929) 16.967 18.580 ( 13.588 -6.895 -10.260) 18.370 19.531 ( -3.544 3.188 3.091) 5.681 19.572 ( -2.374 2.213 3.679) 4.906 22.175 ( -6.940 29.259 -9.816) 31.632 22.585 ( 16.867 20.791 15.333) 30.852 24.005 ( -16.827 -12.941 -10.453) 23.662 24.398 ( 4.850 -16.718 4.968) 18.102 ======================= Grid point 211 (103/130) ======================= q-point: ( 0.20 0.25 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.097 ( 8.926 5.216 -16.259) 19.268 2.324 ( 11.975 5.796 12.408) 18.192 2.515 ( 7.920 15.540 11.599) 20.947 2.576 ( 18.289 11.984 -17.928) 28.276 3.245 ( 8.569 13.093 -4.768) 16.358 3.396 ( 11.836 19.775 3.815) 23.360 3.964 ( -5.731 2.788 -5.140) 8.188 4.171 ( -3.958 11.578 1.359) 12.312 4.274 ( -2.350 6.107 2.032) 6.852 4.381 ( -3.838 5.542 -1.977) 7.025 4.593 ( -3.562 2.059 -1.054) 4.247 4.818 ( 7.524 17.565 16.467) 25.225 5.150 ( -5.680 8.511 -4.771) 11.290 5.457 ( -9.500 -1.020 9.053) 13.162 5.726 ( 4.517 -4.206 -6.416) 8.903 5.778 ( 0.870 -6.742 -5.261) 8.596 6.271 ( -8.731 -3.168 -11.717) 14.952 6.575 ( -5.837 10.023 13.907) 18.109 6.644 ( 5.694 5.932 -9.567) 12.615 6.880 ( 3.964 1.966 14.039) 14.720 7.120 ( -1.351 8.230 4.930) 9.688 7.315 ( -2.819 -2.271 -9.997) 10.633 7.327 ( 8.774 11.845 -7.687) 16.624 7.604 ( 0.806 11.395 -5.736) 12.783 7.824 ( -2.176 -4.957 5.180) 7.492 8.045 ( -0.605 -8.420 -0.435) 8.453 8.108 ( -1.080 7.417 8.143) 11.068 8.413 ( 9.875 -4.016 -0.009) 10.661 8.461 ( 3.829 -1.069 -0.053) 3.975 8.923 ( 9.640 -15.594 -6.949) 19.606 9.129 ( 13.702 0.290 -1.142) 13.752 9.244 ( 0.338 2.416 2.059) 3.192 9.446 ( -2.028 -0.712 6.026) 6.398 9.593 ( 1.454 -5.313 2.921) 6.235 9.935 ( 1.277 -0.576 1.533) 2.077 9.954 ( -3.110 -2.615 5.525) 6.858 10.110 ( -2.341 -1.727 -2.933) 4.131 10.174 ( 3.258 -3.482 2.971) 5.618 10.465 ( -2.579 -1.031 -5.111) 5.817 10.591 ( -10.138 -6.777 2.875) 12.529 10.651 ( 0.017 4.503 -1.622) 4.786 10.744 ( -3.166 3.357 -0.936) 4.709 10.857 ( -1.922 3.855 1.308) 4.501 10.992 ( -1.413 12.445 -2.177) 12.712 11.055 ( -2.668 4.601 -2.988) 6.100 11.101 ( 3.745 6.379 -6.508) 9.853 11.356 ( -0.075 6.256 5.253) 8.169 11.665 ( 3.800 -0.542 -2.965) 4.850 11.822 ( -3.323 3.463 -2.841) 5.577 12.012 ( -2.213 0.363 -1.553) 2.728 12.122 ( -7.435 9.351 -0.822) 11.974 12.331 ( -3.947 -1.509 -3.527) 5.504 12.431 ( -5.805 1.225 0.564) 5.959 12.610 ( 0.686 2.834 -1.648) 3.349 12.632 ( 0.803 0.734 3.063) 3.251 12.698 ( -1.914 -15.018 3.318) 15.499 12.856 ( -1.969 -7.836 -0.185) 8.082 12.983 ( -1.881 2.051 2.772) 3.928 13.231 ( -5.234 -4.525 -4.080) 8.032 13.287 ( -3.156 -5.323 -9.026) 10.944 13.353 ( -1.374 11.975 3.385) 12.520 13.413 ( -6.849 -1.862 2.159) 7.419 13.579 ( -3.130 2.690 4.754) 6.295 13.674 ( -2.325 -0.915 -0.485) 2.545 13.870 ( 2.936 0.567 -2.642) 3.991 13.927 ( 0.738 1.506 -3.217) 3.628 14.116 ( 2.110 4.032 -5.196) 6.907 14.135 ( -1.140 1.762 9.176) 9.413 14.254 ( 5.110 6.657 -2.135) 8.659 14.627 ( 2.986 -4.418 5.070) 7.358 14.788 ( 9.606 1.935 0.062) 9.799 14.868 ( -5.317 8.788 5.424) 11.615 14.965 ( 6.208 -11.660 -2.208) 13.392 15.510 ( 1.859 -7.797 -1.079) 8.088 15.672 ( -4.918 -3.923 10.712) 12.423 15.838 ( -0.377 -1.647 -2.993) 3.436 15.895 ( -3.590 -12.564 -2.780) 13.359 15.981 ( -2.273 -1.052 0.824) 2.637 16.033 ( 7.250 -1.181 -8.626) 11.330 16.348 ( -1.906 -8.776 0.901) 9.026 17.021 ( -17.237 -9.624 16.878) 25.973 17.330 ( -9.491 -13.066 -6.499) 17.408 18.580 ( 8.557 -4.301 -7.558) 12.200 18.690 ( 4.908 -5.490 -7.184) 10.288 19.476 ( -4.322 3.841 2.697) 6.380 19.533 ( -4.295 3.179 3.776) 6.543 22.069 ( -0.252 24.698 -3.435) 24.937 23.004 ( 13.356 13.404 17.542) 25.803 23.582 ( -17.119 -10.007 -13.685) 24.093 24.448 ( -1.259 -14.692 1.342) 14.807 ======================= Grid point 212 (104/130) ======================= q-point: ( 0.30 0.25 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.260 ( 15.306 6.849 -3.757) 17.185 2.634 ( 12.568 3.981 7.935) 15.388 2.709 ( 7.213 19.103 6.210) 21.343 2.802 ( 16.039 13.552 -12.612) 24.494 3.362 ( 5.744 4.660 -4.631) 8.727 3.620 ( 7.326 19.566 4.195) 21.310 3.842 ( -4.074 -2.990 -2.519) 5.647 4.125 ( -2.466 16.444 0.571) 16.638 4.261 ( -1.795 2.653 -2.154) 3.860 4.295 ( -3.411 2.676 1.094) 4.472 4.514 ( -1.295 0.473 0.631) 1.516 4.965 ( -3.614 16.404 -11.553) 20.387 5.041 ( -6.018 3.946 16.544) 18.041 5.370 ( -0.737 5.146 9.216) 10.581 5.538 ( -7.940 -4.992 -13.633) 16.547 5.922 ( 4.829 -2.443 -3.061) 6.217 6.090 ( -1.474 -4.145 -2.951) 5.297 6.546 ( -9.996 5.085 22.022) 24.713 6.785 ( 14.522 3.730 -8.770) 17.370 6.949 ( -6.457 -0.035 2.699) 6.998 7.152 ( 2.753 7.088 3.829) 8.513 7.203 ( 0.761 -5.869 -0.730) 5.962 7.438 ( 8.002 9.288 -9.159) 15.303 7.595 ( 1.302 13.032 -6.005) 14.408 7.817 ( -1.791 -3.582 1.448) 4.258 8.023 ( -3.850 -1.990 2.430) 4.969 8.195 ( 4.256 12.702 5.014) 14.304 8.298 ( -4.314 5.934 1.220) 7.437 8.735 ( 9.384 -7.167 -1.504) 11.904 9.032 ( 7.269 -13.471 -7.587) 17.085 9.280 ( 1.240 -3.627 5.745) 6.907 9.359 ( 7.461 0.699 6.880) 10.173 9.489 ( 3.595 -0.019 1.379) 3.850 9.636 ( 0.803 -5.240 3.600) 6.408 9.898 ( -3.336 -2.796 -4.236) 6.073 9.928 ( -0.903 0.104 -3.662) 3.774 10.067 ( -2.748 2.775 4.567) 6.009 10.244 ( 2.247 0.627 0.610) 2.411 10.377 ( -4.506 -6.747 -3.265) 8.746 10.417 ( -5.317 -4.537 -4.712) 8.430 10.565 ( -2.513 5.092 -3.663) 6.757 10.768 ( -2.028 1.677 6.847) 7.335 10.857 ( 0.823 4.749 2.943) 5.648 11.014 ( 2.704 8.430 0.416) 8.863 11.023 ( 1.583 6.600 3.966) 7.861 11.143 ( 4.245 5.904 -6.715) 9.898 11.393 ( 0.282 7.324 5.492) 9.159 11.700 ( 2.338 -0.024 -4.165) 4.776 11.760 ( -0.800 5.047 -1.711) 5.389 11.915 ( -4.567 4.470 -6.400) 9.044 11.953 ( -9.474 11.229 -0.586) 14.703 12.222 ( -4.887 -2.887 -3.635) 6.740 12.300 ( -8.060 -4.669 -0.056) 9.314 12.515 ( -3.367 2.140 -8.267) 9.180 12.626 ( -2.144 0.348 -0.397) 2.209 12.745 ( -8.242 -5.447 3.563) 10.502 12.790 ( -0.401 -8.396 6.710) 10.755 12.919 ( -2.179 -1.449 -6.389) 6.904 13.082 ( -5.807 -5.401 -2.489) 8.312 13.191 ( -0.698 0.907 -6.863) 6.958 13.312 ( -2.590 11.481 -0.433) 11.777 13.373 ( -0.087 5.184 4.568) 6.910 13.599 ( -0.552 1.159 5.693) 5.836 13.690 ( 1.959 -4.860 5.141) 7.340 13.886 ( -0.952 7.002 -0.310) 7.073 13.932 ( 1.704 -3.452 -0.326) 3.863 14.145 ( 4.806 -2.539 -3.037) 6.226 14.194 ( 2.055 -0.721 5.226) 5.662 14.312 ( 1.011 -3.945 2.388) 4.721 14.666 ( -4.063 1.114 3.682) 5.595 14.861 ( 4.205 0.046 0.201) 4.210 14.961 ( 6.646 3.444 -2.008) 7.750 15.040 ( 4.232 -6.899 -2.130) 8.369 15.537 ( 0.335 -8.119 0.921) 8.178 15.619 ( -7.291 -8.577 11.267) 15.927 15.728 ( -12.253 -13.293 6.415) 19.183 15.842 ( 1.527 3.517 0.056) 3.835 15.981 ( 1.449 0.768 0.572) 1.737 16.113 ( 4.260 -0.600 -6.408) 7.718 16.313 ( 2.280 -6.725 -9.567) 11.914 16.930 ( -3.168 -6.516 8.533) 11.194 17.148 ( -4.707 -9.043 -7.167) 12.462 18.635 ( 2.144 -4.039 -4.879) 6.687 18.697 ( 1.316 -4.737 -5.595) 7.449 19.410 ( -4.297 3.875 2.502) 6.304 19.469 ( -4.624 4.008 2.975) 6.804 22.088 ( 2.380 19.634 1.677) 19.849 23.088 ( -12.427 6.593 -10.433) 17.514 23.426 ( 6.921 -4.744 12.765) 15.276 24.389 ( -4.006 -12.537 -2.699) 13.435 ======================= Grid point 213 (105/130) ======================= q-point: ( 0.40 0.25 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.601 ( 17.842 5.118 8.550) 20.436 2.881 ( 4.656 14.688 7.529) 17.149 2.899 ( 11.802 5.229 2.868) 13.223 3.002 ( 12.969 13.095 -9.603) 20.781 3.369 ( -0.925 -1.093 -6.277) 6.439 3.651 ( -4.606 4.859 -7.522) 10.070 3.816 ( -1.544 1.984 9.385) 9.716 4.028 ( -6.143 19.517 2.951) 20.673 4.159 ( -3.675 -0.914 -7.075) 8.025 4.288 ( -0.372 14.428 1.439) 14.505 4.582 ( 4.381 3.621 2.375) 6.160 4.804 ( -2.883 11.022 -10.930) 15.788 4.922 ( -11.965 2.587 11.865) 17.048 5.284 ( -6.647 -2.560 -15.402) 16.969 5.541 ( 6.836 7.420 9.130) 13.607 5.903 ( 0.210 -2.541 -7.217) 7.654 6.163 ( 4.384 -5.491 5.684) 9.038 6.494 ( -10.993 -1.253 18.041) 21.164 6.818 ( -2.523 -1.131 -3.016) 4.091 7.024 ( 12.137 1.791 -2.298) 12.482 7.198 ( -1.650 -1.918 1.799) 3.104 7.295 ( 8.678 5.591 0.192) 10.325 7.529 ( 5.532 -0.570 -4.580) 7.204 7.590 ( 1.802 10.401 -2.945) 10.959 7.757 ( -4.283 2.616 0.054) 5.019 7.899 ( -7.987 5.612 -0.783) 9.793 8.264 ( -1.066 14.033 5.714) 15.189 8.335 ( 6.236 7.525 -3.540) 10.395 8.834 ( 2.540 -7.417 2.893) 8.356 9.083 ( 2.664 -9.665 -6.874) 12.155 9.342 ( -0.605 -5.838 7.428) 9.467 9.485 ( 0.547 -0.418 8.320) 8.349 9.599 ( 7.692 -0.509 -2.754) 8.186 9.685 ( 2.140 -1.899 1.640) 3.298 9.798 ( -2.753 -4.923 -4.247) 7.060 9.873 ( -2.009 -2.135 -2.901) 4.125 10.057 ( -1.670 5.056 5.823) 7.890 10.257 ( -0.677 2.062 -2.004) 2.954 10.289 ( -2.899 -4.459 -2.367) 5.822 10.304 ( -2.244 -5.092 -5.746) 7.999 10.560 ( 2.740 8.848 1.282) 9.351 10.732 ( -4.244 2.035 3.737) 6.010 10.912 ( 1.487 7.348 5.081) 9.056 11.045 ( 2.611 4.251 -3.026) 5.835 11.148 ( 2.397 1.902 5.535) 6.325 11.168 ( 3.790 5.249 -4.156) 7.693 11.442 ( 0.552 7.863 4.853) 9.256 11.709 ( 1.597 2.137 -1.314) 2.974 11.758 ( -3.097 11.659 -1.972) 12.223 11.788 ( 0.937 7.045 -9.830) 12.130 11.805 ( -4.286 7.164 4.748) 9.604 12.099 ( -4.928 -4.193 -5.052) 8.209 12.113 ( -10.389 -4.369 -1.249) 11.339 12.349 ( -7.483 4.889 -10.733) 13.968 12.569 ( -1.001 -1.815 -0.675) 2.179 12.657 ( -1.786 -0.999 0.556) 2.120 12.752 ( -4.558 0.457 0.597) 4.620 12.851 ( -2.034 -5.788 -5.228) 8.060 13.021 ( -1.045 -4.913 1.965) 5.393 13.135 ( -1.582 4.597 -4.434) 6.580 13.306 ( 1.683 4.951 3.594) 6.345 13.454 ( 3.181 2.438 5.799) 7.049 13.612 ( -0.209 -1.265 0.817) 1.520 13.758 ( 0.907 -4.927 2.835) 5.756 13.867 ( -2.128 7.461 6.476) 10.106 13.965 ( 1.084 0.006 1.248) 1.654 14.220 ( 6.904 -4.721 -9.296) 12.505 14.298 ( -1.438 -2.589 3.239) 4.389 14.325 ( 1.877 -5.993 10.261) 12.030 14.628 ( -1.247 -2.185 6.302) 6.785 14.877 ( -0.514 -12.548 -6.847) 14.304 14.999 ( 1.814 0.380 -8.321) 8.525 15.137 ( 4.485 1.668 2.290) 5.305 15.445 ( -8.730 -13.278 -0.220) 15.892 15.596 ( -4.429 -8.736 10.389) 14.278 15.640 ( -0.953 -7.218 6.821) 9.976 15.901 ( 3.366 3.873 2.764) 5.828 16.015 ( 0.979 2.499 1.361) 3.009 16.085 ( -5.055 1.630 2.963) 6.082 16.319 ( 8.012 -3.874 -18.412) 20.450 16.955 ( 0.693 -5.232 2.139) 5.695 17.050 ( -0.709 -6.409 -6.468) 9.133 18.613 ( -2.244 -3.372 0.420) 4.072 18.678 ( 0.886 -4.828 -5.638) 7.475 19.362 ( -2.049 3.296 2.021) 4.376 19.408 ( -3.182 4.254 1.586) 5.545 22.169 ( 3.318 16.071 5.724) 17.379 22.770 ( -10.069 6.997 -13.909) 18.541 23.663 ( 6.141 -4.710 15.651) 17.460 24.273 ( -4.514 -10.750 -6.678) 13.436 ======================= Grid point 214 (106/130) ======================= q-point: (-0.50 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.923 ( -6.402 10.620 7.583) 14.535 2.989 ( 11.676 1.506 13.380) 17.822 3.093 ( 4.144 14.847 -4.837) 16.155 3.174 ( 11.092 5.146 0.432) 12.235 3.277 ( -0.715 -3.842 -10.658) 11.352 3.361 ( -16.169 0.174 -11.242) 19.694 3.846 ( -0.154 -2.643 9.300) 9.669 4.033 ( 1.359 8.169 -2.870) 8.765 4.087 ( 1.483 17.148 2.969) 17.466 4.241 ( -2.873 24.980 -5.039) 25.645 4.623 ( -3.741 2.349 5.283) 6.886 4.729 ( -0.355 10.311 -5.304) 11.600 4.839 ( -4.368 4.511 11.639) 13.225 5.153 ( 6.323 -5.653 -16.949) 18.952 5.684 ( 2.027 4.151 7.618) 8.909 5.834 ( -2.746 -0.841 -6.918) 7.490 6.304 ( 2.896 -6.114 9.711) 11.835 6.388 ( -5.728 -4.701 5.342) 9.135 6.824 ( 0.608 2.040 6.363) 6.710 7.091 ( 1.851 0.985 -13.331) 13.495 7.256 ( 1.426 -3.425 12.164) 12.717 7.424 ( -0.432 2.078 -3.265) 3.894 7.491 ( -5.023 8.549 -0.914) 9.957 7.626 ( 6.519 0.730 -10.083) 12.030 7.735 ( 3.441 7.160 1.928) 8.174 7.810 ( 2.416 4.317 -4.720) 6.838 8.268 ( -2.942 11.993 6.086) 13.767 8.388 ( 2.096 11.098 -4.458) 12.142 8.903 ( 0.881 -8.411 6.305) 10.548 9.016 ( -5.796 -5.822 -3.715) 9.017 9.363 ( -2.733 -3.721 10.608) 11.569 9.511 ( -0.027 -3.799 -1.504) 4.085 9.668 ( -4.863 0.454 0.954) 4.977 9.700 ( 4.512 -0.542 -2.839) 5.358 9.808 ( 4.096 -3.874 -0.562) 5.666 9.822 ( -1.354 -7.938 -1.538) 8.198 10.104 ( 2.547 5.462 5.284) 8.015 10.183 ( -4.114 -1.290 -0.080) 4.312 10.221 ( -3.137 -3.460 -0.892) 4.755 10.279 ( 2.236 -1.092 -5.654) 6.177 10.665 ( 2.675 4.869 2.698) 6.176 10.683 ( 0.293 5.173 1.095) 5.296 10.968 ( 1.270 9.514 2.163) 9.840 11.037 ( -0.413 7.707 -5.268) 9.345 11.141 ( -5.134 -1.789 4.162) 6.848 11.240 ( 6.417 0.537 -3.986) 7.573 11.488 ( 0.742 11.805 7.156) 13.825 11.670 ( -1.403 11.652 -4.769) 12.669 11.712 ( -0.572 6.731 -0.156) 6.757 11.797 ( 0.896 7.499 -9.913) 12.463 11.873 ( 5.254 4.285 9.116) 11.360 11.937 ( -3.164 -0.843 2.367) 4.040 12.031 ( 1.506 -4.469 -3.898) 6.118 12.132 ( -6.841 1.863 -10.525) 12.690 12.592 ( 2.465 -1.010 0.945) 2.826 12.626 ( -2.119 1.297 -1.922) 3.141 12.707 ( -0.091 -0.021 2.066) 2.068 12.771 ( -2.077 -3.985 -4.047) 6.048 13.032 ( 0.133 -2.413 2.514) 3.487 13.088 ( -0.467 7.855 -2.066) 8.135 13.394 ( 3.417 -2.751 5.032) 6.676 13.481 ( -2.191 -9.709 -2.506) 10.264 13.665 ( 3.826 4.806 5.000) 7.921 13.737 ( -2.996 1.134 -1.777) 3.663 13.905 ( -0.020 4.051 8.128) 9.082 13.996 ( 2.121 3.969 0.142) 4.502 14.196 ( -6.389 2.289 -1.277) 6.906 14.279 ( 5.943 -4.885 -9.301) 12.070 14.491 ( 3.199 -11.838 15.529) 19.787 14.708 ( 2.182 -4.143 10.007) 11.048 14.770 ( -4.031 -13.478 -10.406) 17.499 14.926 ( -2.436 -2.445 -10.121) 10.693 15.223 ( 2.057 -4.930 4.370) 6.902 15.318 ( -1.569 -7.022 -4.275) 8.369 15.595 ( -3.356 -7.758 9.844) 12.975 15.680 ( 0.799 -7.900 3.084) 8.518 15.943 ( -6.010 2.094 8.984) 11.010 16.015 ( -4.990 2.176 7.903) 9.596 16.060 ( 6.680 4.453 -5.425) 9.690 16.332 ( 6.377 -2.218 -18.788) 19.964 16.967 ( 0.155 -3.078 -0.502) 3.122 17.030 ( 3.051 -6.292 -6.165) 9.323 18.571 ( -3.630 -3.129 3.955) 6.214 18.655 ( 0.055 -5.153 -3.550) 6.258 19.365 ( 0.846 2.853 1.201) 3.209 19.381 ( 0.133 4.191 -0.008) 4.193 22.296 ( 4.837 13.532 9.201) 17.064 22.522 ( -6.725 10.331 -12.369) 17.463 23.877 ( 5.747 -7.009 14.095) 16.758 24.131 ( -4.255 -9.169 -10.130) 14.311 ======================= Grid point 215 (107/130) ======================= q-point: (-0.40 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.753 ( -17.368 10.615 7.054) 21.543 2.846 ( -20.813 5.758 -10.916) 24.197 2.991 ( -8.713 11.953 -4.543) 15.474 3.114 ( -0.630 3.635 -9.080) 9.801 3.300 ( 4.376 3.282 -0.196) 5.474 3.455 ( 7.885 -1.957 8.444) 11.718 3.941 ( 2.318 0.534 8.237) 8.573 4.045 ( 4.041 -1.017 -9.125) 10.031 4.116 ( -1.651 26.597 -0.474) 26.653 4.243 ( 6.570 21.971 3.387) 23.181 4.563 ( -5.508 3.097 8.484) 10.579 4.626 ( -7.064 6.963 -0.389) 9.926 4.974 ( 8.580 5.158 11.034) 14.899 5.269 ( 16.418 -6.150 -16.660) 24.186 5.693 ( -6.052 1.105 -3.858) 7.261 5.748 ( -1.339 1.613 5.422) 5.813 6.233 ( -7.480 -3.291 1.922) 8.395 6.536 ( 8.877 -7.786 8.517) 14.559 6.862 ( -3.655 3.635 7.116) 8.787 7.038 ( 3.684 3.684 -15.312) 16.174 7.240 ( -10.238 2.562 -4.355) 11.417 7.284 ( -4.654 5.408 5.126) 8.785 7.396 ( -4.824 4.774 3.758) 7.758 7.734 ( 7.764 0.822 -13.644) 15.720 7.806 ( 4.058 6.134 -1.631) 7.533 7.929 ( 12.072 1.274 -5.305) 13.248 8.238 ( -3.886 6.529 4.985) 9.088 8.371 ( -0.463 15.565 -2.520) 15.775 8.845 ( -9.839 -6.255 2.048) 11.838 8.933 ( -3.051 -10.864 6.168) 12.860 9.408 ( -1.774 0.050 13.383) 13.501 9.472 ( -2.537 -5.187 -3.740) 6.880 9.545 ( -8.672 -0.671 2.988) 9.197 9.723 ( 0.504 -6.219 -2.611) 6.764 9.814 ( 2.347 -7.970 -4.939) 9.665 9.861 ( 1.495 -0.021 -1.114) 1.864 10.136 ( -1.254 -1.852 3.771) 4.384 10.176 ( -0.365 1.036 -0.573) 1.239 10.211 ( 4.346 3.763 3.713) 6.843 10.280 ( 0.707 -3.923 -3.148) 5.079 10.607 ( -3.243 4.675 -2.446) 6.193 10.796 ( 5.592 4.131 -0.813) 7.000 10.970 ( -1.845 6.243 0.184) 6.513 11.005 ( 0.733 7.582 -0.935) 7.675 11.093 ( -2.143 3.175 1.233) 4.024 11.319 ( 3.917 -4.089 -6.520) 8.635 11.528 ( -3.166 4.765 6.555) 8.700 11.633 ( 1.799 16.601 -7.235) 18.198 11.710 ( -1.983 -1.233 0.097) 2.337 11.721 ( 2.079 12.626 -0.693) 12.815 11.966 ( -1.099 3.307 -8.652) 9.327 12.007 ( 4.690 0.877 2.912) 5.590 12.084 ( 9.325 7.926 8.885) 15.124 12.128 ( 8.222 -4.842 1.499) 9.659 12.565 ( -1.849 1.284 -0.915) 2.430 12.654 ( 2.437 -3.208 0.645) 4.080 12.748 ( 2.824 -3.048 -0.162) 4.158 12.759 ( 2.366 -1.459 3.196) 4.236 13.049 ( -0.241 -1.022 2.387) 2.607 13.102 ( 3.497 8.128 -2.205) 9.119 13.391 ( -3.694 -8.877 -4.647) 10.679 13.482 ( 2.347 -3.338 2.981) 5.054 13.641 ( -3.884 6.950 -2.982) 8.502 13.764 ( 2.273 -0.448 2.694) 3.553 13.935 ( -1.364 2.499 2.878) 4.048 14.057 ( 1.237 4.048 -3.367) 5.408 14.077 ( -2.152 3.405 1.037) 4.159 14.321 ( 3.614 -2.683 -4.228) 6.175 14.586 ( -6.540 -10.465 -11.157) 16.636 14.648 ( 1.889 -13.702 14.147) 19.785 14.772 ( -1.881 -1.999 -0.242) 2.755 14.833 ( -0.617 -2.576 0.424) 2.682 15.218 ( -1.809 -3.268 -3.499) 5.118 15.372 ( 4.323 -8.320 4.550) 10.421 15.603 ( -1.505 -8.463 6.663) 10.876 15.705 ( -1.211 -7.294 4.800) 8.815 15.880 ( -3.614 1.639 4.214) 5.788 15.961 ( -6.429 1.740 8.498) 10.797 16.174 ( 7.644 1.372 -4.247) 8.851 16.291 ( 2.781 -1.662 -17.587) 17.883 16.975 ( 1.705 -1.298 -0.206) 2.153 17.072 ( 6.513 -8.183 -8.340) 13.377 18.532 ( -4.094 -3.533 5.881) 7.989 18.631 ( -1.398 -5.813 -0.037) 5.979 19.390 ( 2.025 4.931 -0.098) 5.331 19.428 ( 4.015 2.211 -0.414) 4.602 22.332 ( -5.324 13.545 -9.882) 17.592 22.493 ( 8.302 10.948 12.388) 18.500 23.967 ( -4.832 -7.329 -13.079) 15.752 24.082 ( 6.584 -9.010 11.471) 16.004 ======================= Grid point 216 (108/130) ======================= q-point: (-0.30 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.296 ( -23.963 9.056 -5.876) 26.283 2.508 ( -19.305 14.742 9.155) 25.959 2.819 ( -5.036 15.349 -6.741) 17.504 2.954 ( -5.719 4.154 -15.262) 16.820 3.300 ( -5.981 11.686 1.929) 13.268 3.560 ( -2.873 2.431 8.252) 9.069 3.933 ( -2.097 15.128 -7.643) 17.078 4.075 ( 2.722 2.456 5.808) 6.868 4.169 ( 2.738 11.440 1.478) 11.855 4.344 ( 1.091 0.475 -1.109) 1.627 4.517 ( -1.594 3.889 0.442) 4.226 4.658 ( 6.967 12.110 15.215) 20.657 5.227 ( 6.829 3.665 8.408) 11.435 5.434 ( 5.908 3.718 -11.378) 13.349 5.589 ( 7.489 -4.843 -10.932) 14.109 5.775 ( -0.618 0.133 7.871) 7.896 6.093 ( -7.911 -1.837 0.066) 8.122 6.677 ( -10.981 1.653 2.039) 11.290 6.818 ( 6.585 -4.765 8.479) 11.746 7.008 ( 7.501 1.978 -20.297) 21.729 7.104 ( -6.784 13.571 9.585) 17.946 7.241 ( -0.526 11.958 -1.598) 12.076 7.342 ( -4.261 5.807 3.972) 8.225 7.627 ( -5.013 -1.489 -14.271) 15.199 7.908 ( 6.141 3.310 -4.237) 8.162 8.099 ( 7.297 -4.492 -6.413) 10.703 8.234 ( 2.177 8.238 2.846) 8.983 8.361 ( 2.262 9.877 -3.184) 10.621 8.662 ( -13.169 -6.300 5.182) 15.491 8.891 ( -4.874 -13.331 4.422) 14.867 9.322 ( -13.565 -1.778 5.445) 14.725 9.384 ( -4.929 -6.327 -2.564) 8.420 9.493 ( -2.253 3.346 10.577) 11.320 9.719 ( 1.879 -8.526 -4.794) 9.960 9.827 ( 2.733 -7.655 -3.812) 8.978 9.860 ( -1.148 0.233 2.057) 2.368 10.181 ( 2.997 3.827 -2.271) 5.365 10.199 ( 1.597 -1.064 3.325) 3.839 10.257 ( -1.374 -6.581 4.653) 8.176 10.322 ( 4.501 1.040 3.123) 5.576 10.549 ( -0.548 5.971 -1.925) 6.298 10.876 ( 3.226 3.505 -1.029) 4.873 10.956 ( 0.744 3.144 -2.926) 4.359 10.995 ( -0.180 4.787 -1.661) 5.071 11.054 ( -2.969 6.983 0.494) 7.605 11.265 ( -0.767 -7.415 -15.678) 17.360 11.485 ( -3.039 5.970 2.351) 7.100 11.615 ( -0.778 7.473 -1.019) 7.582 11.718 ( 1.701 2.836 1.509) 3.635 11.801 ( 4.617 9.823 1.764) 10.996 11.973 ( 5.471 9.029 -0.555) 10.572 12.141 ( 5.735 -1.468 3.345) 6.800 12.302 ( 6.683 -1.521 5.656) 8.887 12.314 ( 7.898 3.668 4.535) 9.818 12.586 ( 3.664 1.732 3.188) 5.156 12.694 ( 1.610 -4.799 2.482) 5.637 12.819 ( 3.062 -0.771 2.901) 4.288 12.897 ( 9.518 -6.058 1.501) 11.381 13.068 ( 0.715 -0.768 3.399) 3.557 13.136 ( 1.221 -4.124 -7.853) 8.953 13.326 ( 1.323 7.608 -1.011) 7.788 13.490 ( -0.454 1.979 -4.833) 5.242 13.602 ( 0.696 1.810 1.460) 2.427 13.786 ( -0.326 -1.962 -1.062) 2.255 13.896 ( -3.111 5.532 -1.020) 6.428 13.988 ( -3.054 1.381 3.671) 4.971 14.098 ( 1.655 3.110 -9.340) 9.983 14.330 ( -4.613 -5.444 -2.013) 7.414 14.402 ( -0.914 -3.670 -8.637) 9.429 14.726 ( 0.519 -5.183 1.022) 5.308 14.788 ( 3.065 -6.275 6.265) 9.381 14.818 ( -5.181 1.971 6.504) 8.546 15.125 ( -3.976 1.967 -7.380) 8.610 15.441 ( -2.626 -8.207 8.256) 11.934 15.633 ( -2.021 -10.831 8.675) 14.023 15.693 ( -5.137 -7.358 8.641) 12.458 15.880 ( -0.506 1.741 6.922) 7.155 15.927 ( 2.055 -2.414 -3.713) 4.882 16.196 ( 1.944 -0.928 -15.033) 15.187 16.300 ( 6.465 -1.923 -3.323) 7.519 17.049 ( 5.971 -2.320 1.224) 6.522 17.172 ( 12.738 -11.186 -13.417) 21.619 18.490 ( -5.242 -4.480 6.926) 9.774 18.597 ( -3.746 -6.680 3.824) 8.561 19.441 ( 3.121 5.388 0.039) 6.227 19.505 ( 4.052 1.867 -0.453) 4.485 22.177 ( -4.937 17.036 -6.801) 18.996 22.797 ( 13.936 7.269 15.153) 21.832 23.752 ( -7.670 -4.509 -15.995) 18.303 24.278 ( 6.618 -10.866 7.868) 14.959 ======================= Grid point 217 (109/130) ======================= q-point: (-0.20 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.872 ( -18.433 12.328 3.708) 22.484 2.195 ( -21.495 16.347 13.482) 30.183 2.699 ( -1.663 8.976 -14.114) 16.809 2.728 ( -5.713 12.870 -13.924) 19.803 3.132 ( -12.264 23.256 6.365) 27.051 3.469 ( -9.406 10.868 0.252) 14.375 3.889 ( 1.801 8.262 -0.618) 8.478 4.160 ( 2.822 12.569 2.825) 13.188 4.233 ( 3.281 -1.002 3.466) 4.877 4.339 ( -0.710 1.987 2.426) 3.216 4.560 ( 3.176 0.453 1.798) 3.678 4.914 ( 6.564 13.862 10.278) 18.463 5.168 ( -5.283 7.976 -7.808) 12.349 5.538 ( 5.141 2.784 4.039) 7.106 5.735 ( 10.795 -7.937 -15.558) 20.533 5.783 ( -3.588 -0.675 2.537) 4.446 6.021 ( 1.367 0.968 9.272) 9.422 6.420 ( -12.253 4.299 1.312) 13.051 6.961 ( -0.977 10.992 4.678) 11.986 7.025 ( -0.174 10.094 -4.532) 11.066 7.164 ( 9.943 -7.207 5.217) 13.342 7.202 ( -3.469 6.686 -5.084) 9.088 7.235 ( -2.810 11.150 -8.916) 14.550 7.510 ( 0.412 7.801 -0.106) 7.813 7.969 ( 4.882 -3.140 -6.910) 9.025 8.090 ( -3.314 -7.125 -4.393) 9.002 8.283 ( -3.101 -3.609 -1.575) 5.012 8.390 ( -7.569 3.546 -1.967) 8.586 8.466 ( 4.401 2.722 -0.970) 5.265 8.818 ( -4.958 -15.293 1.126) 16.116 9.061 ( -16.800 -3.419 5.827) 18.108 9.260 ( -6.965 -1.865 0.063) 7.211 9.516 ( -0.919 3.476 5.045) 6.195 9.712 ( 2.135 -5.676 -8.477) 10.422 9.849 ( -2.718 -1.479 6.321) 7.038 9.888 ( 2.137 -8.432 4.504) 9.795 10.122 ( -5.040 -2.817 -2.657) 6.356 10.255 ( 2.900 4.542 0.869) 5.459 10.355 ( 4.344 -2.164 3.804) 6.166 10.470 ( 7.606 -5.236 10.543) 14.015 10.563 ( 2.160 4.175 0.960) 4.798 10.878 ( -1.442 4.893 -1.217) 5.245 10.952 ( 0.846 5.391 -5.272) 7.588 10.985 ( -1.278 5.050 -3.247) 6.138 11.019 ( 1.727 1.516 2.161) 3.155 11.139 ( 0.727 -3.685 -16.400) 16.824 11.454 ( -1.319 7.587 -0.340) 7.709 11.593 ( -1.701 3.340 1.312) 3.971 11.779 ( 3.667 3.182 1.172) 4.995 11.908 ( 3.543 6.338 4.757) 8.681 12.109 ( 6.854 8.904 3.283) 11.706 12.253 ( 3.628 -3.123 2.980) 5.639 12.429 ( 4.581 -3.788 0.541) 5.969 12.462 ( 4.472 2.065 7.970) 9.369 12.680 ( 3.853 2.094 -1.717) 4.709 12.742 ( -1.320 -6.133 5.392) 8.273 12.919 ( 3.804 1.945 7.837) 8.926 12.942 ( -2.893 -10.317 -10.756) 15.183 13.101 ( 0.351 2.134 3.853) 4.419 13.223 ( 11.558 -6.741 1.241) 13.438 13.404 ( 6.373 12.942 -2.685) 14.673 13.488 ( 4.896 -3.887 -4.369) 7.627 13.632 ( 0.960 1.744 0.754) 2.129 13.759 ( 0.104 -1.138 -4.864) 4.997 13.834 ( -2.108 4.854 -0.340) 5.303 13.991 ( 0.495 5.385 -2.551) 5.980 14.017 ( -2.004 2.190 -4.043) 5.016 14.196 ( -4.982 3.262 -0.800) 6.008 14.372 ( 0.507 -3.874 -7.723) 8.655 14.699 ( -5.811 -3.479 -0.552) 6.796 14.736 ( -6.325 0.239 4.923) 8.018 14.884 ( 1.041 -4.214 3.984) 5.892 15.011 ( 0.714 8.429 -7.723) 11.454 15.395 ( -8.850 -6.498 10.117) 14.930 15.601 ( -7.066 -10.463 12.484) 17.756 15.680 ( -1.555 -7.942 6.300) 10.256 15.920 ( 1.056 -0.936 -1.198) 1.851 15.958 ( 2.141 -1.739 -1.670) 3.224 16.175 ( 6.120 -2.241 -11.188) 12.948 16.382 ( 3.011 -4.567 -1.174) 5.594 17.228 ( 11.687 -5.728 2.759) 13.305 17.398 ( 22.586 -15.725 -17.632) 32.685 18.414 ( -8.091 -5.324 6.617) 11.730 18.529 ( -7.765 -7.597 7.009) 12.928 19.499 ( 2.482 4.952 0.864) 5.606 19.565 ( 2.018 1.505 0.616) 2.591 22.061 ( -3.302 21.449 -2.596) 21.856 23.218 ( 17.348 5.654 11.549) 21.594 23.447 ( -10.795 -3.251 -14.754) 18.569 24.424 ( 4.023 -12.711 3.584) 13.806 ======================= Grid point 218 (110/130) ======================= q-point: (-0.10 0.25 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.698 ( -6.567 11.271 17.099) 21.506 1.920 ( -17.087 15.405 17.882) 29.138 2.491 ( -2.004 3.268 -24.895) 25.188 2.594 ( -2.909 13.447 -13.358) 19.176 3.003 ( -6.525 30.439 10.336) 32.802 3.267 ( -7.530 16.768 -6.146) 19.381 3.986 ( 4.842 8.767 7.227) 12.351 4.241 ( 2.476 15.928 3.483) 16.491 4.321 ( 2.343 1.010 4.407) 5.092 4.362 ( 2.053 1.299 3.351) 4.139 4.606 ( -0.105 2.886 0.902) 3.026 4.864 ( -6.514 17.136 -8.963) 20.406 5.209 ( 5.706 4.124 3.658) 7.934 5.533 ( -7.931 1.988 -0.997) 8.237 5.664 ( -1.294 -2.592 2.493) 3.822 5.878 ( 10.074 -6.837 -15.203) 19.477 6.217 ( 5.642 7.084 18.006) 20.155 6.324 ( 0.399 1.536 9.303) 9.438 6.919 ( -5.743 10.048 13.907) 18.093 6.988 ( -3.529 1.066 -12.091) 12.641 7.012 ( 2.350 7.211 -18.649) 20.133 7.210 ( 2.581 15.436 -2.253) 15.811 7.365 ( 2.505 4.095 1.919) 5.169 7.595 ( 5.522 1.824 4.163) 7.152 7.783 ( -25.446 -5.998 2.628) 26.275 8.013 ( 4.289 -4.111 -10.872) 12.389 8.178 ( 4.196 -9.769 -3.596) 11.223 8.418 ( 9.052 1.203 -11.183) 14.437 8.443 ( -12.432 -1.243 5.142) 13.510 8.666 ( -11.043 -13.100 2.831) 17.366 8.936 ( 4.469 0.847 -2.318) 5.105 9.122 ( -8.707 2.116 3.355) 9.568 9.533 ( -0.002 1.065 2.328) 2.560 9.690 ( 0.823 -5.712 -7.445) 9.420 9.817 ( -5.125 -1.991 7.929) 9.649 9.954 ( -0.651 -6.583 8.418) 10.706 10.012 ( -4.849 -3.112 0.787) 5.815 10.296 ( 2.318 3.199 -4.973) 6.351 10.457 ( 3.402 2.987 6.688) 8.076 10.622 ( 2.523 0.507 2.670) 3.708 10.713 ( 7.786 -6.963 6.187) 12.140 10.841 ( -3.275 6.883 2.193) 7.931 10.890 ( -1.959 6.912 -1.157) 7.276 10.980 ( 3.640 1.064 -9.409) 10.144 11.085 ( 4.871 -0.835 -4.650) 6.786 11.117 ( 4.770 -1.068 0.642) 4.930 11.422 ( -0.796 8.528 -2.896) 9.041 11.560 ( -3.047 2.513 1.149) 4.113 11.864 ( 4.171 2.471 1.223) 5.000 11.980 ( 0.446 3.825 4.850) 6.192 12.256 ( 6.093 6.001 1.781) 8.735 12.320 ( 1.011 -3.026 3.989) 5.108 12.509 ( 3.097 0.984 2.351) 4.011 12.557 ( -1.963 7.091 0.667) 7.388 12.670 ( -2.334 -7.102 -0.309) 7.482 12.725 ( 1.306 -4.401 -2.417) 5.188 12.847 ( -0.903 -5.193 -1.230) 5.412 13.046 ( 3.293 0.250 6.510) 7.300 13.118 ( -1.268 -2.784 3.741) 4.833 13.379 ( 2.720 3.915 -3.317) 5.807 13.496 ( 5.447 0.833 -1.803) 5.798 13.596 ( 5.794 -10.326 -2.009) 12.010 13.652 ( 2.474 1.641 -1.442) 3.300 13.722 ( 0.643 1.407 -6.528) 6.708 13.837 ( 2.524 3.585 -0.357) 4.399 13.921 ( -0.149 2.918 -4.527) 5.388 14.067 ( 2.719 8.668 2.275) 9.364 14.120 ( -2.982 11.146 0.571) 11.552 14.322 ( 1.814 0.114 -9.380) 9.554 14.546 ( -9.975 0.774 1.844) 10.173 14.657 ( -2.268 -6.996 -0.668) 7.385 14.781 ( -10.389 -6.675 0.245) 12.351 15.131 ( 12.894 8.850 -5.369) 16.535 15.273 ( -10.854 -7.087 11.821) 17.543 15.594 ( -1.552 -6.964 8.272) 10.924 15.696 ( -0.554 -7.074 3.591) 7.953 15.915 ( 1.543 -1.108 -4.310) 4.710 15.963 ( -1.274 -1.688 0.160) 2.121 16.248 ( 6.482 -5.511 -5.454) 10.106 16.383 ( -2.637 -5.126 0.069) 5.765 17.520 ( 14.945 -11.606 4.917) 19.550 17.749 ( 23.288 -22.151 -14.266) 35.164 18.274 ( -8.969 -3.744 2.992) 10.169 18.381 ( -12.702 -6.798 6.552) 15.827 19.544 ( 1.229 3.645 1.915) 4.297 19.587 ( -0.791 1.418 2.191) 2.727 22.045 ( 2.338 25.988 2.978) 26.263 22.963 ( -18.372 16.850 -21.081) 32.648 23.756 ( 20.651 -11.687 13.875) 27.487 24.458 ( -1.929 -14.289 -0.921) 14.448 ======================= Grid point 219 (111/130) ======================= q-point: ( 0.00 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.980 ( 3.316 6.562 9.529) 12.036 2.133 ( -0.305 12.549 6.589) 14.177 2.317 ( -3.560 -7.368 -19.638) 21.274 2.395 ( 5.076 0.181 -18.368) 19.057 3.616 ( 0.926 22.347 3.801) 22.687 3.659 ( -2.053 20.127 -1.295) 20.273 4.203 ( -0.036 3.210 8.251) 8.853 4.303 ( -0.916 -0.736 -0.893) 1.476 4.486 ( 6.315 -0.682 9.324) 11.282 4.552 ( -1.252 -2.829 3.939) 5.009 4.811 ( 0.416 15.502 5.204) 16.358 4.985 ( -5.236 8.728 -9.791) 14.123 5.367 ( -2.013 8.290 4.510) 9.650 5.489 ( -0.621 5.697 -5.777) 8.137 5.659 ( 0.868 -0.411 0.888) 1.308 5.779 ( 2.382 -7.275 -11.081) 13.468 6.477 ( 5.081 1.368 12.455) 13.521 6.638 ( 2.747 5.565 5.539) 8.318 6.810 ( -1.501 0.591 -1.156) 1.985 7.020 ( -6.031 3.268 -11.548) 13.432 7.066 ( 1.565 -1.663 7.899) 8.223 7.171 ( -5.422 -4.973 -1.870) 7.592 7.496 ( -2.385 7.161 0.263) 7.552 7.582 ( 6.985 7.877 -6.219) 12.228 7.808 ( -0.112 2.530 1.481) 2.934 7.908 ( 1.866 -5.439 -8.239) 10.047 8.090 ( 9.587 -8.981 2.065) 13.297 8.179 ( -8.612 -8.045 -5.708) 13.095 8.372 ( -11.468 13.124 13.526) 22.062 8.674 ( 12.610 7.822 -14.471) 20.727 9.040 ( -10.849 3.931 6.248) 13.122 9.158 ( 11.891 3.039 -5.089) 13.287 9.474 ( -5.041 -4.858 1.926) 7.261 9.494 ( -3.669 -4.469 0.085) 5.782 9.794 ( -2.081 -4.084 14.397) 15.109 9.836 ( -2.702 -4.540 11.553) 12.704 9.987 ( 1.227 2.944 -7.159) 7.838 10.150 ( 1.400 -8.334 -11.705) 14.437 10.584 ( 0.500 -1.817 9.117) 9.310 10.652 ( -0.484 -3.230 1.817) 3.737 10.755 ( 3.783 -0.551 0.793) 3.904 10.808 ( -0.337 -5.069 -0.166) 5.083 11.065 ( 2.331 4.753 -1.067) 5.400 11.096 ( -0.052 10.889 -1.758) 11.030 11.213 ( -0.226 7.787 1.923) 8.024 11.258 ( 4.775 10.343 -2.629) 11.692 11.587 ( -0.832 7.449 3.197) 8.149 11.617 ( -0.684 5.530 0.639) 5.608 11.924 ( -3.267 -3.648 1.200) 5.042 12.015 ( 1.829 2.766 -7.641) 8.329 12.158 ( -1.959 -15.257 4.140) 15.930 12.267 ( -0.154 -12.774 -4.799) 13.646 12.563 ( 2.683 1.518 6.064) 6.802 12.593 ( -1.238 1.219 1.286) 2.161 12.642 ( 3.747 1.226 4.962) 6.337 12.753 ( -2.798 1.644 -2.919) 4.366 12.828 ( 3.425 3.614 1.002) 5.079 12.938 ( -5.140 -3.012 -5.516) 8.118 13.117 ( 3.053 -1.358 7.756) 8.445 13.321 ( -6.030 -2.907 -5.891) 8.917 13.398 ( -0.255 -10.070 -2.624) 10.409 13.446 ( 3.922 -9.273 -6.591) 12.034 13.789 ( -0.056 7.321 2.112) 7.619 13.806 ( 1.512 7.636 0.117) 7.785 14.042 ( 2.545 7.284 0.102) 7.716 14.080 ( -2.044 9.235 -2.926) 9.900 14.225 ( 0.906 4.159 1.652) 4.566 14.273 ( -0.853 3.990 -2.599) 4.838 14.314 ( 4.728 -3.682 0.216) 5.996 14.355 ( -6.736 -1.295 -3.070) 7.515 14.591 ( 0.158 2.529 3.582) 4.388 14.657 ( 0.016 3.631 -2.699) 4.524 15.057 ( -5.626 -2.239 10.201) 11.862 15.233 ( 3.129 -7.741 -5.518) 10.008 15.525 ( 1.707 -5.715 5.147) 7.878 15.630 ( 6.079 -5.674 -5.893) 10.192 15.849 ( -0.054 -3.621 0.179) 3.626 15.859 ( 0.627 -4.317 -0.658) 4.412 16.172 ( -0.775 -4.598 0.166) 4.665 16.195 ( -4.692 -4.139 -2.205) 6.634 17.396 ( -11.543 -7.032 12.584) 18.467 17.490 ( -6.119 -11.859 3.098) 13.699 18.231 ( 6.902 1.091 -5.825) 9.097 18.286 ( 11.528 -1.618 -10.525) 15.694 19.611 ( -1.616 1.708 3.804) 4.472 19.617 ( -1.347 1.574 3.210) 3.820 22.697 ( 8.060 19.027 9.248) 22.639 22.911 ( -9.553 13.172 -10.704) 19.477 23.867 ( 9.499 -11.301 6.645) 16.189 24.013 ( -7.976 -14.022 -6.826) 17.516 ======================= Grid point 220 (112/130) ======================= q-point: ( 0.10 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.156 ( 7.552 2.883 6.054) 10.099 2.183 ( 4.100 0.488 -13.611) 14.223 2.336 ( 13.668 6.709 10.041) 18.239 2.483 ( 16.350 1.244 -17.532) 24.005 3.577 ( -3.648 17.882 1.276) 18.295 3.709 ( 4.227 19.900 1.770) 20.421 4.140 ( -9.563 -0.788 -0.498) 9.609 4.242 ( -3.242 -0.337 3.381) 4.697 4.512 ( -1.455 2.739 -3.631) 4.775 4.652 ( 2.423 -1.211 -0.414) 2.740 4.782 ( -6.502 15.452 -0.212) 16.766 4.926 ( 2.624 9.255 7.882) 12.437 5.388 ( -0.173 5.539 6.070) 8.219 5.475 ( 1.881 6.636 -2.573) 7.362 5.672 ( 0.514 1.146 0.296) 1.290 5.706 ( -2.602 -8.578 -8.777) 12.546 6.507 ( -9.385 1.049 -11.162) 14.621 6.629 ( 3.364 0.261 8.242) 8.906 6.823 ( -5.283 6.102 6.556) 10.399 6.895 ( 0.762 6.921 -0.102) 6.964 7.136 ( 0.316 -3.546 4.403) 5.663 7.222 ( 6.424 -4.624 1.129) 7.995 7.489 ( 2.713 8.588 -3.841) 9.792 7.756 ( -5.078 -1.948 -0.476) 5.460 7.779 ( 16.779 1.723 -4.363) 17.423 7.869 ( -1.207 -4.381 -5.671) 7.267 8.027 ( -0.263 -1.193 -5.763) 5.891 8.298 ( 8.115 -9.340 3.599) 12.886 8.339 ( 0.161 14.102 10.393) 17.519 8.826 ( 5.497 11.874 -10.245) 16.618 8.904 ( 1.233 -3.049 1.380) 3.566 9.314 ( 6.946 4.707 -3.923) 9.262 9.412 ( -3.939 -8.450 4.980) 10.570 9.446 ( -4.067 -1.722 8.257) 9.364 9.852 ( -4.254 -6.519 18.198) 19.793 9.880 ( 1.896 -0.866 5.371) 5.761 9.994 ( 4.423 1.232 -6.237) 7.744 10.086 ( 0.107 -7.246 -10.544) 12.794 10.584 ( -4.987 -2.563 1.819) 5.894 10.594 ( -4.974 -2.334 -0.898) 5.567 10.771 ( -0.484 -0.707 -4.341) 4.425 10.837 ( 2.132 -1.002 0.446) 2.398 11.064 ( -0.432 13.985 -1.579) 14.081 11.096 ( 1.087 5.332 -2.203) 5.871 11.205 ( -1.006 0.902 -4.013) 4.234 11.307 ( 3.617 13.709 -4.650) 14.921 11.576 ( -1.862 11.933 3.757) 12.648 11.637 ( 1.323 2.874 1.601) 3.546 11.868 ( -3.255 -4.140 2.050) 5.651 11.983 ( -1.534 -2.010 -2.949) 3.885 12.180 ( 0.589 -15.062 6.540) 16.431 12.242 ( 0.162 -13.318 -2.731) 13.596 12.537 ( -4.624 4.047 -2.354) 6.580 12.586 ( -5.681 2.055 -3.340) 6.903 12.637 ( 0.347 -1.993 2.234) 3.014 12.765 ( 1.244 9.118 2.481) 9.531 12.769 ( -5.948 -4.950 -3.910) 8.670 12.939 ( 3.872 -0.395 4.770) 6.157 13.174 ( -3.496 -2.852 -6.441) 7.864 13.262 ( 1.674 -6.115 10.037) 11.871 13.319 ( -3.922 -5.643 -3.757) 7.832 13.425 ( -0.975 -7.962 -2.458) 8.389 13.785 ( -0.738 6.192 -0.971) 6.311 13.810 ( -2.396 7.349 -2.329) 8.073 13.955 ( -6.432 8.709 0.349) 10.832 14.065 ( -0.427 6.840 -1.297) 6.975 14.195 ( -1.478 -0.042 0.694) 1.634 14.223 ( -3.078 -0.027 -1.692) 3.512 14.357 ( 7.765 7.288 0.823) 10.682 14.512 ( 7.523 -0.189 0.128) 7.527 14.642 ( 4.215 4.374 3.392) 6.957 14.676 ( 4.291 -2.238 -2.078) 5.266 15.018 ( -5.859 0.498 9.299) 11.002 15.253 ( 2.376 -11.359 -2.840) 11.947 15.558 ( -1.665 -6.536 4.072) 7.878 15.654 ( 2.661 -8.090 -13.162) 15.677 15.858 ( 2.978 -0.196 -2.919) 4.174 15.917 ( 4.441 -3.180 -0.845) 5.527 16.074 ( -7.572 -1.912 2.866) 8.319 16.162 ( -2.207 -7.537 5.678) 9.692 17.147 ( -20.614 -3.885 14.972) 25.772 17.292 ( -13.821 -10.851 3.671) 17.951 18.395 ( 13.485 0.821 -10.139) 16.892 18.482 ( 14.022 -3.231 -11.420) 18.370 19.589 ( -3.082 2.186 3.491) 5.145 19.609 ( -2.326 1.217 3.469) 4.351 22.679 ( -7.149 19.359 -8.822) 22.444 22.942 ( 9.328 11.648 11.102) 18.600 23.762 ( -12.009 -8.266 -8.525) 16.888 24.046 ( 4.514 -16.168 5.735) 17.739 ======================= Grid point 221 (113/130) ======================= q-point: ( 0.20 0.38 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.229 ( 10.466 6.845 -9.414) 15.653 2.403 ( 11.970 0.936 5.766) 13.320 2.680 ( 13.982 4.178 7.567) 16.438 2.734 ( 19.766 3.454 -13.128) 23.978 3.528 ( -2.993 12.488 2.549) 13.092 3.829 ( 5.270 12.934 4.631) 14.714 3.926 ( -7.368 1.320 -6.567) 9.958 4.255 ( 2.771 -0.107 2.359) 3.641 4.429 ( -4.548 3.666 -3.125) 6.625 4.519 ( -8.361 0.687 -8.422) 11.887 4.721 ( -4.133 15.478 3.401) 16.378 5.068 ( 3.618 4.877 11.201) 12.741 5.395 ( -1.290 7.918 -1.766) 8.215 5.432 ( -7.377 -1.909 -2.635) 8.063 5.611 ( -1.089 -0.605 -1.494) 1.945 5.741 ( 6.188 0.621 2.394) 6.664 6.251 ( -8.783 3.731 -10.847) 14.447 6.722 ( -0.460 0.362 -0.302) 0.659 6.765 ( -5.815 5.384 15.871) 17.739 6.935 ( 2.868 -3.229 3.246) 5.402 7.121 ( -4.725 2.548 0.917) 5.446 7.274 ( -2.105 4.327 2.791) 5.562 7.570 ( 7.739 2.377 -10.270) 13.078 7.646 ( -1.679 -8.417 1.677) 8.745 7.819 ( 1.564 0.348 -7.155) 7.332 7.978 ( 4.673 9.631 0.223) 10.707 8.195 ( 16.958 -6.682 -4.457) 18.764 8.428 ( 1.484 -8.755 2.609) 9.255 8.485 ( 8.850 18.053 8.655) 21.890 8.764 ( 0.811 5.288 -3.861) 6.597 9.116 ( 15.247 -2.154 -5.327) 16.294 9.302 ( -7.074 0.684 6.208) 9.436 9.430 ( 3.505 -6.924 -2.336) 8.104 9.466 ( -2.331 1.600 13.844) 14.129 9.887 ( -1.781 -5.182 6.063) 8.172 9.966 ( 3.365 -1.438 3.869) 5.326 10.024 ( -0.789 -4.075 -2.621) 4.909 10.059 ( 5.370 -1.138 -3.461) 6.489 10.439 ( -7.814 -2.949 -5.127) 9.800 10.454 ( -7.840 -4.747 -3.119) 9.681 10.726 ( 0.010 4.186 -5.196) 6.673 10.859 ( -0.757 1.956 2.190) 3.032 11.059 ( 0.413 12.438 -1.200) 12.503 11.091 ( 0.442 6.748 -2.421) 7.183 11.147 ( 0.872 0.829 -7.451) 7.548 11.347 ( 3.638 16.126 -4.086) 17.028 11.591 ( -0.515 12.035 6.099) 13.502 11.661 ( 0.935 -1.322 -0.973) 1.889 11.829 ( -2.866 -2.893 3.168) 5.159 11.920 ( -3.386 -4.933 -0.944) 6.057 12.194 ( -1.635 -7.002 -2.020) 7.469 12.275 ( 0.147 -20.311 8.569) 22.046 12.363 ( -6.635 6.607 -6.786) 11.564 12.509 ( -4.012 2.930 -1.052) 5.078 12.570 ( -4.480 -3.309 -3.230) 6.438 12.683 ( -1.628 -5.832 -0.832) 6.112 12.768 ( -2.590 7.092 1.291) 7.659 13.029 ( 0.014 0.048 3.999) 4.000 13.068 ( -4.534 -5.303 -5.018) 8.594 13.201 ( -2.271 -2.562 -5.545) 6.517 13.273 ( -1.821 -6.407 3.135) 7.361 13.499 ( 2.758 -4.349 6.813) 8.540 13.678 ( -6.190 5.704 -1.404) 8.533 13.734 ( -3.274 4.372 -2.479) 5.998 13.921 ( 0.207 7.441 3.232) 8.115 14.034 ( -1.798 5.877 0.614) 6.177 14.165 ( -2.554 1.401 0.308) 2.930 14.202 ( 0.522 1.472 0.637) 1.686 14.459 ( 0.370 12.629 -4.919) 13.558 14.567 ( 4.050 -1.550 2.010) 4.780 14.753 ( 3.441 -5.130 2.532) 6.676 14.845 ( 10.691 1.252 -0.341) 10.770 14.977 ( -2.928 1.725 6.738) 7.546 15.284 ( 1.886 -13.039 -0.429) 13.182 15.495 ( -8.018 -10.446 0.427) 13.176 15.558 ( -5.782 -12.376 -1.137) 13.707 15.905 ( 3.620 3.595 -3.928) 6.439 15.985 ( -2.088 0.928 4.367) 4.929 16.010 ( 6.794 -1.393 -5.468) 8.832 16.163 ( -1.715 -8.074 4.632) 9.465 16.925 ( -10.983 -0.753 10.496) 15.210 17.092 ( -8.363 -9.002 0.901) 12.320 18.543 ( 8.642 0.179 -9.110) 12.558 18.611 ( 6.891 -2.615 -8.847) 11.515 19.541 ( -4.281 2.335 2.872) 5.659 19.573 ( -3.652 0.866 2.729) 4.641 22.531 ( -3.510 19.549 -4.579) 20.383 23.150 ( 3.591 -5.421 6.136) 8.941 23.494 ( -8.641 7.531 -3.952) 12.125 24.118 ( 0.017 -16.440 2.922) 16.697 ======================= Grid point 222 (114/130) ======================= q-point: ( 0.30 0.38 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.431 ( 14.267 8.923 -1.125) 16.866 2.675 ( 12.505 -0.409 4.266) 13.220 2.938 ( 8.947 5.465 4.463) 11.394 2.996 ( 16.359 4.408 -12.308) 20.941 3.487 ( -3.377 7.020 2.113) 8.072 3.739 ( -5.406 -5.076 -4.679) 8.768 3.985 ( 2.378 13.225 1.547) 13.526 4.289 ( -8.883 -0.622 -7.594) 11.703 4.347 ( -1.151 2.766 1.659) 3.425 4.385 ( 8.846 2.337 1.271) 9.238 4.667 ( -3.981 16.651 5.903) 18.110 5.108 ( -5.994 2.410 1.293) 6.588 5.190 ( -10.281 1.135 -6.120) 12.019 5.439 ( 4.520 -0.840 1.438) 4.817 5.597 ( -0.174 12.611 -0.670) 12.630 5.886 ( 5.454 -2.015 2.303) 6.254 6.037 ( -5.935 2.736 -6.709) 9.366 6.580 ( -13.758 -5.697 10.707) 18.340 6.863 ( 3.708 3.652 1.996) 5.574 6.937 ( -1.875 -2.901 0.310) 3.468 7.119 ( 1.138 5.878 11.722) 13.163 7.249 ( -2.864 1.778 4.357) 5.509 7.521 ( 1.128 -4.539 -8.698) 9.876 7.716 ( -1.104 -8.163 -1.806) 8.433 7.848 ( 9.747 12.531 -11.407) 19.548 8.073 ( 3.742 9.563 1.287) 10.349 8.406 ( 7.098 -4.626 -0.319) 8.478 8.435 ( -0.583 2.587 2.585) 3.703 8.721 ( 8.685 14.522 4.425) 17.490 8.821 ( 7.867 -2.306 -7.182) 10.899 9.214 ( -5.044 -2.937 6.795) 8.958 9.354 ( 10.766 -2.242 -0.932) 11.036 9.470 ( 1.042 -4.592 2.695) 5.425 9.536 ( 0.890 -0.419 10.301) 10.348 9.837 ( -1.392 -3.754 -9.719) 10.512 9.991 ( -1.555 4.781 -3.465) 6.106 10.067 ( 1.649 -3.997 7.692) 8.824 10.142 ( 3.736 -5.004 1.504) 6.424 10.259 ( -6.527 -4.469 -3.860) 8.802 10.308 ( -4.426 -4.311 -2.593) 6.700 10.711 ( 2.014 8.108 -4.403) 9.444 10.841 ( -2.465 3.239 1.424) 4.312 11.056 ( 1.440 4.803 -3.462) 6.093 11.080 ( 0.185 6.881 -1.469) 7.038 11.167 ( 4.135 7.549 -2.554) 8.979 11.379 ( 2.402 15.343 -3.772) 15.981 11.632 ( 0.099 11.744 6.632) 13.488 11.667 ( 1.331 -4.131 -2.344) 4.933 11.805 ( -3.308 -5.321 5.590) 8.396 11.856 ( -1.605 -1.696 -1.776) 2.934 12.119 ( -4.293 -0.426 -2.272) 4.876 12.185 ( -5.760 1.451 -3.784) 7.042 12.315 ( -4.672 -8.157 2.482) 9.723 12.420 ( -3.377 -1.184 1.214) 3.778 12.494 ( -1.730 -4.316 -2.924) 5.493 12.646 ( -1.095 -2.837 -2.204) 3.756 12.702 ( -4.211 -0.166 -0.341) 4.228 12.931 ( -5.832 -5.593 -4.262) 9.136 12.991 ( -3.440 1.155 -1.139) 3.803 13.123 ( -0.356 -4.767 -7.409) 8.817 13.347 ( 2.630 -0.198 8.126) 8.543 13.476 ( -3.826 1.301 -0.995) 4.161 13.647 ( -3.896 3.087 -0.419) 4.988 13.675 ( 0.675 -2.572 5.918) 6.488 13.970 ( 1.170 5.208 5.690) 7.801 14.022 ( -0.402 4.309 2.365) 4.932 14.129 ( -1.170 1.072 1.252) 2.021 14.207 ( -0.578 1.794 0.657) 1.996 14.411 ( -1.025 13.651 -1.231) 13.745 14.627 ( 0.492 -2.378 0.119) 2.432 14.760 ( -3.725 -2.152 0.784) 4.373 14.987 ( 5.958 -0.451 -4.218) 7.314 15.060 ( 6.462 -0.794 2.418) 6.945 15.294 ( -11.469 -12.942 3.044) 17.558 15.312 ( 0.095 -15.002 1.497) 15.077 15.449 ( -7.224 -13.154 6.097) 16.198 15.936 ( 1.741 4.887 0.953) 5.275 16.029 ( 4.343 3.224 -1.323) 5.568 16.110 ( 3.703 -0.437 -0.852) 3.825 16.165 ( 4.192 -6.438 -6.885) 10.316 16.865 ( -2.131 -0.473 5.537) 5.952 16.984 ( -3.546 -6.243 -0.381) 7.190 18.599 ( 3.105 0.005 -6.231) 6.962 18.638 ( 2.040 -1.550 -6.016) 6.539 19.471 ( -4.731 2.133 2.354) 5.699 19.513 ( -4.011 0.496 1.381) 4.271 22.477 ( -0.648 17.309 -0.001) 17.321 23.066 ( -7.727 -9.162 -7.983) 14.401 23.491 ( 2.482 11.219 9.905) 15.170 24.097 ( -2.596 -14.944 -0.764) 15.187 ======================= Grid point 223 (115/130) ======================= q-point: ( 0.40 0.38 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.736 ( 14.927 7.289 7.194) 18.102 2.914 ( 9.083 0.015 3.812) 9.851 3.107 ( 6.676 4.785 3.249) 8.833 3.171 ( 10.718 1.722 -12.537) 16.584 3.424 ( -3.536 6.302 -0.717) 7.261 3.616 ( -3.984 -3.487 -9.451) 10.832 3.895 ( -9.350 4.374 3.049) 10.764 4.083 ( -6.827 -3.607 -7.010) 10.428 4.457 ( 6.416 10.538 5.396) 13.466 4.548 ( 4.510 8.996 2.933) 10.482 4.662 ( -2.587 6.430 9.673) 11.899 4.931 ( -4.925 -1.157 -11.174) 12.266 5.029 ( -4.113 10.295 0.698) 11.108 5.393 ( -6.339 7.329 -9.199) 13.360 5.687 ( 6.546 8.659 4.541) 11.767 5.892 ( -1.635 3.293 -3.468) 5.054 6.031 ( 3.146 -6.790 4.433) 8.698 6.399 ( -10.225 -8.698 4.586) 14.186 6.846 ( -2.758 3.586 6.859) 8.217 7.044 ( 2.311 -2.438 12.074) 12.532 7.150 ( -2.054 1.535 -0.026) 2.564 7.299 ( 4.402 -2.341 5.675) 7.554 7.525 ( 5.629 -2.288 -10.579) 12.200 7.647 ( -1.689 -3.568 -6.838) 7.896 7.923 ( 4.213 12.040 -5.415) 13.858 8.080 ( -3.287 11.899 -1.149) 12.398 8.476 ( 2.442 3.243 2.399) 4.716 8.498 ( 3.615 -4.619 0.128) 5.866 8.830 ( -0.747 16.137 6.389) 17.371 8.922 ( 7.571 -2.112 -7.954) 11.183 9.214 ( -0.656 -6.375 7.379) 9.773 9.500 ( 1.345 0.475 7.164) 7.304 9.526 ( 3.763 -5.257 1.512) 6.640 9.625 ( 1.658 -6.575 0.199) 6.784 9.737 ( 0.904 1.782 -8.896) 9.117 9.903 ( -5.364 3.181 -1.376) 6.386 10.111 ( -0.508 -0.962 3.804) 3.956 10.164 ( -1.770 -4.124 -2.637) 5.205 10.178 ( 0.355 -4.369 -3.280) 5.475 10.274 ( -0.215 -2.781 3.264) 4.294 10.736 ( 2.608 7.336 -2.838) 8.287 10.794 ( -1.946 4.058 -0.804) 4.572 11.069 ( 2.911 -0.054 -4.217) 5.124 11.090 ( 0.898 2.694 0.119) 2.842 11.236 ( 3.337 12.247 0.075) 12.694 11.380 ( 0.269 14.383 -3.612) 14.832 11.667 ( -1.062 5.636 5.722) 8.102 11.712 ( 2.992 1.721 1.847) 3.915 11.764 ( -2.929 -6.350 4.265) 8.191 11.855 ( 1.647 -0.113 -1.713) 2.379 12.028 ( -3.258 6.566 -0.986) 7.396 12.065 ( -4.540 3.585 -2.101) 6.155 12.196 ( -5.874 6.087 -1.381) 8.571 12.344 ( -4.523 -6.052 -4.239) 8.663 12.471 ( -0.227 -7.572 1.060) 7.649 12.615 ( 0.725 -2.519 -5.370) 5.976 12.643 ( -1.836 -5.120 0.982) 5.527 12.779 ( -5.813 0.339 -6.298) 8.577 12.938 ( -2.287 -2.396 2.506) 4.154 13.092 ( 1.939 -5.964 -7.153) 9.513 13.414 ( -0.290 2.763 2.457) 3.709 13.446 ( -0.976 1.458 5.725) 5.988 13.597 ( -0.531 -0.618 1.154) 1.413 13.707 ( -1.141 -3.219 3.408) 4.825 14.006 ( -1.822 3.318 6.745) 7.734 14.071 ( 3.266 2.850 3.595) 5.632 14.143 ( 1.057 -0.844 -0.100) 1.356 14.202 ( -0.561 -2.192 2.774) 3.580 14.417 ( 0.726 14.345 2.441) 14.569 14.611 ( -1.623 0.846 1.812) 2.576 14.673 ( -3.557 -1.834 -3.840) 5.546 14.985 ( -2.751 -5.736 -6.489) 9.087 15.133 ( -6.367 -12.221 6.589) 15.274 15.176 ( 3.994 0.168 -3.015) 5.007 15.331 ( -1.310 -15.325 4.946) 16.156 15.402 ( 0.445 -13.469 0.599) 13.489 15.985 ( 0.271 3.541 5.775) 6.780 16.090 ( -1.344 0.642 1.093) 1.847 16.107 ( 2.038 3.361 -0.463) 3.958 16.247 ( 9.515 -2.324 -14.443) 17.450 16.886 ( 0.972 -1.566 1.731) 2.528 16.938 ( -1.110 -4.023 -0.783) 4.246 18.589 ( -0.908 0.431 -1.506) 1.811 18.623 ( 0.316 -1.130 -4.133) 4.296 19.410 ( -2.791 1.587 1.712) 3.638 19.451 ( -2.557 0.253 -0.106) 2.572 22.498 ( 1.327 14.825 3.575) 15.308 22.872 ( -5.864 0.721 -8.910) 10.691 23.615 ( 2.616 1.818 10.848) 11.306 24.021 ( -3.336 -12.890 -4.200) 13.961 ======================= Grid point 224 (116/130) ======================= q-point: (-0.50 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.013 ( 1.352 3.170 6.185) 7.080 3.075 ( 7.047 3.919 11.017) 13.652 3.192 ( 1.357 -3.555 -9.550) 10.280 3.251 ( 3.125 0.582 2.841) 4.263 3.360 ( -1.168 7.701 -9.009) 11.909 3.396 ( -7.881 4.023 -11.607) 14.595 3.831 ( 0.576 0.955 5.334) 5.449 3.963 ( 0.188 -4.210 -6.805) 8.005 4.570 ( 0.930 13.786 4.635) 14.574 4.583 ( -2.083 8.856 7.408) 11.732 4.651 ( -5.008 1.445 5.231) 7.385 4.857 ( 5.136 -0.897 -10.798) 11.991 5.057 ( 3.326 13.898 3.476) 14.707 5.192 ( -5.261 10.886 -8.775) 14.939 5.795 ( 1.194 7.467 2.103) 7.848 5.835 ( -2.179 2.007 -2.096) 3.629 6.144 ( 3.876 -9.169 8.241) 12.924 6.261 ( -5.597 -8.039 -0.496) 9.808 6.888 ( 0.756 4.052 9.518) 10.372 7.093 ( 0.585 -2.125 -2.012) 2.984 7.173 ( -0.435 -1.777 12.067) 12.205 7.358 ( -4.196 -6.235 1.074) 7.592 7.565 ( 6.500 -0.294 -11.657) 13.350 7.612 ( 7.072 -2.441 -12.064) 14.195 7.970 ( 3.287 13.575 -1.504) 14.048 7.986 ( -3.239 12.334 -2.671) 13.029 8.512 ( -1.296 0.376 3.147) 3.424 8.549 ( 1.343 -1.270 -0.833) 2.027 8.810 ( -6.273 9.172 8.760) 14.150 8.971 ( 2.053 4.658 -5.974) 7.848 9.277 ( 0.443 -4.891 11.525) 12.528 9.456 ( -6.581 -3.652 -3.385) 8.253 9.543 ( -3.292 -6.836 5.649) 9.459 9.646 ( 1.328 -5.609 -1.106) 5.869 9.785 ( -2.262 4.110 -1.517) 4.931 9.824 ( 6.734 2.283 -3.916) 8.117 10.103 ( -3.773 -2.851 -0.108) 4.730 10.125 ( 0.223 -4.050 -2.035) 4.538 10.188 ( 1.445 1.880 5.494) 5.984 10.283 ( 0.753 -1.691 -2.547) 3.148 10.728 ( -2.042 3.496 0.811) 4.129 10.800 ( 4.201 3.581 -5.495) 7.789 11.082 ( -2.271 -2.191 -0.338) 3.174 11.109 ( 3.221 -2.535 -2.776) 4.951 11.287 ( 1.876 16.698 1.500) 16.870 11.339 ( -1.600 14.450 -3.852) 15.040 11.663 ( -3.452 -0.367 6.883) 7.709 11.732 ( -4.151 6.411 9.027) 11.824 11.804 ( 4.034 -2.630 -4.754) 6.767 11.883 ( 3.676 -1.857 -3.477) 5.389 12.004 ( 0.442 3.157 2.182) 3.863 12.024 ( 1.781 8.919 -0.683) 9.121 12.120 ( -0.654 10.198 -0.667) 10.241 12.216 ( -3.558 0.806 -6.423) 7.387 12.491 ( 0.857 -8.453 1.599) 8.646 12.585 ( 0.318 -6.113 -7.610) 9.766 12.634 ( -0.333 -3.201 1.950) 3.763 12.669 ( -1.532 -0.179 -2.348) 2.809 12.934 ( -1.069 -4.003 5.039) 6.524 13.080 ( 2.036 -6.647 -7.975) 10.579 13.429 ( -3.143 4.676 3.799) 6.795 13.450 ( 2.710 4.728 1.592) 5.677 13.652 ( 3.267 -4.488 2.815) 6.224 13.683 ( -2.634 -4.180 0.802) 5.006 14.023 ( -0.718 2.797 5.636) 6.332 14.145 ( 1.226 1.733 -2.458) 3.248 14.169 ( 4.001 -2.271 2.647) 5.307 14.211 ( -1.344 -4.335 1.285) 4.717 14.443 ( -0.865 13.315 5.192) 14.318 14.582 ( -1.867 0.359 -6.485) 6.758 14.657 ( 2.614 -0.274 9.105) 9.477 14.849 ( -4.735 -5.297 -7.752) 10.515 15.087 ( -3.223 -8.351 5.852) 10.695 15.215 ( 3.556 -2.559 -5.610) 7.118 15.333 ( -2.330 -16.283 5.774) 17.433 15.439 ( 3.197 -13.458 -3.197) 14.197 15.992 ( -5.352 2.338 8.346) 10.187 16.041 ( -4.937 0.337 7.054) 8.616 16.168 ( 5.855 5.249 -7.364) 10.773 16.293 ( 5.465 -1.406 -13.689) 14.807 16.912 ( 1.121 -2.106 -0.285) 2.403 16.929 ( 1.162 -2.995 -1.706) 3.637 18.554 ( -2.833 0.824 2.078) 3.609 18.596 ( -1.104 -1.177 -1.404) 2.139 19.399 ( 0.800 0.924 0.835) 1.480 19.425 ( 0.481 0.392 -1.313) 1.452 22.574 ( 3.293 12.209 5.833) 13.926 22.723 ( -3.665 7.300 -8.430) 11.738 23.743 ( 3.339 -4.444 10.302) 11.706 23.922 ( -3.025 -10.245 -6.684) 12.601 ======================= Grid point 225 (117/130) ======================= q-point: (-0.40 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.909 ( -15.772 5.532 -3.105) 17.000 2.989 ( -11.012 7.201 -2.972) 13.489 3.058 ( -6.638 -0.507 -7.665) 10.153 3.226 ( -3.843 0.672 -3.096) 4.981 3.363 ( 4.865 3.331 4.022) 7.137 3.444 ( 7.507 0.993 2.219) 7.891 3.948 ( 6.908 0.810 4.753) 8.425 4.008 ( 8.159 -1.672 -6.131) 10.342 4.517 ( -8.898 6.381 5.518) 12.261 4.535 ( -7.153 4.954 -1.323) 8.801 4.691 ( 4.540 10.788 9.376) 14.997 4.862 ( -0.463 10.908 -8.171) 13.636 5.091 ( 7.497 6.509 -1.692) 10.072 5.249 ( 8.500 4.791 1.168) 9.827 5.732 ( -5.721 4.470 -0.123) 7.262 5.828 ( -0.279 6.635 2.231) 7.005 6.130 ( -5.039 -7.233 -2.716) 9.224 6.324 ( 6.799 -12.400 7.650) 16.078 6.959 ( -2.621 5.979 8.826) 10.978 7.099 ( 3.121 2.480 -11.738) 12.397 7.231 ( -0.869 -3.203 5.671) 6.570 7.256 ( -1.578 -4.333 6.962) 8.351 7.579 ( 4.228 5.457 -13.543) 15.201 7.691 ( 6.445 -0.978 -13.005) 14.547 7.908 ( -1.098 4.845 -4.734) 6.863 8.060 ( 4.980 11.631 0.408) 12.659 8.458 ( -6.644 -2.832 3.111) 7.864 8.532 ( -1.747 3.561 -1.534) 4.252 8.731 ( -8.271 -1.555 9.324) 12.560 8.917 ( -4.513 14.288 -0.883) 15.010 9.333 ( -3.070 -5.821 -0.440) 6.596 9.386 ( 0.364 -5.386 11.197) 12.430 9.482 ( -7.850 -4.970 6.868) 11.554 9.544 ( -8.693 -7.658 3.059) 11.982 9.791 ( 3.975 4.917 -8.293) 10.428 9.925 ( 4.078 4.304 -2.632) 6.487 10.042 ( -2.052 -4.697 2.876) 5.878 10.118 ( 0.331 -4.399 1.039) 4.532 10.268 ( 1.090 0.529 -2.445) 2.729 10.277 ( 2.803 0.851 0.662) 3.003 10.695 ( -1.863 4.278 0.192) 4.670 10.851 ( 5.051 0.863 -5.251) 7.337 11.021 ( -2.886 -0.290 0.176) 2.906 11.121 ( -0.601 -6.237 -1.762) 6.509 11.272 ( -2.322 13.355 -4.921) 14.421 11.327 ( 0.637 14.974 1.640) 15.077 11.642 ( -3.610 0.569 5.222) 6.374 11.690 ( -5.124 5.366 6.762) 10.038 11.837 ( 3.497 1.502 -4.682) 6.033 11.940 ( 5.134 -3.267 -5.041) 7.902 12.031 ( 1.541 11.424 -1.816) 11.669 12.066 ( 3.052 -0.140 -1.381) 3.353 12.164 ( 3.610 8.083 2.222) 9.127 12.222 ( 5.590 1.404 2.716) 6.372 12.516 ( 1.502 -6.417 1.236) 6.706 12.548 ( 0.815 -6.744 -4.187) 7.980 12.654 ( 1.270 -3.094 0.445) 3.374 12.689 ( 3.528 -0.257 2.694) 4.446 12.958 ( -0.091 -4.090 4.770) 6.284 13.055 ( 1.167 -6.610 -7.880) 10.351 13.418 ( 0.339 4.975 2.211) 5.455 13.526 ( 3.612 5.337 -0.442) 6.460 13.619 ( -2.831 -5.125 -0.797) 5.909 13.727 ( 2.367 -3.469 0.835) 4.282 14.050 ( 0.027 3.538 3.062) 4.679 14.155 ( -1.203 2.266 -4.263) 4.976 14.163 ( 1.337 0.427 -3.288) 3.575 14.254 ( 2.577 -3.492 1.574) 4.617 14.446 ( -3.278 3.136 1.395) 4.746 14.531 ( 0.002 7.888 2.096) 8.162 14.741 ( 0.401 -0.701 -6.386) 6.437 14.796 ( 2.834 -1.654 9.783) 10.319 15.090 ( -0.483 -9.683 4.992) 10.904 15.243 ( 1.929 -2.790 -2.491) 4.208 15.322 ( -1.360 -17.556 2.235) 17.750 15.465 ( 1.216 -13.775 -1.299) 13.889 15.927 ( -5.220 2.697 4.992) 7.710 15.987 ( -7.039 0.508 9.529) 11.858 16.218 ( 4.801 2.501 -8.046) 9.697 16.271 ( 2.422 -0.390 -12.606) 12.842 16.935 ( 2.480 -2.457 -1.770) 3.915 16.953 ( 2.920 -2.722 -2.888) 4.927 18.511 ( -4.066 0.775 4.237) 5.923 18.561 ( -2.815 -1.564 1.918) 3.748 19.446 ( 3.430 0.774 0.003) 3.516 19.452 ( 3.290 0.591 -1.499) 3.664 22.610 ( -2.616 11.898 -7.173) 14.137 22.706 ( 5.942 8.182 7.020) 12.310 23.815 ( -2.811 -6.208 -8.170) 10.639 23.887 ( 4.729 -8.845 8.663) 13.253 ======================= Grid point 226 (118/130) ======================= q-point: (-0.30 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.509 ( -17.992 10.823 -8.343) 22.593 2.779 ( -14.211 11.054 4.599) 18.582 2.868 ( -6.795 -3.529 -11.283) 13.636 3.081 ( -6.161 1.274 -6.826) 9.283 3.489 ( 4.291 5.697 4.589) 8.481 3.581 ( 3.993 1.460 5.495) 6.948 4.101 ( 3.258 4.040 -7.131) 8.820 4.126 ( 6.575 2.465 7.124) 10.003 4.341 ( -9.351 0.662 2.251) 9.641 4.386 ( -6.654 0.812 0.452) 6.718 4.741 ( -1.478 19.115 -0.479) 19.178 4.948 ( 9.725 11.151 7.430) 16.557 5.282 ( 9.347 0.623 -2.378) 9.665 5.410 ( 8.399 -4.354 -2.035) 9.677 5.628 ( -3.222 7.248 -1.513) 8.075 5.866 ( 2.336 9.822 4.458) 11.037 6.001 ( -5.850 -6.985 -3.550) 9.778 6.537 ( 9.480 -16.002 9.300) 20.795 6.826 ( -12.836 8.642 3.397) 15.842 7.095 ( 4.571 5.148 -8.533) 10.964 7.311 ( 2.951 0.633 4.903) 5.757 7.360 ( 7.268 1.351 0.714) 7.427 7.535 ( 1.780 5.330 -20.320) 21.083 7.625 ( -5.365 11.688 -0.513) 12.871 7.858 ( 0.688 -8.358 -10.682) 13.581 8.114 ( 0.012 7.227 -2.135) 7.536 8.328 ( -10.142 -11.204 5.840) 16.202 8.510 ( 2.530 7.505 -3.407) 8.622 8.638 ( -7.804 -3.808 8.822) 12.378 8.801 ( -7.198 16.554 -0.772) 18.067 9.262 ( -14.591 -3.774 6.016) 16.228 9.302 ( -2.609 -0.331 2.565) 3.674 9.449 ( -1.112 -15.277 -0.513) 15.326 9.524 ( -1.232 -2.469 18.457) 18.662 9.777 ( 1.347 3.060 -9.551) 10.120 9.915 ( -3.721 2.825 3.611) 5.905 10.096 ( 4.210 -4.917 1.584) 6.664 10.155 ( 1.227 -3.807 1.669) 4.334 10.239 ( 0.619 1.956 -3.886) 4.394 10.339 ( 2.640 -1.140 -0.864) 3.003 10.661 ( -1.467 5.082 -0.122) 5.291 10.909 ( 4.173 -0.725 -4.562) 6.225 10.999 ( -0.009 0.452 1.119) 1.207 11.070 ( -4.302 -5.008 1.650) 6.805 11.195 ( -0.333 10.605 -8.184) 13.400 11.326 ( -1.544 15.343 1.086) 15.459 11.607 ( -2.865 1.824 3.975) 5.228 11.643 ( -3.516 3.646 3.635) 6.234 11.874 ( 3.566 2.408 -3.689) 5.668 11.978 ( 3.437 2.832 -7.267) 8.523 12.081 ( 3.852 4.344 0.729) 5.851 12.132 ( 4.040 -1.451 1.505) 4.549 12.292 ( 3.733 2.870 6.831) 8.297 12.317 ( 3.904 -1.075 0.699) 4.109 12.545 ( 0.652 -8.678 -1.937) 8.916 12.619 ( 7.758 -4.978 1.405) 9.324 12.695 ( 3.197 -4.460 -0.682) 5.530 12.821 ( 6.135 0.759 6.116) 8.696 13.002 ( 2.700 -2.497 1.352) 3.918 13.035 ( 2.216 -3.195 -3.129) 4.991 13.460 ( 1.701 1.203 -1.163) 2.386 13.494 ( -2.590 -0.409 -3.039) 4.014 13.645 ( 3.926 1.917 0.073) 4.370 13.747 ( 0.309 -1.852 -1.814) 2.611 14.054 ( -0.206 5.120 -2.979) 5.927 14.098 ( -1.640 8.135 1.837) 8.500 14.176 ( 2.461 1.559 -8.561) 9.043 14.279 ( 1.067 -5.860 -3.332) 6.824 14.369 ( -3.804 11.015 1.939) 11.814 14.579 ( 0.947 0.945 4.909) 5.088 14.764 ( 2.227 -1.145 -0.437) 2.542 14.872 ( -0.253 1.455 5.735) 5.922 15.109 ( -0.559 -6.577 -0.809) 6.650 15.237 ( -1.912 -10.258 3.663) 11.059 15.336 ( 0.267 -13.486 2.586) 13.734 15.466 ( -2.364 -13.198 5.208) 14.384 15.889 ( -0.819 0.901 1.063) 1.617 15.926 ( -4.682 0.868 7.184) 8.619 16.206 ( 1.901 1.298 -12.074) 12.292 16.264 ( 3.963 -1.495 -7.322) 8.459 16.994 ( 5.839 -2.813 -2.938) 7.116 17.010 ( 6.617 -3.945 -5.397) 9.406 18.455 ( -5.678 0.313 5.670) 8.030 18.512 ( -5.053 -2.209 5.020) 7.457 19.510 ( 3.708 1.544 -0.937) 4.125 19.523 ( 3.780 0.275 0.368) 3.808 22.525 ( -1.903 15.543 -4.612) 16.324 22.898 ( 8.888 0.820 7.607) 11.727 23.698 ( -3.363 0.617 -9.162) 9.779 24.033 ( 5.062 -12.018 5.546) 14.171 ======================= Grid point 227 (119/130) ======================= q-point: (-0.20 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.159 ( -13.754 14.438 -3.681) 20.277 2.507 ( -17.236 13.121 4.603) 22.146 2.654 ( -5.639 -5.812 -15.213) 17.234 2.890 ( -8.782 -1.821 -9.406) 12.997 3.554 ( 0.603 15.497 0.264) 15.511 3.716 ( 4.242 9.027 11.986) 15.593 3.982 ( -4.969 5.811 -9.452) 12.158 4.213 ( -1.941 -0.932 6.485) 6.833 4.318 ( 1.882 0.345 7.148) 7.400 4.381 ( 3.982 -1.638 3.251) 5.395 4.743 ( 1.212 17.978 1.038) 18.049 5.175 ( 6.591 4.825 5.017) 9.586 5.305 ( -1.839 7.300 -1.292) 7.638 5.563 ( 9.819 -6.001 -8.808) 14.492 5.620 ( 3.195 3.005 -2.775) 5.190 5.816 ( -6.330 0.533 -4.976) 8.069 6.034 ( 6.261 5.863 9.300) 12.652 6.618 ( -9.907 10.632 4.056) 15.088 6.795 ( 8.884 -16.493 9.655) 21.075 7.116 ( 1.600 1.687 -4.682) 5.228 7.314 ( -3.291 8.201 -8.446) 12.224 7.333 ( -10.892 9.367 -2.722) 14.621 7.481 ( 7.935 4.318 -7.405) 11.681 7.609 ( 3.571 7.388 0.730) 8.238 7.843 ( 5.550 -11.236 -8.678) 15.244 8.024 ( -8.583 -0.096 -2.405) 8.914 8.124 ( -12.746 -5.355 1.020) 13.863 8.500 ( -3.909 -14.229 -3.107) 15.080 8.627 ( 0.635 14.341 6.953) 15.950 8.658 ( -3.710 15.547 -5.958) 17.057 9.000 ( -14.607 -2.788 6.316) 16.157 9.269 ( -5.981 1.620 7.870) 10.016 9.477 ( 5.468 -11.679 -5.023) 13.840 9.619 ( -2.403 0.760 14.608) 14.824 9.732 ( 0.299 -4.418 -4.863) 6.577 9.862 ( -5.917 0.051 7.384) 9.463 10.118 ( -2.652 1.296 -4.214) 5.145 10.178 ( 3.700 -6.914 -2.371) 8.192 10.307 ( 4.871 -0.575 5.072) 7.055 10.399 ( 5.284 -3.400 1.028) 6.367 10.648 ( -0.099 3.713 0.889) 3.819 10.921 ( -2.101 -4.143 -0.559) 4.679 11.008 ( -0.798 0.854 1.224) 1.692 11.032 ( 1.568 -0.011 0.891) 1.804 11.159 ( 2.664 10.400 -8.898) 13.944 11.290 ( -2.912 17.955 1.070) 18.221 11.594 ( -2.111 3.590 5.031) 6.531 11.615 ( -1.029 1.843 1.273) 2.465 11.921 ( 2.812 -0.185 -1.223) 3.072 11.999 ( 4.523 6.423 -8.044) 11.243 12.144 ( 1.320 -6.186 2.307) 6.733 12.246 ( 5.812 2.979 3.856) 7.585 12.338 ( 0.092 -10.169 2.768) 10.539 12.431 ( 3.512 5.403 5.287) 8.336 12.557 ( 2.406 -7.461 -1.058) 7.911 12.708 ( 1.309 -8.407 -4.766) 9.752 12.771 ( 4.394 0.869 1.164) 4.628 12.969 ( 4.639 -1.443 4.931) 6.923 13.086 ( 6.095 -2.691 -1.320) 6.792 13.139 ( 8.135 0.247 0.180) 8.141 13.365 ( -4.147 -2.830 -3.873) 6.341 13.528 ( 2.047 -0.970 0.106) 2.268 13.701 ( 2.159 2.874 -0.862) 3.696 13.741 ( 1.776 -0.510 -3.198) 3.693 14.013 ( -1.432 9.559 -2.906) 10.093 14.120 ( 0.364 5.218 -5.941) 7.916 14.129 ( 2.312 6.052 -2.183) 6.836 14.276 ( 1.315 -2.679 -3.272) 4.429 14.358 ( -0.597 11.579 4.482) 12.430 14.597 ( -1.791 -1.482 0.043) 2.325 14.722 ( -7.324 -2.648 4.095) 8.799 14.867 ( -3.884 1.394 -1.557) 4.410 15.103 ( 4.409 -2.817 -4.221) 6.722 15.206 ( -6.432 -9.844 6.218) 13.302 15.355 ( -0.309 -10.476 7.359) 12.806 15.478 ( -0.709 -10.836 7.798) 13.369 15.880 ( -0.974 -1.203 -0.649) 1.678 15.920 ( -0.859 -1.270 3.206) 3.554 16.175 ( 3.313 1.342 -10.306) 10.908 16.285 ( 2.734 -4.290 -5.958) 7.834 17.126 ( 9.949 -3.613 -1.571) 10.700 17.158 ( 14.904 -6.854 -9.822) 19.120 18.366 ( -7.926 -0.078 5.731) 9.782 18.431 ( -8.032 -2.812 6.573) 10.753 19.566 ( 2.170 1.768 0.601) 2.862 19.585 ( 1.960 0.604 1.490) 2.535 22.485 ( -0.034 18.767 -0.412) 18.772 23.124 ( 8.078 -11.212 6.045) 15.083 23.572 ( -2.048 11.689 -8.504) 14.600 24.137 ( 2.901 -14.267 1.291) 14.616 ======================= Grid point 228 (120/130) ======================= q-point: (-0.10 0.38 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 200 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.961 ( -6.221 13.553 2.974) 15.206 2.234 ( -13.468 13.745 5.457) 20.002 2.464 ( -1.197 -6.368 -19.145) 20.212 2.614 ( -10.620 -4.713 -14.551) 18.621 3.566 ( 0.450 21.608 3.192) 21.847 3.742 ( -4.724 21.193 -1.174) 21.745 4.032 ( 9.631 0.030 6.837) 11.811 4.262 ( 3.127 -3.169 2.860) 5.292 4.374 ( -0.887 0.551 8.705) 8.767 4.502 ( 2.553 -1.073 8.228) 8.681 4.778 ( 1.024 16.309 1.763) 16.436 5.139 ( -3.886 2.905 -8.657) 9.924 5.360 ( 1.237 12.486 4.612) 13.368 5.586 ( -3.734 0.610 -8.292) 9.114 5.628 ( 2.101 -0.684 -0.570) 2.282 5.767 ( 5.786 -3.597 -9.057) 11.334 6.247 ( 8.213 4.640 12.082) 15.328 6.547 ( -1.713 11.769 8.566) 14.657 6.898 ( -3.141 -9.348 -1.248) 9.940 7.072 ( -1.536 -1.555 -2.214) 3.111 7.126 ( -8.006 6.387 1.974) 10.430 7.275 ( 3.209 -1.819 -5.665) 6.760 7.539 ( 4.171 10.736 -7.667) 13.836 7.670 ( -14.032 1.291 4.972) 14.942 7.765 ( 1.252 1.657 -3.083) 3.718 7.895 ( 4.167 -10.388 -7.942) 13.724 7.996 ( -0.283 0.981 -2.120) 2.353 8.371 ( -7.169 -13.360 -3.697) 15.606 8.544 ( -13.442 10.612 10.984) 20.346 8.604 ( 2.254 12.512 -9.569) 15.912 8.966 ( 9.125 1.849 -2.497) 9.639 9.182 ( -8.806 2.225 7.633) 11.865 9.527 ( 1.892 -7.174 -4.737) 8.802 9.582 ( -4.006 1.860 -2.410) 5.031 9.754 ( -3.763 -8.056 14.775) 17.244 9.814 ( -3.750 -3.240 9.293) 10.532 10.038 ( -1.374 3.116 -6.519) 7.355 10.190 ( 2.432 -8.102 -9.755) 12.912 10.459 ( 4.918 -0.895 9.553) 10.781 10.559 ( 6.824 -5.571 6.147) 10.742 10.675 ( 2.244 1.338 1.796) 3.170 10.851 ( -4.921 -5.071 3.341) 7.816 11.027 ( 2.586 2.963 -2.336) 4.574 11.080 ( 2.236 0.278 -0.003) 2.253 11.178 ( 4.464 12.699 -4.260) 14.119 11.238 ( -2.888 17.866 1.045) 18.128 11.586 ( -1.528 5.664 3.217) 6.690 11.619 ( -0.209 2.560 1.786) 3.128 11.950 ( 0.068 -2.187 0.664) 2.286 12.022 ( 3.850 5.747 -9.450) 11.711 12.165 ( -0.756 -11.642 2.595) 11.952 12.308 ( -1.512 -9.489 -0.531) 9.623 12.424 ( 6.749 -0.795 5.012) 8.444 12.528 ( 3.136 1.846 5.584) 6.665 12.611 ( 1.616 -2.069 -0.128) 2.629 12.700 ( 1.931 -6.220 1.060) 6.599 12.830 ( 1.695 6.167 -1.607) 6.595 13.037 ( -0.766 -1.461 2.224) 2.769 13.089 ( -2.343 1.436 -5.547) 6.191 13.306 ( 9.138 -3.701 -1.856) 10.032 13.360 ( 4.334 -11.043 -1.225) 11.926 13.501 ( -3.913 -4.460 -4.118) 7.223 13.750 ( 1.947 6.544 2.229) 7.182 13.774 ( 3.338 3.457 -1.660) 5.084 13.983 ( 1.609 9.122 -1.762) 9.429 14.080 ( 1.198 8.250 -3.756) 9.144 14.201 ( 3.213 3.399 -0.799) 4.745 14.268 ( 0.646 -3.121 -4.447) 5.471 14.357 ( -3.099 8.999 1.383) 9.618 14.515 ( -5.949 -0.935 -0.592) 6.051 14.605 ( -6.067 0.246 4.199) 7.382 14.736 ( -5.671 1.750 -4.230) 7.288 15.108 ( -7.713 -6.102 10.621) 14.475 15.190 ( 6.068 -3.956 -6.664) 9.843 15.435 ( 2.731 -7.229 6.923) 10.375 15.542 ( 3.104 -7.774 3.772) 9.182 15.849 ( -0.808 -3.205 -1.424) 3.599 15.900 ( -2.758 -3.499 1.148) 4.601 16.178 ( 2.250 -1.001 -5.666) 6.178 16.270 ( -0.682 -5.022 -4.586) 6.835 17.334 ( 9.983 -5.541 1.794) 11.558 17.405 ( 14.614 -10.340 -6.684) 19.109 18.247 ( -6.118 0.248 1.890) 6.408 18.302 ( -7.905 -2.183 2.750) 8.649 19.599 ( 0.254 1.776 2.469) 3.052 19.616 ( -0.280 1.121 2.702) 2.938 22.533 ( 3.814 20.703 4.776) 21.587 23.144 ( -6.373 -2.763 -6.836) 9.746 23.628 ( 10.078 3.162 3.157) 11.024 24.143 ( -1.956 -15.320 -3.179) 15.768 ======================= Grid point 229 (121/130) ======================= q-point: ( 0.00 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.140 ( 0.801 -8.395 -7.728) 11.439 2.140 ( 0.801 8.395 -7.729) 11.439 2.337 ( 1.476 -6.245 -5.643) 8.545 2.337 ( 1.476 6.245 -5.643) 8.545 3.874 ( -0.723 -1.062 -0.113) 1.289 3.874 ( -0.723 1.062 -0.113) 1.289 4.268 ( -1.715 -2.703 4.980) 5.920 4.268 ( -1.715 2.703 4.980) 5.920 4.488 ( 4.159 -2.140 7.041) 8.453 4.488 ( 4.159 2.140 7.041) 8.453 5.014 ( -2.079 -4.334 -2.401) 5.373 5.014 ( -2.079 4.334 -2.401) 5.373 5.564 ( 0.028 -5.308 -4.930) 7.244 5.564 ( 0.028 5.308 -4.930) 7.244 5.636 ( -0.214 -3.182 -0.378) 3.212 5.636 ( -0.214 3.182 -0.378) 3.212 6.570 ( 1.527 -6.766 1.890) 7.189 6.570 ( 1.527 6.766 1.890) 7.189 6.957 ( 2.438 -8.682 6.578) 11.162 6.957 ( 2.438 8.682 6.578) 11.162 7.083 ( -6.142 -2.625 -0.498) 6.698 7.083 ( -6.142 2.625 -0.498) 6.698 7.627 ( 1.308 -4.569 -5.082) 6.958 7.627 ( 1.308 4.569 -5.082) 6.958 7.812 ( 2.975 -1.977 -6.751) 7.638 7.812 ( 2.975 1.977 -6.751) 7.638 8.052 ( -1.022 -3.383 -0.321) 3.549 8.052 ( -1.022 3.383 -0.321) 3.549 8.674 ( -1.673 -10.081 2.376) 10.492 8.674 ( -1.673 10.081 2.376) 10.492 9.162 ( 2.857 -4.887 -1.514) 5.860 9.162 ( 2.857 4.887 -1.514) 5.860 9.408 ( -4.372 -1.103 0.322) 4.520 9.408 ( -4.372 1.103 0.322) 4.520 9.753 ( -1.719 -2.636 12.884) 13.263 9.753 ( -1.719 2.636 12.884) 13.263 10.044 ( 0.572 -2.553 -8.170) 8.578 10.044 ( 0.572 2.553 -8.170) 8.578 10.580 ( 0.742 -2.128 4.740) 5.248 10.580 ( 0.742 2.128 4.740) 5.248 10.747 ( 2.121 -0.724 0.281) 2.258 10.747 ( 2.121 0.724 0.281) 2.258 11.115 ( 2.487 -1.615 -0.782) 3.067 11.115 ( 2.487 1.615 -0.782) 3.067 11.507 ( 1.423 -1.619 -0.132) 2.159 11.507 ( 1.423 1.619 -0.132) 2.159 11.653 ( -0.376 -4.762 -0.690) 4.826 11.653 ( -0.376 4.762 -0.690) 4.826 11.849 ( -2.776 -2.202 6.628) 7.516 11.849 ( -2.776 2.202 6.628) 7.516 12.071 ( -1.166 -2.785 -8.783) 9.288 12.071 ( -1.166 2.785 -8.783) 9.288 12.566 ( 0.124 -1.598 0.883) 1.830 12.566 ( 0.124 1.598 0.883) 1.830 12.717 ( 4.986 -4.174 7.110) 9.635 12.717 ( 4.986 4.174 7.110) 9.635 12.931 ( -4.351 -1.735 -3.489) 5.841 12.931 ( -4.351 1.735 -3.489) 5.841 13.186 ( 0.883 -8.155 1.521) 8.343 13.186 ( 0.883 8.155 1.521) 8.343 13.299 ( -0.157 -2.825 -8.129) 8.607 13.299 ( -0.157 2.825 -8.129) 8.607 13.903 ( 0.046 -0.956 3.887) 4.003 13.903 ( 0.046 0.956 3.887) 4.003 14.159 ( 1.158 -3.447 -3.840) 5.288 14.159 ( 1.158 3.447 -3.840) 5.288 14.263 ( 5.298 -1.316 0.673) 5.501 14.263 ( 5.298 1.316 0.673) 5.501 14.318 ( -6.656 -1.581 -0.916) 6.902 14.318 ( -6.656 1.581 -0.916) 6.902 14.678 ( -0.339 -3.030 0.166) 3.053 14.678 ( -0.339 3.030 0.166) 3.053 15.090 ( -1.677 -4.811 3.395) 6.122 15.090 ( -1.677 4.811 3.395) 6.122 15.487 ( 4.084 -4.331 -0.840) 6.012 15.487 ( 4.084 4.331 -0.840) 6.012 15.814 ( 1.092 -0.486 -0.562) 1.321 15.814 ( 1.092 0.486 -0.562) 1.321 16.137 ( -2.965 -0.923 -2.183) 3.796 16.137 ( -2.965 0.923 -2.183) 3.796 17.350 ( -8.442 -2.151 7.884) 11.749 17.350 ( -8.442 2.151 7.884) 11.749 18.256 ( 8.951 -1.267 -8.382) 12.328 18.256 ( 8.951 1.267 -8.382) 12.328 19.632 ( -1.474 -0.198 3.702) 3.990 19.632 ( -1.474 0.198 3.702) 3.990 22.985 ( 1.431 -6.765 2.443) 7.333 22.985 ( 1.431 6.765 2.443) 7.333 23.791 ( -1.381 -5.098 -2.994) 6.071 23.791 ( -1.381 5.098 -2.994) 6.071 ======================= Grid point 231 (122/130) ======================= q-point: ( 0.10 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.183 ( 7.779 -0.458 -4.037) 8.776 2.183 ( 7.779 0.458 -4.037) 8.776 2.457 ( 13.889 -3.831 -4.272) 15.028 2.457 ( 13.889 3.831 -4.272) 15.028 3.842 ( -3.571 -6.368 1.356) 7.426 3.842 ( -3.571 6.368 1.356) 7.426 4.190 ( -5.931 -4.814 2.792) 8.133 4.190 ( -5.931 4.814 2.792) 8.133 4.587 ( 1.545 -4.073 -3.782) 5.769 4.587 ( 1.545 4.073 -3.782) 5.769 4.984 ( -0.402 -3.311 3.428) 4.783 4.984 ( -0.402 3.311 3.428) 4.783 5.497 ( -3.940 -6.558 -1.415) 7.780 5.497 ( -3.940 6.558 -1.415) 7.780 5.659 ( 2.178 -4.123 -0.184) 4.666 5.659 ( 2.178 4.123 -0.184) 4.666 6.584 ( -0.395 -4.914 -2.538) 5.545 6.584 ( -0.395 4.914 -2.538) 5.545 6.897 ( -8.104 -3.638 5.791) 10.604 6.897 ( -8.104 3.638 5.791) 10.604 7.166 ( 8.936 -5.398 3.056) 10.878 7.166 ( 8.936 5.398 3.056) 10.878 7.622 ( -4.536 -6.924 -1.510) 8.414 7.622 ( -4.536 6.924 -1.510) 8.414 7.810 ( 8.420 -2.811 -9.312) 12.865 7.810 ( 8.420 2.811 -9.312) 12.865 8.098 ( 4.749 -6.266 0.248) 7.866 8.098 ( 4.749 6.266 0.248) 7.866 8.716 ( 3.408 -14.709 4.342) 15.711 8.716 ( 3.408 14.709 4.342) 15.711 9.139 ( -1.522 -15.000 -3.161) 15.404 9.139 ( -1.522 15.000 -3.161) 15.404 9.417 ( 0.697 -2.626 7.042) 7.548 9.417 ( 0.697 2.626 7.042) 7.548 9.799 ( -1.078 -3.095 7.829) 8.487 9.799 ( -1.078 3.095 7.829) 8.487 10.021 ( 2.262 -0.762 -5.234) 5.752 10.021 ( 2.262 0.762 -5.234) 5.752 10.552 ( -4.881 -0.953 -1.076) 5.089 10.552 ( -4.881 0.953 -1.076) 5.089 10.794 ( 3.234 -2.692 -2.060) 4.685 10.794 ( 3.234 2.692 -2.060) 4.685 11.126 ( 0.906 -2.237 -5.005) 5.557 11.126 ( 0.906 2.237 -5.005) 5.557 11.509 ( -0.144 -10.845 -2.459) 11.121 11.509 ( -0.144 10.845 -2.459) 11.121 11.649 ( -0.103 -1.730 0.210) 1.746 11.649 ( -0.103 1.730 0.210) 1.746 11.857 ( -2.370 -3.780 9.336) 10.347 11.857 ( -2.370 3.780 9.336) 10.347 12.006 ( -0.933 -2.100 -2.875) 3.681 12.006 ( -0.933 2.100 -2.875) 3.681 12.573 ( -0.150 -0.883 0.280) 0.938 12.573 ( -0.150 0.883 0.280) 0.938 12.685 ( -7.159 -3.531 -5.344) 9.607 12.685 ( -7.159 3.531 -5.344) 9.607 12.923 ( 1.244 -3.069 4.163) 5.320 12.923 ( 1.244 3.069 4.163) 5.320 13.209 ( -0.332 -2.984 1.965) 3.588 13.209 ( -0.332 2.984 1.965) 3.588 13.233 ( -0.730 -8.215 -4.293) 9.297 13.233 ( -0.730 8.215 -4.293) 9.297 13.892 ( -3.535 -1.511 0.351) 3.861 13.892 ( -3.536 1.511 0.351) 3.861 14.109 ( -4.244 -4.623 0.051) 6.276 14.109 ( -4.244 4.624 0.051) 6.276 14.193 ( -0.565 -1.964 -2.668) 3.361 14.193 ( -0.565 1.964 -2.668) 3.361 14.455 ( 8.016 -4.389 2.407) 9.450 14.455 ( 8.016 4.389 2.407) 9.450 14.712 ( 4.063 -1.813 0.234) 4.455 14.712 ( 4.063 1.813 0.234) 4.455 15.062 ( -3.408 -5.322 3.690) 7.318 15.062 ( -3.408 5.322 3.690) 7.318 15.506 ( -0.644 -3.733 -4.733) 6.062 15.506 ( -0.644 3.733 -4.733) 6.062 15.870 ( 5.943 -1.205 -3.808) 7.160 15.870 ( 5.943 1.205 -3.808) 7.160 16.066 ( -5.014 -1.780 5.229) 7.460 16.066 ( -5.014 1.780 5.229) 7.460 17.147 ( -15.932 -3.401 9.407) 18.811 17.147 ( -15.932 3.401 9.407) 18.811 18.428 ( 13.633 -2.096 -11.148) 17.735 18.428 ( 13.633 2.096 -11.148) 17.735 19.617 ( -2.753 -0.482 3.496) 4.476 19.617 ( -2.753 0.482 3.496) 4.476 22.981 ( -2.226 -8.254 -1.821) 8.740 22.981 ( -2.226 8.254 -1.821) 8.740 23.765 ( -0.661 -8.942 1.567) 9.102 23.765 ( -0.661 8.942 1.567) 9.102 ======================= Grid point 233 (123/130) ======================= q-point: ( 0.20 -0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.357 ( 12.034 -4.785 -1.647) 13.055 2.357 ( 12.034 4.785 -1.647) 13.055 2.745 ( 17.195 -1.788 -2.830) 17.518 2.745 ( 17.195 1.788 -2.830) 17.518 3.746 ( -7.399 -8.481 2.281) 11.484 3.746 ( -7.399 8.481 2.281) 11.484 4.167 ( 2.998 -9.084 0.397) 9.574 4.167 ( 2.998 9.084 0.397) 9.574 4.486 ( -6.379 -2.249 -7.010) 9.741 4.486 ( -6.379 2.249 -7.010) 9.741 5.021 ( -0.270 -10.052 4.350) 10.956 5.021 ( -0.270 10.052 4.350) 10.956 5.400 ( -5.536 -1.737 -0.302) 5.810 5.400 ( -5.536 1.737 -0.302) 5.810 5.714 ( 3.767 -4.205 0.433) 5.662 5.714 ( 3.767 4.205 0.433) 5.662 6.487 ( -6.591 -16.629 -5.781) 18.798 6.487 ( -6.591 16.629 -5.781) 18.798 6.858 ( -2.481 -3.460 11.856) 12.597 6.858 ( -2.481 3.460 11.856) 12.597 7.352 ( 8.001 -10.357 1.218) 13.144 7.352 ( 8.001 10.357 1.218) 13.144 7.442 ( -10.484 -5.198 -0.491) 11.712 7.442 ( -10.484 5.198 -0.491) 11.712 7.996 ( 14.863 -10.519 -10.073) 20.809 7.996 ( 14.863 10.519 -10.073) 20.809 8.201 ( 5.713 -10.457 -0.134) 11.917 8.201 ( 5.713 10.457 -0.134) 11.917 8.835 ( 4.275 -8.995 5.412) 11.335 8.835 ( 4.275 8.995 5.412) 11.335 9.133 ( 3.594 -9.242 -1.592) 10.043 9.133 ( 3.594 9.242 -1.592) 10.043 9.461 ( -2.402 -4.150 8.410) 9.680 9.461 ( -2.402 4.150 8.410) 9.680 9.829 ( 0.676 -3.192 3.191) 4.564 9.829 ( 0.676 3.192 3.191) 4.564 10.061 ( 4.020 -1.202 -1.705) 4.529 10.061 ( 4.020 1.202 -1.705) 4.529 10.395 ( -8.510 -0.656 -4.787) 9.786 10.395 ( -8.510 0.656 -4.787) 9.786 10.836 ( 2.740 -4.384 -2.683) 5.824 10.836 ( 2.740 4.384 -2.683) 5.824 11.104 ( 1.844 -2.654 -7.570) 8.231 11.104 ( 1.844 2.654 -7.570) 8.231 11.485 ( 0.414 -15.409 -3.689) 15.849 11.485 ( 0.414 15.409 -3.689) 15.849 11.638 ( -1.438 -2.540 0.540) 2.969 11.638 ( -1.438 2.540 0.540) 2.969 11.875 ( -1.063 -9.419 4.970) 10.703 11.875 ( -1.063 9.419 4.970) 10.703 11.999 ( -1.892 -5.254 7.139) 9.064 11.999 ( -1.892 5.254 7.139) 9.064 12.476 ( -7.183 -4.356 -4.856) 9.704 12.476 ( -7.183 4.356 -4.856) 9.704 12.599 ( 0.017 -3.386 -0.773) 3.473 12.599 ( 0.017 3.386 -0.773) 3.473 12.891 ( -4.237 -5.395 -3.331) 7.626 12.891 ( -4.237 5.395 -3.331) 7.626 13.135 ( -3.120 -3.760 -4.935) 6.945 13.135 ( -3.120 3.760 -4.935) 6.945 13.312 ( 3.221 -9.822 9.007) 13.710 13.312 ( 3.221 9.822 9.007) 13.710 13.771 ( -6.397 -1.831 -3.200) 7.383 13.771 ( -6.397 1.831 -3.200) 7.383 14.071 ( -2.359 -4.526 4.826) 7.025 14.071 ( -2.359 4.526 4.826) 7.025 14.184 ( 0.241 -1.566 -1.415) 2.124 14.184 ( 0.241 1.566 -1.415) 2.124 14.574 ( 3.232 -2.380 2.232) 4.593 14.574 ( 3.232 2.380 2.232) 4.593 14.824 ( 7.312 -7.285 -2.679) 10.664 14.824 ( 7.312 7.285 -2.679) 10.664 15.029 ( -2.633 -7.661 3.555) 8.847 15.029 ( -2.633 7.661 3.555) 8.847 15.391 ( -8.024 -2.227 -1.942) 8.551 15.391 ( -8.024 2.227 -1.942) 8.551 15.973 ( 8.395 -2.221 -6.733) 10.989 15.973 ( 8.395 2.221 -6.733) 10.989 16.032 ( -3.298 -4.207 7.958) 9.587 16.032 ( -3.298 4.207 7.958) 9.587 16.959 ( -8.706 -3.864 6.064) 11.292 16.959 ( -8.706 3.864 6.064) 11.292 18.566 ( 8.110 -1.727 -9.325) 12.479 18.566 ( 8.110 1.727 -9.325) 12.479 19.574 ( -4.053 -0.771 2.565) 4.858 19.574 ( -4.053 0.771 2.565) 4.858 22.896 ( -3.963 -15.541 -3.387) 16.392 22.896 ( -3.963 15.541 -3.387) 16.392 23.776 ( -0.542 -15.900 3.600) 16.312 23.776 ( -0.542 15.900 3.600) 16.312 ======================= Grid point 235 (124/130) ======================= q-point: ( 0.30 -0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.601 ( 13.463 -6.475 1.197) 14.986 2.601 ( 13.462 6.475 1.197) 14.986 3.012 ( 12.293 -1.903 -3.373) 12.888 3.012 ( 12.293 1.903 -3.373) 12.888 3.626 ( -5.412 -5.921 -0.237) 8.025 3.626 ( -5.412 5.921 -0.237) 8.025 4.198 ( -6.134 -7.452 -3.895) 10.408 4.198 ( -6.134 7.452 -3.895) 10.408 4.390 ( 5.910 -1.082 0.398) 6.022 4.390 ( 5.910 1.082 0.398) 6.022 4.980 ( -7.226 -11.456 2.567) 13.786 4.980 ( -7.226 11.456 2.567) 13.786 5.324 ( -0.830 -8.728 -1.163) 8.844 5.324 ( -0.830 8.728 -1.163) 8.844 5.799 ( 4.245 -5.908 0.517) 7.293 5.799 ( 4.245 5.908 0.517) 7.293 6.295 ( -8.679 -17.670 -4.631) 20.223 6.295 ( -8.679 17.670 -4.631) 20.223 6.916 ( -2.674 -0.729 14.954) 15.208 6.916 ( -2.674 0.729 14.954) 15.208 7.271 ( -5.794 -3.271 1.481) 6.816 7.271 ( -5.794 3.271 1.481) 6.816 7.483 ( 5.568 -8.126 -3.672) 10.513 7.483 ( 5.568 8.126 -3.672) 10.513 8.161 ( 8.538 -14.861 -8.702) 19.221 8.161 ( 8.538 14.861 -8.702) 19.221 8.304 ( 5.033 -10.890 -0.270) 12.000 8.304 ( 5.033 10.890 -0.270) 12.000 8.930 ( 3.736 -4.909 1.808) 6.429 8.930 ( 3.736 4.909 1.808) 6.429 9.245 ( 5.655 -8.716 3.101) 10.842 9.245 ( 5.655 8.716 3.101) 10.842 9.453 ( -1.965 -4.682 4.485) 6.775 9.453 ( -1.965 4.682 4.485) 6.775 9.875 ( 1.641 -8.123 2.075) 8.543 9.875 ( 1.641 8.123 2.075) 8.543 10.109 ( 1.161 -4.481 -3.648) 5.894 10.109 ( 1.161 4.481 -3.648) 5.894 10.225 ( -5.299 -2.965 0.053) 6.072 10.225 ( -5.299 2.965 0.053) 6.072 10.856 ( 1.509 -3.351 -3.471) 5.055 10.856 ( 1.509 3.351 -3.471) 5.055 11.089 ( 1.853 -2.794 -7.679) 8.379 11.089 ( 1.853 2.794 -7.679) 8.379 11.491 ( 3.253 -13.378 -3.665) 14.247 11.491 ( 3.253 13.378 -3.665) 14.247 11.614 ( -1.532 -3.711 2.032) 4.500 11.614 ( -1.532 3.711 2.032) 4.500 11.882 ( -0.698 -11.416 1.462) 11.531 11.882 ( -0.698 11.416 1.462) 11.531 12.012 ( -3.435 -9.720 10.289) 14.566 12.012 ( -3.435 9.720 10.289) 14.566 12.333 ( -4.718 -6.580 -2.503) 8.475 12.333 ( -4.718 6.580 -2.503) 8.475 12.582 ( -0.966 -5.650 -3.768) 6.859 12.582 ( -0.966 5.650 -3.768) 6.859 12.767 ( -5.038 -6.752 -3.735) 9.216 12.767 ( -5.038 6.752 -3.735) 9.216 13.048 ( -2.419 -2.876 -4.365) 5.759 13.048 ( -2.419 2.876 -4.365) 5.759 13.411 ( 0.839 -5.819 6.696) 8.910 13.411 ( 0.839 5.819 6.696) 8.910 13.662 ( -3.359 -1.159 0.005) 3.553 13.662 ( -3.359 1.159 0.005) 3.553 14.055 ( -2.546 -1.732 4.242) 5.242 14.055 ( -2.546 1.732 4.242) 5.242 14.176 ( -0.697 -3.466 0.253) 3.544 14.176 ( -0.697 3.466 0.253) 3.544 14.630 ( 0.965 -2.510 3.135) 4.130 14.630 ( 0.965 2.510 3.135) 4.130 14.896 ( 1.622 -9.259 -3.054) 9.884 14.896 ( 1.622 9.259 -3.054) 9.884 15.000 ( -2.358 -7.481 0.276) 7.849 15.000 ( -2.358 7.481 0.276) 7.849 15.249 ( -5.097 -4.723 2.276) 7.312 15.249 ( -5.097 4.723 2.276) 7.312 16.035 ( -0.388 -4.798 3.763) 6.110 16.035 ( -0.388 4.798 3.763) 6.110 16.094 ( 8.281 -2.273 -6.192) 10.587 16.094 ( 8.281 2.273 -6.192) 10.587 16.891 ( -2.630 -2.792 3.324) 5.075 16.891 ( -2.630 2.792 3.324) 5.075 18.613 ( 2.902 -1.024 -6.182) 6.906 18.613 ( 2.902 1.024 -6.182) 6.906 19.504 ( -4.465 -1.088 1.406) 4.806 19.504 ( -4.465 1.088 1.406) 4.806 22.809 ( -2.879 -14.386 -1.839) 14.786 22.809 ( -2.879 14.386 -1.839) 14.786 23.780 ( -1.425 -15.096 2.522) 15.372 23.780 ( -1.425 15.096 2.522) 15.372 ======================= Grid point 237 (125/130) ======================= q-point: ( 0.40 -0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.871 ( 12.287 -4.665 4.800) 13.992 2.871 ( 12.287 4.665 4.800) 13.992 3.158 ( 5.726 -1.627 -3.473) 6.892 3.158 ( 5.726 1.627 -3.473) 6.892 3.542 ( -1.914 -4.203 -5.222) 6.971 3.542 ( -1.914 4.203 -5.222) 6.971 3.992 ( -9.265 -4.752 -3.364) 10.942 3.992 ( -9.265 4.752 -3.364) 10.942 4.580 ( 8.340 -2.708 4.195) 9.720 4.580 ( 8.340 2.708 4.195) 9.720 4.822 ( -8.342 -6.785 0.105) 10.753 4.822 ( -8.342 6.785 0.105) 10.753 5.323 ( 0.516 -11.967 -2.442) 12.224 5.323 ( 0.516 11.967 -2.442) 12.224 5.871 ( 2.876 -7.156 1.475) 7.852 5.871 ( 2.876 7.156 1.475) 7.852 6.132 ( -5.360 -15.433 -2.726) 16.563 6.132 ( -5.360 15.433 -2.726) 16.563 6.943 ( -4.535 -5.305 15.090) 16.626 6.943 ( -4.535 5.305 15.090) 16.626 7.242 ( 0.010 -4.003 1.590) 4.308 7.242 ( 0.010 4.003 1.590) 4.308 7.525 ( 4.146 -4.284 -8.403) 10.303 7.525 ( 4.146 4.284 -8.403) 10.303 8.205 ( 1.718 -10.589 -4.481) 11.625 8.205 ( 1.718 10.589 -4.481) 11.626 8.381 ( 3.267 -6.818 -0.999) 7.626 8.381 ( 3.267 6.818 -0.999) 7.626 9.023 ( 4.980 -7.373 1.277) 8.988 9.023 ( 4.980 7.373 1.277) 8.988 9.290 ( -4.219 -17.906 4.587) 18.960 9.290 ( -4.219 17.906 4.587) 18.960 9.511 ( 4.951 -1.422 1.993) 5.523 9.511 ( 4.951 1.422 1.993) 5.523 9.869 ( -2.550 -7.572 -1.819) 8.194 9.869 ( -2.550 7.572 -1.819) 8.194 10.081 ( 1.083 -3.026 -2.778) 4.248 10.081 ( 1.083 3.026 -2.778) 4.248 10.204 ( -0.977 -3.279 4.048) 5.300 10.204 ( -0.977 3.279 4.048) 5.300 10.843 ( 0.135 -1.554 -4.653) 4.907 10.843 ( 0.135 1.554 -4.653) 4.907 11.069 ( 1.180 -1.762 -5.947) 6.313 11.069 ( 1.180 1.762 -5.947) 6.313 11.552 ( 4.379 -10.356 -2.049) 11.429 11.552 ( 4.379 10.356 -2.049) 11.429 11.622 ( 0.776 -3.957 3.132) 5.106 11.622 ( 0.776 3.957 3.132) 5.106 11.868 ( -1.405 -9.162 0.739) 9.299 11.868 ( -1.405 9.162 0.739) 9.299 11.999 ( -4.236 -10.885 7.038) 13.636 11.999 ( -4.236 10.885 7.038) 13.636 12.271 ( -1.145 -9.332 0.664) 9.426 12.271 ( -1.145 9.332 0.663) 9.426 12.492 ( -3.195 -7.875 -8.953) 12.344 12.492 ( -3.195 7.875 -8.953) 12.344 12.691 ( -1.849 -7.221 1.115) 7.537 12.691 ( -1.849 7.221 1.115) 7.537 12.983 ( -1.123 -4.738 -4.921) 6.923 12.983 ( -1.123 4.738 -4.921) 6.923 13.459 ( 1.246 -1.673 4.718) 5.158 13.459 ( 1.246 1.673 4.718) 5.158 13.621 ( -2.933 -3.645 2.416) 5.266 13.621 ( -2.933 3.645 2.416) 5.266 14.049 ( -0.469 -1.835 2.824) 3.400 14.049 ( -0.469 1.835 2.824) 3.400 14.159 ( -1.401 -2.788 0.873) 3.240 14.159 ( -1.401 2.788 0.873) 3.240 14.661 ( 0.004 -6.139 3.792) 7.216 14.661 ( 0.004 6.139 3.792) 7.216 14.858 ( -4.784 -10.756 3.802) 12.371 14.858 ( -4.784 10.756 3.802) 12.371 14.953 ( -0.901 -12.342 -2.874) 12.704 14.953 ( -0.901 12.342 -2.874) 12.704 15.229 ( 1.861 -2.764 -3.238) 4.646 15.229 ( 1.861 2.764 -3.238) 4.646 16.048 ( -2.160 -2.725 6.227) 7.132 16.048 ( -2.160 2.725 6.227) 7.132 16.198 ( 7.908 -3.283 -9.420) 12.730 16.198 ( 7.908 3.283 -9.420) 12.730 16.883 ( -0.283 -1.270 1.466) 1.960 16.883 ( -0.283 1.270 1.466) 1.960 18.606 ( -0.159 -0.838 -2.595) 2.732 18.606 ( -0.159 0.838 -2.595) 2.732 19.438 ( -2.702 -1.171 0.241) 2.955 19.438 ( -2.702 1.171 0.241) 2.955 22.766 ( -0.970 -10.033 -0.360) 10.087 22.766 ( -0.970 10.033 -0.360) 10.087 23.761 ( -1.614 -11.019 1.196) 11.201 23.761 ( -1.614 11.019 1.196) 11.201 ======================= Grid point 239 (126/130) ======================= q-point: (-0.50 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.085 ( 4.451 -3.287 3.341) 6.464 3.085 ( 4.451 3.287 3.341) 6.464 3.196 ( 0.424 -3.973 0.523) 4.030 3.196 ( 0.424 3.973 0.523) 4.030 3.446 ( -2.875 -0.670 -9.279) 9.737 3.446 ( -2.875 0.670 -9.279) 9.737 3.879 ( 0.588 -3.460 -1.525) 3.826 3.879 ( 0.588 3.460 -1.525) 3.826 4.655 ( -5.134 -1.622 7.448) 9.191 4.655 ( -5.134 1.622 7.448) 9.191 4.771 ( 5.092 -5.889 -4.259) 8.874 4.771 ( 5.092 5.889 -4.259) 8.874 5.292 ( -1.431 -4.455 -1.842) 5.029 5.292 ( -1.431 4.455 -1.842) 5.029 5.941 ( 2.012 -8.691 4.794) 10.127 5.941 ( 2.012 8.691 4.794) 10.127 6.036 ( -3.212 -12.901 -3.270) 13.691 6.036 ( -3.212 12.901 -3.270) 13.691 6.992 ( 0.532 -5.676 11.166) 12.537 6.992 ( 0.532 5.676 11.166) 12.537 7.227 ( -3.750 -5.393 2.754) 7.123 7.227 ( -3.750 5.393 2.754) 7.123 7.565 ( 8.602 -1.117 -13.792) 16.293 7.565 ( 8.602 1.117 -13.792) 16.293 8.192 ( -0.722 -0.470 -1.375) 1.622 8.192 ( -0.722 0.470 -1.375) 1.622 8.407 ( 0.245 -0.857 -1.213) 1.506 8.407 ( 0.245 0.857 -1.213) 1.506 9.114 ( -0.017 -1.589 3.956) 4.263 9.114 ( -0.017 1.589 3.956) 4.263 9.205 ( -4.431 -11.364 3.458) 12.678 9.205 ( -4.431 11.364 3.458) 12.678 9.557 ( -4.189 -3.536 4.421) 7.043 9.557 ( -4.189 3.536 4.421) 7.043 9.848 ( 4.300 -0.952 -4.139) 6.044 9.848 ( 4.300 0.952 -4.139) 6.044 10.073 ( -1.308 -0.296 -2.048) 2.448 10.073 ( -1.308 0.296 -2.048) 2.448 10.229 ( 1.191 -2.501 3.267) 4.284 10.229 ( 1.191 2.501 3.267) 4.284 10.812 ( 0.432 -3.018 -4.302) 5.273 10.812 ( 0.432 3.018 -4.302) 5.273 11.048 ( -0.251 -0.359 -3.466) 3.493 11.048 ( -0.251 0.359 -3.466) 3.493 11.583 ( -1.296 -4.746 0.814) 4.986 11.583 ( -1.296 4.746 0.814) 4.986 11.683 ( 3.223 -7.165 -0.022) 7.857 11.683 ( 3.223 7.165 -0.022) 7.857 11.853 ( -0.548 -0.525 1.390) 1.584 11.853 ( -0.548 0.525 1.390) 1.584 11.971 ( -1.438 -5.528 3.849) 6.888 11.971 ( -1.438 5.528 3.849) 6.888 12.284 ( 1.203 -9.212 2.065) 9.517 12.284 ( 1.203 9.212 2.065) 9.517 12.386 ( -1.202 -10.209 -7.764) 12.882 12.386 ( -1.202 10.209 -7.764) 12.882 12.693 ( 0.650 -4.428 1.552) 4.737 12.693 ( 0.650 4.428 1.552) 4.737 12.938 ( -0.104 -6.043 -4.300) 7.417 12.938 ( -0.104 6.043 -4.300) 7.417 13.542 ( 3.764 -4.338 4.448) 7.264 13.542 ( 3.764 4.338 4.448) 7.264 13.568 ( -3.611 -5.281 0.853) 6.454 13.568 ( -3.611 5.281 0.853) 6.454 14.073 ( 1.461 -3.116 0.570) 3.488 14.073 ( 1.461 3.116 0.570) 3.488 14.145 ( -0.320 -0.982 0.838) 1.329 14.145 ( -0.320 0.982 0.838) 1.330 14.683 ( -0.519 -2.529 3.083) 4.021 14.683 ( -0.519 2.529 3.083) 4.021 14.810 ( -3.363 -15.640 6.830) 17.395 14.810 ( -3.363 15.640 6.830) 17.395 14.926 ( -0.267 -18.264 -2.289) 18.409 14.926 ( -0.267 18.264 -2.289) 18.409 15.244 ( 3.047 -4.280 -6.414) 8.291 15.244 ( 3.047 4.280 -6.414) 8.291 16.031 ( -4.843 -1.233 7.706) 9.185 16.031 ( -4.843 1.233 7.706) 9.185 16.255 ( 5.167 -2.786 -10.053) 11.641 16.255 ( 5.167 2.786 -10.053) 11.641 16.894 ( 0.881 -0.502 -0.032) 1.015 16.894 ( 0.881 0.502 -0.032) 1.015 18.578 ( -2.072 -1.009 0.642) 2.392 18.578 ( -2.072 1.009 0.642) 2.392 19.416 ( 0.753 -0.825 -0.741) 1.340 19.416 ( 0.753 0.825 -0.741) 1.340 22.761 ( 0.543 -4.319 -0.363) 4.368 22.761 ( 0.543 4.319 -0.363) 4.368 23.746 ( -0.510 -5.159 0.963) 5.273 23.746 ( -0.510 5.159 0.963) 5.273 ======================= Grid point 241 (127/130) ======================= q-point: (-0.40 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.006 ( -9.442 -3.594 -7.503) 12.585 3.006 ( -9.442 3.594 -7.503) 12.585 3.144 ( -6.505 -6.459 -0.243) 9.170 3.144 ( -6.505 6.459 -0.243) 9.170 3.435 ( 4.781 -2.401 2.313) 5.829 3.435 ( 4.781 2.401 2.313) 5.829 3.975 ( 8.874 -1.556 -1.329) 9.107 3.975 ( 8.874 1.556 -1.329) 9.107 4.568 ( -9.495 -0.773 4.322) 10.461 4.568 ( -9.495 0.773 4.322) 10.461 4.870 ( 8.893 -5.370 -3.284) 10.895 4.870 ( 8.893 5.370 -3.284) 10.895 5.273 ( -0.296 -5.040 1.566) 5.286 5.273 ( -0.296 5.040 1.566) 5.286 5.920 ( -4.653 -11.418 -1.849) 12.468 5.920 ( -4.653 11.418 -1.849) 12.468 6.045 ( 3.406 -12.875 4.274) 13.987 6.045 ( 3.406 12.875 4.274) 13.987 7.107 ( 0.208 -7.508 11.621) 13.837 7.107 ( 0.208 7.508 11.621) 13.837 7.165 ( 1.130 -3.946 -4.093) 5.796 7.165 ( 1.130 3.946 -4.093) 5.796 7.641 ( 9.720 -2.976 -17.123) 19.913 7.641 ( 9.720 2.976 -17.123) 19.913 8.145 ( -4.958 -12.215 0.862) 13.211 8.145 ( -4.958 12.215 0.862) 13.211 8.376 ( -2.365 -9.754 -0.698) 10.061 8.376 ( -2.365 9.754 -0.698) 10.061 9.012 ( -7.753 -14.089 2.416) 16.262 9.012 ( -7.753 14.089 2.416) 16.262 9.258 ( 1.110 -5.664 7.953) 9.827 9.258 ( 1.110 5.664 7.953) 9.827 9.445 ( -9.969 -2.246 6.500) 12.111 9.445 ( -9.969 2.246 6.500) 12.111 9.920 ( 4.215 -5.862 -5.942) 9.350 9.920 ( 4.215 5.862 -5.942) 9.350 10.030 ( -0.784 -4.006 0.742) 4.149 10.030 ( -0.784 4.006 0.742) 4.149 10.275 ( 1.898 -0.487 -0.289) 1.981 10.275 ( 1.898 0.487 -0.289) 1.981 10.805 ( 0.868 -5.492 -2.201) 5.980 10.805 ( 0.868 5.492 -2.201) 5.980 11.015 ( -1.214 -1.284 -0.876) 1.972 11.015 ( -1.214 1.284 -0.876) 1.972 11.522 ( -4.691 -3.546 0.354) 5.891 11.522 ( -4.691 3.546 0.354) 5.891 11.706 ( 0.680 -7.998 -3.462) 8.741 11.706 ( 0.680 7.998 -3.462) 8.741 11.862 ( 0.217 -10.322 1.381) 10.416 11.862 ( 0.217 10.322 1.381) 10.416 12.031 ( 4.146 -4.023 4.028) 7.043 12.031 ( 4.146 4.023 4.028) 7.043 12.335 ( 0.634 -9.080 -4.955) 10.364 12.335 ( 0.634 9.080 -4.955) 10.364 12.349 ( 3.664 -6.754 2.696) 8.143 12.349 ( 3.664 6.754 2.696) 8.143 12.725 ( 2.128 -2.341 -0.433) 3.193 12.725 ( 2.128 2.341 -0.433) 3.193 12.932 ( 1.860 -2.982 -1.268) 3.736 12.932 ( 1.860 2.982 -1.268) 3.736 13.506 ( -2.650 -4.557 -0.422) 5.288 13.506 ( -2.650 4.557 -0.423) 5.288 13.643 ( 3.984 -4.751 1.464) 6.371 13.643 ( 3.984 4.751 1.464) 6.371 14.106 ( 2.694 -2.421 -2.266) 4.272 14.106 ( 2.694 2.421 -2.266) 4.272 14.163 ( 1.333 -1.957 0.589) 2.440 14.163 ( 1.333 1.957 0.589) 2.440 14.675 ( -2.417 -8.658 3.579) 9.675 14.675 ( -2.417 8.658 3.579) 9.675 14.830 ( 0.021 -5.095 4.655) 6.901 14.830 ( 0.021 5.095 4.655) 6.901 14.913 ( 0.406 -16.323 0.117) 16.328 14.913 ( 0.406 16.323 0.117) 16.328 15.258 ( 2.341 -4.542 -4.437) 6.768 15.258 ( 2.341 4.542 -4.437) 6.768 15.976 ( -6.162 -1.615 7.558) 9.885 15.976 ( -6.162 1.615 7.558) 9.885 16.259 ( 2.807 -1.159 -9.958) 10.410 16.259 ( 2.807 1.159 -9.958) 10.410 16.917 ( 2.221 -0.786 -1.438) 2.761 16.917 ( 2.221 0.786 -1.438) 2.761 18.536 ( -3.751 -1.226 3.261) 5.120 18.536 ( -3.751 1.226 3.261) 5.120 19.454 ( 3.581 -0.265 -1.066) 3.746 19.454 ( 3.581 0.265 -1.066) 3.746 22.775 ( 1.404 -2.593 -1.156) 3.167 22.775 ( 1.404 2.593 -1.156) 3.167 23.761 ( 1.249 -1.976 1.247) 2.649 23.761 ( 1.249 1.976 1.247) 2.649 ======================= Grid point 243 (128/130) ======================= q-point: (-0.30 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.723 ( -11.825 -8.999 -10.602) 18.254 2.723 ( -11.825 8.999 -10.602) 18.254 2.992 ( -9.823 -8.110 -0.153) 12.739 2.992 ( -9.823 8.110 -0.153) 12.739 3.577 ( 7.404 -2.624 3.767) 8.712 3.577 ( 7.404 2.624 3.767) 8.712 4.149 ( 8.551 -0.598 0.839) 8.613 4.149 ( 8.551 0.598 0.839) 8.613 4.364 ( -12.583 -1.557 1.940) 12.826 4.364 ( -12.583 1.557 1.940) 12.826 5.030 ( 7.096 -5.078 -1.075) 8.792 5.030 ( 7.096 5.078 -1.075) 8.792 5.308 ( 4.176 -3.841 0.010) 5.674 5.308 ( 4.176 3.841 0.010) 5.674 5.818 ( -4.470 -9.784 -1.522) 10.864 5.818 ( -4.470 9.784 -1.522) 10.864 6.170 ( 5.922 -17.627 6.385) 19.661 6.170 ( 5.922 17.627 6.385) 19.661 7.047 ( -6.791 -10.421 4.497) 13.227 7.047 ( -6.791 10.421 4.497) 13.227 7.323 ( 12.645 -4.795 -4.216) 14.165 7.323 ( 12.645 4.795 -4.216) 14.165 7.654 ( 3.446 -7.235 -19.006) 20.626 7.654 ( 3.446 7.235 -19.006) 20.626 8.003 ( -10.860 -17.596 5.222) 21.327 8.003 ( -10.860 17.596 5.222) 21.327 8.321 ( -2.949 -11.616 -1.365) 12.062 8.321 ( -2.949 11.616 -1.365) 12.062 8.925 ( -2.759 -11.579 2.044) 12.078 8.925 ( -2.759 11.579 2.044) 12.078 9.209 ( -12.121 -1.617 6.141) 13.684 9.209 ( -12.121 1.617 6.141) 13.684 9.397 ( 0.029 -8.186 10.268) 13.132 9.397 ( 0.029 8.186 10.268) 13.132 9.885 ( -3.758 -5.357 -0.636) 6.574 9.885 ( -3.758 5.357 -0.636) 6.574 10.082 ( 4.676 -2.946 -2.039) 5.891 10.082 ( 4.676 2.946 -2.039) 5.891 10.290 ( 1.209 -2.816 -2.809) 4.157 10.290 ( 1.209 2.816 -2.809) 4.157 10.798 ( -1.354 -8.136 0.570) 8.268 10.798 ( -1.354 8.136 0.570) 8.268 11.002 ( 0.063 -0.755 0.422) 0.867 11.002 ( 0.063 0.755 0.422) 0.867 11.447 ( -2.660 -8.094 0.083) 8.520 11.447 ( -2.660 8.094 0.083) 8.520 11.688 ( 0.678 -6.375 -4.295) 7.716 11.688 ( 0.678 6.375 -4.295) 7.716 11.873 ( -0.216 -12.068 1.647) 12.182 11.873 ( -0.216 12.068 1.647) 12.182 12.134 ( 3.870 -6.899 1.402) 8.034 12.134 ( 3.870 6.899 1.402) 8.034 12.325 ( 1.692 -10.796 -2.768) 11.273 12.325 ( 1.692 10.796 -2.768) 11.273 12.468 ( 5.438 -6.779 3.870) 9.513 12.468 ( 5.438 6.779 3.870) 9.513 12.765 ( 2.961 -6.761 -1.305) 7.496 12.765 ( 2.961 6.761 -1.305) 7.496 12.995 ( 4.872 -0.845 0.562) 4.976 12.995 ( 4.872 0.845 0.562) 4.976 13.469 ( -1.013 -1.245 -0.386) 1.651 13.469 ( -1.013 1.245 -0.386) 1.651 13.699 ( 2.202 -2.886 -2.015) 4.151 13.699 ( 2.202 2.886 -2.015) 4.151 14.149 ( 4.005 -3.625 -3.800) 6.605 14.149 ( 4.005 3.625 -3.800) 6.605 14.184 ( 0.527 -2.458 -0.689) 2.607 14.184 ( 0.527 2.458 -0.689) 2.607 14.649 ( -2.993 -11.085 3.347) 11.960 14.649 ( -2.993 11.085 3.347) 11.960 14.819 ( -2.558 -12.578 0.982) 12.873 14.819 ( -2.558 12.578 0.982) 12.873 14.975 ( 3.922 -6.758 2.613) 8.239 14.975 ( 3.922 6.758 2.613) 8.239 15.267 ( -0.175 -3.865 1.414) 4.119 15.267 ( -0.175 3.865 1.414) 4.119 15.921 ( -3.950 -1.299 5.378) 6.798 15.921 ( -3.950 1.299 5.378) 6.798 16.235 ( 2.248 -1.366 -9.991) 10.332 16.235 ( 2.248 1.366 -9.991) 10.332 16.968 ( 5.201 -0.575 -3.210) 6.138 16.968 ( 5.201 0.575 -3.210) 6.138 18.477 ( -5.730 -1.448 5.308) 7.944 18.477 ( -5.730 1.448 5.308) 7.944 19.524 ( 3.970 -0.204 -0.356) 3.991 19.524 ( 3.970 0.204 -0.356) 3.991 22.799 ( 1.946 -9.854 -0.924) 10.087 22.799 ( 1.946 9.854 -0.924) 10.087 23.804 ( 2.376 -8.985 0.443) 9.304 23.804 ( 2.376 8.985 0.443) 9.304 ======================= Grid point 245 (129/130) ======================= q-point: (-0.20 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.446 ( -9.137 -12.277 -10.556) 18.591 2.446 ( -9.137 12.277 -10.556) 18.591 2.759 ( -13.542 -9.466 -2.603) 16.726 2.759 ( -13.542 9.466 -2.603) 16.726 3.759 ( 9.147 -4.192 1.857) 10.232 3.759 ( 9.147 4.192 1.857) 10.232 4.141 ( -7.536 -6.880 1.644) 10.336 4.141 ( -7.536 6.880 1.644) 10.336 4.327 ( 4.044 -1.688 6.890) 8.165 4.327 ( 4.044 1.688 6.890) 8.165 5.081 ( 0.040 -11.784 -0.625) 11.801 5.081 ( 0.040 11.784 -0.625) 11.801 5.441 ( 9.746 -5.204 -4.219) 11.826 5.441 ( 9.746 5.204 -4.219) 11.826 5.731 ( -3.759 -6.240 -1.015) 7.355 5.731 ( -3.759 6.240 -1.015) 7.355 6.341 ( 6.312 -19.686 7.531) 22.002 6.341 ( 6.312 19.686 7.531) 22.002 6.953 ( -5.058 -13.818 2.293) 14.893 6.953 ( -5.058 13.818 2.293) 14.893 7.464 ( -6.090 -0.900 -8.081) 10.159 7.464 ( -6.090 0.900 -8.081) 10.159 7.560 ( 10.176 -10.450 -8.096) 16.683 7.560 ( 10.176 10.450 -8.096) 16.683 7.854 ( -7.127 -11.130 -0.142) 13.217 7.854 ( -7.127 11.130 -0.142) 13.217 8.233 ( -4.619 -10.635 -2.745) 11.915 8.233 ( -4.619 10.635 -2.745) 11.915 8.891 ( -5.310 -6.350 0.873) 8.323 8.891 ( -5.310 6.350 0.873) 8.323 9.042 ( -5.534 -18.477 5.735) 20.123 9.042 ( -5.534 18.477 5.735) 20.123 9.487 ( 1.514 -9.455 8.723) 12.953 9.487 ( 1.514 9.455 8.723) 12.953 9.792 ( -6.552 -5.704 2.268) 8.978 9.792 ( -6.552 5.704 2.268) 8.978 10.127 ( 1.750 -0.465 -4.606) 4.949 10.127 ( 1.750 0.465 -4.606) 4.949 10.326 ( 4.596 -2.841 0.982) 5.491 10.326 ( 4.596 2.841 0.982) 5.491 10.762 ( -3.332 -7.857 2.923) 9.021 10.762 ( -3.332 7.857 2.923) 9.021 11.021 ( 1.750 -0.835 -0.125) 1.943 11.021 ( 1.750 0.835 -0.125) 1.943 11.432 ( 0.625 -10.016 0.734) 10.062 11.432 ( 0.625 10.016 0.734) 10.062 11.677 ( 0.768 -2.503 -3.041) 4.013 11.677 ( 0.768 2.503 -3.041) 4.013 11.874 ( -1.026 -10.865 1.909) 11.079 11.874 ( -1.026 10.865 1.909) 11.079 12.179 ( 1.556 -6.180 -3.839) 7.440 12.179 ( 1.556 6.180 -3.839) 7.440 12.381 ( 4.327 -7.966 2.968) 9.539 12.381 ( 4.327 7.966 2.968) 9.539 12.565 ( 2.376 -5.684 0.836) 6.217 12.565 ( 2.376 5.684 0.836) 6.217 12.843 ( 5.591 -6.786 1.251) 8.881 12.843 ( 5.591 6.786 1.251) 8.881 13.103 ( 5.889 -2.201 -1.389) 6.438 13.103 ( 5.889 2.201 -1.389) 6.438 13.438 ( -2.299 -6.683 -1.813) 7.297 13.438 ( -2.299 6.683 -1.813) 7.297 13.732 ( 3.573 -0.541 -0.937) 3.733 13.732 ( 3.573 0.541 -0.937) 3.733 14.164 ( -1.510 -3.790 -0.745) 4.147 14.164 ( -1.510 3.790 -0.745) 4.147 14.200 ( 3.905 -1.980 -5.231) 6.822 14.200 ( 3.905 1.980 -5.231) 6.822 14.595 ( -4.714 -6.453 1.222) 8.084 14.595 ( -4.714 6.453 1.222) 8.084 14.770 ( -3.469 -10.660 1.409) 11.299 14.770 ( -3.469 10.660 1.409) 11.299 15.049 ( 1.698 -2.631 2.069) 3.753 15.049 ( 1.698 2.631 2.069) 3.753 15.291 ( 1.001 -4.858 5.496) 7.403 15.291 ( 1.001 4.858 5.496) 7.403 15.892 ( -2.787 -1.445 2.612) 4.084 15.892 ( -2.787 1.445 2.612) 4.084 16.214 ( 2.463 -2.500 -9.009) 9.668 16.214 ( 2.463 2.500 -9.009) 9.668 17.090 ( 10.865 -0.365 -4.766) 11.870 17.090 ( 10.865 0.365 -4.766) 11.870 18.386 ( -8.004 -1.634 5.814) 10.026 18.386 ( -8.004 1.634 5.814) 10.026 19.588 ( 2.228 -0.457 1.196) 2.570 19.588 ( 2.228 0.457 1.196) 2.570 22.842 ( 2.655 -15.387 1.202) 15.660 22.842 ( 2.655 15.387 1.202) 15.660 23.842 ( 1.806 -13.721 -2.003) 13.984 23.842 ( 1.806 13.721 -2.003) 13.984 ======================= Grid point 247 (130/130) ======================= q-point: (-0.10 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.25e-05 5.25e-05 5.25e-05 5.25e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.243 ( -4.586 -12.715 -10.096) 16.871 2.243 ( -4.586 12.715 -10.096) 16.871 2.479 ( -11.271 -8.765 -5.121) 15.169 2.479 ( -11.271 8.765 -5.121) 15.168 3.877 ( 1.877 -7.857 -1.560) 8.227 3.877 ( 1.877 7.857 -1.560) 8.227 4.145 ( 5.626 -8.940 6.237) 12.267 4.145 ( 5.626 8.940 6.237) 12.267 4.420 ( -0.685 -4.162 9.878) 10.740 4.420 ( -0.685 4.162 9.878) 10.740 5.061 ( -0.898 -9.116 -2.275) 9.438 5.061 ( -0.898 9.116 -2.275) 9.438 5.553 ( 5.193 -4.253 -6.333) 9.228 5.553 ( 5.193 4.253 -6.333) 9.228 5.668 ( -2.053 -6.195 -1.038) 6.608 5.668 ( -2.053 6.195 -1.038) 6.608 6.491 ( 4.098 -15.408 6.114) 17.076 6.491 ( 4.098 15.408 6.114) 17.076 6.904 ( -1.723 -10.507 3.526) 11.216 6.904 ( -1.723 10.507 3.526) 11.216 7.246 ( -9.567 -3.570 -1.932) 10.392 7.246 ( -9.567 3.570 -1.932) 10.392 7.693 ( -1.086 -5.726 -3.543) 6.821 7.693 ( -1.086 5.726 -3.543) 6.821 7.745 ( 5.543 -2.330 -8.159) 10.135 7.745 ( 5.543 2.330 -8.159) 10.135 8.125 ( -4.543 -9.655 -2.322) 10.920 8.125 ( -4.543 9.655 -2.322) 10.920 8.748 ( -7.563 -3.121 1.950) 8.411 8.748 ( -7.563 3.121 1.950) 8.411 9.081 ( 4.106 -10.568 1.440) 11.429 9.081 ( 4.106 10.568 1.440) 11.429 9.517 ( -3.175 -7.529 -1.205) 8.260 9.517 ( -3.175 7.529 -1.205) 8.260 9.712 ( -4.758 -5.248 11.858) 13.813 9.712 ( -4.758 5.248 11.858) 13.813 10.096 ( 0.187 -2.221 -7.811) 8.123 10.096 ( 0.187 2.221 -7.811) 8.123 10.467 ( 5.990 -2.502 6.426) 9.134 10.467 ( 5.990 2.502 6.426) 9.134 10.730 ( -1.760 -4.674 3.048) 5.851 10.730 ( -1.760 4.674 3.048) 5.851 11.063 ( 2.775 -1.227 -0.228) 3.043 11.063 ( 2.775 1.227 -0.228) 3.043 11.467 ( 2.023 -8.928 1.027) 9.211 11.467 ( 2.023 8.928 1.027) 9.211 11.668 ( -0.064 -4.295 -1.676) 4.611 11.668 ( -0.064 4.295 -1.676) 4.611 11.862 ( -1.942 -6.365 3.101) 7.342 11.862 ( -1.942 6.365 3.101) 7.342 12.148 ( -0.289 -4.116 -7.944) 8.952 12.148 ( -0.289 4.116 -7.944) 8.952 12.515 ( 5.084 -4.969 6.092) 9.362 12.515 ( 5.084 4.969 6.092) 9.362 12.592 ( 1.396 -3.604 1.354) 4.095 12.592 ( 1.396 3.604 1.354) 4.095 12.956 ( 4.068 -6.072 -0.167) 7.311 12.956 ( 4.068 6.072 -0.167) 7.311 13.168 ( 1.797 -6.377 -1.743) 6.851 13.168 ( 1.797 6.377 -1.743) 6.851 13.361 ( -1.766 -7.263 -6.430) 9.860 13.361 ( -1.766 7.263 -6.430) 9.860 13.830 ( 4.578 -0.310 3.818) 5.969 13.830 ( 4.578 0.310 3.818) 5.969 14.136 ( 0.002 -4.621 -0.048) 4.621 14.136 ( 0.002 4.621 -0.048) 4.621 14.218 ( 2.152 -0.758 -5.748) 6.184 14.218 ( 2.152 0.758 -5.748) 6.184 14.482 ( -7.762 -3.021 0.178) 8.331 14.482 ( -7.762 3.021 0.178) 8.331 14.711 ( -2.947 -6.607 0.262) 7.239 14.711 ( -2.947 6.607 0.262) 7.239 15.079 ( 0.055 -3.613 3.053) 4.730 15.079 ( 0.055 3.613 3.053) 4.730 15.385 ( 4.771 -4.325 3.762) 7.458 15.385 ( 4.771 4.325 3.762) 7.458 15.841 ( -3.213 -1.802 0.577) 3.729 15.841 ( -3.213 1.802 0.577) 3.729 16.192 ( 0.410 -2.263 -6.360) 6.763 16.192 ( 0.410 2.263 -6.360) 6.763 17.290 ( 10.553 -1.352 -1.645) 10.766 17.290 ( 10.553 1.352 -1.645) 10.766 18.266 ( -6.180 -1.382 1.627) 6.539 18.266 ( -6.180 1.382 1.627) 6.539 19.623 ( 0.075 -0.471 2.834) 2.874 19.623 ( 0.075 0.471 2.834) 2.874 22.915 ( 3.053 -15.758 3.474) 16.423 22.915 ( 3.053 15.758 3.474) 16.423 23.836 ( -0.140 -13.571 -4.232) 14.216 23.836 ( -0.140 13.571 -4.232) 14.216 =================== End of collection of collisions =================== ----------- Thermal conductivity (W/m-k) with tetrahedron method ----------- # T(K) xx yy zz yz xz xy #ipm 0.0 0.000 0.000 0.000 0.000 0.000 0.000 3/36000 10.0 2059.422 1943.960 1227.222 0.000 120.561 0.000 3/36000 20.0 373.560 529.775 246.199 0.000 -38.087 0.000 3/36000 30.0 147.664 191.858 103.906 0.000 -8.579 0.000 3/36000 40.0 80.460 93.268 59.064 0.000 -2.153 0.000 3/36000 50.0 49.077 53.743 37.032 0.000 -0.540 0.000 3/36000 60.0 32.523 34.716 25.060 0.000 -0.062 0.000 3/36000 70.0 23.077 24.331 18.079 0.000 0.085 0.000 3/36000 80.0 17.300 18.116 13.737 0.000 0.121 0.000 3/36000 90.0 13.550 14.128 10.880 0.000 0.118 0.000 3/36000 100.0 10.992 11.426 8.909 0.000 0.102 0.000 3/36000 110.0 9.171 9.514 7.495 0.000 0.084 0.000 3/36000 120.0 7.830 8.111 6.446 0.000 0.066 0.000 3/36000 130.0 6.812 7.051 5.646 0.000 0.050 0.000 3/36000 140.0 6.020 6.229 5.020 0.000 0.036 0.000 3/36000 150.0 5.390 5.577 4.520 0.000 0.024 0.000 3/36000 160.0 4.879 5.049 4.113 0.000 0.014 0.000 3/36000 170.0 4.458 4.615 3.776 0.000 0.006 0.000 3/36000 180.0 4.105 4.253 3.493 0.000 -0.001 0.000 3/36000 190.0 3.806 3.946 3.252 0.000 -0.006 0.000 3/36000 200.0 3.550 3.683 3.045 0.000 -0.011 0.000 3/36000 210.0 3.328 3.455 2.865 0.000 -0.015 0.000 3/36000 220.0 3.133 3.256 2.707 0.000 -0.018 0.000 3/36000 230.0 2.962 3.080 2.567 0.000 -0.020 0.000 3/36000 240.0 2.809 2.924 2.442 0.000 -0.022 0.000 3/36000 250.0 2.673 2.785 2.330 0.000 -0.024 0.000 3/36000 260.0 2.550 2.659 2.229 0.000 -0.025 0.000 3/36000 270.0 2.439 2.545 2.137 0.000 -0.026 0.000 3/36000 280.0 2.337 2.441 2.053 0.000 -0.027 0.000 3/36000 290.0 2.245 2.346 1.976 0.000 -0.028 0.000 3/36000 300.0 2.160 2.259 1.905 0.000 -0.028 0.000 3/36000 310.0 2.081 2.178 1.839 0.000 -0.028 0.000 3/36000 320.0 2.009 2.104 1.778 0.000 -0.028 0.000 3/36000 330.0 1.941 2.034 1.721 0.000 -0.028 0.000 3/36000 340.0 1.878 1.970 1.668 0.000 -0.028 0.000 3/36000 350.0 1.820 1.909 1.618 0.000 -0.028 0.000 3/36000 360.0 1.765 1.853 1.572 0.000 -0.028 0.000 3/36000 370.0 1.714 1.800 1.528 0.000 -0.028 0.000 3/36000 380.0 1.665 1.750 1.487 0.000 -0.028 0.000 3/36000 390.0 1.620 1.703 1.448 0.000 -0.027 0.000 3/36000 400.0 1.577 1.658 1.411 0.000 -0.027 0.000 3/36000 410.0 1.536 1.616 1.376 0.000 -0.027 0.000 3/36000 420.0 1.497 1.576 1.342 0.000 -0.027 0.000 3/36000 430.0 1.461 1.538 1.311 0.000 -0.026 0.000 3/36000 440.0 1.426 1.502 1.281 0.000 -0.026 0.000 3/36000 450.0 1.393 1.468 1.252 0.000 -0.026 0.000 3/36000 460.0 1.361 1.435 1.225 0.000 -0.025 0.000 3/36000 470.0 1.331 1.404 1.198 0.000 -0.025 0.000 3/36000 480.0 1.302 1.374 1.173 0.000 -0.025 0.000 3/36000 490.0 1.275 1.345 1.149 0.000 -0.024 0.000 3/36000 500.0 1.248 1.318 1.126 0.000 -0.024 0.000 3/36000 510.0 1.223 1.291 1.104 0.000 -0.024 0.000 3/36000 520.0 1.199 1.266 1.083 0.000 -0.023 0.000 3/36000 530.0 1.176 1.242 1.063 0.000 -0.023 0.000 3/36000 540.0 1.153 1.219 1.043 0.000 -0.023 0.000 3/36000 550.0 1.132 1.196 1.024 0.000 -0.022 0.000 3/36000 560.0 1.111 1.175 1.006 0.000 -0.022 0.000 3/36000 570.0 1.091 1.154 0.988 0.000 -0.022 0.000 3/36000 580.0 1.072 1.134 0.971 0.000 -0.021 0.000 3/36000 590.0 1.053 1.114 0.955 0.000 -0.021 0.000 3/36000 600.0 1.036 1.096 0.939 0.000 -0.021 0.000 3/36000 610.0 1.018 1.077 0.924 0.000 -0.021 0.000 3/36000 620.0 1.001 1.060 0.909 0.000 -0.020 0.000 3/36000 630.0 0.985 1.043 0.894 0.000 -0.020 0.000 3/36000 640.0 0.970 1.027 0.881 0.000 -0.020 0.000 3/36000 650.0 0.955 1.011 0.867 0.000 -0.020 0.000 3/36000 660.0 0.940 0.995 0.854 0.000 -0.019 0.000 3/36000 670.0 0.926 0.980 0.841 0.000 -0.019 0.000 3/36000 680.0 0.912 0.966 0.829 0.000 -0.019 0.000 3/36000 690.0 0.898 0.952 0.817 0.000 -0.019 0.000 3/36000 700.0 0.885 0.938 0.805 0.000 -0.018 0.000 3/36000 710.0 0.873 0.925 0.794 0.000 -0.018 0.000 3/36000 720.0 0.861 0.912 0.783 0.000 -0.018 0.000 3/36000 730.0 0.849 0.900 0.773 0.000 -0.018 0.000 3/36000 740.0 0.837 0.887 0.762 0.000 -0.017 0.000 3/36000 750.0 0.826 0.876 0.752 0.000 -0.017 0.000 3/36000 760.0 0.815 0.864 0.742 0.000 -0.017 0.000 3/36000 770.0 0.804 0.853 0.733 0.000 -0.017 0.000 3/36000 780.0 0.794 0.842 0.723 0.000 -0.017 0.000 3/36000 790.0 0.784 0.831 0.714 0.000 -0.017 0.000 3/36000 800.0 0.774 0.821 0.705 0.000 -0.016 0.000 3/36000 810.0 0.764 0.811 0.697 0.000 -0.016 0.000 3/36000 820.0 0.755 0.801 0.688 0.000 -0.016 0.000 3/36000 830.0 0.746 0.791 0.680 0.000 -0.016 0.000 3/36000 840.0 0.737 0.782 0.672 0.000 -0.016 0.000 3/36000 850.0 0.728 0.773 0.664 0.000 -0.015 0.000 3/36000 860.0 0.719 0.764 0.657 0.000 -0.015 0.000 3/36000 870.0 0.711 0.755 0.649 0.000 -0.015 0.000 3/36000 880.0 0.703 0.746 0.642 0.000 -0.015 0.000 3/36000 890.0 0.695 0.738 0.635 0.000 -0.015 0.000 3/36000 900.0 0.687 0.730 0.628 0.000 -0.015 0.000 3/36000 910.0 0.680 0.722 0.621 0.000 -0.015 0.000 3/36000 920.0 0.672 0.714 0.614 0.000 -0.014 0.000 3/36000 930.0 0.665 0.706 0.607 0.000 -0.014 0.000 3/36000 940.0 0.658 0.699 0.601 0.000 -0.014 0.000 3/36000 950.0 0.651 0.691 0.595 0.000 -0.014 0.000 3/36000 960.0 0.644 0.684 0.589 0.000 -0.014 0.000 3/36000 970.0 0.637 0.677 0.583 0.000 -0.014 0.000 3/36000 980.0 0.631 0.670 0.577 0.000 -0.014 0.000 3/36000 990.0 0.625 0.663 0.571 0.000 -0.013 0.000 3/36000 1000.0 0.618 0.657 0.565 0.000 -0.013 0.000 3/36000 Thermal conductivity related properties were written into "kappa-m1085.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 02:22:41]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|