----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 20:35:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pbca (61) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.002672189999999 0.000000000000000 0.000000000000000 b 0.000000000000000 9.109658050000002 0.000000000000000 c 0.000000000000000 0.000000000000000 8.642401390000000 Atomic positions (fractional): *1 Al 0.96444877888019 0.51639935352988 0.16492488299519 26.982 2 Al 0.53555122111981 0.48360064647012 0.66492488299519 26.982 3 Al 0.46444877888019 0.98360064647012 0.83507511700481 26.982 4 Al 0.03555122111981 0.01639935352988 0.33507511700481 26.982 5 Al 0.03555122111981 0.48360064647012 0.83507511700481 26.982 6 Al 0.46444877888019 0.51639935352988 0.33507511700481 26.982 7 Al 0.53555122111981 0.01639935352988 0.16492488299519 26.982 8 Al 0.96444877888019 0.98360064647012 0.66492488299519 26.982 *9 H 0.16755036384124 0.60654727250525 0.54560812064550 1.008 10 H 0.33244963615876 0.39345272749475 0.04560812064550 1.008 11 H 0.66755036384124 0.89345272749475 0.45439187935450 1.008 12 H 0.83244963615876 0.10654727250525 0.95439187935450 1.008 13 H 0.83244963615876 0.39345272749475 0.45439187935450 1.008 14 H 0.66755036384124 0.60654727250525 0.95439187935450 1.008 15 H 0.33244963615876 0.10654727250525 0.54560812064550 1.008 16 H 0.16755036384124 0.89345272749475 0.04560812064550 1.008 *17 H 0.33741310945249 0.69763765714805 0.11228232705628 1.008 18 H 0.16258689054751 0.30236234285195 0.61228232705628 1.008 19 H 0.83741310945249 0.80236234285195 0.88771767294372 1.008 20 H 0.66258689054751 0.19763765714805 0.38771767294372 1.008 21 H 0.66258689054751 0.30236234285195 0.88771767294372 1.008 22 H 0.83741310945249 0.69763765714805 0.38771767294372 1.008 23 H 0.16258689054751 0.19763765714805 0.11228232705628 1.008 24 H 0.33741310945249 0.80236234285195 0.61228232705628 1.008 *25 H 0.83065191535026 0.69536553697764 0.69376204327104 1.008 26 H 0.66934808464974 0.30463446302236 0.19376204327104 1.008 27 H 0.33065191535026 0.80463446302236 0.30623795672896 1.008 28 H 0.16934808464974 0.19536553697764 0.80623795672896 1.008 29 H 0.16934808464974 0.30463446302236 0.30623795672896 1.008 30 H 0.33065191535026 0.69536553697764 0.80623795672896 1.008 31 H 0.66934808464974 0.19536553697764 0.69376204327104 1.008 32 H 0.83065191535026 0.80463446302236 0.19376204327104 1.008 *33 O 0.36136805222332 0.61372614779434 0.51984432086167 15.999 34 O 0.13863194777668 0.38627385220566 0.01984432086167 15.999 35 O 0.86136805222332 0.88627385220566 0.48015567913833 15.999 36 O 0.63863194777668 0.11372614779434 0.98015567913833 15.999 37 O 0.63863194777668 0.38627385220566 0.48015567913833 15.999 38 O 0.86136805222332 0.61372614779434 0.98015567913833 15.999 39 O 0.13863194777668 0.11372614779434 0.51984432086167 15.999 40 O 0.36136805222332 0.88627385220566 0.01984432086167 15.999 *41 O 0.26654158994034 0.63540356941407 0.19671550058548 15.999 42 O 0.23345841005966 0.36459643058593 0.69671550058548 15.999 43 O 0.76654158994034 0.86459643058593 0.80328449941452 15.999 44 O 0.73345841005966 0.13540356941407 0.30328449941452 15.999 45 O 0.73345841005966 0.36459643058593 0.80328449941452 15.999 46 O 0.76654158994034 0.63540356941407 0.30328449941452 15.999 47 O 0.23345841005966 0.13540356941407 0.19671550058548 15.999 48 O 0.26654158994034 0.86459643058593 0.69671550058548 15.999 *49 O 0.86321091985070 0.59030088865947 0.66933063790331 15.999 50 O 0.63678908014930 0.40969911134053 0.16933063790331 15.999 51 O 0.36321091985071 0.90969911134053 0.33066936209669 15.999 52 O 0.13678908014930 0.09030088865947 0.83066936209669 15.999 53 O 0.13678908014930 0.40969911134053 0.33066936209669 15.999 54 O 0.36321091985071 0.59030088865947 0.83066936209669 15.999 55 O 0.63678908014930 0.09030088865947 0.66933063790331 15.999 56 O 0.86321091985070 0.90969911134053 0.16933063790331 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.002672189999999 0.000000000000000 0.000000000000000 b 0.000000000000000 9.109658050000002 0.000000000000000 c 0.000000000000000 0.000000000000000 8.642401390000000 Atomic positions (fractional): *1 Al 0.96444877888019 0.51639935352988 0.16492488299519 26.982 > 1 2 Al 0.53555122111981 0.48360064647012 0.66492488299519 26.982 > 2 3 Al 0.46444877888019 0.98360064647012 0.83507511700481 26.982 > 3 4 Al 0.03555122111981 0.01639935352988 0.33507511700481 26.982 > 4 5 Al 0.03555122111981 0.48360064647012 0.83507511700481 26.982 > 5 6 Al 0.46444877888019 0.51639935352988 0.33507511700481 26.982 > 6 7 Al 0.53555122111981 0.01639935352988 0.16492488299519 26.982 > 7 8 Al 0.96444877888019 0.98360064647012 0.66492488299519 26.982 > 8 *9 H 0.16755036384124 0.60654727250525 0.54560812064550 1.008 > 9 10 H 0.33244963615876 0.39345272749475 0.04560812064550 1.008 > 10 11 H 0.66755036384124 0.89345272749475 0.45439187935450 1.008 > 11 12 H 0.83244963615876 0.10654727250525 0.95439187935450 1.008 > 12 13 H 0.83244963615876 0.39345272749475 0.45439187935450 1.008 > 13 14 H 0.66755036384124 0.60654727250525 0.95439187935450 1.008 > 14 15 H 0.33244963615876 0.10654727250525 0.54560812064550 1.008 > 15 16 H 0.16755036384124 0.89345272749475 0.04560812064550 1.008 > 16 *17 H 0.33741310945249 0.69763765714805 0.11228232705628 1.008 > 17 18 H 0.16258689054751 0.30236234285195 0.61228232705628 1.008 > 18 19 H 0.83741310945249 0.80236234285195 0.88771767294372 1.008 > 19 20 H 0.66258689054751 0.19763765714805 0.38771767294372 1.008 > 20 21 H 0.66258689054751 0.30236234285195 0.88771767294372 1.008 > 21 22 H 0.83741310945249 0.69763765714805 0.38771767294372 1.008 > 22 23 H 0.16258689054751 0.19763765714805 0.11228232705628 1.008 > 23 24 H 0.33741310945249 0.80236234285195 0.61228232705628 1.008 > 24 *25 H 0.83065191535026 0.69536553697764 0.69376204327104 1.008 > 25 26 H 0.66934808464974 0.30463446302236 0.19376204327104 1.008 > 26 27 H 0.33065191535026 0.80463446302236 0.30623795672896 1.008 > 27 28 H 0.16934808464974 0.19536553697764 0.80623795672896 1.008 > 28 29 H 0.16934808464974 0.30463446302236 0.30623795672896 1.008 > 29 30 H 0.33065191535026 0.69536553697764 0.80623795672896 1.008 > 30 31 H 0.66934808464974 0.19536553697764 0.69376204327104 1.008 > 31 32 H 0.83065191535026 0.80463446302236 0.19376204327104 1.008 > 32 *33 O 0.36136805222332 0.61372614779434 0.51984432086167 15.999 > 33 34 O 0.13863194777668 0.38627385220566 0.01984432086167 15.999 > 34 35 O 0.86136805222332 0.88627385220566 0.48015567913833 15.999 > 35 36 O 0.63863194777668 0.11372614779434 0.98015567913833 15.999 > 36 37 O 0.63863194777668 0.38627385220566 0.48015567913833 15.999 > 37 38 O 0.86136805222332 0.61372614779434 0.98015567913833 15.999 > 38 39 O 0.13863194777668 0.11372614779434 0.51984432086167 15.999 > 39 40 O 0.36136805222332 0.88627385220566 0.01984432086167 15.999 > 40 *41 O 0.26654158994034 0.63540356941407 0.19671550058548 15.999 > 41 42 O 0.23345841005966 0.36459643058593 0.69671550058548 15.999 > 42 43 O 0.76654158994034 0.86459643058593 0.80328449941452 15.999 > 43 44 O 0.73345841005966 0.13540356941407 0.30328449941452 15.999 > 44 45 O 0.73345841005966 0.36459643058593 0.80328449941452 15.999 > 45 46 O 0.76654158994034 0.63540356941407 0.30328449941452 15.999 > 46 47 O 0.23345841005966 0.13540356941407 0.19671550058548 15.999 > 47 48 O 0.26654158994034 0.86459643058593 0.69671550058548 15.999 > 48 *49 O 0.86321091985070 0.59030088865947 0.66933063790331 15.999 > 49 50 O 0.63678908014930 0.40969911134053 0.16933063790331 15.999 > 50 51 O 0.36321091985071 0.90969911134053 0.33066936209669 15.999 > 51 52 O 0.13678908014930 0.09030088865947 0.83066936209669 15.999 > 52 53 O 0.13678908014930 0.40969911134053 0.33066936209669 15.999 > 53 54 O 0.36321091985071 0.59030088865947 0.83066936209669 15.999 > 54 55 O 0.63678908014930 0.09030088865947 0.66933063790331 15.999 > 55 56 O 0.86321091985070 0.90969911134053 0.16933063790331 15.999 > 56 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.005344379999999 0.000000000000000 0.000000000000000 b 0.000000000000000 9.109658050000002 0.000000000000000 c 0.000000000000000 0.000000000000000 8.642401390000000 Atomic positions (fractional): *1 Al 0.48222438944009 0.51639935352988 0.16492488299519 26.982 > 1 2 Al 0.98222438944009 0.51639935352988 0.16492488299519 26.982 > 1 3 Al 0.26777561055991 0.48360064647012 0.66492488299519 26.982 > 2 4 Al 0.76777561055991 0.48360064647012 0.66492488299519 26.982 > 2 5 Al 0.23222438944009 0.98360064647012 0.83507511700481 26.982 > 3 6 Al 0.73222438944009 0.98360064647012 0.83507511700481 26.982 > 3 7 Al 0.01777561055991 0.01639935352988 0.33507511700481 26.982 > 4 8 Al 0.51777561055991 0.01639935352988 0.33507511700481 26.982 > 4 9 Al 0.01777561055991 0.48360064647012 0.83507511700481 26.982 > 5 10 Al 0.51777561055991 0.48360064647012 0.83507511700481 26.982 > 5 11 Al 0.23222438944009 0.51639935352988 0.33507511700481 26.982 > 6 12 Al 0.73222438944009 0.51639935352988 0.33507511700481 26.982 > 6 13 Al 0.26777561055991 0.01639935352988 0.16492488299519 26.982 > 7 14 Al 0.76777561055991 0.01639935352988 0.16492488299519 26.982 > 7 15 Al 0.48222438944009 0.98360064647012 0.66492488299519 26.982 > 8 16 Al 0.98222438944009 0.98360064647012 0.66492488299519 26.982 > 8 *17 H 0.08377518192062 0.60654727250525 0.54560812064550 1.008 > 9 18 H 0.58377518192062 0.60654727250525 0.54560812064550 1.008 > 9 19 H 0.16622481807938 0.39345272749475 0.04560812064550 1.008 > 10 20 H 0.66622481807938 0.39345272749475 0.04560812064550 1.008 > 10 21 H 0.33377518192062 0.89345272749475 0.45439187935450 1.008 > 11 22 H 0.83377518192062 0.89345272749475 0.45439187935450 1.008 > 11 23 H 0.41622481807938 0.10654727250525 0.95439187935450 1.008 > 12 24 H 0.91622481807938 0.10654727250525 0.95439187935450 1.008 > 12 25 H 0.41622481807938 0.39345272749475 0.45439187935450 1.008 > 13 26 H 0.91622481807938 0.39345272749475 0.45439187935450 1.008 > 13 27 H 0.33377518192062 0.60654727250525 0.95439187935450 1.008 > 14 28 H 0.83377518192062 0.60654727250525 0.95439187935450 1.008 > 14 29 H 0.16622481807938 0.10654727250525 0.54560812064550 1.008 > 15 30 H 0.66622481807938 0.10654727250525 0.54560812064550 1.008 > 15 31 H 0.08377518192062 0.89345272749475 0.04560812064550 1.008 > 16 32 H 0.58377518192062 0.89345272749475 0.04560812064550 1.008 > 16 *33 H 0.16870655472625 0.69763765714805 0.11228232705628 1.008 > 17 34 H 0.66870655472625 0.69763765714805 0.11228232705628 1.008 > 17 35 H 0.08129344527375 0.30236234285195 0.61228232705628 1.008 > 18 36 H 0.58129344527375 0.30236234285195 0.61228232705628 1.008 > 18 37 H 0.41870655472625 0.80236234285195 0.88771767294372 1.008 > 19 38 H 0.91870655472625 0.80236234285195 0.88771767294372 1.008 > 19 39 H 0.33129344527375 0.19763765714805 0.38771767294372 1.008 > 20 40 H 0.83129344527375 0.19763765714805 0.38771767294372 1.008 > 20 41 H 0.33129344527375 0.30236234285195 0.88771767294372 1.008 > 21 42 H 0.83129344527375 0.30236234285195 0.88771767294372 1.008 > 21 43 H 0.41870655472625 0.69763765714805 0.38771767294372 1.008 > 22 44 H 0.91870655472625 0.69763765714805 0.38771767294372 1.008 > 22 45 H 0.08129344527375 0.19763765714805 0.11228232705628 1.008 > 23 46 H 0.58129344527375 0.19763765714805 0.11228232705628 1.008 > 23 47 H 0.16870655472625 0.80236234285195 0.61228232705628 1.008 > 24 48 H 0.66870655472625 0.80236234285195 0.61228232705628 1.008 > 24 *49 H 0.41532595767513 0.69536553697764 0.69376204327104 1.008 > 25 50 H 0.91532595767513 0.69536553697764 0.69376204327104 1.008 > 25 51 H 0.33467404232487 0.30463446302236 0.19376204327104 1.008 > 26 52 H 0.83467404232487 0.30463446302236 0.19376204327104 1.008 > 26 53 H 0.16532595767513 0.80463446302236 0.30623795672896 1.008 > 27 54 H 0.66532595767513 0.80463446302236 0.30623795672896 1.008 > 27 55 H 0.08467404232487 0.19536553697764 0.80623795672896 1.008 > 28 56 H 0.58467404232487 0.19536553697764 0.80623795672896 1.008 > 28 57 H 0.08467404232487 0.30463446302236 0.30623795672896 1.008 > 29 58 H 0.58467404232487 0.30463446302236 0.30623795672896 1.008 > 29 59 H 0.16532595767513 0.69536553697764 0.80623795672896 1.008 > 30 60 H 0.66532595767513 0.69536553697764 0.80623795672896 1.008 > 30 61 H 0.33467404232487 0.19536553697764 0.69376204327104 1.008 > 31 62 H 0.83467404232487 0.19536553697764 0.69376204327104 1.008 > 31 63 H 0.41532595767513 0.80463446302236 0.19376204327104 1.008 > 32 64 H 0.91532595767513 0.80463446302236 0.19376204327104 1.008 > 32 *65 O 0.18068402611166 0.61372614779434 0.51984432086167 15.999 > 33 66 O 0.68068402611166 0.61372614779434 0.51984432086167 15.999 > 33 67 O 0.06931597388834 0.38627385220566 0.01984432086167 15.999 > 34 68 O 0.56931597388834 0.38627385220566 0.01984432086167 15.999 > 34 69 O 0.43068402611166 0.88627385220566 0.48015567913833 15.999 > 35 70 O 0.93068402611166 0.88627385220566 0.48015567913833 15.999 > 35 71 O 0.31931597388834 0.11372614779434 0.98015567913833 15.999 > 36 72 O 0.81931597388834 0.11372614779434 0.98015567913833 15.999 > 36 73 O 0.31931597388834 0.38627385220566 0.48015567913833 15.999 > 37 74 O 0.81931597388834 0.38627385220566 0.48015567913833 15.999 > 37 75 O 0.43068402611166 0.61372614779434 0.98015567913833 15.999 > 38 76 O 0.93068402611166 0.61372614779434 0.98015567913833 15.999 > 38 77 O 0.06931597388834 0.11372614779434 0.51984432086167 15.999 > 39 78 O 0.56931597388834 0.11372614779434 0.51984432086167 15.999 > 39 79 O 0.18068402611166 0.88627385220566 0.01984432086167 15.999 > 40 80 O 0.68068402611166 0.88627385220566 0.01984432086167 15.999 > 40 *81 O 0.13327079497017 0.63540356941407 0.19671550058548 15.999 > 41 82 O 0.63327079497017 0.63540356941407 0.19671550058548 15.999 > 41 83 O 0.11672920502983 0.36459643058593 0.69671550058548 15.999 > 42 84 O 0.61672920502983 0.36459643058593 0.69671550058548 15.999 > 42 85 O 0.38327079497017 0.86459643058593 0.80328449941452 15.999 > 43 86 O 0.88327079497017 0.86459643058593 0.80328449941452 15.999 > 43 87 O 0.36672920502983 0.13540356941407 0.30328449941452 15.999 > 44 88 O 0.86672920502983 0.13540356941407 0.30328449941452 15.999 > 44 89 O 0.36672920502983 0.36459643058593 0.80328449941452 15.999 > 45 90 O 0.86672920502983 0.36459643058593 0.80328449941452 15.999 > 45 91 O 0.38327079497017 0.63540356941407 0.30328449941452 15.999 > 46 92 O 0.88327079497017 0.63540356941407 0.30328449941452 15.999 > 46 93 O 0.11672920502983 0.13540356941407 0.19671550058548 15.999 > 47 94 O 0.61672920502983 0.13540356941407 0.19671550058548 15.999 > 47 95 O 0.13327079497017 0.86459643058593 0.69671550058548 15.999 > 48 96 O 0.63327079497017 0.86459643058593 0.69671550058548 15.999 > 48 *97 O 0.43160545992535 0.59030088865947 0.66933063790331 15.999 > 49 98 O 0.93160545992535 0.59030088865947 0.66933063790331 15.999 > 49 99 O 0.31839454007465 0.40969911134053 0.16933063790331 15.999 > 50 100 O 0.81839454007465 0.40969911134053 0.16933063790331 15.999 > 50 101 O 0.18160545992535 0.90969911134053 0.33066936209669 15.999 > 51 102 O 0.68160545992535 0.90969911134053 0.33066936209669 15.999 > 51 103 O 0.06839454007465 0.09030088865947 0.83066936209669 15.999 > 52 104 O 0.56839454007465 0.09030088865947 0.83066936209669 15.999 > 52 105 O 0.06839454007465 0.40969911134053 0.33066936209669 15.999 > 53 106 O 0.56839454007465 0.40969911134053 0.33066936209669 15.999 > 53 107 O 0.18160545992535 0.59030088865947 0.83066936209669 15.999 > 54 108 O 0.68160545992535 0.59030088865947 0.83066936209669 15.999 > 54 109 O 0.31839454007465 0.09030088865947 0.66933063790331 15.999 > 55 110 O 0.81839454007465 0.09030088865947 0.66933063790331 15.999 > 55 111 O 0.43160545992535 0.90969911134053 0.16933063790331 15.999 > 56 112 O 0.93160545992535 0.90969911134053 0.16933063790331 15.999 > 56 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.7736624 0.0000000 0.0000000 0.0000000 2.8609904 0.0000000 0.0000000 0.0000000 2.7783059 -------------------------- Born effective charges -------------------------- 1 Al 2.9692874 -0.0155942 -0.0240472 -0.0031800 2.7016293 0.0768364 -0.0060786 -0.0163173 2.8870325 2 Al 2.9692874 -0.0155942 0.0240472 -0.0031800 2.7016293 -0.0768364 0.0060786 0.0163173 2.8870325 3 Al 2.9692874 0.0155942 0.0240472 0.0031800 2.7016293 0.0768364 0.0060786 -0.0163173 2.8870325 4 Al 2.9692874 0.0155942 -0.0240472 0.0031800 2.7016293 -0.0768364 -0.0060786 0.0163173 2.8870325 5 Al 2.9692874 -0.0155942 -0.0240472 -0.0031800 2.7016293 0.0768364 -0.0060786 -0.0163173 2.8870325 6 Al 2.9692874 -0.0155942 0.0240472 -0.0031800 2.7016293 -0.0768364 0.0060786 0.0163173 2.8870325 7 Al 2.9692874 0.0155942 0.0240472 0.0031800 2.7016293 0.0768364 0.0060786 -0.0163173 2.8870325 8 Al 2.9692874 0.0155942 -0.0240472 0.0031800 2.7016293 -0.0768364 -0.0060786 0.0163173 2.8870325 9 H 0.8428311 0.0211861 -0.2366947 0.0279227 0.3932636 -0.0165120 -0.2747509 -0.0077630 0.5445812 10 H 0.8428311 0.0211861 0.2366947 0.0279227 0.3932636 0.0165120 0.2747509 0.0077630 0.5445812 11 H 0.8428311 -0.0211861 0.2366947 -0.0279227 0.3932636 -0.0165120 0.2747509 -0.0077630 0.5445812 12 H 0.8428311 -0.0211861 -0.2366947 -0.0279227 0.3932636 0.0165120 -0.2747509 0.0077630 0.5445812 13 H 0.8428311 0.0211861 -0.2366947 0.0279227 0.3932636 -0.0165120 -0.2747509 -0.0077630 0.5445812 14 H 0.8428311 0.0211861 0.2366947 0.0279227 0.3932636 0.0165120 0.2747509 0.0077630 0.5445812 15 H 0.8428311 -0.0211861 0.2366947 -0.0279227 0.3932636 -0.0165120 0.2747509 -0.0077630 0.5445812 16 H 0.8428311 -0.0211861 -0.2366947 -0.0279227 0.3932636 0.0165120 -0.2747509 0.0077630 0.5445812 17 H 0.3742620 0.0460185 -0.0310264 0.0794358 0.8615411 -0.2313624 -0.0601503 -0.1993446 0.5925693 18 H 0.3742620 0.0460185 0.0310264 0.0794358 0.8615411 0.2313624 0.0601503 0.1993446 0.5925693 19 H 0.3742620 -0.0460185 0.0310264 -0.0794358 0.8615411 -0.2313624 0.0601503 -0.1993446 0.5925693 20 H 0.3742620 -0.0460185 -0.0310264 -0.0794358 0.8615411 0.2313624 -0.0601503 0.1993446 0.5925693 21 H 0.3742620 0.0460185 -0.0310264 0.0794358 0.8615411 -0.2313624 -0.0601503 -0.1993446 0.5925693 22 H 0.3742620 0.0460185 0.0310264 0.0794358 0.8615411 0.2313624 0.0601503 0.1993446 0.5925693 23 H 0.3742620 -0.0460185 0.0310264 -0.0794358 0.8615411 -0.2313624 0.0601503 -0.1993446 0.5925693 24 H 0.3742620 -0.0460185 -0.0310264 -0.0794358 0.8615411 0.2313624 -0.0601503 0.1993446 0.5925693 25 H 0.3817466 -0.0906564 -0.0635374 -0.0880493 0.9548050 0.1891504 -0.0670940 0.1870965 0.4918855 26 H 0.3817466 -0.0906564 0.0635374 -0.0880493 0.9548050 -0.1891504 0.0670940 -0.1870965 0.4918855 27 H 0.3817466 0.0906564 0.0635374 0.0880493 0.9548050 0.1891504 0.0670940 0.1870965 0.4918855 28 H 0.3817466 0.0906564 -0.0635374 0.0880493 0.9548050 -0.1891504 -0.0670940 -0.1870965 0.4918855 29 H 0.3817466 -0.0906564 -0.0635374 -0.0880493 0.9548050 0.1891504 -0.0670940 0.1870965 0.4918855 30 H 0.3817466 -0.0906564 0.0635374 -0.0880493 0.9548050 -0.1891504 0.0670940 -0.1870965 0.4918855 31 H 0.3817466 0.0906564 0.0635374 0.0880493 0.9548050 0.1891504 0.0670940 0.1870965 0.4918855 32 H 0.3817466 0.0906564 -0.0635374 0.0880493 0.9548050 -0.1891504 -0.0670940 -0.1870965 0.4918855 33 O -1.4535176 0.2219410 0.1052347 0.1729872 -1.4996884 -0.0621107 0.1728511 -0.1264654 -1.6898892 34 O -1.4535176 0.2219410 -0.1052347 0.1729872 -1.4996884 0.0621107 -0.1728511 0.1264654 -1.6898892 35 O -1.4535176 -0.2219410 -0.1052347 -0.1729872 -1.4996884 -0.0621107 -0.1728511 -0.1264654 -1.6898892 36 O -1.4535176 -0.2219410 0.1052347 -0.1729872 -1.4996884 0.0621107 0.1728511 0.1264654 -1.6898892 37 O -1.4535176 0.2219410 0.1052347 0.1729872 -1.4996884 -0.0621107 0.1728511 -0.1264654 -1.6898892 38 O -1.4535176 0.2219410 -0.1052347 0.1729872 -1.4996884 0.0621107 -0.1728511 0.1264654 -1.6898892 39 O -1.4535176 -0.2219410 -0.1052347 -0.1729872 -1.4996884 -0.0621107 -0.1728511 -0.1264654 -1.6898892 40 O -1.4535176 -0.2219410 0.1052347 -0.1729872 -1.4996884 0.0621107 0.1728511 0.1264654 -1.6898892 41 O -1.4346893 -0.1483195 -0.1771223 -0.2074037 -1.8236783 0.1141533 -0.1419305 0.1148158 -1.4158116 42 O -1.4346893 -0.1483195 0.1771223 -0.2074037 -1.8236783 -0.1141533 0.1419305 -0.1148158 -1.4158116 43 O -1.4346893 0.1483195 0.1771223 0.2074037 -1.8236783 0.1141533 0.1419305 0.1148158 -1.4158116 44 O -1.4346893 0.1483195 -0.1771223 0.2074037 -1.8236783 -0.1141533 -0.1419305 -0.1148158 -1.4158116 45 O -1.4346893 -0.1483195 -0.1771223 -0.2074037 -1.8236783 0.1141533 -0.1419305 0.1148158 -1.4158116 46 O -1.4346893 -0.1483195 0.1771223 -0.2074037 -1.8236783 -0.1141533 0.1419305 -0.1148158 -1.4158116 47 O -1.4346893 0.1483195 0.1771223 0.2074037 -1.8236783 0.1141533 0.1419305 0.1148158 -1.4158116 48 O -1.4346893 0.1483195 -0.1771223 0.2074037 -1.8236783 -0.1141533 -0.1419305 -0.1148158 -1.4158116 49 O -1.6799201 -0.0564439 0.0405398 -0.0716622 -1.5878722 0.0984903 -0.0222652 -0.0001106 -1.4103676 50 O -1.6799201 -0.0564439 -0.0405398 -0.0716622 -1.5878722 -0.0984903 0.0222652 0.0001106 -1.4103676 51 O -1.6799201 0.0564439 -0.0405398 0.0716622 -1.5878722 0.0984903 0.0222652 -0.0001106 -1.4103676 52 O -1.6799201 0.0564439 0.0405398 0.0716622 -1.5878722 -0.0984903 -0.0222652 0.0001106 -1.4103676 53 O -1.6799201 -0.0564439 0.0405398 -0.0716622 -1.5878722 0.0984903 -0.0222652 -0.0001106 -1.4103676 54 O -1.6799201 -0.0564439 -0.0405398 -0.0716622 -1.5878722 -0.0984903 0.0222652 0.0001106 -1.4103676 55 O -1.6799201 0.0564439 -0.0405398 0.0716622 -1.5878722 0.0984903 0.0222652 -0.0001106 -1.4103676 56 O -1.6799201 0.0564439 0.0405398 0.0716622 -1.5878722 -0.0984903 -0.0222652 0.0001106 -1.4103676 ---------------------------------------------------------------------------- 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: 336/336 Permutation basis: 28392/28392 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3654 Number of blocks in projector: 3654 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: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 270 eigenvectors found. (1) Complementary block size: 28 (1) Compute compressed projector. (1) Use standard solver. (1) 14 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 272 eigenvectors found. (1) Complementary block size: 26 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 270 eigenvectors found. (1) Complementary block size: 28 (1) Compute compressed projector. (1) Use standard solver. (1) 14 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 434 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 434 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 434 Use standard eigh solver. Tree of FC basis block matrices: - (3654, 3591), data: False |-- (434, 427), data: True |-- (434, 427), data: True |-- (434, 427), data: True |-- (784, 770), data: False |-- (784, 14), data: (784, 28) @ (28, 14) |-- (284, 270), data: True |-- (500, 486), data: False |-- (500, 12), data: (500, 26) @ (26, 12) |-- (250, 238), data: True |-- (250, 236), data: True |-- (784, 770), data: False |-- (784, 12), data: (784, 26) @ (26, 12) |-- (284, 272), data: True |-- (500, 486), data: False |-- (500, 14), data: (500, 28) @ (28, 14) |-- (250, 236), data: True |-- (250, 236), data: True |-- (784, 770), data: False |-- (784, 14), data: (784, 28) @ (28, 14) |-- (284, 270), data: True |-- (500, 486), data: False |-- (500, 12), data: (500, 26) @ (26, 12) |-- (250, 238), data: True |-- (250, 236), data: True ----- Solver_atoms: 1 -- 112 / 112 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 880 - Time: 0.994 Solver_block: 200 / 880 - Time: 0.880 Solver_block: 300 / 880 - Time: 0.878 Solver_block: 400 / 880 - Time: 0.873 Solver_block: 500 / 880 - Time: 0.880 Solver_block: 600 / 880 - Time: 0.881 Solver_block: 700 / 880 - Time: 0.871 Solver_block: 800 / 880 - Time: 0.879 Solver_block: 880 / 880 - Time: 0.725 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 8.037 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (zz) -0.00000000 (zz) Permutation basis: 336/336 Permutation basis: 28392/28392 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3654 Number of blocks in projector: 3654 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: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 270 eigenvectors found. (1) Complementary block size: 28 (1) Compute compressed projector. (1) Use standard solver. (1) 14 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 272 eigenvectors found. (1) Complementary block size: 26 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 270 eigenvectors found. (1) Complementary block size: 28 (1) Compute compressed projector. (1) Use standard solver. (1) 14 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 434 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 434 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 434 Use standard eigh solver. Tree of FC basis block matrices: - (3654, 3591), data: False |-- (434, 427), data: True |-- (434, 427), data: True |-- (434, 427), data: True |-- (784, 770), data: False |-- (784, 14), data: (784, 28) @ (28, 14) |-- (284, 270), data: True |-- (500, 486), data: False |-- (500, 12), data: (500, 26) @ (26, 12) |-- (250, 238), data: True |-- (250, 236), data: True |-- (784, 770), data: False |-- (784, 12), data: (784, 26) @ (26, 12) |-- (284, 272), data: True |-- (500, 486), data: False |-- (500, 14), data: (500, 28) @ (28, 14) |-- (250, 236), data: True |-- (250, 236), data: True |-- (784, 770), data: False |-- (784, 14), data: (784, 28) @ (28, 14) |-- (284, 270), data: True |-- (500, 486), data: False |-- (500, 12), data: (500, 26) @ (26, 12) |-- (250, 238), data: True |-- (250, 236), data: True Max drift after symmetrization by symfc projector: -0.00000000 (zz) -0.00000000 (zz) 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 2026-01-08 20:36:04]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 20:36:05]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pbca (61) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.002672189999999 0.000000000000000 0.000000000000000 b 0.000000000000000 9.109658050000002 0.000000000000000 c 0.000000000000000 0.000000000000000 8.642401390000000 Atomic positions (fractional): 1 Al 0.96444877888019 0.51639935352988 0.16492488299519 26.982 2 Al 0.53555122111981 0.48360064647012 0.66492488299519 26.982 3 Al 0.46444877888019 0.98360064647012 0.83507511700481 26.982 4 Al 0.03555122111981 0.01639935352988 0.33507511700481 26.982 5 Al 0.03555122111981 0.48360064647012 0.83507511700481 26.982 6 Al 0.46444877888019 0.51639935352988 0.33507511700481 26.982 7 Al 0.53555122111981 0.01639935352988 0.16492488299519 26.982 8 Al 0.96444877888019 0.98360064647012 0.66492488299519 26.982 9 H 0.16755036384124 0.60654727250525 0.54560812064550 1.008 10 H 0.33244963615876 0.39345272749475 0.04560812064550 1.008 11 H 0.66755036384124 0.89345272749475 0.45439187935450 1.008 12 H 0.83244963615876 0.10654727250525 0.95439187935450 1.008 13 H 0.83244963615876 0.39345272749475 0.45439187935450 1.008 14 H 0.66755036384124 0.60654727250525 0.95439187935450 1.008 15 H 0.33244963615876 0.10654727250525 0.54560812064550 1.008 16 H 0.16755036384124 0.89345272749475 0.04560812064550 1.008 17 H 0.33741310945249 0.69763765714805 0.11228232705628 1.008 18 H 0.16258689054751 0.30236234285195 0.61228232705628 1.008 19 H 0.83741310945249 0.80236234285195 0.88771767294372 1.008 20 H 0.66258689054751 0.19763765714805 0.38771767294372 1.008 21 H 0.66258689054751 0.30236234285195 0.88771767294372 1.008 22 H 0.83741310945249 0.69763765714805 0.38771767294372 1.008 23 H 0.16258689054751 0.19763765714805 0.11228232705628 1.008 24 H 0.33741310945249 0.80236234285195 0.61228232705628 1.008 25 H 0.83065191535026 0.69536553697764 0.69376204327104 1.008 26 H 0.66934808464974 0.30463446302236 0.19376204327104 1.008 27 H 0.33065191535026 0.80463446302236 0.30623795672896 1.008 28 H 0.16934808464974 0.19536553697764 0.80623795672896 1.008 29 H 0.16934808464974 0.30463446302236 0.30623795672896 1.008 30 H 0.33065191535026 0.69536553697764 0.80623795672896 1.008 31 H 0.66934808464974 0.19536553697764 0.69376204327104 1.008 32 H 0.83065191535026 0.80463446302236 0.19376204327104 1.008 33 O 0.36136805222332 0.61372614779434 0.51984432086167 15.999 34 O 0.13863194777668 0.38627385220566 0.01984432086167 15.999 35 O 0.86136805222332 0.88627385220566 0.48015567913833 15.999 36 O 0.63863194777668 0.11372614779434 0.98015567913833 15.999 37 O 0.63863194777668 0.38627385220566 0.48015567913833 15.999 38 O 0.86136805222332 0.61372614779434 0.98015567913833 15.999 39 O 0.13863194777668 0.11372614779434 0.51984432086167 15.999 40 O 0.36136805222332 0.88627385220566 0.01984432086167 15.999 41 O 0.26654158994034 0.63540356941407 0.19671550058548 15.999 42 O 0.23345841005966 0.36459643058593 0.69671550058548 15.999 43 O 0.76654158994034 0.86459643058593 0.80328449941452 15.999 44 O 0.73345841005966 0.13540356941407 0.30328449941452 15.999 45 O 0.73345841005966 0.36459643058593 0.80328449941452 15.999 46 O 0.76654158994034 0.63540356941407 0.30328449941452 15.999 47 O 0.23345841005966 0.13540356941407 0.19671550058548 15.999 48 O 0.26654158994034 0.86459643058593 0.69671550058548 15.999 49 O 0.86321091985070 0.59030088865947 0.66933063790331 15.999 50 O 0.63678908014930 0.40969911134053 0.16933063790331 15.999 51 O 0.36321091985071 0.90969911134053 0.33066936209669 15.999 52 O 0.13678908014930 0.09030088865947 0.83066936209669 15.999 53 O 0.13678908014930 0.40969911134053 0.33066936209669 15.999 54 O 0.36321091985071 0.59030088865947 0.83066936209669 15.999 55 O 0.63678908014930 0.09030088865947 0.66933063790331 15.999 56 O 0.86321091985070 0.90969911134053 0.16933063790331 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.005344379999999 0.000000000000000 0.000000000000000 b 0.000000000000000 9.109658050000002 0.000000000000000 c 0.000000000000000 0.000000000000000 8.642401390000000 Atomic positions (fractional): 1 Al 0.48222438944009 0.51639935352988 0.16492488299519 26.982 > 1 2 Al 0.98222438944009 0.51639935352988 0.16492488299519 26.982 > 1 3 Al 0.26777561055991 0.48360064647012 0.66492488299519 26.982 > 3 4 Al 0.76777561055991 0.48360064647012 0.66492488299519 26.982 > 3 5 Al 0.23222438944009 0.98360064647012 0.83507511700481 26.982 > 5 6 Al 0.73222438944009 0.98360064647012 0.83507511700481 26.982 > 5 7 Al 0.01777561055991 0.01639935352988 0.33507511700481 26.982 > 7 8 Al 0.51777561055991 0.01639935352988 0.33507511700481 26.982 > 7 9 Al 0.01777561055991 0.48360064647012 0.83507511700481 26.982 > 9 10 Al 0.51777561055991 0.48360064647012 0.83507511700481 26.982 > 9 11 Al 0.23222438944009 0.51639935352988 0.33507511700481 26.982 > 11 12 Al 0.73222438944009 0.51639935352988 0.33507511700481 26.982 > 11 13 Al 0.26777561055991 0.01639935352988 0.16492488299519 26.982 > 13 14 Al 0.76777561055991 0.01639935352988 0.16492488299519 26.982 > 13 15 Al 0.48222438944009 0.98360064647012 0.66492488299519 26.982 > 15 16 Al 0.98222438944009 0.98360064647012 0.66492488299519 26.982 > 15 17 H 0.08377518192062 0.60654727250525 0.54560812064550 1.008 > 17 18 H 0.58377518192062 0.60654727250525 0.54560812064550 1.008 > 17 19 H 0.16622481807938 0.39345272749475 0.04560812064550 1.008 > 19 20 H 0.66622481807938 0.39345272749475 0.04560812064550 1.008 > 19 21 H 0.33377518192062 0.89345272749475 0.45439187935450 1.008 > 21 22 H 0.83377518192062 0.89345272749475 0.45439187935450 1.008 > 21 23 H 0.41622481807938 0.10654727250525 0.95439187935450 1.008 > 23 24 H 0.91622481807938 0.10654727250525 0.95439187935450 1.008 > 23 25 H 0.41622481807938 0.39345272749475 0.45439187935450 1.008 > 25 26 H 0.91622481807938 0.39345272749475 0.45439187935450 1.008 > 25 27 H 0.33377518192062 0.60654727250525 0.95439187935450 1.008 > 27 28 H 0.83377518192062 0.60654727250525 0.95439187935450 1.008 > 27 29 H 0.16622481807938 0.10654727250525 0.54560812064550 1.008 > 29 30 H 0.66622481807938 0.10654727250525 0.54560812064550 1.008 > 29 31 H 0.08377518192062 0.89345272749475 0.04560812064550 1.008 > 31 32 H 0.58377518192062 0.89345272749475 0.04560812064550 1.008 > 31 33 H 0.16870655472625 0.69763765714805 0.11228232705628 1.008 > 33 34 H 0.66870655472625 0.69763765714805 0.11228232705628 1.008 > 33 35 H 0.08129344527375 0.30236234285195 0.61228232705628 1.008 > 35 36 H 0.58129344527375 0.30236234285195 0.61228232705628 1.008 > 35 37 H 0.41870655472625 0.80236234285195 0.88771767294372 1.008 > 37 38 H 0.91870655472625 0.80236234285195 0.88771767294372 1.008 > 37 39 H 0.33129344527375 0.19763765714805 0.38771767294372 1.008 > 39 40 H 0.83129344527375 0.19763765714805 0.38771767294372 1.008 > 39 41 H 0.33129344527375 0.30236234285195 0.88771767294372 1.008 > 41 42 H 0.83129344527375 0.30236234285195 0.88771767294372 1.008 > 41 43 H 0.41870655472625 0.69763765714805 0.38771767294372 1.008 > 43 44 H 0.91870655472625 0.69763765714805 0.38771767294372 1.008 > 43 45 H 0.08129344527375 0.19763765714805 0.11228232705628 1.008 > 45 46 H 0.58129344527375 0.19763765714805 0.11228232705628 1.008 > 45 47 H 0.16870655472625 0.80236234285195 0.61228232705628 1.008 > 47 48 H 0.66870655472625 0.80236234285195 0.61228232705628 1.008 > 47 49 H 0.41532595767513 0.69536553697764 0.69376204327104 1.008 > 49 50 H 0.91532595767513 0.69536553697764 0.69376204327104 1.008 > 49 51 H 0.33467404232487 0.30463446302236 0.19376204327104 1.008 > 51 52 H 0.83467404232487 0.30463446302236 0.19376204327104 1.008 > 51 53 H 0.16532595767513 0.80463446302236 0.30623795672896 1.008 > 53 54 H 0.66532595767513 0.80463446302236 0.30623795672896 1.008 > 53 55 H 0.08467404232487 0.19536553697764 0.80623795672896 1.008 > 55 56 H 0.58467404232487 0.19536553697764 0.80623795672896 1.008 > 55 57 H 0.08467404232487 0.30463446302236 0.30623795672896 1.008 > 57 58 H 0.58467404232487 0.30463446302236 0.30623795672896 1.008 > 57 59 H 0.16532595767513 0.69536553697764 0.80623795672896 1.008 > 59 60 H 0.66532595767513 0.69536553697764 0.80623795672896 1.008 > 59 61 H 0.33467404232487 0.19536553697764 0.69376204327104 1.008 > 61 62 H 0.83467404232487 0.19536553697764 0.69376204327104 1.008 > 61 63 H 0.41532595767513 0.80463446302236 0.19376204327104 1.008 > 63 64 H 0.91532595767513 0.80463446302236 0.19376204327104 1.008 > 63 65 O 0.18068402611166 0.61372614779434 0.51984432086167 15.999 > 65 66 O 0.68068402611166 0.61372614779434 0.51984432086167 15.999 > 65 67 O 0.06931597388834 0.38627385220566 0.01984432086167 15.999 > 67 68 O 0.56931597388834 0.38627385220566 0.01984432086167 15.999 > 67 69 O 0.43068402611166 0.88627385220566 0.48015567913833 15.999 > 69 70 O 0.93068402611166 0.88627385220566 0.48015567913833 15.999 > 69 71 O 0.31931597388834 0.11372614779434 0.98015567913833 15.999 > 71 72 O 0.81931597388834 0.11372614779434 0.98015567913833 15.999 > 71 73 O 0.31931597388834 0.38627385220566 0.48015567913833 15.999 > 73 74 O 0.81931597388834 0.38627385220566 0.48015567913833 15.999 > 73 75 O 0.43068402611166 0.61372614779434 0.98015567913833 15.999 > 75 76 O 0.93068402611166 0.61372614779434 0.98015567913833 15.999 > 75 77 O 0.06931597388834 0.11372614779434 0.51984432086167 15.999 > 77 78 O 0.56931597388834 0.11372614779434 0.51984432086167 15.999 > 77 79 O 0.18068402611166 0.88627385220566 0.01984432086167 15.999 > 79 80 O 0.68068402611166 0.88627385220566 0.01984432086167 15.999 > 79 81 O 0.13327079497017 0.63540356941407 0.19671550058548 15.999 > 81 82 O 0.63327079497017 0.63540356941407 0.19671550058548 15.999 > 81 83 O 0.11672920502983 0.36459643058593 0.69671550058548 15.999 > 83 84 O 0.61672920502983 0.36459643058593 0.69671550058548 15.999 > 83 85 O 0.38327079497017 0.86459643058593 0.80328449941452 15.999 > 85 86 O 0.88327079497017 0.86459643058593 0.80328449941452 15.999 > 85 87 O 0.36672920502983 0.13540356941407 0.30328449941452 15.999 > 87 88 O 0.86672920502983 0.13540356941407 0.30328449941452 15.999 > 87 89 O 0.36672920502983 0.36459643058593 0.80328449941452 15.999 > 89 90 O 0.86672920502983 0.36459643058593 0.80328449941452 15.999 > 89 91 O 0.38327079497017 0.63540356941407 0.30328449941452 15.999 > 91 92 O 0.88327079497017 0.63540356941407 0.30328449941452 15.999 > 91 93 O 0.11672920502983 0.13540356941407 0.19671550058548 15.999 > 93 94 O 0.61672920502983 0.13540356941407 0.19671550058548 15.999 > 93 95 O 0.13327079497017 0.86459643058593 0.69671550058548 15.999 > 95 96 O 0.63327079497017 0.86459643058593 0.69671550058548 15.999 > 95 97 O 0.43160545992535 0.59030088865947 0.66933063790331 15.999 > 97 98 O 0.93160545992535 0.59030088865947 0.66933063790331 15.999 > 97 99 O 0.31839454007465 0.40969911134053 0.16933063790331 15.999 > 99 100 O 0.81839454007465 0.40969911134053 0.16933063790331 15.999 > 99 101 O 0.18160545992535 0.90969911134053 0.33066936209669 15.999 > 101 102 O 0.68160545992535 0.90969911134053 0.33066936209669 15.999 > 101 103 O 0.06839454007465 0.09030088865947 0.83066936209669 15.999 > 103 104 O 0.56839454007465 0.09030088865947 0.83066936209669 15.999 > 103 105 O 0.06839454007465 0.40969911134053 0.33066936209669 15.999 > 105 106 O 0.56839454007465 0.40969911134053 0.33066936209669 15.999 > 105 107 O 0.18160545992535 0.59030088865947 0.83066936209669 15.999 > 107 108 O 0.68160545992535 0.59030088865947 0.83066936209669 15.999 > 107 109 O 0.31839454007465 0.09030088865947 0.66933063790331 15.999 > 109 110 O 0.81839454007465 0.09030088865947 0.66933063790331 15.999 > 109 111 O 0.43160545992535 0.90969911134053 0.16933063790331 15.999 > 111 112 O 0.93160545992535 0.90969911134053 0.16933063790331 15.999 > 111 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.7736624 0.0000000 0.0000000 0.0000000 2.8609904 0.0000000 0.0000000 0.0000000 2.7783059 -------------------------- Born effective charges -------------------------- 1 Al 2.9692874 -0.0155942 -0.0240472 -0.0031800 2.7016293 0.0768364 -0.0060786 -0.0163173 2.8870325 2 Al 2.9692874 -0.0155942 0.0240472 -0.0031800 2.7016293 -0.0768364 0.0060786 0.0163173 2.8870325 3 Al 2.9692874 0.0155942 0.0240472 0.0031800 2.7016293 0.0768364 0.0060786 -0.0163173 2.8870325 4 Al 2.9692874 0.0155942 -0.0240472 0.0031800 2.7016293 -0.0768364 -0.0060786 0.0163173 2.8870325 5 Al 2.9692874 -0.0155942 -0.0240472 -0.0031800 2.7016293 0.0768364 -0.0060786 -0.0163173 2.8870325 6 Al 2.9692874 -0.0155942 0.0240472 -0.0031800 2.7016293 -0.0768364 0.0060786 0.0163173 2.8870325 7 Al 2.9692874 0.0155942 0.0240472 0.0031800 2.7016293 0.0768364 0.0060786 -0.0163173 2.8870325 8 Al 2.9692874 0.0155942 -0.0240472 0.0031800 2.7016293 -0.0768364 -0.0060786 0.0163173 2.8870325 9 H 0.8428311 0.0211861 -0.2366947 0.0279227 0.3932636 -0.0165120 -0.2747509 -0.0077630 0.5445812 10 H 0.8428311 0.0211861 0.2366947 0.0279227 0.3932636 0.0165120 0.2747509 0.0077630 0.5445812 11 H 0.8428311 -0.0211861 0.2366947 -0.0279227 0.3932636 -0.0165120 0.2747509 -0.0077630 0.5445812 12 H 0.8428311 -0.0211861 -0.2366947 -0.0279227 0.3932636 0.0165120 -0.2747509 0.0077630 0.5445812 13 H 0.8428311 0.0211861 -0.2366947 0.0279227 0.3932636 -0.0165120 -0.2747509 -0.0077630 0.5445812 14 H 0.8428311 0.0211861 0.2366947 0.0279227 0.3932636 0.0165120 0.2747509 0.0077630 0.5445812 15 H 0.8428311 -0.0211861 0.2366947 -0.0279227 0.3932636 -0.0165120 0.2747509 -0.0077630 0.5445812 16 H 0.8428311 -0.0211861 -0.2366947 -0.0279227 0.3932636 0.0165120 -0.2747509 0.0077630 0.5445812 17 H 0.3742620 0.0460185 -0.0310264 0.0794358 0.8615411 -0.2313624 -0.0601503 -0.1993446 0.5925693 18 H 0.3742620 0.0460185 0.0310264 0.0794358 0.8615411 0.2313624 0.0601503 0.1993446 0.5925693 19 H 0.3742620 -0.0460185 0.0310264 -0.0794358 0.8615411 -0.2313624 0.0601503 -0.1993446 0.5925693 20 H 0.3742620 -0.0460185 -0.0310264 -0.0794358 0.8615411 0.2313624 -0.0601503 0.1993446 0.5925693 21 H 0.3742620 0.0460185 -0.0310264 0.0794358 0.8615411 -0.2313624 -0.0601503 -0.1993446 0.5925693 22 H 0.3742620 0.0460185 0.0310264 0.0794358 0.8615411 0.2313624 0.0601503 0.1993446 0.5925693 23 H 0.3742620 -0.0460185 0.0310264 -0.0794358 0.8615411 -0.2313624 0.0601503 -0.1993446 0.5925693 24 H 0.3742620 -0.0460185 -0.0310264 -0.0794358 0.8615411 0.2313624 -0.0601503 0.1993446 0.5925693 25 H 0.3817466 -0.0906564 -0.0635374 -0.0880493 0.9548050 0.1891504 -0.0670940 0.1870965 0.4918855 26 H 0.3817466 -0.0906564 0.0635374 -0.0880493 0.9548050 -0.1891504 0.0670940 -0.1870965 0.4918855 27 H 0.3817466 0.0906564 0.0635374 0.0880493 0.9548050 0.1891504 0.0670940 0.1870965 0.4918855 28 H 0.3817466 0.0906564 -0.0635374 0.0880493 0.9548050 -0.1891504 -0.0670940 -0.1870965 0.4918855 29 H 0.3817466 -0.0906564 -0.0635374 -0.0880493 0.9548050 0.1891504 -0.0670940 0.1870965 0.4918855 30 H 0.3817466 -0.0906564 0.0635374 -0.0880493 0.9548050 -0.1891504 0.0670940 -0.1870965 0.4918855 31 H 0.3817466 0.0906564 0.0635374 0.0880493 0.9548050 0.1891504 0.0670940 0.1870965 0.4918855 32 H 0.3817466 0.0906564 -0.0635374 0.0880493 0.9548050 -0.1891504 -0.0670940 -0.1870965 0.4918855 33 O -1.4535176 0.2219410 0.1052347 0.1729872 -1.4996884 -0.0621107 0.1728511 -0.1264654 -1.6898892 34 O -1.4535176 0.2219410 -0.1052347 0.1729872 -1.4996884 0.0621107 -0.1728511 0.1264654 -1.6898892 35 O -1.4535176 -0.2219410 -0.1052347 -0.1729872 -1.4996884 -0.0621107 -0.1728511 -0.1264654 -1.6898892 36 O -1.4535176 -0.2219410 0.1052347 -0.1729872 -1.4996884 0.0621107 0.1728511 0.1264654 -1.6898892 37 O -1.4535176 0.2219410 0.1052347 0.1729872 -1.4996884 -0.0621107 0.1728511 -0.1264654 -1.6898892 38 O -1.4535176 0.2219410 -0.1052347 0.1729872 -1.4996884 0.0621107 -0.1728511 0.1264654 -1.6898892 39 O -1.4535176 -0.2219410 -0.1052347 -0.1729872 -1.4996884 -0.0621107 -0.1728511 -0.1264654 -1.6898892 40 O -1.4535176 -0.2219410 0.1052347 -0.1729872 -1.4996884 0.0621107 0.1728511 0.1264654 -1.6898892 41 O -1.4346893 -0.1483195 -0.1771223 -0.2074037 -1.8236783 0.1141533 -0.1419305 0.1148158 -1.4158116 42 O -1.4346893 -0.1483195 0.1771223 -0.2074037 -1.8236783 -0.1141533 0.1419305 -0.1148158 -1.4158116 43 O -1.4346893 0.1483195 0.1771223 0.2074037 -1.8236783 0.1141533 0.1419305 0.1148158 -1.4158116 44 O -1.4346893 0.1483195 -0.1771223 0.2074037 -1.8236783 -0.1141533 -0.1419305 -0.1148158 -1.4158116 45 O -1.4346893 -0.1483195 -0.1771223 -0.2074037 -1.8236783 0.1141533 -0.1419305 0.1148158 -1.4158116 46 O -1.4346893 -0.1483195 0.1771223 -0.2074037 -1.8236783 -0.1141533 0.1419305 -0.1148158 -1.4158116 47 O -1.4346893 0.1483195 0.1771223 0.2074037 -1.8236783 0.1141533 0.1419305 0.1148158 -1.4158116 48 O -1.4346893 0.1483195 -0.1771223 0.2074037 -1.8236783 -0.1141533 -0.1419305 -0.1148158 -1.4158116 49 O -1.6799201 -0.0564439 0.0405398 -0.0716622 -1.5878722 0.0984903 -0.0222652 -0.0001106 -1.4103676 50 O -1.6799201 -0.0564439 -0.0405398 -0.0716622 -1.5878722 -0.0984903 0.0222652 0.0001106 -1.4103676 51 O -1.6799201 0.0564439 -0.0405398 0.0716622 -1.5878722 0.0984903 0.0222652 -0.0001106 -1.4103676 52 O -1.6799201 0.0564439 0.0405398 0.0716622 -1.5878722 -0.0984903 -0.0222652 0.0001106 -1.4103676 53 O -1.6799201 -0.0564439 0.0405398 -0.0716622 -1.5878722 0.0984903 -0.0222652 -0.0001106 -1.4103676 54 O -1.6799201 -0.0564439 -0.0405398 -0.0716622 -1.5878722 -0.0984903 0.0222652 0.0001106 -1.4103676 55 O -1.6799201 0.0564439 -0.0405398 0.0716622 -1.5878722 0.0984903 0.0222652 -0.0001106 -1.4103676 56 O -1.6799201 0.0564439 0.0405398 0.0716622 -1.5878722 -0.0984903 -0.0222652 0.0001106 -1.4103676 ---------------------------------------------------------------------------- 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 17, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 81, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 97, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (yyy) -0.00000000 (yyy) -0.00000000 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (xz) -0.00000000 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 20:36:42]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 20:36:42]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: Pbca (61) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.002672189999999 0.000000000000000 0.000000000000000 b 0.000000000000000 9.109658050000002 0.000000000000000 c 0.000000000000000 0.000000000000000 8.642401390000000 Atomic positions (fractional): 1 Al 0.96444877888019 0.51639935352988 0.16492488299519 26.982 2 Al 0.53555122111981 0.48360064647012 0.66492488299519 26.982 3 Al 0.46444877888019 0.98360064647012 0.83507511700481 26.982 4 Al 0.03555122111981 0.01639935352988 0.33507511700481 26.982 5 Al 0.03555122111981 0.48360064647012 0.83507511700481 26.982 6 Al 0.46444877888019 0.51639935352988 0.33507511700481 26.982 7 Al 0.53555122111981 0.01639935352988 0.16492488299519 26.982 8 Al 0.96444877888019 0.98360064647012 0.66492488299519 26.982 9 H 0.16755036384124 0.60654727250525 0.54560812064550 1.008 10 H 0.33244963615876 0.39345272749475 0.04560812064550 1.008 11 H 0.66755036384124 0.89345272749475 0.45439187935450 1.008 12 H 0.83244963615876 0.10654727250525 0.95439187935450 1.008 13 H 0.83244963615876 0.39345272749475 0.45439187935450 1.008 14 H 0.66755036384124 0.60654727250525 0.95439187935450 1.008 15 H 0.33244963615876 0.10654727250525 0.54560812064550 1.008 16 H 0.16755036384124 0.89345272749475 0.04560812064550 1.008 17 H 0.33741310945249 0.69763765714805 0.11228232705628 1.008 18 H 0.16258689054751 0.30236234285195 0.61228232705628 1.008 19 H 0.83741310945249 0.80236234285195 0.88771767294372 1.008 20 H 0.66258689054751 0.19763765714805 0.38771767294372 1.008 21 H 0.66258689054751 0.30236234285195 0.88771767294372 1.008 22 H 0.83741310945249 0.69763765714805 0.38771767294372 1.008 23 H 0.16258689054751 0.19763765714805 0.11228232705628 1.008 24 H 0.33741310945249 0.80236234285195 0.61228232705628 1.008 25 H 0.83065191535026 0.69536553697764 0.69376204327104 1.008 26 H 0.66934808464974 0.30463446302236 0.19376204327104 1.008 27 H 0.33065191535026 0.80463446302236 0.30623795672896 1.008 28 H 0.16934808464974 0.19536553697764 0.80623795672896 1.008 29 H 0.16934808464974 0.30463446302236 0.30623795672896 1.008 30 H 0.33065191535026 0.69536553697764 0.80623795672896 1.008 31 H 0.66934808464974 0.19536553697764 0.69376204327104 1.008 32 H 0.83065191535026 0.80463446302236 0.19376204327104 1.008 33 O 0.36136805222332 0.61372614779434 0.51984432086167 15.999 34 O 0.13863194777668 0.38627385220566 0.01984432086167 15.999 35 O 0.86136805222332 0.88627385220566 0.48015567913833 15.999 36 O 0.63863194777668 0.11372614779434 0.98015567913833 15.999 37 O 0.63863194777668 0.38627385220566 0.48015567913833 15.999 38 O 0.86136805222332 0.61372614779434 0.98015567913833 15.999 39 O 0.13863194777668 0.11372614779434 0.51984432086167 15.999 40 O 0.36136805222332 0.88627385220566 0.01984432086167 15.999 41 O 0.26654158994034 0.63540356941407 0.19671550058548 15.999 42 O 0.23345841005966 0.36459643058593 0.69671550058548 15.999 43 O 0.76654158994034 0.86459643058593 0.80328449941452 15.999 44 O 0.73345841005966 0.13540356941407 0.30328449941452 15.999 45 O 0.73345841005966 0.36459643058593 0.80328449941452 15.999 46 O 0.76654158994034 0.63540356941407 0.30328449941452 15.999 47 O 0.23345841005966 0.13540356941407 0.19671550058548 15.999 48 O 0.26654158994034 0.86459643058593 0.69671550058548 15.999 49 O 0.86321091985070 0.59030088865947 0.66933063790331 15.999 50 O 0.63678908014930 0.40969911134053 0.16933063790331 15.999 51 O 0.36321091985071 0.90969911134053 0.33066936209669 15.999 52 O 0.13678908014930 0.09030088865947 0.83066936209669 15.999 53 O 0.13678908014930 0.40969911134053 0.33066936209669 15.999 54 O 0.36321091985071 0.59030088865947 0.83066936209669 15.999 55 O 0.63678908014930 0.09030088865947 0.66933063790331 15.999 56 O 0.86321091985070 0.90969911134053 0.16933063790331 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.005344379999999 0.000000000000000 0.000000000000000 b 0.000000000000000 9.109658050000002 0.000000000000000 c 0.000000000000000 0.000000000000000 8.642401390000000 Atomic positions (fractional): 1 Al 0.48222438944009 0.51639935352988 0.16492488299519 26.982 > 1 2 Al 0.98222438944009 0.51639935352988 0.16492488299519 26.982 > 1 3 Al 0.26777561055991 0.48360064647012 0.66492488299519 26.982 > 3 4 Al 0.76777561055991 0.48360064647012 0.66492488299519 26.982 > 3 5 Al 0.23222438944009 0.98360064647012 0.83507511700481 26.982 > 5 6 Al 0.73222438944009 0.98360064647012 0.83507511700481 26.982 > 5 7 Al 0.01777561055991 0.01639935352988 0.33507511700481 26.982 > 7 8 Al 0.51777561055991 0.01639935352988 0.33507511700481 26.982 > 7 9 Al 0.01777561055991 0.48360064647012 0.83507511700481 26.982 > 9 10 Al 0.51777561055991 0.48360064647012 0.83507511700481 26.982 > 9 11 Al 0.23222438944009 0.51639935352988 0.33507511700481 26.982 > 11 12 Al 0.73222438944009 0.51639935352988 0.33507511700481 26.982 > 11 13 Al 0.26777561055991 0.01639935352988 0.16492488299519 26.982 > 13 14 Al 0.76777561055991 0.01639935352988 0.16492488299519 26.982 > 13 15 Al 0.48222438944009 0.98360064647012 0.66492488299519 26.982 > 15 16 Al 0.98222438944009 0.98360064647012 0.66492488299519 26.982 > 15 17 H 0.08377518192062 0.60654727250525 0.54560812064550 1.008 > 17 18 H 0.58377518192062 0.60654727250525 0.54560812064550 1.008 > 17 19 H 0.16622481807938 0.39345272749475 0.04560812064550 1.008 > 19 20 H 0.66622481807938 0.39345272749475 0.04560812064550 1.008 > 19 21 H 0.33377518192062 0.89345272749475 0.45439187935450 1.008 > 21 22 H 0.83377518192062 0.89345272749475 0.45439187935450 1.008 > 21 23 H 0.41622481807938 0.10654727250525 0.95439187935450 1.008 > 23 24 H 0.91622481807938 0.10654727250525 0.95439187935450 1.008 > 23 25 H 0.41622481807938 0.39345272749475 0.45439187935450 1.008 > 25 26 H 0.91622481807938 0.39345272749475 0.45439187935450 1.008 > 25 27 H 0.33377518192062 0.60654727250525 0.95439187935450 1.008 > 27 28 H 0.83377518192062 0.60654727250525 0.95439187935450 1.008 > 27 29 H 0.16622481807938 0.10654727250525 0.54560812064550 1.008 > 29 30 H 0.66622481807938 0.10654727250525 0.54560812064550 1.008 > 29 31 H 0.08377518192062 0.89345272749475 0.04560812064550 1.008 > 31 32 H 0.58377518192062 0.89345272749475 0.04560812064550 1.008 > 31 33 H 0.16870655472625 0.69763765714805 0.11228232705628 1.008 > 33 34 H 0.66870655472625 0.69763765714805 0.11228232705628 1.008 > 33 35 H 0.08129344527375 0.30236234285195 0.61228232705628 1.008 > 35 36 H 0.58129344527375 0.30236234285195 0.61228232705628 1.008 > 35 37 H 0.41870655472625 0.80236234285195 0.88771767294372 1.008 > 37 38 H 0.91870655472625 0.80236234285195 0.88771767294372 1.008 > 37 39 H 0.33129344527375 0.19763765714805 0.38771767294372 1.008 > 39 40 H 0.83129344527375 0.19763765714805 0.38771767294372 1.008 > 39 41 H 0.33129344527375 0.30236234285195 0.88771767294372 1.008 > 41 42 H 0.83129344527375 0.30236234285195 0.88771767294372 1.008 > 41 43 H 0.41870655472625 0.69763765714805 0.38771767294372 1.008 > 43 44 H 0.91870655472625 0.69763765714805 0.38771767294372 1.008 > 43 45 H 0.08129344527375 0.19763765714805 0.11228232705628 1.008 > 45 46 H 0.58129344527375 0.19763765714805 0.11228232705628 1.008 > 45 47 H 0.16870655472625 0.80236234285195 0.61228232705628 1.008 > 47 48 H 0.66870655472625 0.80236234285195 0.61228232705628 1.008 > 47 49 H 0.41532595767513 0.69536553697764 0.69376204327104 1.008 > 49 50 H 0.91532595767513 0.69536553697764 0.69376204327104 1.008 > 49 51 H 0.33467404232487 0.30463446302236 0.19376204327104 1.008 > 51 52 H 0.83467404232487 0.30463446302236 0.19376204327104 1.008 > 51 53 H 0.16532595767513 0.80463446302236 0.30623795672896 1.008 > 53 54 H 0.66532595767513 0.80463446302236 0.30623795672896 1.008 > 53 55 H 0.08467404232487 0.19536553697764 0.80623795672896 1.008 > 55 56 H 0.58467404232487 0.19536553697764 0.80623795672896 1.008 > 55 57 H 0.08467404232487 0.30463446302236 0.30623795672896 1.008 > 57 58 H 0.58467404232487 0.30463446302236 0.30623795672896 1.008 > 57 59 H 0.16532595767513 0.69536553697764 0.80623795672896 1.008 > 59 60 H 0.66532595767513 0.69536553697764 0.80623795672896 1.008 > 59 61 H 0.33467404232487 0.19536553697764 0.69376204327104 1.008 > 61 62 H 0.83467404232487 0.19536553697764 0.69376204327104 1.008 > 61 63 H 0.41532595767513 0.80463446302236 0.19376204327104 1.008 > 63 64 H 0.91532595767513 0.80463446302236 0.19376204327104 1.008 > 63 65 O 0.18068402611166 0.61372614779434 0.51984432086167 15.999 > 65 66 O 0.68068402611166 0.61372614779434 0.51984432086167 15.999 > 65 67 O 0.06931597388834 0.38627385220566 0.01984432086167 15.999 > 67 68 O 0.56931597388834 0.38627385220566 0.01984432086167 15.999 > 67 69 O 0.43068402611166 0.88627385220566 0.48015567913833 15.999 > 69 70 O 0.93068402611166 0.88627385220566 0.48015567913833 15.999 > 69 71 O 0.31931597388834 0.11372614779434 0.98015567913833 15.999 > 71 72 O 0.81931597388834 0.11372614779434 0.98015567913833 15.999 > 71 73 O 0.31931597388834 0.38627385220566 0.48015567913833 15.999 > 73 74 O 0.81931597388834 0.38627385220566 0.48015567913833 15.999 > 73 75 O 0.43068402611166 0.61372614779434 0.98015567913833 15.999 > 75 76 O 0.93068402611166 0.61372614779434 0.98015567913833 15.999 > 75 77 O 0.06931597388834 0.11372614779434 0.51984432086167 15.999 > 77 78 O 0.56931597388834 0.11372614779434 0.51984432086167 15.999 > 77 79 O 0.18068402611166 0.88627385220566 0.01984432086167 15.999 > 79 80 O 0.68068402611166 0.88627385220566 0.01984432086167 15.999 > 79 81 O 0.13327079497017 0.63540356941407 0.19671550058548 15.999 > 81 82 O 0.63327079497017 0.63540356941407 0.19671550058548 15.999 > 81 83 O 0.11672920502983 0.36459643058593 0.69671550058548 15.999 > 83 84 O 0.61672920502983 0.36459643058593 0.69671550058548 15.999 > 83 85 O 0.38327079497017 0.86459643058593 0.80328449941452 15.999 > 85 86 O 0.88327079497017 0.86459643058593 0.80328449941452 15.999 > 85 87 O 0.36672920502983 0.13540356941407 0.30328449941452 15.999 > 87 88 O 0.86672920502983 0.13540356941407 0.30328449941452 15.999 > 87 89 O 0.36672920502983 0.36459643058593 0.80328449941452 15.999 > 89 90 O 0.86672920502983 0.36459643058593 0.80328449941452 15.999 > 89 91 O 0.38327079497017 0.63540356941407 0.30328449941452 15.999 > 91 92 O 0.88327079497017 0.63540356941407 0.30328449941452 15.999 > 91 93 O 0.11672920502983 0.13540356941407 0.19671550058548 15.999 > 93 94 O 0.61672920502983 0.13540356941407 0.19671550058548 15.999 > 93 95 O 0.13327079497017 0.86459643058593 0.69671550058548 15.999 > 95 96 O 0.63327079497017 0.86459643058593 0.69671550058548 15.999 > 95 97 O 0.43160545992535 0.59030088865947 0.66933063790331 15.999 > 97 98 O 0.93160545992535 0.59030088865947 0.66933063790331 15.999 > 97 99 O 0.31839454007465 0.40969911134053 0.16933063790331 15.999 > 99 100 O 0.81839454007465 0.40969911134053 0.16933063790331 15.999 > 99 101 O 0.18160545992535 0.90969911134053 0.33066936209669 15.999 > 101 102 O 0.68160545992535 0.90969911134053 0.33066936209669 15.999 > 101 103 O 0.06839454007465 0.09030088865947 0.83066936209669 15.999 > 103 104 O 0.56839454007465 0.09030088865947 0.83066936209669 15.999 > 103 105 O 0.06839454007465 0.40969911134053 0.33066936209669 15.999 > 105 106 O 0.56839454007465 0.40969911134053 0.33066936209669 15.999 > 105 107 O 0.18160545992535 0.59030088865947 0.83066936209669 15.999 > 107 108 O 0.68160545992535 0.59030088865947 0.83066936209669 15.999 > 107 109 O 0.31839454007465 0.09030088865947 0.66933063790331 15.999 > 109 110 O 0.81839454007465 0.09030088865947 0.66933063790331 15.999 > 109 111 O 0.43160545992535 0.90969911134053 0.16933063790331 15.999 > 111 112 O 0.93160545992535 0.90969911134053 0.16933063790331 15.999 > 111 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.7736624 0.0000000 0.0000000 0.0000000 2.8609904 0.0000000 0.0000000 0.0000000 2.7783059 -------------------------- Born effective charges -------------------------- 1 Al 2.9692874 -0.0155942 -0.0240472 -0.0031800 2.7016293 0.0768364 -0.0060786 -0.0163173 2.8870325 2 Al 2.9692874 -0.0155942 0.0240472 -0.0031800 2.7016293 -0.0768364 0.0060786 0.0163173 2.8870325 3 Al 2.9692874 0.0155942 0.0240472 0.0031800 2.7016293 0.0768364 0.0060786 -0.0163173 2.8870325 4 Al 2.9692874 0.0155942 -0.0240472 0.0031800 2.7016293 -0.0768364 -0.0060786 0.0163173 2.8870325 5 Al 2.9692874 -0.0155942 -0.0240472 -0.0031800 2.7016293 0.0768364 -0.0060786 -0.0163173 2.8870325 6 Al 2.9692874 -0.0155942 0.0240472 -0.0031800 2.7016293 -0.0768364 0.0060786 0.0163173 2.8870325 7 Al 2.9692874 0.0155942 0.0240472 0.0031800 2.7016293 0.0768364 0.0060786 -0.0163173 2.8870325 8 Al 2.9692874 0.0155942 -0.0240472 0.0031800 2.7016293 -0.0768364 -0.0060786 0.0163173 2.8870325 9 H 0.8428311 0.0211861 -0.2366947 0.0279227 0.3932636 -0.0165120 -0.2747509 -0.0077630 0.5445812 10 H 0.8428311 0.0211861 0.2366947 0.0279227 0.3932636 0.0165120 0.2747509 0.0077630 0.5445812 11 H 0.8428311 -0.0211861 0.2366947 -0.0279227 0.3932636 -0.0165120 0.2747509 -0.0077630 0.5445812 12 H 0.8428311 -0.0211861 -0.2366947 -0.0279227 0.3932636 0.0165120 -0.2747509 0.0077630 0.5445812 13 H 0.8428311 0.0211861 -0.2366947 0.0279227 0.3932636 -0.0165120 -0.2747509 -0.0077630 0.5445812 14 H 0.8428311 0.0211861 0.2366947 0.0279227 0.3932636 0.0165120 0.2747509 0.0077630 0.5445812 15 H 0.8428311 -0.0211861 0.2366947 -0.0279227 0.3932636 -0.0165120 0.2747509 -0.0077630 0.5445812 16 H 0.8428311 -0.0211861 -0.2366947 -0.0279227 0.3932636 0.0165120 -0.2747509 0.0077630 0.5445812 17 H 0.3742620 0.0460185 -0.0310264 0.0794358 0.8615411 -0.2313624 -0.0601503 -0.1993446 0.5925693 18 H 0.3742620 0.0460185 0.0310264 0.0794358 0.8615411 0.2313624 0.0601503 0.1993446 0.5925693 19 H 0.3742620 -0.0460185 0.0310264 -0.0794358 0.8615411 -0.2313624 0.0601503 -0.1993446 0.5925693 20 H 0.3742620 -0.0460185 -0.0310264 -0.0794358 0.8615411 0.2313624 -0.0601503 0.1993446 0.5925693 21 H 0.3742620 0.0460185 -0.0310264 0.0794358 0.8615411 -0.2313624 -0.0601503 -0.1993446 0.5925693 22 H 0.3742620 0.0460185 0.0310264 0.0794358 0.8615411 0.2313624 0.0601503 0.1993446 0.5925693 23 H 0.3742620 -0.0460185 0.0310264 -0.0794358 0.8615411 -0.2313624 0.0601503 -0.1993446 0.5925693 24 H 0.3742620 -0.0460185 -0.0310264 -0.0794358 0.8615411 0.2313624 -0.0601503 0.1993446 0.5925693 25 H 0.3817466 -0.0906564 -0.0635374 -0.0880493 0.9548050 0.1891504 -0.0670940 0.1870965 0.4918855 26 H 0.3817466 -0.0906564 0.0635374 -0.0880493 0.9548050 -0.1891504 0.0670940 -0.1870965 0.4918855 27 H 0.3817466 0.0906564 0.0635374 0.0880493 0.9548050 0.1891504 0.0670940 0.1870965 0.4918855 28 H 0.3817466 0.0906564 -0.0635374 0.0880493 0.9548050 -0.1891504 -0.0670940 -0.1870965 0.4918855 29 H 0.3817466 -0.0906564 -0.0635374 -0.0880493 0.9548050 0.1891504 -0.0670940 0.1870965 0.4918855 30 H 0.3817466 -0.0906564 0.0635374 -0.0880493 0.9548050 -0.1891504 0.0670940 -0.1870965 0.4918855 31 H 0.3817466 0.0906564 0.0635374 0.0880493 0.9548050 0.1891504 0.0670940 0.1870965 0.4918855 32 H 0.3817466 0.0906564 -0.0635374 0.0880493 0.9548050 -0.1891504 -0.0670940 -0.1870965 0.4918855 33 O -1.4535176 0.2219410 0.1052347 0.1729872 -1.4996884 -0.0621107 0.1728511 -0.1264654 -1.6898892 34 O -1.4535176 0.2219410 -0.1052347 0.1729872 -1.4996884 0.0621107 -0.1728511 0.1264654 -1.6898892 35 O -1.4535176 -0.2219410 -0.1052347 -0.1729872 -1.4996884 -0.0621107 -0.1728511 -0.1264654 -1.6898892 36 O -1.4535176 -0.2219410 0.1052347 -0.1729872 -1.4996884 0.0621107 0.1728511 0.1264654 -1.6898892 37 O -1.4535176 0.2219410 0.1052347 0.1729872 -1.4996884 -0.0621107 0.1728511 -0.1264654 -1.6898892 38 O -1.4535176 0.2219410 -0.1052347 0.1729872 -1.4996884 0.0621107 -0.1728511 0.1264654 -1.6898892 39 O -1.4535176 -0.2219410 -0.1052347 -0.1729872 -1.4996884 -0.0621107 -0.1728511 -0.1264654 -1.6898892 40 O -1.4535176 -0.2219410 0.1052347 -0.1729872 -1.4996884 0.0621107 0.1728511 0.1264654 -1.6898892 41 O -1.4346893 -0.1483195 -0.1771223 -0.2074037 -1.8236783 0.1141533 -0.1419305 0.1148158 -1.4158116 42 O -1.4346893 -0.1483195 0.1771223 -0.2074037 -1.8236783 -0.1141533 0.1419305 -0.1148158 -1.4158116 43 O -1.4346893 0.1483195 0.1771223 0.2074037 -1.8236783 0.1141533 0.1419305 0.1148158 -1.4158116 44 O -1.4346893 0.1483195 -0.1771223 0.2074037 -1.8236783 -0.1141533 -0.1419305 -0.1148158 -1.4158116 45 O -1.4346893 -0.1483195 -0.1771223 -0.2074037 -1.8236783 0.1141533 -0.1419305 0.1148158 -1.4158116 46 O -1.4346893 -0.1483195 0.1771223 -0.2074037 -1.8236783 -0.1141533 0.1419305 -0.1148158 -1.4158116 47 O -1.4346893 0.1483195 0.1771223 0.2074037 -1.8236783 0.1141533 0.1419305 0.1148158 -1.4158116 48 O -1.4346893 0.1483195 -0.1771223 0.2074037 -1.8236783 -0.1141533 -0.1419305 -0.1148158 -1.4158116 49 O -1.6799201 -0.0564439 0.0405398 -0.0716622 -1.5878722 0.0984903 -0.0222652 -0.0001106 -1.4103676 50 O -1.6799201 -0.0564439 -0.0405398 -0.0716622 -1.5878722 -0.0984903 0.0222652 0.0001106 -1.4103676 51 O -1.6799201 0.0564439 -0.0405398 0.0716622 -1.5878722 0.0984903 0.0222652 -0.0001106 -1.4103676 52 O -1.6799201 0.0564439 0.0405398 0.0716622 -1.5878722 -0.0984903 -0.0222652 0.0001106 -1.4103676 53 O -1.6799201 -0.0564439 0.0405398 -0.0716622 -1.5878722 0.0984903 -0.0222652 -0.0001106 -1.4103676 54 O -1.6799201 -0.0564439 -0.0405398 -0.0716622 -1.5878722 -0.0984903 0.0222652 0.0001106 -1.4103676 55 O -1.6799201 0.0564439 -0.0405398 0.0716622 -1.5878722 0.0984903 0.0222652 -0.0001106 -1.4103676 56 O -1.6799201 0.0564439 0.0405398 0.0716622 -1.5878722 -0.0984903 -0.0222652 0.0001106 -1.4103676 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (yyy) -0.00000000 (yyy) -0.00000000 (yyy) Max drift of fc2: -0.00000000 (zz) -0.00000000 (zz) --------------------------- 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 5 6 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.57, Number of G-points: 291, Lambda: 0.10 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/72) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72 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 1.983 ( 0.000 0.000 0.000) 0.000 2.126 ( 0.000 0.000 0.000) 0.000 3.533 ( 0.000 0.000 0.000) 0.000 3.819 ( 0.000 0.000 0.000) 0.000 3.916 ( 0.000 0.000 0.000) 0.000 4.954 ( 0.000 0.000 0.000) 0.000 5.344 ( 0.000 0.000 0.000) 0.000 5.349 ( 0.000 0.000 0.000) 0.000 6.105 ( 0.000 0.000 0.000) 0.000 6.867 ( 0.000 0.000 0.000) 0.000 7.231 ( 0.000 0.000 0.000) 0.000 7.306 ( 0.000 0.000 0.000) 0.000 7.464 ( 0.000 0.000 0.000) 0.000 7.612 ( 0.000 0.000 0.000) 0.000 7.628 ( 0.000 0.000 0.000) 0.000 7.656 ( 0.000 0.000 0.000) 0.000 7.696 ( 0.000 0.000 0.000) 0.000 7.785 ( 0.000 0.000 0.000) 0.000 7.827 ( 0.000 0.000 0.000) 0.000 7.989 ( 0.000 0.000 0.000) 0.000 8.431 ( 0.000 0.000 0.000) 0.000 8.547 ( 0.000 0.000 0.000) 0.000 8.568 ( 0.000 0.000 0.000) 0.000 8.571 ( 0.000 0.000 0.000) 0.000 8.706 ( 0.000 0.000 0.000) 0.000 8.730 ( 0.000 0.000 0.000) 0.000 8.823 ( 0.000 0.000 0.000) 0.000 8.833 ( 0.000 0.000 0.000) 0.000 9.131 ( 0.000 0.000 0.000) 0.000 9.164 ( 0.000 0.000 0.000) 0.000 9.423 ( 0.000 0.000 0.000) 0.000 9.428 ( 0.000 0.000 0.000) 0.000 9.920 ( 0.000 0.000 0.000) 0.000 10.101 ( 0.000 0.000 0.000) 0.000 10.374 ( 0.000 0.000 0.000) 0.000 10.587 ( 0.000 0.000 0.000) 0.000 10.682 ( 0.000 0.000 0.000) 0.000 10.750 ( 0.000 0.000 0.000) 0.000 10.936 ( 0.000 0.000 0.000) 0.000 11.580 ( 0.000 0.000 0.000) 0.000 11.722 ( 0.000 0.000 0.000) 0.000 11.929 ( 0.000 0.000 0.000) 0.000 12.015 ( 0.000 0.000 0.000) 0.000 12.049 ( 0.000 0.000 0.000) 0.000 12.053 ( 0.000 0.000 0.000) 0.000 12.055 ( 0.000 0.000 0.000) 0.000 12.065 ( 0.000 0.000 0.000) 0.000 12.198 ( 0.000 0.000 0.000) 0.000 12.740 ( 0.000 0.000 0.000) 0.000 12.828 ( 0.000 0.000 0.000) 0.000 12.877 ( 0.000 0.000 0.000) 0.000 12.881 ( 0.000 0.000 0.000) 0.000 12.981 ( 0.000 0.000 0.000) 0.000 13.049 ( 0.000 0.000 0.000) 0.000 13.092 ( 0.000 0.000 0.000) 0.000 13.196 ( 0.000 0.000 0.000) 0.000 13.248 ( 0.000 0.000 0.000) 0.000 13.546 ( 0.000 0.000 0.000) 0.000 13.652 ( 0.000 0.000 0.000) 0.000 13.716 ( 0.000 0.000 0.000) 0.000 14.589 ( 0.000 0.000 0.000) 0.000 14.603 ( 0.000 0.000 0.000) 0.000 15.042 ( 0.000 0.000 0.000) 0.000 15.056 ( 0.000 0.000 0.000) 0.000 15.100 ( 0.000 0.000 0.000) 0.000 15.139 ( 0.000 0.000 0.000) 0.000 15.169 ( 0.000 0.000 0.000) 0.000 15.187 ( 0.000 0.000 0.000) 0.000 15.196 ( 0.000 0.000 0.000) 0.000 15.607 ( 0.000 0.000 0.000) 0.000 15.683 ( 0.000 0.000 0.000) 0.000 15.688 ( 0.000 0.000 0.000) 0.000 15.841 ( 0.000 0.000 0.000) 0.000 15.969 ( 0.000 0.000 0.000) 0.000 16.040 ( 0.000 0.000 0.000) 0.000 16.068 ( 0.000 0.000 0.000) 0.000 16.423 ( 0.000 0.000 0.000) 0.000 16.443 ( 0.000 0.000 0.000) 0.000 16.486 ( 0.000 0.000 0.000) 0.000 16.606 ( 0.000 0.000 0.000) 0.000 16.683 ( 0.000 0.000 0.000) 0.000 16.743 ( 0.000 0.000 0.000) 0.000 16.873 ( 0.000 0.000 0.000) 0.000 17.036 ( 0.000 0.000 0.000) 0.000 17.293 ( 0.000 0.000 0.000) 0.000 17.565 ( 0.000 0.000 0.000) 0.000 17.668 ( 0.000 0.000 0.000) 0.000 17.984 ( 0.000 0.000 0.000) 0.000 18.118 ( 0.000 0.000 0.000) 0.000 18.366 ( 0.000 0.000 0.000) 0.000 18.436 ( 0.000 0.000 0.000) 0.000 18.637 ( 0.000 0.000 0.000) 0.000 18.842 ( 0.000 0.000 0.000) 0.000 19.360 ( 0.000 0.000 0.000) 0.000 19.590 ( 0.000 0.000 0.000) 0.000 19.685 ( 0.000 0.000 0.000) 0.000 19.905 ( 0.000 0.000 0.000) 0.000 20.027 ( 0.000 0.000 0.000) 0.000 20.560 ( 0.000 0.000 0.000) 0.000 21.196 ( 0.000 0.000 0.000) 0.000 21.550 ( 0.000 0.000 0.000) 0.000 24.133 ( 0.000 0.000 0.000) 0.000 24.471 ( 0.000 0.000 0.000) 0.000 24.583 ( 0.000 0.000 0.000) 0.000 25.264 ( 0.000 0.000 0.000) 0.000 25.625 ( 0.000 0.000 0.000) 0.000 25.786 ( 0.000 0.000 0.000) 0.000 26.229 ( 0.000 0.000 0.000) 0.000 26.285 ( 0.000 0.000 0.000) 0.000 26.844 ( 0.000 0.000 0.000) 0.000 27.056 ( 0.000 0.000 0.000) 0.000 27.612 ( 0.000 0.000 0.000) 0.000 27.719 ( 0.000 0.000 0.000) 0.000 27.987 ( 0.000 0.000 0.000) 0.000 28.014 ( 0.000 0.000 0.000) 0.000 28.166 ( 0.000 0.000 0.000) 0.000 28.470 ( 0.000 0.000 0.000) 0.000 29.383 ( 0.000 0.000 0.000) 0.000 29.490 ( 0.000 0.000 0.000) 0.000 29.682 ( 0.000 0.000 0.000) 0.000 30.283 ( 0.000 0.000 0.000) 0.000 30.450 ( 0.000 0.000 0.000) 0.000 30.536 ( 0.000 0.000 0.000) 0.000 30.585 ( 0.000 0.000 0.000) 0.000 30.601 ( 0.000 0.000 0.000) 0.000 31.286 ( 0.000 0.000 0.000) 0.000 31.402 ( 0.000 0.000 0.000) 0.000 31.412 ( 0.000 0.000 0.000) 0.000 31.628 ( 0.000 0.000 0.000) 0.000 31.629 ( 0.000 0.000 0.000) 0.000 31.729 ( 0.000 0.000 0.000) 0.000 31.924 ( 0.000 0.000 0.000) 0.000 32.039 ( 0.000 0.000 0.000) 0.000 32.712 ( 0.000 0.000 0.000) 0.000 32.722 ( 0.000 0.000 0.000) 0.000 33.158 ( 0.000 0.000 0.000) 0.000 33.794 ( 0.000 0.000 0.000) 0.000 33.881 ( 0.000 0.000 0.000) 0.000 34.117 ( 0.000 0.000 0.000) 0.000 34.358 ( 0.000 0.000 0.000) 0.000 34.783 ( 0.000 0.000 0.000) 0.000 98.326 ( 0.000 0.000 0.000) 0.000 98.349 ( 0.000 0.000 0.000) 0.000 98.413 ( 0.000 0.000 0.000) 0.000 98.489 ( 0.000 0.000 0.000) 0.000 98.546 ( 0.000 0.000 0.000) 0.000 98.772 ( 0.000 0.000 0.000) 0.000 98.774 ( 0.000 0.000 0.000) 0.000 98.934 ( 0.000 0.000 0.000) 0.000 100.053 ( 0.000 0.000 0.000) 0.000 100.241 ( 0.000 0.000 0.000) 0.000 100.431 ( 0.000 0.000 0.000) 0.000 100.434 ( 0.000 0.000 0.000) 0.000 100.613 ( 0.000 0.000 0.000) 0.000 100.866 ( 0.000 0.000 0.000) 0.000 100.949 ( 0.000 0.000 0.000) 0.000 101.035 ( 0.000 0.000 0.000) 0.000 102.327 ( 0.000 0.000 0.000) 0.000 102.486 ( 0.000 0.000 0.000) 0.000 102.577 ( 0.000 0.000 0.000) 0.000 102.611 ( 0.000 0.000 0.000) 0.000 102.687 ( 0.000 0.000 0.000) 0.000 103.070 ( 0.000 0.000 0.000) 0.000 103.137 ( 0.000 0.000 0.000) 0.000 104.793 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/72) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.542 ( 29.540 0.000 0.000) 29.540 0.944 ( 46.905 0.000 0.000) 46.905 1.644 ( 81.164 0.000 0.000) 81.164 2.201 ( 20.680 0.000 0.000) 20.680 2.632 ( 44.918 0.000 0.000) 44.918 3.606 ( 6.931 0.000 0.000) 6.931 4.176 ( 33.611 0.000 0.000) 33.611 4.256 ( 32.726 0.000 0.000) 32.726 4.937 ( -1.342 0.000 0.000) 1.342 5.383 ( 3.399 0.000 0.000) 3.399 5.387 ( 3.741 0.000 0.000) 3.741 6.089 ( -1.242 0.000 0.000) 1.242 6.844 ( -2.450 0.000 0.000) 2.450 7.061 ( -16.640 0.000 0.000) 16.640 7.246 ( -8.216 0.000 0.000) 8.216 7.429 ( -7.969 0.000 0.000) 7.969 7.471 ( -0.182 0.000 0.000) 0.182 7.512 ( -11.746 0.000 0.000) 11.746 7.602 ( -2.952 0.000 0.000) 2.952 7.680 ( -1.221 0.000 0.000) 1.221 7.693 ( -12.633 0.000 0.000) 12.633 7.835 ( -0.506 0.000 0.000) 0.506 8.103 ( 2.565 0.000 0.000) 2.565 8.138 ( -16.232 0.000 0.000) 16.232 8.427 ( -27.829 0.000 0.000) 27.829 8.530 ( -19.557 0.000 0.000) 19.557 8.573 ( -3.663 0.000 0.000) 3.663 8.623 ( 6.851 0.000 0.000) 6.851 8.696 ( 5.512 0.000 0.000) 5.512 8.862 ( 11.389 0.000 0.000) 11.389 8.914 ( 7.991 0.000 0.000) 7.991 8.930 ( -11.015 0.000 0.000) 11.015 9.212 ( -1.327 0.000 0.000) 1.327 9.325 ( 9.340 0.000 0.000) 9.340 9.865 ( 16.764 0.000 0.000) 16.764 9.921 ( 3.354 0.000 0.000) 3.354 10.261 ( 0.372 0.000 0.000) 0.372 10.493 ( 7.016 0.000 0.000) 7.016 10.717 ( 2.218 0.000 0.000) 2.218 10.758 ( 15.701 0.000 0.000) 15.701 10.770 ( 3.293 0.000 0.000) 3.293 11.129 ( 17.804 0.000 0.000) 17.804 11.548 ( 0.040 0.000 0.000) 0.040 11.855 ( -13.340 0.000 0.000) 13.340 11.884 ( -8.823 0.000 0.000) 8.823 11.911 ( 15.216 0.000 0.000) 15.216 11.915 ( -5.205 0.000 0.000) 5.205 12.017 ( -1.961 0.000 0.000) 1.961 12.197 ( 4.560 0.000 0.000) 4.560 12.310 ( 15.029 0.000 0.000) 15.029 12.347 ( 8.584 0.000 0.000) 8.584 12.496 ( -19.108 0.000 0.000) 19.108 12.623 ( -14.088 0.000 0.000) 14.088 12.690 ( -21.032 0.000 0.000) 21.032 12.926 ( 2.135 0.000 0.000) 2.135 12.953 ( -9.757 0.000 0.000) 9.757 12.980 ( 7.913 0.000 0.000) 7.913 13.119 ( -5.142 0.000 0.000) 5.142 13.275 ( -11.817 0.000 0.000) 11.817 13.438 ( 14.460 0.000 0.000) 14.460 13.477 ( -6.698 0.000 0.000) 6.698 13.477 ( 9.839 0.000 0.000) 9.839 14.097 ( 18.372 0.000 0.000) 18.372 14.461 ( -5.993 0.000 0.000) 5.993 14.694 ( 2.815 0.000 0.000) 2.815 14.900 ( -13.978 0.000 0.000) 13.978 15.012 ( -3.690 0.000 0.000) 3.690 15.116 ( -1.391 0.000 0.000) 1.391 15.166 ( -0.349 0.000 0.000) 0.349 15.202 ( 0.959 0.000 0.000) 0.959 15.274 ( 2.846 0.000 0.000) 2.846 15.590 ( -6.209 0.000 0.000) 6.209 15.607 ( 0.900 0.000 0.000) 0.900 15.719 ( 1.768 0.000 0.000) 1.768 15.739 ( -1.524 0.000 0.000) 1.524 15.824 ( -1.629 0.000 0.000) 1.629 16.019 ( -1.837 0.000 0.000) 1.837 16.022 ( -1.917 0.000 0.000) 1.917 16.486 ( 0.568 0.000 0.000) 0.568 16.534 ( 4.350 0.000 0.000) 4.350 16.557 ( 9.793 0.000 0.000) 9.793 16.609 ( -2.548 0.000 0.000) 2.548 16.645 ( 3.676 0.000 0.000) 3.676 16.719 ( 4.298 0.000 0.000) 4.298 16.964 ( -6.576 0.000 0.000) 6.576 17.099 ( 14.267 0.000 0.000) 14.267 17.286 ( -0.867 0.000 0.000) 0.867 17.301 ( -16.671 0.000 0.000) 16.671 17.862 ( 7.519 0.000 0.000) 7.519 17.864 ( 10.010 0.000 0.000) 10.010 17.947 ( -3.685 0.000 0.000) 3.685 18.057 ( -5.143 0.000 0.000) 5.143 18.333 ( -3.274 0.000 0.000) 3.274 18.646 ( 0.838 0.000 0.000) 0.838 18.747 ( -9.167 0.000 0.000) 9.167 19.008 ( -5.663 0.000 0.000) 5.663 19.366 ( 0.848 0.000 0.000) 0.848 19.591 ( 0.015 0.000 0.000) 0.015 19.676 ( -0.846 0.000 0.000) 0.846 19.913 ( 0.445 0.000 0.000) 0.445 20.147 ( 11.185 0.000 0.000) 11.185 20.528 ( -3.177 0.000 0.000) 3.177 21.246 ( -15.305 0.000 0.000) 15.305 21.549 ( -0.084 0.000 0.000) 0.084 24.173 ( 4.050 0.000 0.000) 4.050 24.243 ( -11.209 0.000 0.000) 11.209 24.877 ( 17.702 0.000 0.000) 17.702 25.448 ( -15.500 0.000 0.000) 15.500 25.754 ( -3.165 0.000 0.000) 3.165 26.088 ( 3.088 0.000 0.000) 3.088 26.144 ( -8.211 0.000 0.000) 8.211 26.277 ( -0.901 0.000 0.000) 0.901 27.056 ( -0.195 0.000 0.000) 0.195 27.104 ( 3.442 0.000 0.000) 3.442 27.488 ( -10.658 0.000 0.000) 10.658 27.721 ( -1.116 0.000 0.000) 1.116 27.964 ( -1.937 0.000 0.000) 1.937 28.038 ( 1.759 0.000 0.000) 1.759 28.066 ( -9.374 0.000 0.000) 9.374 28.401 ( -6.545 0.000 0.000) 6.545 29.455 ( 5.771 0.000 0.000) 5.771 29.807 ( 12.227 0.000 0.000) 12.227 29.903 ( 8.409 0.000 0.000) 8.409 30.287 ( 1.328 0.000 0.000) 1.328 30.313 ( -14.003 0.000 0.000) 14.003 30.562 ( 9.619 0.000 0.000) 9.619 30.565 ( -2.448 0.000 0.000) 2.448 30.620 ( -3.314 0.000 0.000) 3.314 31.341 ( 7.341 0.000 0.000) 7.341 31.432 ( 3.004 0.000 0.000) 3.004 31.474 ( 5.897 0.000 0.000) 5.897 31.688 ( 6.318 0.000 0.000) 6.318 31.809 ( 14.833 0.000 0.000) 14.833 32.024 ( 8.412 0.000 0.000) 8.412 32.094 ( 5.293 0.000 0.000) 5.293 32.688 ( -2.212 0.000 0.000) 2.212 32.700 ( -1.860 0.000 0.000) 1.860 33.017 ( 1.242 0.000 0.000) 1.242 33.318 ( 1.745 0.000 0.000) 1.745 33.749 ( -4.670 0.000 0.000) 4.670 33.856 ( -2.425 0.000 0.000) 2.425 34.084 ( -3.191 0.000 0.000) 3.191 34.307 ( -5.094 0.000 0.000) 5.094 34.735 ( -4.819 0.000 0.000) 4.819 98.375 ( 2.431 0.000 0.000) 2.431 98.406 ( -0.291 0.000 0.000) 0.291 98.510 ( 1.712 0.000 0.000) 1.712 98.548 ( 0.245 0.000 0.000) 0.245 98.747 ( -2.000 0.000 0.000) 2.000 98.767 ( -0.755 0.000 0.000) 0.755 98.970 ( 3.050 0.000 0.000) 3.050 99.340 ( -0.443 0.000 0.000) 0.443 100.067 ( 1.409 0.000 0.000) 1.409 100.271 ( 2.929 0.000 0.000) 2.929 100.434 ( 1.029 0.000 0.000) 1.029 100.461 ( 2.032 0.000 0.000) 2.032 100.604 ( -0.971 0.000 0.000) 0.971 100.847 ( -1.750 0.000 0.000) 1.750 101.030 ( -0.619 0.000 0.000) 0.619 101.322 ( -3.538 0.000 0.000) 3.538 102.338 ( 1.116 0.000 0.000) 1.116 102.463 ( -1.420 0.000 0.000) 1.420 102.579 ( 0.190 0.000 0.000) 0.190 102.672 ( 5.325 0.000 0.000) 5.325 102.695 ( 0.837 0.000 0.000) 0.837 103.036 ( -3.266 0.000 0.000) 3.266 103.209 ( -2.467 0.000 0.000) 2.467 104.701 ( -8.963 0.000 0.000) 8.963 ======================= Grid point 2 (3/72) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.206 ( 36.869 0.000 0.000) 36.869 1.870 ( 45.664 0.000 0.000) 45.664 2.748 ( 32.556 0.000 0.000) 32.556 3.219 ( 75.577 0.000 0.000) 75.577 3.688 ( 56.541 0.000 0.000) 56.541 3.819 ( 14.849 0.000 0.000) 14.849 4.921 ( 0.833 0.000 0.000) 0.833 5.045 ( 50.338 0.000 0.000) 50.338 5.122 ( 50.537 0.000 0.000) 50.537 5.442 ( -0.770 0.000 0.000) 0.770 5.479 ( 5.815 0.000 0.000) 5.815 6.075 ( 0.215 0.000 0.000) 0.215 6.686 ( -17.328 0.000 0.000) 17.328 6.760 ( -6.038 0.000 0.000) 6.038 6.956 ( -16.412 0.000 0.000) 16.412 7.143 ( -33.528 0.000 0.000) 33.528 7.215 ( -16.681 0.000 0.000) 16.681 7.393 ( -0.317 0.000 0.000) 0.317 7.506 ( -2.141 0.000 0.000) 2.141 7.564 ( -25.504 0.000 0.000) 25.504 7.569 ( -0.974 0.000 0.000) 0.974 7.697 ( -7.469 0.000 0.000) 7.469 7.945 ( -7.364 0.000 0.000) 7.364 7.961 ( -4.039 0.000 0.000) 4.039 8.006 ( -28.095 0.000 0.000) 28.095 8.009 ( -8.649 0.000 0.000) 8.649 8.476 ( -4.494 0.000 0.000) 4.494 8.830 ( -0.637 0.000 0.000) 0.637 8.846 ( 12.655 0.000 0.000) 12.655 8.859 ( 7.578 0.000 0.000) 7.578 9.114 ( 11.090 0.000 0.000) 11.090 9.150 ( -5.498 0.000 0.000) 5.498 9.162 ( 17.577 0.000 0.000) 17.577 9.373 ( -3.428 0.000 0.000) 3.428 10.124 ( 10.676 0.000 0.000) 10.676 10.124 ( 12.830 0.000 0.000) 12.830 10.295 ( 5.709 0.000 0.000) 5.709 10.475 ( -9.273 0.000 0.000) 9.273 10.684 ( -8.261 0.000 0.000) 8.261 10.899 ( 6.175 0.000 0.000) 6.175 11.112 ( 17.512 0.000 0.000) 17.512 11.558 ( -16.180 0.000 0.000) 16.180 11.571 ( 23.437 0.000 0.000) 23.437 11.594 ( 3.626 0.000 0.000) 3.626 11.695 ( -10.176 0.000 0.000) 10.176 11.847 ( -0.138 0.000 0.000) 0.138 11.941 ( -6.071 0.000 0.000) 6.071 12.003 ( -22.779 0.000 0.000) 22.779 12.163 ( -25.435 0.000 0.000) 25.435 12.219 ( -9.931 0.000 0.000) 9.931 12.240 ( 5.646 0.000 0.000) 5.646 12.374 ( 0.959 0.000 0.000) 0.959 12.504 ( -1.627 0.000 0.000) 1.627 12.510 ( -3.689 0.000 0.000) 3.689 12.876 ( -3.768 0.000 0.000) 3.768 12.888 ( 11.545 0.000 0.000) 11.545 12.993 ( 6.403 0.000 0.000) 6.403 13.207 ( 14.415 0.000 0.000) 14.415 13.281 ( 3.574 0.000 0.000) 3.574 13.369 ( -0.708 0.000 0.000) 0.708 13.668 ( 8.671 0.000 0.000) 8.671 13.730 ( 13.765 0.000 0.000) 13.765 14.366 ( -4.242 0.000 0.000) 4.242 14.392 ( 8.609 0.000 0.000) 8.609 14.624 ( -10.310 0.000 0.000) 10.310 14.694 ( -2.588 0.000 0.000) 2.588 14.933 ( -3.719 0.000 0.000) 3.719 15.122 ( 2.305 0.000 0.000) 2.305 15.154 ( -1.002 0.000 0.000) 1.002 15.212 ( -0.076 0.000 0.000) 0.076 15.299 ( 0.023 0.000 0.000) 0.023 15.470 ( -5.548 0.000 0.000) 5.548 15.648 ( 3.048 0.000 0.000) 3.048 15.665 ( -5.055 0.000 0.000) 5.055 15.722 ( -1.309 0.000 0.000) 1.309 15.797 ( -0.256 0.000 0.000) 0.256 15.969 ( -3.036 0.000 0.000) 3.036 16.036 ( 3.020 0.000 0.000) 3.020 16.426 ( -2.858 0.000 0.000) 2.858 16.603 ( 0.873 0.000 0.000) 0.873 16.639 ( -7.657 0.000 0.000) 7.657 16.688 ( 5.791 0.000 0.000) 5.791 16.739 ( 5.406 0.000 0.000) 5.406 16.789 ( -6.091 0.000 0.000) 6.091 16.882 ( 8.465 0.000 0.000) 8.465 17.016 ( -7.007 0.000 0.000) 7.007 17.246 ( -3.583 0.000 0.000) 3.583 17.373 ( 12.345 0.000 0.000) 12.345 17.834 ( -7.891 0.000 0.000) 7.891 17.934 ( -2.824 0.000 0.000) 2.824 18.056 ( 11.062 0.000 0.000) 11.062 18.057 ( 6.207 0.000 0.000) 6.207 18.235 ( -6.538 0.000 0.000) 6.538 18.504 ( -13.840 0.000 0.000) 13.840 18.667 ( 1.270 0.000 0.000) 1.270 18.825 ( -12.980 0.000 0.000) 12.980 19.399 ( 2.374 0.000 0.000) 2.374 19.584 ( -0.862 0.000 0.000) 0.862 19.653 ( -1.433 0.000 0.000) 1.433 19.905 ( -1.554 0.000 0.000) 1.554 20.435 ( 16.654 0.000 0.000) 16.654 20.438 ( -5.634 0.000 0.000) 5.634 20.839 ( -23.420 0.000 0.000) 23.420 21.548 ( -0.061 0.000 0.000) 0.061 24.078 ( -5.176 0.000 0.000) 5.176 24.296 ( 8.250 0.000 0.000) 8.250 25.095 ( -18.255 0.000 0.000) 18.255 25.228 ( 17.057 0.000 0.000) 17.057 25.662 ( -5.856 0.000 0.000) 5.856 25.918 ( -13.803 0.000 0.000) 13.803 26.148 ( 2.547 0.000 0.000) 2.547 26.237 ( -3.837 0.000 0.000) 3.837 27.063 ( 1.376 0.000 0.000) 1.376 27.211 ( 7.118 0.000 0.000) 7.118 27.232 ( -13.567 0.000 0.000) 13.567 27.675 ( -2.945 0.000 0.000) 2.945 27.830 ( -13.309 0.000 0.000) 13.309 27.909 ( -3.677 0.000 0.000) 3.677 28.067 ( 0.755 0.000 0.000) 0.755 28.230 ( -9.957 0.000 0.000) 9.957 29.567 ( 5.002 0.000 0.000) 5.002 30.035 ( -13.046 0.000 0.000) 13.046 30.090 ( 8.528 0.000 0.000) 8.528 30.147 ( 20.781 0.000 0.000) 20.781 30.339 ( 3.517 0.000 0.000) 3.517 30.502 ( -6.706 0.000 0.000) 6.706 30.547 ( 1.327 0.000 0.000) 1.327 30.791 ( 12.603 0.000 0.000) 12.603 31.517 ( 5.214 0.000 0.000) 5.214 31.557 ( 12.882 0.000 0.000) 12.882 31.627 ( 8.794 0.000 0.000) 8.794 31.900 ( 15.041 0.000 0.000) 15.041 32.137 ( 16.921 0.000 0.000) 16.921 32.174 ( 4.506 0.000 0.000) 4.506 32.238 ( 8.753 0.000 0.000) 8.753 32.633 ( -2.953 0.000 0.000) 2.953 32.679 ( 0.953 0.000 0.000) 0.953 33.048 ( 1.840 0.000 0.000) 1.840 33.363 ( 2.661 0.000 0.000) 2.661 33.598 ( -10.619 0.000 0.000) 10.619 33.792 ( -3.688 0.000 0.000) 3.688 34.001 ( -4.726 0.000 0.000) 4.726 34.159 ( -9.467 0.000 0.000) 9.467 34.592 ( -9.476 0.000 0.000) 9.476 98.411 ( 0.844 0.000 0.000) 0.844 98.439 ( 3.708 0.000 0.000) 3.708 98.546 ( 1.668 0.000 0.000) 1.668 98.555 ( 0.377 0.000 0.000) 0.377 98.706 ( -1.898 0.000 0.000) 1.898 98.743 ( -1.662 0.000 0.000) 1.662 99.040 ( 3.733 0.000 0.000) 3.733 99.327 ( -0.859 0.000 0.000) 0.859 100.109 ( 2.786 0.000 0.000) 2.786 100.353 ( 5.190 0.000 0.000) 5.190 100.473 ( 2.804 0.000 0.000) 2.804 100.509 ( 2.701 0.000 0.000) 2.701 100.573 ( -2.055 0.000 0.000) 2.055 100.802 ( -2.620 0.000 0.000) 2.620 101.006 ( -1.862 0.000 0.000) 1.862 101.222 ( -6.223 0.000 0.000) 6.223 102.371 ( 2.079 0.000 0.000) 2.079 102.447 ( -0.062 0.000 0.000) 0.062 102.583 ( 0.114 0.000 0.000) 0.114 102.720 ( 1.578 0.000 0.000) 1.578 102.805 ( 7.770 0.000 0.000) 7.770 102.947 ( -5.404 0.000 0.000) 5.404 103.141 ( -4.186 0.000 0.000) 4.186 104.454 ( -15.160 0.000 0.000) 15.160 ======================= Grid point 3 (4/72) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.003 ( 42.451 0.000 0.000) 42.451 2.766 ( 43.928 0.000 0.000) 43.928 3.459 ( 37.810 0.000 0.000) 37.810 4.185 ( 22.341 0.000 0.000) 22.341 4.640 ( 64.020 0.000 0.000) 64.020 4.773 ( 49.780 0.000 0.000) 49.780 4.975 ( 5.084 0.000 0.000) 5.084 5.221 ( -22.965 0.000 0.000) 22.965 5.590 ( 4.151 0.000 0.000) 4.151 6.077 ( 48.469 0.000 0.000) 48.469 6.097 ( 1.916 0.000 0.000) 1.916 6.189 ( 51.375 0.000 0.000) 51.375 6.418 ( -34.220 0.000 0.000) 34.220 6.504 ( -0.749 0.000 0.000) 0.749 6.591 ( -12.019 0.000 0.000) 12.019 6.664 ( -11.140 0.000 0.000) 11.140 6.860 ( -34.652 0.000 0.000) 34.652 6.892 ( -13.935 0.000 0.000) 13.935 7.301 ( -10.149 0.000 0.000) 10.149 7.324 ( -25.215 0.000 0.000) 25.215 7.415 ( -7.191 0.000 0.000) 7.191 7.642 ( -1.548 0.000 0.000) 1.548 7.713 ( 1.597 0.000 0.000) 1.597 7.900 ( -0.257 0.000 0.000) 0.257 7.921 ( 0.104 0.000 0.000) 0.104 7.947 ( 5.278 0.000 0.000) 5.278 8.438 ( 1.400 0.000 0.000) 1.400 8.871 ( 4.393 0.000 0.000) 4.393 8.968 ( 3.163 0.000 0.000) 3.163 9.003 ( -8.553 0.000 0.000) 8.553 9.035 ( 5.141 0.000 0.000) 5.141 9.269 ( -5.614 0.000 0.000) 5.614 9.328 ( 8.690 0.000 0.000) 8.690 9.511 ( 15.313 0.000 0.000) 15.313 10.112 ( -27.479 0.000 0.000) 27.479 10.253 ( 3.746 0.000 0.000) 3.746 10.316 ( -28.005 0.000 0.000) 28.005 10.329 ( 10.258 0.000 0.000) 10.258 10.588 ( 18.679 0.000 0.000) 18.679 10.884 ( -9.699 0.000 0.000) 9.699 11.216 ( -17.939 0.000 0.000) 17.939 11.427 ( 14.061 0.000 0.000) 14.061 11.483 ( -12.431 0.000 0.000) 12.431 11.572 ( -15.578 0.000 0.000) 15.578 11.607 ( -22.812 0.000 0.000) 22.812 11.641 ( -0.397 0.000 0.000) 0.397 11.726 ( -2.129 0.000 0.000) 2.129 11.886 ( -3.502 0.000 0.000) 3.502 11.966 ( -11.690 0.000 0.000) 11.690 12.016 ( -12.630 0.000 0.000) 12.630 12.169 ( 13.934 0.000 0.000) 13.934 12.292 ( -1.746 0.000 0.000) 1.746 12.342 ( -9.801 0.000 0.000) 9.801 12.758 ( 21.675 0.000 0.000) 21.675 13.051 ( 14.792 0.000 0.000) 14.792 13.200 ( 13.085 0.000 0.000) 13.085 13.281 ( 21.963 0.000 0.000) 21.963 13.361 ( 4.745 0.000 0.000) 4.745 13.476 ( 9.515 0.000 0.000) 9.515 13.509 ( 13.607 0.000 0.000) 13.607 13.806 ( 4.825 0.000 0.000) 4.825 13.978 ( 11.500 0.000 0.000) 11.500 14.246 ( -8.640 0.000 0.000) 8.640 14.278 ( -11.128 0.000 0.000) 11.128 14.635 ( -1.931 0.000 0.000) 1.931 14.684 ( 8.201 0.000 0.000) 8.201 14.879 ( -1.478 0.000 0.000) 1.478 15.103 ( -4.860 0.000 0.000) 4.860 15.194 ( -2.045 0.000 0.000) 2.045 15.195 ( 4.720 0.000 0.000) 4.720 15.277 ( -2.424 0.000 0.000) 2.424 15.387 ( -2.208 0.000 0.000) 2.208 15.573 ( -3.491 0.000 0.000) 3.491 15.665 ( -2.833 0.000 0.000) 2.833 15.753 ( 6.668 0.000 0.000) 6.668 15.839 ( 4.535 0.000 0.000) 4.535 15.912 ( -2.220 0.000 0.000) 2.220 16.122 ( 5.167 0.000 0.000) 5.167 16.309 ( -18.214 0.000 0.000) 18.214 16.393 ( -1.045 0.000 0.000) 1.045 16.526 ( -7.354 0.000 0.000) 7.354 16.694 ( -2.502 0.000 0.000) 2.502 16.778 ( 2.795 0.000 0.000) 2.795 16.852 ( 5.759 0.000 0.000) 5.759 16.970 ( -2.464 0.000 0.000) 2.464 17.118 ( 13.030 0.000 0.000) 13.030 17.127 ( -8.346 0.000 0.000) 8.346 17.483 ( -10.399 0.000 0.000) 10.399 17.683 ( 0.791 0.000 0.000) 0.791 17.927 ( 2.053 0.000 0.000) 2.053 18.076 ( -9.155 0.000 0.000) 9.155 18.154 ( 3.153 0.000 0.000) 3.153 18.228 ( -1.223 0.000 0.000) 1.223 18.271 ( -7.555 0.000 0.000) 7.555 18.519 ( -11.032 0.000 0.000) 11.032 18.696 ( 1.568 0.000 0.000) 1.568 19.458 ( 3.456 0.000 0.000) 3.456 19.553 ( -2.132 0.000 0.000) 2.132 19.619 ( -1.976 0.000 0.000) 1.976 19.846 ( -4.287 0.000 0.000) 4.287 20.312 ( -6.620 0.000 0.000) 6.620 20.406 ( -17.785 0.000 0.000) 17.785 20.780 ( 17.257 0.000 0.000) 17.257 21.540 ( -1.120 0.000 0.000) 1.120 24.036 ( 0.907 0.000 0.000) 0.907 24.503 ( 12.410 0.000 0.000) 12.410 24.755 ( -15.457 0.000 0.000) 15.457 25.535 ( -6.300 0.000 0.000) 6.300 25.546 ( 14.514 0.000 0.000) 14.514 25.624 ( -14.842 0.000 0.000) 14.842 26.084 ( -12.264 0.000 0.000) 12.264 26.173 ( -0.423 0.000 0.000) 0.423 27.017 ( -6.325 0.000 0.000) 6.325 27.125 ( 5.054 0.000 0.000) 5.054 27.382 ( 9.744 0.000 0.000) 9.744 27.562 ( -13.038 0.000 0.000) 13.038 27.626 ( -1.423 0.000 0.000) 1.423 27.812 ( -6.222 0.000 0.000) 6.222 28.025 ( -10.133 0.000 0.000) 10.133 28.051 ( -2.661 0.000 0.000) 2.661 29.646 ( 2.700 0.000 0.000) 2.700 29.815 ( -8.644 0.000 0.000) 8.644 30.211 ( 3.750 0.000 0.000) 3.750 30.387 ( -4.484 0.000 0.000) 4.484 30.417 ( 4.118 0.000 0.000) 4.118 30.507 ( 8.222 0.000 0.000) 8.222 30.702 ( 19.320 0.000 0.000) 19.320 31.050 ( 12.965 0.000 0.000) 12.965 31.620 ( 4.596 0.000 0.000) 4.596 31.799 ( 7.450 0.000 0.000) 7.450 31.820 ( 12.916 0.000 0.000) 12.916 32.180 ( -2.248 0.000 0.000) 2.248 32.241 ( 15.676 0.000 0.000) 15.676 32.429 ( 9.964 0.000 0.000) 9.964 32.459 ( 14.891 0.000 0.000) 14.891 32.600 ( 1.716 0.000 0.000) 1.716 32.746 ( 4.520 0.000 0.000) 4.520 33.091 ( 2.540 0.000 0.000) 2.540 33.321 ( -16.927 0.000 0.000) 16.927 33.421 ( 3.273 0.000 0.000) 3.273 33.722 ( -2.839 0.000 0.000) 2.839 33.904 ( -4.886 0.000 0.000) 4.886 33.940 ( -12.165 0.000 0.000) 12.165 34.357 ( -13.891 0.000 0.000) 13.891 98.441 ( 2.133 0.000 0.000) 2.133 98.513 ( 3.579 0.000 0.000) 3.579 98.562 ( 0.351 0.000 0.000) 0.351 98.573 ( 1.016 0.000 0.000) 1.016 98.673 ( -1.415 0.000 0.000) 1.415 98.701 ( -2.552 0.000 0.000) 2.552 99.114 ( 3.542 0.000 0.000) 3.542 99.305 ( -1.282 0.000 0.000) 1.282 100.176 ( 3.916 0.000 0.000) 3.916 100.472 ( 6.608 0.000 0.000) 6.608 100.521 ( -3.208 0.000 0.000) 3.208 100.537 ( 3.212 0.000 0.000) 3.212 100.572 ( 3.853 0.000 0.000) 3.853 100.747 ( -2.786 0.000 0.000) 2.786 100.954 ( -3.341 0.000 0.000) 3.341 101.082 ( -7.649 0.000 0.000) 7.649 102.419 ( 2.717 0.000 0.000) 2.717 102.463 ( 1.701 0.000 0.000) 1.701 102.581 ( -0.394 0.000 0.000) 0.394 102.757 ( 2.208 0.000 0.000) 2.208 102.830 ( -6.155 0.000 0.000) 6.155 102.980 ( 9.783 0.000 0.000) 9.783 103.049 ( -4.819 0.000 0.000) 4.819 104.121 ( -17.517 0.000 0.000) 17.517 ======================= Grid point 4 (5/72) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.880 ( 44.651 0.000 0.000) 44.651 3.622 ( 41.526 0.000 0.000) 41.526 4.236 ( 39.136 0.000 0.000) 39.136 4.591 ( -37.174 0.000 0.000) 37.174 4.624 ( 15.924 0.000 0.000) 15.924 5.080 ( 5.410 0.000 0.000) 5.410 5.577 ( 22.447 0.000 0.000) 22.447 5.584 ( -6.031 0.000 0.000) 6.031 5.707 ( 8.735 0.000 0.000) 8.735 5.801 ( 14.521 0.000 0.000) 14.521 5.854 ( -22.479 0.000 0.000) 22.479 6.219 ( -24.482 0.000 0.000) 24.482 6.375 ( -11.150 0.000 0.000) 11.150 6.447 ( 3.020 0.000 0.000) 3.020 6.695 ( 8.482 0.000 0.000) 8.482 6.746 ( -0.503 0.000 0.000) 0.503 6.867 ( -18.756 0.000 0.000) 18.756 6.935 ( 23.595 0.000 0.000) 23.595 7.039 ( -12.921 0.000 0.000) 12.921 7.041 ( 6.182 0.000 0.000) 6.182 7.438 ( 30.836 0.000 0.000) 30.836 7.686 ( 10.785 0.000 0.000) 10.785 7.797 ( 4.809 0.000 0.000) 4.809 7.969 ( 5.072 0.000 0.000) 5.072 7.976 ( 6.609 0.000 0.000) 6.609 8.189 ( 19.569 0.000 0.000) 19.569 8.561 ( 11.782 0.000 0.000) 11.782 8.855 ( -4.067 0.000 0.000) 4.067 8.983 ( -1.921 0.000 0.000) 1.921 8.995 ( 7.741 0.000 0.000) 7.741 9.029 ( -6.834 0.000 0.000) 6.834 9.188 ( -1.530 0.000 0.000) 1.530 9.345 ( -9.675 0.000 0.000) 9.675 9.411 ( -40.866 0.000 0.000) 40.866 9.629 ( -8.343 0.000 0.000) 8.343 9.662 ( -33.789 0.000 0.000) 33.789 10.340 ( 4.858 0.000 0.000) 4.858 10.535 ( 10.191 0.000 0.000) 10.191 10.578 ( -13.753 0.000 0.000) 13.753 10.895 ( -11.526 0.000 0.000) 11.526 10.939 ( 15.743 0.000 0.000) 15.743 11.274 ( -9.526 0.000 0.000) 9.526 11.278 ( -3.798 0.000 0.000) 3.798 11.423 ( -3.932 0.000 0.000) 3.932 11.491 ( -11.643 0.000 0.000) 11.643 11.658 ( -5.356 0.000 0.000) 5.356 11.706 ( 11.521 0.000 0.000) 11.521 11.800 ( -5.240 0.000 0.000) 5.240 11.849 ( -0.958 0.000 0.000) 0.958 11.865 ( -2.222 0.000 0.000) 2.222 11.907 ( -14.941 0.000 0.000) 14.941 12.153 ( -9.516 0.000 0.000) 9.516 12.799 ( 28.143 0.000 0.000) 28.143 13.131 ( 14.675 0.000 0.000) 14.675 13.296 ( 6.727 0.000 0.000) 6.727 13.444 ( 7.958 0.000 0.000) 7.958 13.511 ( 10.670 0.000 0.000) 10.670 13.640 ( 4.869 0.000 0.000) 4.869 13.668 ( 15.313 0.000 0.000) 15.313 13.675 ( 2.973 0.000 0.000) 2.973 13.852 ( -0.404 0.000 0.000) 0.404 14.039 ( -9.867 0.000 0.000) 9.867 14.117 ( -3.374 0.000 0.000) 3.374 14.186 ( 7.119 0.000 0.000) 7.119 14.649 ( 3.580 0.000 0.000) 3.580 14.817 ( 4.745 0.000 0.000) 4.745 14.869 ( -0.018 0.000 0.000) 0.018 14.957 ( -9.024 0.000 0.000) 9.024 15.120 ( -4.564 0.000 0.000) 4.564 15.197 ( -5.465 0.000 0.000) 5.465 15.299 ( 5.187 0.000 0.000) 5.187 15.377 ( 0.499 0.000 0.000) 0.499 15.535 ( -0.472 0.000 0.000) 0.472 15.599 ( -3.410 0.000 0.000) 3.410 15.891 ( -0.069 0.000 0.000) 0.069 15.906 ( -0.894 0.000 0.000) 0.894 15.951 ( 13.089 0.000 0.000) 13.089 16.136 ( 5.811 0.000 0.000) 5.811 16.246 ( 7.154 0.000 0.000) 7.154 16.363 ( -2.337 0.000 0.000) 2.337 16.391 ( -5.778 0.000 0.000) 5.778 16.647 ( -1.996 0.000 0.000) 1.996 16.798 ( -0.670 0.000 0.000) 0.670 16.881 ( -9.565 0.000 0.000) 9.565 16.889 ( -4.567 0.000 0.000) 4.567 17.027 ( 6.634 0.000 0.000) 6.634 17.059 ( -25.577 0.000 0.000) 25.577 17.374 ( 11.808 0.000 0.000) 11.808 17.794 ( 6.326 0.000 0.000) 6.326 17.817 ( -27.545 0.000 0.000) 27.545 17.876 ( -10.770 0.000 0.000) 10.770 17.962 ( 0.010 0.000 0.000) 0.010 18.194 ( 1.330 0.000 0.000) 1.330 18.207 ( -0.223 0.000 0.000) 0.223 18.593 ( 8.154 0.000 0.000) 8.154 18.723 ( 0.823 0.000 0.000) 0.823 19.515 ( -1.084 0.000 0.000) 1.084 19.536 ( 4.405 0.000 0.000) 4.405 19.573 ( -2.592 0.000 0.000) 2.592 19.744 ( -5.580 0.000 0.000) 5.580 20.166 ( -6.466 0.000 0.000) 6.466 20.188 ( -5.334 0.000 0.000) 5.334 21.102 ( 14.510 0.000 0.000) 14.510 21.487 ( -4.533 0.000 0.000) 4.533 24.106 ( 5.812 0.000 0.000) 5.812 24.478 ( -12.336 0.000 0.000) 12.336 24.785 ( 15.476 0.000 0.000) 15.476 25.348 ( -12.602 0.000 0.000) 12.602 25.440 ( -2.218 0.000 0.000) 2.218 25.770 ( -17.182 0.000 0.000) 17.182 25.804 ( 11.305 0.000 0.000) 11.305 26.124 ( -4.483 0.000 0.000) 4.483 26.995 ( 3.389 0.000 0.000) 3.389 27.266 ( 8.840 0.000 0.000) 8.840 27.318 ( -11.214 0.000 0.000) 11.214 27.588 ( 10.618 0.000 0.000) 10.618 27.629 ( 1.817 0.000 0.000) 1.817 27.659 ( -8.987 0.000 0.000) 8.987 27.838 ( -8.292 0.000 0.000) 8.292 27.957 ( -6.659 0.000 0.000) 6.659 29.673 ( 0.160 0.000 0.000) 0.160 29.696 ( -3.322 0.000 0.000) 3.322 30.260 ( 1.639 0.000 0.000) 1.639 30.322 ( -2.220 0.000 0.000) 2.220 30.498 ( 3.847 0.000 0.000) 3.847 30.575 ( 0.956 0.000 0.000) 0.956 31.137 ( 19.645 0.000 0.000) 19.645 31.290 ( 10.293 0.000 0.000) 10.293 31.685 ( 1.901 0.000 0.000) 1.901 31.848 ( -3.769 0.000 0.000) 3.769 32.059 ( 10.754 0.000 0.000) 10.754 32.219 ( 9.056 0.000 0.000) 9.056 32.352 ( -2.664 0.000 0.000) 2.664 32.620 ( 8.695 0.000 0.000) 8.695 32.717 ( 10.537 0.000 0.000) 10.537 32.786 ( 11.485 0.000 0.000) 11.485 32.807 ( 0.732 0.000 0.000) 0.732 32.937 ( -20.932 0.000 0.000) 20.932 33.177 ( 7.830 0.000 0.000) 7.830 33.510 ( 6.402 0.000 0.000) 6.402 33.687 ( -12.924 0.000 0.000) 12.924 33.693 ( 0.142 0.000 0.000) 0.142 33.809 ( -4.566 0.000 0.000) 4.566 34.044 ( -17.034 0.000 0.000) 17.034 98.493 ( 2.936 0.000 0.000) 2.936 98.567 ( -0.008 0.000 0.000) 0.008 98.576 ( 2.640 0.000 0.000) 2.640 98.587 ( 0.463 0.000 0.000) 0.463 98.644 ( -2.932 0.000 0.000) 2.932 98.648 ( -1.257 0.000 0.000) 1.257 99.179 ( 3.015 0.000 0.000) 3.015 99.275 ( -1.781 0.000 0.000) 1.781 100.262 ( 4.602 0.000 0.000) 4.602 100.446 ( -4.193 0.000 0.000) 4.193 100.593 ( 2.507 0.000 0.000) 2.507 100.613 ( 7.376 0.000 0.000) 7.376 100.666 ( 5.271 0.000 0.000) 5.271 100.693 ( -2.626 0.000 0.000) 2.626 100.874 ( -4.598 0.000 0.000) 4.598 100.924 ( -8.007 0.000 0.000) 8.007 102.476 ( 2.829 0.000 0.000) 2.829 102.515 ( 3.451 0.000 0.000) 3.451 102.564 ( -1.305 0.000 0.000) 1.305 102.708 ( -5.885 0.000 0.000) 5.885 102.808 ( 2.851 0.000 0.000) 2.851 102.955 ( -4.492 0.000 0.000) 4.492 103.197 ( 11.957 0.000 0.000) 11.957 103.774 ( -16.765 0.000 0.000) 16.765 ======================= Grid point 5 (6/72) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 36 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.765 ( -43.341 0.000 0.000) 43.341 3.765 ( 43.341 0.000 0.000) 43.341 4.394 ( -33.269 0.000 0.000) 33.269 4.394 ( 33.269 0.000 0.000) 33.269 5.040 ( -39.546 0.000 0.000) 39.546 5.040 ( 39.546 0.000 0.000) 39.546 5.340 ( -17.452 0.000 0.000) 17.452 5.340 ( 17.452 0.000 0.000) 17.452 5.747 ( -17.849 0.000 0.000) 17.849 5.747 ( 17.849 0.000 0.000) 17.849 6.112 ( -16.399 0.000 0.000) 16.399 6.112 ( 16.399 0.000 0.000) 16.399 6.446 ( -24.519 0.000 0.000) 24.519 6.446 ( 24.519 0.000 0.000) 24.519 6.637 ( -12.179 0.000 0.000) 12.179 6.637 ( 12.179 0.000 0.000) 12.179 6.881 ( -10.237 0.000 0.000) 10.237 6.881 ( 10.237 0.000 0.000) 10.237 7.016 ( -6.949 0.000 0.000) 6.949 7.016 ( 6.949 0.000 0.000) 6.949 7.852 ( -1.484 0.000 0.000) 1.484 7.852 ( 1.484 0.000 0.000) 1.484 7.986 ( -7.832 0.000 0.000) 7.832 7.986 ( 7.832 0.000 0.000) 7.832 8.517 ( -44.569 0.000 0.000) 44.569 8.517 ( 44.569 0.000 0.000) 44.569 8.677 ( -26.401 0.000 0.000) 26.401 8.677 ( 26.401 0.000 0.000) 26.401 8.868 ( -13.754 0.000 0.000) 13.754 8.868 ( 13.754 0.000 0.000) 13.754 8.986 ( -18.944 0.000 0.000) 18.944 8.986 ( 18.944 0.000 0.000) 18.944 9.186 ( -12.765 0.000 0.000) 12.765 9.186 ( 12.765 0.000 0.000) 12.765 9.287 ( -14.800 0.000 0.000) 14.800 9.287 ( 14.800 0.000 0.000) 14.800 10.433 ( -4.311 0.000 0.000) 4.311 10.433 ( 4.311 0.000 0.000) 4.311 10.725 ( -8.348 0.000 0.000) 8.348 10.725 ( 8.348 0.000 0.000) 8.348 11.194 ( -8.958 0.000 0.000) 8.958 11.194 ( 8.958 0.000 0.000) 8.958 11.261 ( -7.944 0.000 0.000) 7.944 11.261 ( 7.944 0.000 0.000) 7.944 11.468 ( -10.194 0.000 0.000) 10.194 11.468 ( 10.194 0.000 0.000) 10.194 11.755 ( -1.086 0.000 0.000) 1.086 11.755 ( 1.086 0.000 0.000) 1.086 11.834 ( -0.833 0.000 0.000) 0.833 11.834 ( 0.833 0.000 0.000) 0.833 11.953 ( -10.295 0.000 0.000) 10.295 11.953 ( 10.295 0.000 0.000) 10.295 13.300 ( -20.149 0.000 0.000) 20.149 13.300 ( 20.149 0.000 0.000) 20.149 13.320 ( -4.030 0.000 0.000) 4.030 13.320 ( 4.030 0.000 0.000) 4.030 13.667 ( -3.456 0.000 0.000) 3.456 13.667 ( 3.456 0.000 0.000) 3.456 13.760 ( -6.306 0.000 0.000) 6.306 13.760 ( 6.306 0.000 0.000) 6.306 13.900 ( -6.377 0.000 0.000) 6.377 13.900 ( 6.377 0.000 0.000) 6.377 14.175 ( -6.533 0.000 0.000) 6.533 14.175 ( 6.533 0.000 0.000) 6.533 14.775 ( -8.469 0.000 0.000) 8.469 14.775 ( 8.469 0.000 0.000) 8.469 14.868 ( -0.534 0.000 0.000) 0.534 14.868 ( 0.534 0.000 0.000) 0.534 15.095 ( -3.022 0.000 0.000) 3.022 15.095 ( 3.022 0.000 0.000) 3.022 15.374 ( -1.700 0.000 0.000) 1.700 15.374 ( 1.700 0.000 0.000) 1.700 15.545 ( -1.587 0.000 0.000) 1.587 15.545 ( 1.587 0.000 0.000) 1.587 15.892 ( -0.010 0.000 0.000) 0.010 15.892 ( 0.010 0.000 0.000) 0.010 16.228 ( -12.221 0.000 0.000) 12.221 16.228 ( 12.221 0.000 0.000) 12.221 16.290 ( -5.294 0.000 0.000) 5.294 16.290 ( 5.294 0.000 0.000) 5.294 16.530 ( -22.024 0.000 0.000) 22.024 16.530 ( 22.024 0.000 0.000) 22.024 16.682 ( -6.987 0.000 0.000) 6.987 16.682 ( 6.987 0.000 0.000) 6.987 16.825 ( -1.171 0.000 0.000) 1.171 16.825 ( 1.171 0.000 0.000) 1.171 17.282 ( -18.270 0.000 0.000) 18.270 17.282 ( 18.270 0.000 0.000) 18.270 17.654 ( -10.789 0.000 0.000) 10.789 17.654 ( 10.789 0.000 0.000) 10.789 17.909 ( -4.814 0.000 0.000) 4.814 17.909 ( 4.814 0.000 0.000) 4.814 18.211 ( -0.153 0.000 0.000) 0.153 18.211 ( 0.153 0.000 0.000) 0.153 18.708 ( -2.958 0.000 0.000) 2.958 18.708 ( 2.958 0.000 0.000) 2.958 19.524 ( -1.885 0.000 0.000) 1.885 19.524 ( 1.885 0.000 0.000) 1.885 19.634 ( -5.305 0.000 0.000) 5.305 19.634 ( 5.305 0.000 0.000) 5.305 20.119 ( -1.086 0.000 0.000) 1.086 20.119 ( 1.086 0.000 0.000) 1.086 21.346 ( -9.683 0.000 0.000) 9.683 21.346 ( 9.683 0.000 0.000) 9.683 24.260 ( -9.413 0.000 0.000) 9.413 24.260 ( 9.413 0.000 0.000) 9.413 25.092 ( -14.175 0.000 0.000) 14.175 25.092 ( 14.175 0.000 0.000) 14.175 25.492 ( -8.534 0.000 0.000) 8.534 25.492 ( 8.534 0.000 0.000) 8.534 25.998 ( -8.045 0.000 0.000) 8.045 25.998 ( 8.045 0.000 0.000) 8.045 27.119 ( -8.456 0.000 0.000) 8.456 27.119 ( 8.456 0.000 0.000) 8.456 27.462 ( -10.280 0.000 0.000) 10.280 27.462 ( 10.280 0.000 0.000) 10.280 27.701 ( -5.318 0.000 0.000) 5.318 27.701 ( 5.318 0.000 0.000) 5.318 27.793 ( -9.515 0.000 0.000) 9.515 27.793 ( 9.515 0.000 0.000) 9.515 29.668 ( -0.013 0.000 0.000) 0.013 29.668 ( 0.013 0.000 0.000) 0.013 30.289 ( -1.371 0.000 0.000) 1.371 30.289 ( 1.371 0.000 0.000) 1.371 30.561 ( -2.156 0.000 0.000) 2.156 30.561 ( 2.156 0.000 0.000) 2.156 31.386 ( -3.454 0.000 0.000) 3.454 31.386 ( 3.454 0.000 0.000) 3.454 31.735 ( -4.763 0.000 0.000) 4.763 31.735 ( 4.763 0.000 0.000) 4.763 32.243 ( -7.553 0.000 0.000) 7.553 32.243 ( 7.553 0.000 0.000) 7.553 32.518 ( -19.256 0.000 0.000) 19.256 32.518 ( 19.256 0.000 0.000) 19.256 32.764 ( -4.863 0.000 0.000) 4.863 32.764 ( 4.863 0.000 0.000) 4.863 32.862 ( -3.175 0.000 0.000) 3.175 32.862 ( 3.175 0.000 0.000) 3.175 33.421 ( -13.929 0.000 0.000) 13.929 33.421 ( 13.929 0.000 0.000) 13.929 33.714 ( -14.380 0.000 0.000) 14.380 33.714 ( 14.380 0.000 0.000) 14.380 33.728 ( -3.196 0.000 0.000) 3.196 33.728 ( 3.196 0.000 0.000) 3.196 98.549 ( -2.199 0.000 0.000) 2.199 98.549 ( 2.199 0.000 0.000) 2.199 98.599 ( -1.137 0.000 0.000) 1.137 98.599 ( 1.137 0.000 0.000) 1.137 98.619 ( -1.695 0.000 0.000) 1.695 98.619 ( 1.695 0.000 0.000) 1.695 99.233 ( -2.381 0.000 0.000) 2.381 99.233 ( 2.381 0.000 0.000) 2.381 100.356 ( -4.708 0.000 0.000) 4.708 100.356 ( 4.708 0.000 0.000) 4.708 100.642 ( -2.441 0.000 0.000) 2.441 100.642 ( 2.441 0.000 0.000) 2.441 100.765 ( -7.808 0.000 0.000) 7.808 100.765 ( 7.808 0.000 0.000) 7.808 100.774 ( -5.347 0.000 0.000) 5.347 100.774 ( 5.347 0.000 0.000) 5.347 102.528 ( -2.287 0.000 0.000) 2.287 102.528 ( 2.287 0.000 0.000) 2.287 102.599 ( -4.922 0.000 0.000) 4.922 102.599 ( 4.922 0.000 0.000) 4.922 102.873 ( -3.662 0.000 0.000) 3.662 102.873 ( 3.662 0.000 0.000) 3.662 103.461 ( -14.464 0.000 0.000) 14.464 103.461 ( 14.464 0.000 0.000) 14.464 ======================= Grid point 11 (7/72) ======================= q-point: ( 0.00 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.541 ( 0.000 24.564 0.000) 24.564 0.623 ( 0.000 27.661 0.000) 27.661 1.440 ( 0.000 64.185 0.000) 64.185 1.867 ( 0.000 -10.447 0.000) 10.447 2.007 ( 0.000 -10.617 0.000) 10.617 3.774 ( 0.000 13.303 0.000) 13.303 3.823 ( 0.000 0.115 0.000) 0.115 3.998 ( 0.000 13.617 0.000) 13.617 4.690 ( 0.000 -23.461 0.000) 23.461 5.292 ( 0.000 -3.786 0.000) 3.786 5.314 ( 0.000 -2.890 0.000) 2.890 5.900 ( 0.000 -18.108 0.000) 18.108 6.958 ( 0.000 7.274 0.000) 7.274 7.247 ( 0.000 0.864 0.000) 0.864 7.328 ( 0.000 1.990 0.000) 1.990 7.437 ( 0.000 -1.693 0.000) 1.693 7.571 ( 0.000 -3.191 0.000) 3.191 7.592 ( 0.000 -5.736 0.000) 5.736 7.636 ( 0.000 0.913 0.000) 0.913 7.674 ( 0.000 1.010 0.000) 1.010 7.897 ( 0.000 6.386 0.000) 6.386 8.017 ( 0.000 2.647 0.000) 2.647 8.077 ( 0.000 5.837 0.000) 5.837 8.404 ( 0.000 -1.454 0.000) 1.454 8.417 ( 0.000 -7.379 0.000) 7.379 8.571 ( 0.000 1.804 0.000) 1.804 8.690 ( 0.000 4.567 0.000) 4.567 8.751 ( 0.000 1.582 0.000) 1.582 8.818 ( 0.000 -0.433 0.000) 0.433 8.830 ( 0.000 -0.340 0.000) 0.340 8.928 ( 0.000 3.645 0.000) 3.645 9.025 ( 0.000 -5.061 0.000) 5.061 9.195 ( 0.000 -1.965 0.000) 1.965 9.310 ( 0.000 -8.988 0.000) 8.988 9.496 ( 0.000 6.922 0.000) 6.922 9.901 ( 0.000 -2.037 0.000) 2.037 10.156 ( 0.000 4.671 0.000) 4.671 10.388 ( 0.000 1.309 0.000) 1.309 10.580 ( 0.000 -3.905 0.000) 3.905 10.616 ( 0.000 -4.454 0.000) 4.454 10.833 ( 0.000 6.331 0.000) 6.331 11.018 ( 0.000 6.835 0.000) 6.835 11.528 ( 0.000 -4.590 0.000) 4.590 11.706 ( 0.000 -17.548 0.000) 17.548 11.918 ( 0.000 -6.605 0.000) 6.605 11.971 ( 0.000 -5.650 0.000) 5.650 11.983 ( 0.000 4.719 0.000) 4.719 12.121 ( 0.000 6.346 0.000) 6.346 12.259 ( 0.000 7.809 0.000) 7.809 12.365 ( 0.000 9.007 0.000) 9.007 12.468 ( 0.000 -5.368 0.000) 5.368 12.791 ( 0.000 -7.665 0.000) 7.665 12.806 ( 0.000 4.168 0.000) 4.168 12.842 ( 0.000 -2.869 0.000) 2.869 12.973 ( 0.000 -0.398 0.000) 0.398 13.012 ( 0.000 7.816 0.000) 7.816 13.018 ( 0.000 -2.351 0.000) 2.351 13.101 ( 0.000 0.689 0.000) 0.689 13.139 ( 0.000 -1.628 0.000) 1.628 13.341 ( 0.000 3.938 0.000) 3.938 13.554 ( 0.000 2.925 0.000) 2.925 13.675 ( 0.000 1.748 0.000) 1.748 13.854 ( 0.000 9.352 0.000) 9.352 14.544 ( 0.000 -4.675 0.000) 4.675 14.638 ( 0.000 3.248 0.000) 3.248 15.004 ( 0.000 -1.674 0.000) 1.674 15.050 ( 0.000 -6.037 0.000) 6.037 15.072 ( 0.000 -1.969 0.000) 1.969 15.099 ( 0.000 2.602 0.000) 2.602 15.131 ( 0.000 -3.148 0.000) 3.148 15.136 ( 0.000 -5.419 0.000) 5.419 15.562 ( 0.000 -8.985 0.000) 8.985 15.670 ( 0.000 3.159 0.000) 3.159 15.728 ( 0.000 9.542 0.000) 9.542 15.746 ( 0.000 4.830 0.000) 4.830 15.942 ( 0.000 -2.439 0.000) 2.439 16.030 ( 0.000 -0.744 0.000) 0.744 16.091 ( 0.000 1.947 0.000) 1.947 16.237 ( 0.000 -4.711 0.000) 4.711 16.463 ( 0.000 1.107 0.000) 1.107 16.507 ( 0.000 -6.472 0.000) 6.472 16.589 ( 0.000 -0.412 0.000) 0.412 16.621 ( 0.000 -5.046 0.000) 5.046 16.713 ( 0.000 -2.641 0.000) 2.641 16.888 ( 0.000 6.863 0.000) 6.863 17.036 ( 0.000 12.446 0.000) 12.446 17.186 ( 0.000 9.680 0.000) 9.680 17.334 ( 0.000 3.681 0.000) 3.681 17.502 ( 0.000 -5.339 0.000) 5.339 17.892 ( 0.000 -12.736 0.000) 12.736 18.000 ( 0.000 1.109 0.000) 1.109 18.386 ( 0.000 1.608 0.000) 1.608 18.478 ( 0.000 -13.538 0.000) 13.538 18.714 ( 0.000 16.738 0.000) 16.738 18.734 ( 0.000 -7.160 0.000) 7.160 19.399 ( 0.000 3.797 0.000) 3.797 19.454 ( 0.000 -6.318 0.000) 6.318 19.799 ( 0.000 11.078 0.000) 11.078 19.848 ( 0.000 11.764 0.000) 11.764 19.921 ( 0.000 -8.759 0.000) 8.759 20.502 ( 0.000 -5.197 0.000) 5.197 20.865 ( 0.000 -19.506 0.000) 19.506 21.902 ( 0.000 21.312 0.000) 21.312 23.087 ( 0.000 -9.846 0.000) 9.846 24.159 ( 0.000 2.638 0.000) 2.638 24.442 ( 0.000 -2.664 0.000) 2.664 24.728 ( 0.000 12.156 0.000) 12.156 25.294 ( 0.000 2.818 0.000) 2.818 25.600 ( 0.000 -2.468 0.000) 2.468 25.686 ( 0.000 -8.820 0.000) 8.820 26.378 ( 0.000 7.875 0.000) 7.875 26.836 ( 0.000 -0.811 0.000) 0.811 26.851 ( 0.000 0.510 0.000) 0.510 26.998 ( 0.000 -4.977 0.000) 4.977 27.596 ( 0.000 -1.702 0.000) 1.702 27.675 ( 0.000 -3.616 0.000) 3.616 27.992 ( 0.000 0.346 0.000) 0.346 28.013 ( 0.000 -0.111 0.000) 0.111 28.187 ( 0.000 1.894 0.000) 1.894 28.431 ( 0.000 -3.273 0.000) 3.273 29.386 ( 0.000 0.491 0.000) 0.491 29.477 ( 0.000 -1.112 0.000) 1.112 29.897 ( 0.000 10.486 0.000) 10.486 30.281 ( 0.000 0.097 0.000) 0.097 30.399 ( 0.000 -3.099 0.000) 3.099 30.573 ( 0.000 -3.023 0.000) 3.023 30.587 ( 0.000 3.053 0.000) 3.053 30.606 ( 0.000 1.659 0.000) 1.659 31.250 ( 0.000 -2.787 0.000) 2.787 31.300 ( 0.000 -6.017 0.000) 6.017 31.457 ( 0.000 3.913 0.000) 3.913 31.615 ( 0.000 -1.169 0.000) 1.169 31.696 ( 0.000 -2.355 0.000) 2.355 31.755 ( 0.000 8.282 0.000) 8.282 31.949 ( 0.000 -3.708 0.000) 3.708 32.050 ( 0.000 0.426 0.000) 0.426 32.669 ( 0.000 -3.220 0.000) 3.220 32.680 ( 0.000 -2.450 0.000) 2.450 33.293 ( 0.000 10.369 0.000) 10.369 33.814 ( 0.000 1.848 0.000) 1.848 33.957 ( 0.000 -5.414 0.000) 5.414 34.078 ( 0.000 -3.434 0.000) 3.434 34.407 ( 0.000 4.222 0.000) 4.222 34.750 ( 0.000 -2.966 0.000) 2.966 98.328 ( 0.000 0.173 0.000) 0.173 98.347 ( 0.000 -0.229 0.000) 0.229 98.434 ( 0.000 0.474 0.000) 0.474 98.483 ( 0.000 -0.544 0.000) 0.544 98.567 ( 0.000 1.898 0.000) 1.898 98.753 ( 0.000 -1.909 0.000) 1.909 98.784 ( 0.000 1.099 0.000) 1.099 98.914 ( 0.000 -1.709 0.000) 1.709 100.072 ( 0.000 1.689 0.000) 1.689 100.223 ( 0.000 -1.540 0.000) 1.540 100.436 ( 0.000 0.452 0.000) 0.452 100.439 ( 0.000 0.403 0.000) 0.403 100.637 ( 0.000 2.118 0.000) 2.118 100.883 ( 0.000 -4.191 0.000) 4.191 101.098 ( 0.000 3.933 0.000) 3.933 101.338 ( 0.000 -2.433 0.000) 2.433 102.351 ( 0.000 2.164 0.000) 2.164 102.506 ( 0.000 1.810 0.000) 1.810 102.578 ( 0.000 -2.751 0.000) 2.751 102.643 ( 0.000 5.689 0.000) 5.689 102.672 ( 0.000 -1.410 0.000) 1.410 103.093 ( 0.000 -3.944 0.000) 3.944 104.812 ( 0.000 1.697 0.000) 1.697 104.964 ( 0.000 -1.471 0.000) 1.471 ======================= Grid point 12 (8/72) ======================= q-point: ( 0.10 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.090 ( 40.812 12.358 0.000) 42.642 1.494 ( 14.079 53.656 0.000) 55.472 1.777 ( 70.372 14.954 0.000) 71.943 2.097 ( 21.715 -9.283 0.000) 23.616 2.545 ( 47.167 -7.761 0.000) 47.801 3.882 ( 6.924 22.315 0.000) 23.364 4.172 ( 32.242 -0.963 0.000) 32.256 4.275 ( 30.460 2.523 0.000) 30.564 4.690 ( 0.740 -21.365 0.000) 21.378 5.333 ( 3.649 -3.501 0.000) 5.056 5.354 ( 4.106 -2.781 0.000) 4.959 5.890 ( -0.807 -17.736 0.000) 17.755 6.910 ( -6.329 5.236 0.000) 8.214 7.118 ( -12.480 4.167 0.000) 13.157 7.253 ( -8.427 0.858 0.000) 8.470 7.439 ( -7.361 0.851 0.000) 7.410 7.444 ( 0.005 -1.548 0.000) 1.548 7.479 ( -12.886 -2.622 0.000) 13.150 7.586 ( -1.701 -4.957 0.000) 5.241 7.595 ( -4.155 -0.807 0.000) 4.232 7.785 ( -13.019 4.399 0.000) 13.743 7.990 ( -6.476 9.213 0.000) 11.261 8.095 ( -21.356 -2.974 0.000) 21.562 8.132 ( 2.877 2.544 0.000) 3.841 8.434 ( -8.202 -6.078 0.000) 10.209 8.538 ( -8.781 4.518 0.000) 9.875 8.569 ( -22.800 -0.941 0.000) 22.819 8.654 ( -3.397 1.204 0.000) 3.604 8.710 ( 4.533 0.480 0.000) 4.558 8.882 ( 11.044 2.027 0.000) 11.229 8.942 ( 9.244 1.641 0.000) 9.389 8.954 ( -6.659 0.899 0.000) 6.719 9.146 ( 4.027 -3.284 0.000) 5.196 9.411 ( 4.052 3.327 0.000) 5.243 9.792 ( 15.375 -3.781 0.000) 15.833 9.937 ( 5.928 0.285 0.000) 5.935 10.218 ( 3.976 2.171 0.000) 4.530 10.495 ( 6.626 0.416 0.000) 6.639 10.659 ( 3.131 -3.671 0.000) 4.825 10.726 ( 13.797 -4.602 0.000) 14.545 10.851 ( 2.483 6.081 0.000) 6.568 11.187 ( 15.801 5.617 0.000) 16.770 11.643 ( 8.041 -2.083 0.000) 8.306 11.650 ( -5.900 -14.655 0.000) 15.798 11.834 ( -5.823 -3.113 0.000) 6.603 11.928 ( -2.046 4.356 0.000) 4.813 12.000 ( 0.193 -4.132 0.000) 4.137 12.114 ( -5.720 7.223 0.000) 9.213 12.249 ( -4.403 -0.123 0.000) 4.405 12.329 ( -3.426 5.760 0.000) 6.701 12.373 ( 5.678 2.028 0.000) 6.029 12.581 ( -14.675 3.912 0.000) 15.188 12.650 ( -17.658 -3.296 0.000) 17.963 12.702 ( -11.720 4.332 0.000) 12.495 12.942 ( -1.866 1.370 0.000) 2.314 12.957 ( -4.047 0.396 0.000) 4.066 13.018 ( 2.836 1.733 0.000) 3.323 13.091 ( 1.062 -2.625 0.000) 2.831 13.328 ( -16.582 5.695 0.000) 17.533 13.353 ( 13.945 -3.100 0.000) 14.285 13.506 ( 11.477 1.502 0.000) 11.575 13.550 ( -4.711 4.442 0.000) 6.475 14.111 ( 13.480 1.771 0.000) 13.596 14.470 ( -3.724 -0.532 0.000) 3.762 14.685 ( 1.353 -0.008 0.000) 1.353 14.919 ( -6.168 0.654 0.000) 6.203 15.050 ( -2.297 1.886 0.000) 2.972 15.083 ( -1.179 -2.761 0.000) 3.003 15.114 ( 3.415 -1.966 0.000) 3.940 15.153 ( 3.262 -2.772 0.000) 4.281 15.224 ( 5.019 -3.762 0.000) 6.272 15.528 ( -3.238 -6.899 0.000) 7.621 15.660 ( -2.669 5.134 0.000) 5.786 15.680 ( -0.976 1.443 0.000) 1.742 15.785 ( 0.202 5.106 0.000) 5.110 15.900 ( -6.947 -0.226 0.000) 6.951 16.010 ( 0.224 -1.626 0.000) 1.642 16.011 ( -1.628 -0.362 0.000) 1.668 16.306 ( 4.372 -7.594 0.000) 8.763 16.489 ( -1.838 -5.040 0.000) 5.364 16.535 ( 5.934 0.570 0.000) 5.961 16.648 ( 5.565 -1.582 0.000) 5.786 16.687 ( -0.094 0.824 0.000) 0.829 16.715 ( 8.229 0.377 0.000) 8.238 16.896 ( -2.998 2.475 0.000) 3.887 17.171 ( 10.664 6.820 0.000) 12.658 17.231 ( 0.888 4.416 0.000) 4.504 17.328 ( -0.545 3.982 0.000) 4.019 17.510 ( 4.345 -4.484 0.000) 6.243 17.875 ( -1.349 -11.030 0.000) 11.112 17.968 ( -3.276 1.646 0.000) 3.667 18.334 ( -4.930 -1.915 0.000) 5.289 18.465 ( -1.948 -11.515 0.000) 11.679 18.648 ( -5.843 19.735 0.000) 20.582 18.688 ( -4.007 -5.402 0.000) 6.726 19.393 ( -7.736 -2.910 0.000) 8.266 19.416 ( 1.616 4.272 0.000) 4.568 19.741 ( -6.140 12.308 0.000) 13.755 19.775 ( -3.681 4.673 0.000) 5.949 20.075 ( 11.201 -3.317 0.000) 11.682 20.487 ( -1.202 -3.903 0.000) 4.084 20.568 ( -31.111 5.363 0.000) 31.570 21.535 ( -50.877 42.960 0.000) 66.589 21.860 ( -17.111 20.674 0.000) 26.837 24.184 ( 1.780 2.045 0.000) 2.711 24.307 ( -7.175 3.413 0.000) 7.945 24.933 ( 14.909 5.713 0.000) 15.966 25.402 ( -11.832 -3.728 0.000) 12.405 25.664 ( 7.949 -15.611 0.000) 17.519 25.665 ( -2.126 -7.846 0.000) 8.129 26.351 ( -2.743 7.337 0.000) 7.833 26.501 ( -10.708 12.355 0.000) 16.350 27.000 ( 3.036 -6.994 0.000) 7.624 27.014 ( 0.724 -4.180 0.000) 4.242 27.491 ( -8.921 0.083 0.000) 8.921 27.669 ( -1.597 -4.316 0.000) 4.602 27.970 ( -1.985 0.491 0.000) 2.045 28.026 ( 0.205 -0.818 0.000) 0.843 28.094 ( -7.956 2.358 0.000) 8.298 28.361 ( -6.663 -3.428 0.000) 7.493 29.461 ( 6.840 1.138 0.000) 6.934 29.744 ( 14.545 -5.772 0.000) 15.649 29.993 ( 9.242 9.200 0.000) 13.040 30.283 ( -1.010 0.452 0.000) 1.107 30.342 ( -9.157 1.460 0.000) 9.273 30.540 ( 6.818 -1.296 0.000) 6.940 30.552 ( -1.339 -1.868 0.000) 2.298 30.615 ( -4.387 -0.883 0.000) 4.475 31.320 ( 9.234 -1.089 0.000) 9.298 31.413 ( 7.301 -1.855 0.000) 7.533 31.524 ( 6.232 4.348 0.000) 7.599 31.679 ( 7.712 -0.666 0.000) 7.741 31.866 ( 10.480 4.812 0.000) 11.532 31.958 ( 9.831 -5.813 0.000) 11.421 32.102 ( 5.052 0.219 0.000) 5.057 32.309 ( 20.210 -24.366 0.000) 31.657 32.656 ( -1.628 -2.249 0.000) 2.777 32.770 ( 10.835 -8.152 0.000) 13.559 33.296 ( 0.235 9.379 0.000) 9.382 33.770 ( -4.488 1.980 0.000) 4.905 33.904 ( -4.404 -2.872 0.000) 5.258 34.043 ( -3.321 -3.507 0.000) 4.830 34.356 ( -5.063 4.226 0.000) 6.595 34.701 ( -4.901 -3.036 0.000) 5.765 98.373 ( 2.494 -0.087 0.000) 2.496 98.406 ( 0.394 -0.175 0.000) 0.431 98.504 ( 1.944 -0.500 0.000) 2.008 98.568 ( 0.040 1.709 0.000) 1.709 98.704 ( 21.566 -19.293 0.000) 28.936 98.731 ( -1.866 -1.592 0.000) 2.453 98.780 ( -0.402 1.307 0.000) 1.367 98.945 ( 2.642 -2.147 0.000) 3.404 100.086 ( 1.409 1.696 0.000) 2.205 100.248 ( 2.464 -1.872 0.000) 3.095 100.446 ( 1.482 0.902 0.000) 1.735 100.465 ( 2.074 0.302 0.000) 2.096 100.621 ( -1.428 2.205 0.000) 2.627 100.890 ( 0.322 -3.977 0.000) 3.990 101.051 ( -4.036 4.836 0.000) 6.299 101.309 ( -2.946 -2.092 0.000) 3.613 102.359 ( 0.744 1.933 0.000) 2.071 102.495 ( -0.382 2.736 0.000) 2.763 102.618 ( 2.910 -3.856 0.000) 4.831 102.630 ( -1.108 5.388 0.000) 5.501 102.695 ( 2.656 -0.948 0.000) 2.820 103.074 ( -1.875 -3.786 0.000) 4.225 104.198 ( -46.064 37.914 0.000) 59.660 104.707 ( -10.199 0.442 0.000) 10.209 ======================= Grid point 13 (9/72) ======================= q-point: ( 0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.821 ( 22.367 45.536 0.000) 50.733 1.951 ( 43.970 7.174 0.000) 44.551 2.664 ( 33.440 -7.395 0.000) 34.248 3.270 ( 73.569 4.574 0.000) 73.711 3.632 ( 56.535 -4.312 0.000) 56.699 4.072 ( 13.921 20.345 0.000) 24.652 4.652 ( 4.487 -21.415 0.000) 21.880 5.076 ( 47.817 0.827 0.000) 47.824 5.122 ( 49.916 0.040 0.000) 49.916 5.402 ( 1.470 -2.322 0.000) 2.748 5.463 ( 6.071 -2.025 0.000) 6.399 5.883 ( 0.628 -16.722 0.000) 16.734 6.635 ( -18.106 0.252 0.000) 18.108 6.895 ( -10.696 4.707 0.000) 11.686 6.996 ( -12.853 4.580 0.000) 13.645 7.147 ( -18.091 -4.630 0.000) 18.674 7.156 ( -32.464 1.448 0.000) 32.496 7.399 ( -1.420 0.059 0.000) 1.421 7.472 ( -13.744 -3.658 0.000) 14.222 7.542 ( -2.253 -2.021 0.000) 3.027 7.563 ( -21.619 -0.830 0.000) 21.635 7.630 ( -2.436 -3.824 0.000) 4.534 7.908 ( -2.517 4.582 0.000) 5.227 8.015 ( -22.654 1.100 0.000) 22.681 8.044 ( -9.964 2.216 0.000) 10.208 8.177 ( -9.593 7.056 0.000) 11.908 8.473 ( -2.703 1.951 0.000) 3.334 8.813 ( 11.155 -1.329 0.000) 11.234 8.862 ( 8.478 -0.857 0.000) 8.521 8.877 ( -1.386 2.626 0.000) 2.969 9.131 ( 12.468 1.897 0.000) 12.611 9.136 ( -4.596 -1.007 0.000) 4.705 9.196 ( 16.097 1.969 0.000) 16.217 9.398 ( -4.677 0.857 0.000) 4.755 10.039 ( 10.377 -4.201 0.000) 11.195 10.187 ( 16.488 -1.854 0.000) 16.592 10.286 ( 4.092 6.394 0.000) 7.591 10.487 ( -8.748 1.084 0.000) 8.815 10.651 ( -7.199 -2.507 0.000) 7.623 10.938 ( 4.042 3.489 0.000) 5.340 11.052 ( 16.805 -6.340 0.000) 17.961 11.465 ( -12.485 -8.096 0.000) 14.880 11.573 ( 19.237 2.626 0.000) 19.416 11.710 ( -6.875 1.135 0.000) 6.968 11.732 ( 2.806 6.042 0.000) 6.662 11.890 ( -0.860 3.739 0.000) 3.836 11.896 ( -14.306 -2.248 0.000) 14.481 11.998 ( -13.348 -2.735 0.000) 13.625 12.090 ( -22.637 -3.102 0.000) 22.849 12.216 ( 12.416 -3.726 0.000) 12.963 12.270 ( -12.157 2.660 0.000) 12.444 12.358 ( -10.652 1.681 0.000) 10.784 12.483 ( -8.621 -1.765 0.000) 8.799 12.559 ( -3.263 2.811 0.000) 4.306 12.800 ( -1.803 -2.580 0.000) 3.148 12.957 ( 11.586 5.004 0.000) 12.620 13.102 ( -3.072 -7.630 0.000) 8.225 13.150 ( 4.032 8.662 0.000) 9.555 13.225 ( 14.385 0.459 0.000) 14.392 13.512 ( 1.677 5.030 0.000) 5.302 13.601 ( 10.098 -3.808 0.000) 10.793 13.741 ( 11.577 -0.285 0.000) 11.580 14.258 ( -0.308 -2.506 0.000) 2.525 14.446 ( 0.073 -0.625 0.000) 0.629 14.643 ( -3.485 2.360 0.000) 4.208 14.862 ( 0.154 11.091 0.000) 11.092 14.985 ( -3.271 3.764 0.000) 4.987 15.086 ( 2.229 -2.947 0.000) 3.695 15.149 ( 0.985 0.494 0.000) 1.102 15.233 ( 3.291 -0.064 0.000) 3.291 15.289 ( 1.549 -0.950 0.000) 1.817 15.451 ( -4.255 -2.902 0.000) 5.151 15.578 ( -7.904 -3.050 0.000) 8.473 15.645 ( 1.214 0.940 0.000) 1.535 15.758 ( -2.380 2.836 0.000) 3.703 15.797 ( -2.260 -0.668 0.000) 2.357 15.964 ( -2.890 -0.041 0.000) 2.891 16.066 ( 4.187 0.548 0.000) 4.223 16.371 ( 0.940 -12.158 0.000) 12.194 16.459 ( -0.573 -0.261 0.000) 0.630 16.647 ( 4.579 -1.386 0.000) 4.784 16.733 ( 3.899 -0.477 0.000) 3.928 16.744 ( -6.244 0.034 0.000) 6.244 16.785 ( 0.956 6.290 0.000) 6.363 16.898 ( 8.627 0.288 0.000) 8.632 17.104 ( -8.551 4.442 0.000) 9.636 17.269 ( -3.458 2.133 0.000) 4.063 17.421 ( 10.947 3.755 0.000) 11.573 17.727 ( 13.214 -7.034 0.000) 14.970 17.849 ( -9.818 1.680 0.000) 9.960 17.869 ( 2.002 -6.202 0.000) 6.517 18.211 ( -6.319 -4.664 0.000) 7.854 18.371 ( -7.560 -6.309 0.000) 9.846 18.518 ( -6.720 18.087 0.000) 19.295 18.618 ( -2.095 -5.305 0.000) 5.704 19.073 ( -22.324 9.539 0.000) 24.276 19.459 ( 2.517 4.672 0.000) 5.307 19.612 ( -4.937 5.838 0.000) 7.646 19.714 ( -2.455 3.251 0.000) 4.074 20.079 ( -13.958 8.372 0.000) 16.276 20.291 ( 6.755 -5.174 0.000) 8.509 20.498 ( 5.518 -0.529 0.000) 5.544 20.932 ( -20.981 14.418 0.000) 25.457 21.640 ( -8.419 5.995 0.000) 10.336 24.140 ( -3.570 5.175 0.000) 6.287 24.324 ( 6.790 1.997 0.000) 7.078 25.099 ( -15.935 0.828 0.000) 15.957 25.240 ( 15.085 1.363 0.000) 15.147 25.602 ( -4.061 -5.211 0.000) 6.606 25.681 ( -5.208 -15.018 0.000) 15.895 26.279 ( -4.081 7.239 0.000) 8.310 26.358 ( -6.249 9.295 0.000) 11.200 27.018 ( 1.038 -3.820 0.000) 3.959 27.078 ( 2.886 -7.531 0.000) 8.065 27.302 ( -7.035 2.659 0.000) 7.521 27.616 ( -3.144 -5.078 0.000) 5.973 27.847 ( -12.326 1.557 0.000) 12.424 27.923 ( -4.294 1.104 0.000) 4.434 28.051 ( -0.231 -1.275 0.000) 1.296 28.190 ( -9.707 -3.337 0.000) 10.264 29.594 ( 5.756 2.653 0.000) 6.338 29.993 ( 9.842 -6.302 0.000) 11.687 30.071 ( -12.302 3.116 0.000) 12.690 30.262 ( 17.226 7.478 0.000) 18.779 30.331 ( 0.123 -1.340 0.000) 1.346 30.501 ( -3.288 0.634 0.000) 3.349 30.561 ( 2.931 0.697 0.000) 3.012 30.749 ( 11.820 -3.503 0.000) 12.328 31.535 ( 8.360 1.670 0.000) 8.526 31.588 ( 12.754 2.130 0.000) 12.931 31.683 ( 9.007 4.839 0.000) 10.225 31.916 ( 15.422 1.223 0.000) 15.470 32.124 ( 13.818 -0.374 0.000) 13.823 32.130 ( 6.398 -3.714 0.000) 7.398 32.242 ( 8.872 -0.272 0.000) 8.877 32.486 ( 3.008 -12.682 0.000) 13.034 32.628 ( -0.191 -1.111 0.000) 1.128 33.003 ( 9.466 -10.898 0.000) 14.435 33.304 ( 0.677 5.635 0.000) 5.675 33.628 ( -9.872 2.719 0.000) 10.240 33.808 ( -4.888 -1.563 0.000) 5.132 33.955 ( -5.163 -3.919 0.000) 6.482 34.209 ( -9.461 4.200 0.000) 10.352 34.556 ( -9.555 -3.179 0.000) 10.070 98.413 ( 1.092 0.227 0.000) 1.116 98.440 ( 3.253 -0.001 0.000) 3.253 98.550 ( 2.582 0.593 0.000) 2.649 98.568 ( 0.009 1.200 0.000) 1.200 98.690 ( -2.070 -1.374 0.000) 2.484 98.767 ( -0.852 2.121 0.000) 2.285 99.006 ( 3.239 -2.947 0.000) 4.379 99.013 ( 9.609 -18.714 0.000) 21.037 100.128 ( 2.809 1.732 0.000) 3.300 100.317 ( 4.302 -2.730 0.000) 5.095 100.496 ( 3.395 1.505 0.000) 3.714 100.517 ( 3.008 0.566 0.000) 3.061 100.585 ( -2.118 2.057 0.000) 2.953 100.881 ( -1.428 -1.456 0.000) 2.039 100.962 ( -4.560 2.641 0.000) 5.269 101.223 ( -5.528 -1.134 0.000) 5.643 102.381 ( 1.497 1.542 0.000) 2.150 102.503 ( 1.267 4.392 0.000) 4.571 102.608 ( -0.964 4.068 0.000) 4.180 102.669 ( 2.288 -4.120 0.000) 4.713 102.789 ( 6.507 -1.749 0.000) 6.738 103.019 ( -3.541 -3.021 0.000) 4.655 103.532 ( -22.870 30.940 0.000) 38.475 104.432 ( -16.564 -2.193 0.000) 16.709 ======================= Grid point 14 (10/72) ======================= q-point: ( 0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.388 ( 33.523 31.564 0.000) 46.044 2.824 ( 43.193 5.247 0.000) 43.511 3.388 ( 38.175 -6.226 0.000) 38.679 4.351 ( 20.900 12.337 0.000) 24.270 4.653 ( 62.371 1.201 0.000) 62.382 4.728 ( 17.917 -13.243 0.000) 22.280 4.803 ( 38.683 -3.906 0.000) 38.880 5.257 ( -18.810 3.265 0.000) 19.091 5.567 ( 3.095 -2.339 0.000) 3.879 5.906 ( 1.631 -15.937 0.000) 16.020 6.094 ( 47.982 1.321 0.000) 48.000 6.185 ( 53.067 -0.540 0.000) 53.069 6.371 ( -6.574 -4.638 0.000) 8.045 6.442 ( -34.671 2.130 0.000) 34.736 6.639 ( -13.163 0.318 0.000) 13.167 6.785 ( -17.092 -5.179 0.000) 17.860 6.799 ( -34.239 -5.217 0.000) 34.635 6.822 ( -5.138 7.171 0.000) 8.821 7.237 ( -18.131 -2.662 0.000) 18.325 7.365 ( -14.569 0.524 0.000) 14.579 7.449 ( -5.535 2.399 0.000) 6.032 7.589 ( -1.927 -3.073 0.000) 3.627 7.746 ( 0.007 3.923 0.000) 3.923 7.927 ( 5.380 3.112 0.000) 6.215 7.951 ( 0.743 2.819 0.000) 2.915 8.098 ( 0.793 6.984 0.000) 7.028 8.445 ( 0.224 2.175 0.000) 2.186 8.891 ( 2.081 0.194 0.000) 2.090 8.962 ( 3.781 -0.354 0.000) 3.798 8.999 ( -7.632 0.781 0.000) 7.672 9.009 ( 4.766 -1.938 0.000) 5.145 9.280 ( -5.976 0.084 0.000) 5.977 9.359 ( 8.841 2.705 0.000) 9.245 9.523 ( 14.228 0.506 0.000) 14.237 10.127 ( -27.433 1.497 0.000) 27.474 10.229 ( 8.384 -2.123 0.000) 8.648 10.296 ( -27.767 -1.670 0.000) 27.817 10.345 ( 5.737 -0.370 0.000) 5.748 10.584 ( 18.896 3.299 0.000) 19.182 10.888 ( -11.054 0.547 0.000) 11.067 11.174 ( -14.895 -3.690 0.000) 15.345 11.359 ( 13.695 -7.087 0.000) 15.420 11.516 ( -17.720 -2.952 0.000) 17.964 11.550 ( -19.210 3.882 0.000) 19.599 11.611 ( -11.069 1.109 0.000) 11.124 11.717 ( -0.750 5.362 0.000) 5.414 11.760 ( -2.027 2.796 0.000) 3.454 11.863 ( -4.773 -2.200 0.000) 5.255 11.976 ( -6.010 -1.318 0.000) 6.153 11.985 ( -13.259 1.354 0.000) 13.328 12.197 ( -10.844 -1.407 0.000) 10.935 12.255 ( -9.597 -7.143 0.000) 11.963 12.296 ( 15.736 3.269 0.000) 16.072 12.728 ( 19.022 -2.992 0.000) 19.256 12.987 ( 14.552 -4.427 0.000) 15.210 13.159 ( 7.821 -8.129 0.000) 11.281 13.290 ( 8.755 4.455 0.000) 9.823 13.306 ( 18.218 1.967 0.000) 18.324 13.534 ( 15.132 1.617 0.000) 15.218 13.591 ( 5.361 3.286 0.000) 6.288 13.747 ( 4.484 -4.155 0.000) 6.113 13.963 ( 11.009 -1.860 0.000) 11.165 14.162 ( -7.087 -1.220 0.000) 7.191 14.346 ( -8.982 -0.627 0.000) 9.004 14.642 ( 1.848 5.099 0.000) 5.423 14.905 ( 3.788 14.016 0.000) 14.519 14.938 ( -1.304 4.767 0.000) 4.942 15.147 ( -1.923 3.650 0.000) 4.125 15.157 ( 3.897 -3.423 0.000) 5.186 15.256 ( -3.193 4.689 0.000) 5.673 15.293 ( -0.750 1.025 0.000) 1.270 15.361 ( -2.267 -2.631 0.000) 3.472 15.465 ( -2.417 -6.430 0.000) 6.869 15.682 ( -1.254 1.390 0.000) 1.872 15.730 ( 3.620 -0.804 0.000) 3.709 15.799 ( 2.685 -3.962 0.000) 4.786 15.917 ( -1.248 0.724 0.000) 1.443 16.163 ( 4.983 2.432 0.000) 5.544 16.303 ( -7.551 -2.189 0.000) 7.863 16.466 ( 0.919 4.025 0.000) 4.129 16.556 ( -8.845 2.791 0.000) 9.275 16.712 ( -6.425 2.652 0.000) 6.950 16.720 ( 2.871 -5.218 0.000) 5.956 16.805 ( 2.860 -2.160 0.000) 3.584 16.974 ( -0.681 0.499 0.000) 0.844 17.143 ( -8.822 1.543 0.000) 8.956 17.158 ( 10.826 2.467 0.000) 11.104 17.534 ( -19.285 -5.319 0.000) 20.005 17.625 ( 6.975 5.180 0.000) 8.689 17.894 ( 4.541 -2.259 0.000) 5.072 18.019 ( 9.995 -6.103 0.000) 11.711 18.102 ( -6.383 0.364 0.000) 6.393 18.217 ( -4.978 -2.705 0.000) 5.665 18.335 ( -15.663 6.405 0.000) 16.922 18.601 ( -0.004 -7.771 0.000) 7.771 18.640 ( -16.032 5.692 0.000) 17.012 19.508 ( 2.124 3.706 0.000) 4.272 19.535 ( -3.149 1.020 0.000) 3.310 19.676 ( -1.275 3.044 0.000) 3.300 19.882 ( -7.176 0.100 0.000) 7.177 20.299 ( -2.695 0.630 0.000) 2.768 20.567 ( -15.001 15.018 0.000) 21.227 20.737 ( 14.812 -4.129 0.000) 15.377 21.509 ( -5.307 -3.429 0.000) 6.318 24.118 ( 1.521 6.955 0.000) 7.119 24.507 ( 11.217 -0.170 0.000) 11.218 24.804 ( -13.377 4.712 0.000) 14.182 25.495 ( 1.764 -2.295 0.000) 2.895 25.505 ( -11.174 -9.883 0.000) 14.917 25.541 ( 6.941 -1.252 0.000) 7.053 26.138 ( -12.683 4.492 0.000) 13.455 26.222 ( -5.783 3.440 0.000) 6.729 27.015 ( -1.820 -0.159 0.000) 1.827 27.117 ( 5.256 -0.268 0.000) 5.262 27.335 ( 7.828 -3.462 0.000) 8.559 27.569 ( -1.044 -5.091 0.000) 5.197 27.591 ( -12.596 2.594 0.000) 12.860 27.819 ( -6.390 0.304 0.000) 6.398 27.976 ( -9.164 -3.533 0.000) 9.821 28.033 ( -4.092 -1.759 0.000) 4.454 29.682 ( 2.951 3.346 0.000) 4.461 29.861 ( -8.288 4.038 0.000) 9.219 30.127 ( 3.979 -6.678 0.000) 7.774 30.278 ( -3.763 -6.287 0.000) 7.327 30.522 ( 3.713 6.086 0.000) 7.129 30.562 ( 7.861 4.547 0.000) 9.081 30.744 ( 18.353 2.558 0.000) 18.530 30.993 ( 12.137 -4.952 0.000) 13.108 31.672 ( 5.930 4.677 0.000) 7.552 31.859 ( 7.735 5.315 0.000) 9.386 31.866 ( 13.580 3.205 0.000) 13.953 32.150 ( 2.105 -1.072 0.000) 2.363 32.271 ( 10.541 0.700 0.000) 10.564 32.366 ( 10.062 -3.700 0.000) 10.721 32.457 ( 11.770 -1.743 0.000) 11.899 32.545 ( 6.638 -6.177 0.000) 9.068 32.677 ( 4.301 -1.908 0.000) 4.705 33.144 ( 5.255 -1.688 0.000) 5.519 33.330 ( 2.345 -1.459 0.000) 2.762 33.377 ( -14.857 4.936 0.000) 15.656 33.718 ( -3.828 -1.815 0.000) 4.236 33.846 ( -5.662 -4.808 0.000) 7.428 33.989 ( -12.286 3.885 0.000) 12.886 34.321 ( -13.822 -3.192 0.000) 14.185 98.444 ( 1.996 0.257 0.000) 2.012 98.499 ( 2.431 -1.075 0.000) 2.658 98.567 ( -0.134 0.489 0.000) 0.506 98.605 ( 2.801 2.769 0.000) 3.938 98.649 ( -2.111 -1.450 0.000) 2.561 98.747 ( -1.158 3.370 0.000) 3.564 99.069 ( 2.979 -3.844 0.000) 4.863 99.133 ( 3.272 -12.603 0.000) 13.021 100.197 ( 3.962 1.815 0.000) 4.358 100.416 ( 5.484 -3.712 0.000) 6.623 100.535 ( -2.994 1.950 0.000) 3.573 100.566 ( 3.215 1.560 0.000) 3.573 100.594 ( 4.968 1.455 0.000) 5.176 100.831 ( -3.399 3.900 0.000) 5.174 100.873 ( -4.410 -3.651 0.000) 5.725 101.098 ( -6.690 -0.075 0.000) 6.691 102.419 ( 2.277 1.417 0.000) 2.682 102.546 ( 2.919 5.750 0.000) 6.449 102.590 ( -1.006 2.645 0.000) 2.830 102.716 ( 2.553 -3.491 0.000) 4.324 102.937 ( -4.642 -1.041 0.000) 4.757 102.946 ( 9.075 -3.146 0.000) 9.605 103.186 ( -13.163 17.895 0.000) 22.215 104.076 ( -18.330 -4.216 0.000) 18.808 ======================= Grid point 15 (11/72) ======================= q-point: ( 0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 3.125 ( 39.288 21.067 0.000) 44.580 3.670 ( 41.124 4.305 0.000) 41.349 4.167 ( 39.095 -5.983 0.000) 39.550 4.693 ( -34.553 9.049 0.000) 35.718 4.742 ( 11.367 10.253 0.000) 15.308 4.904 ( 10.801 -16.205 0.000) 19.475 5.522 ( -8.587 -6.149 0.000) 10.562 5.571 ( 6.332 -1.940 0.000) 6.623 5.706 ( 18.326 0.720 0.000) 18.340 5.724 ( 11.848 -5.748 0.000) 13.169 5.842 ( -11.275 -0.470 0.000) 11.284 6.184 ( -18.026 -1.862 0.000) 18.122 6.332 ( -1.089 -8.898 0.000) 8.965 6.399 ( -11.342 1.323 0.000) 11.419 6.554 ( -4.495 -9.189 0.000) 10.230 6.803 ( -6.138 -2.212 0.000) 6.525 6.840 ( -8.188 4.500 0.000) 9.343 6.956 ( 23.242 1.809 0.000) 23.312 7.065 ( 13.781 0.972 0.000) 13.815 7.097 ( -10.376 2.573 0.000) 10.690 7.468 ( 25.545 2.585 0.000) 25.675 7.640 ( 13.602 -2.600 0.000) 13.849 7.838 ( 6.513 4.242 0.000) 7.772 8.026 ( 4.694 3.482 0.000) 5.844 8.116 ( 8.772 9.557 0.000) 12.973 8.224 ( 16.041 3.685 0.000) 16.459 8.535 ( 11.258 -2.100 0.000) 11.452 8.821 ( -5.043 -3.453 0.000) 6.112 8.979 ( -2.559 -0.368 0.000) 2.585 9.009 ( -5.747 -1.521 0.000) 5.945 9.011 ( 6.586 1.909 0.000) 6.857 9.196 ( -1.465 0.232 0.000) 1.483 9.356 ( -16.039 1.179 0.000) 16.082 9.438 ( -36.302 2.476 0.000) 36.386 9.589 ( -17.852 -3.043 0.000) 18.109 9.668 ( -24.823 -0.324 0.000) 24.825 10.368 ( 5.949 1.879 0.000) 6.239 10.505 ( 9.599 -2.461 0.000) 9.909 10.592 ( -11.730 1.655 0.000) 11.846 10.911 ( -11.594 0.049 0.000) 11.594 10.930 ( 15.047 1.076 0.000) 15.085 11.166 ( -7.593 -4.097 0.000) 8.627 11.339 ( -5.761 1.257 0.000) 5.897 11.473 ( -4.343 4.091 0.000) 5.966 11.535 ( -7.188 -0.377 0.000) 7.198 11.633 ( 2.865 -2.256 0.000) 3.647 11.699 ( -4.124 2.231 0.000) 4.689 11.773 ( -4.248 -2.301 0.000) 4.831 11.851 ( -1.829 -0.028 0.000) 1.829 11.866 ( -1.554 -0.077 0.000) 1.556 11.895 ( -12.665 -0.948 0.000) 12.700 12.086 ( -8.218 -5.520 0.000) 9.899 12.793 ( 26.097 0.152 0.000) 26.098 13.086 ( 14.894 -3.997 0.000) 15.421 13.221 ( 6.881 -5.555 0.000) 8.843 13.353 ( 8.620 -7.021 0.000) 11.117 13.470 ( 8.120 -0.102 0.000) 8.120 13.546 ( 4.875 -4.316 0.000) 6.511 13.667 ( 0.507 -0.784 0.000) 0.933 13.773 ( -0.062 -6.552 0.000) 6.552 13.821 ( 11.606 6.753 0.000) 13.428 14.047 ( -2.649 2.227 0.000) 3.461 14.167 ( 7.309 -2.137 0.000) 7.615 14.175 ( -6.014 1.675 0.000) 6.243 14.687 ( 3.288 5.762 0.000) 6.634 14.910 ( -3.036 4.926 0.000) 5.787 14.978 ( 2.523 10.689 0.000) 10.983 15.051 ( -5.998 6.149 0.000) 8.590 15.154 ( -4.136 2.640 0.000) 4.907 15.181 ( -2.297 -1.173 0.000) 2.579 15.308 ( 3.063 0.504 0.000) 3.104 15.369 ( 0.867 -2.828 0.000) 2.958 15.463 ( 2.023 -1.739 0.000) 2.668 15.615 ( -4.166 2.141 0.000) 4.684 15.876 ( 7.750 -2.647 0.000) 8.189 15.899 ( 5.776 -3.154 0.000) 6.581 15.935 ( 4.350 1.087 0.000) 4.484 16.152 ( -2.633 2.387 0.000) 3.554 16.276 ( 4.506 1.662 0.000) 4.803 16.425 ( -3.199 2.944 0.000) 4.347 16.476 ( -0.469 8.032 0.000) 8.046 16.650 ( 0.288 0.390 0.000) 0.485 16.738 ( -3.242 -6.148 0.000) 6.951 16.865 ( 2.875 -4.872 0.000) 5.657 16.919 ( -3.979 2.553 0.000) 4.728 16.943 ( -9.418 -0.510 0.000) 9.432 17.092 ( -19.270 -0.315 0.000) 19.273 17.368 ( 7.320 -2.518 0.000) 7.741 17.762 ( 5.911 0.395 0.000) 5.924 17.798 ( -21.860 1.183 0.000) 21.892 17.921 ( -10.034 2.177 0.000) 10.268 17.993 ( -4.542 2.577 0.000) 5.223 18.158 ( 4.114 -2.642 0.000) 4.889 18.201 ( 1.145 -0.260 0.000) 1.174 18.536 ( 1.615 -5.904 0.000) 6.120 18.604 ( -0.035 -9.399 0.000) 9.399 19.494 ( -0.604 1.006 0.000) 1.173 19.530 ( -0.196 1.675 0.000) 1.686 19.672 ( 1.023 3.363 0.000) 3.515 19.775 ( -3.912 -0.545 0.000) 3.950 20.246 ( -1.963 6.774 0.000) 7.053 20.340 ( -7.883 15.262 0.000) 17.178 21.022 ( 13.092 -7.167 0.000) 14.926 21.401 ( -6.117 -7.905 0.000) 9.995 24.197 ( 6.151 7.856 0.000) 9.978 24.560 ( -11.218 7.335 0.000) 13.403 24.762 ( 13.873 -2.691 0.000) 14.132 25.273 ( -11.583 -6.801 0.000) 13.432 25.455 ( -0.212 1.661 0.000) 1.674 25.762 ( 10.472 -3.740 0.000) 11.120 25.820 ( -16.944 4.143 0.000) 17.443 26.102 ( -6.723 -2.045 0.000) 7.027 27.036 ( 4.142 3.733 0.000) 5.576 27.275 ( 9.718 1.164 0.000) 9.787 27.356 ( -10.782 3.372 0.000) 11.297 27.508 ( 7.547 -6.207 0.000) 9.772 27.598 ( 5.061 -3.509 0.000) 6.159 27.670 ( -8.391 0.597 0.000) 8.412 27.786 ( -9.174 -3.917 0.000) 9.975 27.927 ( -6.926 -2.633 0.000) 7.409 29.714 ( 0.460 3.728 0.000) 3.756 29.746 ( -3.321 4.378 0.000) 5.495 30.175 ( 1.311 -6.833 0.000) 6.958 30.220 ( -1.948 -7.266 0.000) 7.523 30.602 ( 3.742 7.583 0.000) 8.456 30.650 ( 2.203 6.351 0.000) 6.722 31.125 ( 16.044 -2.233 0.000) 16.199 31.212 ( 9.007 -6.742 0.000) 11.251 31.771 ( 3.951 7.475 0.000) 8.455 31.923 ( -2.265 7.054 0.000) 7.409 32.108 ( 10.279 3.535 0.000) 10.870 32.222 ( 8.509 0.805 0.000) 8.547 32.347 ( -0.616 -1.032 0.000) 1.202 32.543 ( 7.613 -5.871 0.000) 9.613 32.638 ( 3.630 -5.406 0.000) 6.512 32.705 ( 1.667 -8.287 0.000) 8.453 32.839 ( 12.951 4.783 0.000) 13.806 33.074 ( -12.903 9.901 0.000) 16.264 33.241 ( 6.113 4.344 0.000) 7.499 33.426 ( 7.777 -6.218 0.000) 9.957 33.667 ( -0.909 -2.804 0.000) 2.948 33.715 ( -10.803 0.701 0.000) 10.825 33.750 ( -7.797 -3.443 0.000) 8.523 34.012 ( -16.670 -2.833 0.000) 16.909 98.491 ( 2.656 -0.107 0.000) 2.658 98.536 ( 1.331 -1.641 0.000) 2.113 98.562 ( -0.392 -0.263 0.000) 0.472 98.603 ( -2.463 -1.457 0.000) 2.862 98.657 ( 2.305 4.347 0.000) 4.921 98.723 ( -1.236 4.450 0.000) 4.619 99.122 ( 2.275 -4.892 0.000) 5.395 99.166 ( 0.413 -8.640 0.000) 8.650 100.283 ( 4.633 1.924 0.000) 5.017 100.465 ( -3.992 1.979 0.000) 4.455 100.533 ( 6.085 -4.388 0.000) 7.502 100.628 ( 3.123 2.049 0.000) 3.735 100.706 ( 6.028 1.628 0.000) 6.244 100.755 ( -4.134 4.504 0.000) 6.114 100.779 ( -4.920 -5.497 0.000) 7.377 100.963 ( -6.732 0.820 0.000) 6.782 102.470 ( 2.731 1.435 0.000) 3.085 102.564 ( -1.634 1.787 0.000) 2.421 102.619 ( 4.432 6.814 0.000) 8.129 102.774 ( 3.258 -2.615 0.000) 4.177 102.835 ( -5.507 3.243 0.000) 6.391 102.976 ( -8.102 7.227 0.000) 10.857 103.151 ( 11.496 -4.168 0.000) 12.228 103.720 ( -16.942 -4.989 0.000) 17.661 ======================= Grid point 16 (12/72) ======================= q-point: (-0.50 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.924 ( -39.836 13.926 0.000) 42.200 3.924 ( 39.836 13.926 0.000) 42.200 4.437 ( -33.511 3.873 0.000) 33.734 4.437 ( 33.511 3.873 0.000) 33.734 4.958 ( -37.286 -6.866 0.000) 37.912 4.958 ( 37.286 -6.866 0.000) 37.912 5.253 ( -16.217 -9.355 0.000) 18.722 5.253 ( 16.217 -9.355 0.000) 18.722 5.766 ( -17.865 2.987 0.000) 18.113 5.766 ( 17.865 2.987 0.000) 18.113 6.136 ( -16.664 2.137 0.000) 16.800 6.136 ( 16.664 2.137 0.000) 16.800 6.382 ( -20.877 -7.406 0.000) 22.152 6.382 ( 20.877 -7.406 0.000) 22.152 6.477 ( -11.639 -8.178 0.000) 14.225 6.477 ( 11.639 -8.178 0.000) 14.225 6.964 ( -7.717 4.127 0.000) 8.751 6.964 ( 7.717 4.127 0.000) 8.752 7.058 ( -4.910 2.908 0.000) 5.707 7.058 ( 4.910 2.908 0.000) 5.707 7.923 ( -2.724 5.595 0.000) 6.223 7.923 ( 2.724 5.595 0.000) 6.223 8.020 ( -9.365 2.633 0.000) 9.728 8.020 ( 9.365 2.633 0.000) 9.728 8.538 ( -40.704 1.937 0.000) 40.750 8.538 ( 40.704 1.937 0.000) 40.750 8.699 ( -26.716 2.199 0.000) 26.806 8.699 ( 26.716 2.199 0.000) 26.806 8.828 ( -13.367 -3.556 0.000) 13.832 8.828 ( 13.367 -3.556 0.000) 13.832 8.958 ( -20.402 -2.466 0.000) 20.551 8.958 ( 20.403 -2.466 0.000) 20.551 9.193 ( -13.098 0.712 0.000) 13.118 9.193 ( 13.098 0.712 0.000) 13.118 9.284 ( -13.238 -0.426 0.000) 13.244 9.284 ( 13.238 -0.426 0.000) 13.244 10.470 ( -4.165 3.024 0.000) 5.147 10.470 ( 4.165 3.024 0.000) 5.147 10.703 ( -9.985 -2.047 0.000) 10.192 10.703 ( 9.985 -2.047 0.000) 10.192 11.138 ( -3.101 -1.688 0.000) 3.531 11.138 ( 3.101 -1.688 0.000) 3.531 11.325 ( -5.471 2.770 0.000) 6.133 11.325 ( 5.471 2.770 0.000) 6.133 11.490 ( -8.830 1.881 0.000) 9.028 11.490 ( 8.830 1.881 0.000) 9.028 11.727 ( -0.812 -3.225 0.000) 3.326 11.727 ( 0.812 -3.225 0.000) 3.326 11.822 ( -1.796 -0.912 0.000) 2.014 11.822 ( 1.796 -0.912 0.000) 2.014 11.924 ( -6.983 -1.758 0.000) 7.201 11.924 ( 6.983 -1.758 0.000) 7.201 13.231 ( -11.929 -4.131 0.000) 12.624 13.231 ( 11.929 -4.131 0.000) 12.624 13.295 ( -9.039 -2.891 0.000) 9.490 13.295 ( 9.039 -2.891 0.000) 9.490 13.566 ( -1.578 -4.778 0.000) 5.031 13.566 ( 1.578 -4.778 0.000) 5.031 13.707 ( -4.750 -5.591 0.000) 7.336 13.707 ( 4.750 -5.591 0.000) 7.336 14.004 ( -5.203 6.240 0.000) 8.125 14.004 ( 5.203 6.240 0.000) 8.125 14.179 ( -4.667 -0.229 0.000) 4.672 14.179 ( 4.667 -0.229 0.000) 4.672 14.792 ( -6.946 4.527 0.000) 8.291 14.792 ( 6.946 4.527 0.000) 8.291 14.993 ( -0.069 6.470 0.000) 6.470 14.993 ( 0.069 6.470 0.000) 6.470 15.131 ( -1.418 3.597 0.000) 3.866 15.131 ( 1.418 3.597 0.000) 3.866 15.365 ( -1.715 -1.565 0.000) 2.321 15.365 ( 1.715 -1.565 0.000) 2.321 15.529 ( -4.143 1.098 0.000) 4.286 15.529 ( 4.143 1.098 0.000) 4.286 15.943 ( -0.941 3.205 0.000) 3.341 15.943 ( 0.941 3.205 0.000) 3.341 16.098 ( -6.906 -6.395 0.000) 9.412 16.098 ( 6.906 -6.395 0.000) 9.412 16.432 ( -4.691 5.818 0.000) 7.474 16.432 ( 4.691 5.818 0.000) 7.474 16.488 ( -15.569 -2.212 0.000) 15.725 16.488 ( 15.569 -2.212 0.000) 15.725 16.730 ( -8.124 2.238 0.000) 8.427 16.730 ( 8.124 2.238 0.000) 8.427 16.856 ( -1.382 3.044 0.000) 3.344 16.856 ( 1.382 3.044 0.000) 3.344 17.177 ( -18.190 -8.045 0.000) 19.890 17.177 ( 18.190 -8.045 0.000) 19.890 17.703 ( -8.854 4.439 0.000) 9.904 17.703 ( 8.854 4.439 0.000) 9.904 17.899 ( -5.717 -0.302 0.000) 5.725 17.899 ( 5.717 -0.302 0.000) 5.725 18.209 ( -0.946 -0.217 0.000) 0.971 18.209 ( 0.946 -0.217 0.000) 0.971 18.586 ( -2.041 -9.889 0.000) 10.098 18.586 ( 2.041 -9.889 0.000) 10.098 19.507 ( -1.498 1.326 0.000) 2.001 19.507 ( 1.498 1.326 0.000) 2.001 19.712 ( -2.647 1.488 0.000) 3.037 19.712 ( 2.647 1.488 0.000) 3.037 20.242 ( -2.081 12.123 0.000) 12.301 20.242 ( 2.081 12.123 0.000) 12.301 21.248 ( -9.401 -8.761 0.000) 12.851 21.248 ( 9.401 -8.761 0.000) 12.851 24.354 ( -9.286 8.187 0.000) 12.379 24.354 ( 9.286 8.187 0.000) 12.379 25.035 ( -12.784 -5.390 0.000) 13.874 25.035 ( 12.784 -5.390 0.000) 13.874 25.540 ( -9.503 4.301 0.000) 10.430 25.540 ( 9.503 4.301 0.000) 10.430 25.950 ( -8.455 -4.198 0.000) 9.440 25.950 ( 8.455 -4.198 0.000) 9.440 27.164 ( -8.237 4.003 0.000) 9.158 27.164 ( 8.237 4.003 0.000) 9.158 27.482 ( -10.355 1.899 0.000) 10.528 27.482 ( 10.355 1.899 0.000) 10.528 27.628 ( -6.339 -5.959 0.000) 8.700 27.628 ( 6.339 -5.959 0.000) 8.700 27.762 ( -9.240 -2.995 0.000) 9.713 27.762 ( 9.240 -2.995 0.000) 9.713 29.716 ( -0.257 4.182 0.000) 4.190 29.716 ( 0.257 4.182 0.000) 4.190 30.194 ( -0.874 -7.224 0.000) 7.276 30.194 ( 0.874 -7.224 0.000) 7.276 30.657 ( -1.450 7.622 0.000) 7.759 30.657 ( 1.450 7.622 0.000) 7.759 31.305 ( -1.331 -7.095 0.000) 7.219 31.305 ( 1.331 -7.095 0.000) 7.219 31.844 ( -3.976 9.358 0.000) 10.167 31.844 ( 3.976 9.358 0.000) 10.167 32.267 ( -5.424 1.730 0.000) 5.693 32.267 ( 5.424 1.730 0.000) 5.693 32.492 ( -14.039 -2.026 0.000) 14.185 32.492 ( 14.039 -2.026 0.000) 14.185 32.671 ( -4.252 -7.112 0.000) 8.286 32.671 ( 4.252 -7.112 0.000) 8.286 32.968 ( -1.017 8.121 0.000) 8.184 32.968 ( 1.017 8.121 0.000) 8.184 33.453 ( -13.560 2.755 0.000) 13.837 33.453 ( 13.560 2.755 0.000) 13.837 33.626 ( -9.065 -6.704 0.000) 11.275 33.626 ( 9.065 -6.704 0.000) 11.275 33.714 ( -8.706 -2.279 0.000) 9.000 33.714 ( 8.706 -2.279 0.000) 9.000 98.544 ( -2.196 -0.420 0.000) 2.236 98.544 ( 2.196 -0.420 0.000) 2.236 98.558 ( -1.313 -1.571 0.000) 2.047 98.558 ( 1.313 -1.571 0.000) 2.047 98.696 ( -1.570 4.814 0.000) 5.064 98.696 ( 1.570 4.814 0.000) 5.064 99.157 ( -1.197 -6.331 0.000) 6.443 99.157 ( 1.197 -6.331 0.000) 6.443 100.377 ( -4.647 1.996 0.000) 5.057 100.377 ( 4.647 1.996 0.000) 5.057 100.654 ( -5.895 -3.591 0.000) 6.903 100.654 ( 5.895 -3.591 0.000) 6.903 100.694 ( -3.558 1.683 0.000) 3.935 100.694 ( 3.558 1.683 0.000) 3.935 100.831 ( -6.442 1.363 0.000) 6.584 100.831 ( 6.442 1.363 0.000) 6.584 102.523 ( -2.434 1.470 0.000) 2.843 102.523 ( 2.434 1.470 0.000) 2.843 102.721 ( -5.641 6.906 0.000) 8.917 102.721 ( 5.641 6.906 0.000) 8.917 102.852 ( -4.744 -0.192 0.000) 4.748 102.852 ( 4.744 -0.192 0.000) 4.748 103.408 ( -14.242 -4.835 0.000) 15.041 103.408 ( 14.242 -4.835 0.000) 15.041 ======================= Grid point 22 (13/72) ======================= q-point: ( 0.00 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.070 ( 0.000 23.297 0.000) 23.297 1.199 ( 0.000 24.448 0.000) 24.448 1.540 ( 0.000 -18.798 0.000) 18.798 1.678 ( 0.000 -18.834 0.000) 18.834 2.779 ( 0.000 56.503 0.000) 56.503 3.755 ( 0.000 -16.680 0.000) 16.680 3.876 ( 0.000 1.381 0.000) 1.381 4.019 ( 0.000 -26.513 0.000) 26.513 4.616 ( 0.000 34.565 0.000) 34.565 5.228 ( 0.000 -1.196 0.000) 1.196 5.247 ( 0.000 -2.526 0.000) 2.526 5.352 ( 0.000 -30.615 0.000) 30.615 7.127 ( 0.000 6.978 0.000) 6.978 7.234 ( 0.000 -2.561 0.000) 2.561 7.393 ( 0.000 3.753 0.000) 3.753 7.424 ( 0.000 0.912 0.000) 0.912 7.480 ( 0.000 -4.106 0.000) 4.106 7.485 ( 0.000 -4.364 0.000) 4.364 7.666 ( 0.000 1.534 0.000) 1.534 7.687 ( 0.000 -0.105 0.000) 0.105 8.033 ( 0.000 5.866 0.000) 5.866 8.108 ( 0.000 5.626 0.000) 5.626 8.134 ( 0.000 -2.157 0.000) 2.157 8.254 ( 0.000 -7.290 0.000) 7.290 8.449 ( 0.000 6.174 0.000) 6.174 8.577 ( 0.000 -3.020 0.000) 3.020 8.767 ( 0.000 2.440 0.000) 2.440 8.782 ( 0.000 0.909 0.000) 0.909 8.806 ( 0.000 -0.488 0.000) 0.488 8.815 ( 0.000 -1.022 0.000) 1.022 8.964 ( 0.000 1.258 0.000) 1.258 9.021 ( 0.000 4.444 0.000) 4.444 9.094 ( 0.000 -9.275 0.000) 9.275 9.116 ( 0.000 -4.216 0.000) 4.216 9.677 ( 0.000 8.114 0.000) 8.114 9.824 ( 0.000 -5.085 0.000) 5.085 10.291 ( 0.000 7.287 0.000) 7.287 10.435 ( 0.000 2.955 0.000) 2.955 10.456 ( 0.000 -7.117 0.000) 7.117 10.515 ( 0.000 -4.335 0.000) 4.335 11.025 ( 0.000 11.234 0.000) 11.234 11.201 ( 0.000 9.063 0.000) 9.063 11.325 ( 0.000 -16.043 0.000) 16.043 11.390 ( 0.000 -7.740 0.000) 7.740 11.824 ( 0.000 -1.603 0.000) 1.603 11.854 ( 0.000 -4.052 0.000) 4.052 12.121 ( 0.000 7.417 0.000) 7.417 12.267 ( 0.000 -0.801 0.000) 0.801 12.362 ( 0.000 3.466 0.000) 3.466 12.411 ( 0.000 5.994 0.000) 5.994 12.488 ( 0.000 0.618 0.000) 0.618 12.579 ( 0.000 -10.962 0.000) 10.962 12.800 ( 0.000 0.574 0.000) 0.574 12.845 ( 0.000 -1.323 0.000) 1.323 12.971 ( 0.000 0.101 0.000) 0.101 12.977 ( 0.000 -0.806 0.000) 0.806 13.115 ( 0.000 0.497 0.000) 0.497 13.123 ( 0.000 -0.302 0.000) 0.302 13.214 ( 0.000 9.193 0.000) 9.193 13.358 ( 0.000 -3.033 0.000) 3.033 13.660 ( 0.000 4.697 0.000) 4.697 13.705 ( 0.000 0.346 0.000) 0.346 14.080 ( 0.000 11.688 0.000) 11.688 14.358 ( 0.000 -12.047 0.000) 12.047 14.743 ( 0.000 6.102 0.000) 6.102 14.897 ( 0.000 -7.601 0.000) 7.601 14.993 ( 0.000 1.027 0.000) 1.027 15.035 ( 0.000 -1.074 0.000) 1.074 15.040 ( 0.000 -2.061 0.000) 2.061 15.050 ( 0.000 -3.732 0.000) 3.732 15.182 ( 0.000 5.333 0.000) 5.333 15.343 ( 0.000 -9.337 0.000) 9.337 15.763 ( 0.000 4.815 0.000) 4.815 15.854 ( 0.000 4.360 0.000) 4.360 15.866 ( 0.000 -4.303 0.000) 4.303 15.904 ( 0.000 1.919 0.000) 1.919 16.070 ( 0.000 7.871 0.000) 7.871 16.140 ( 0.000 2.104 0.000) 2.104 16.176 ( 0.000 -1.526 0.000) 1.526 16.300 ( 0.000 -10.535 0.000) 10.535 16.515 ( 0.000 -3.199 0.000) 3.199 16.516 ( 0.000 -3.091 0.000) 3.091 16.539 ( 0.000 4.010 0.000) 4.010 16.634 ( 0.000 -4.279 0.000) 4.279 17.121 ( 0.000 11.509 0.000) 11.509 17.330 ( 0.000 11.629 0.000) 11.629 17.346 ( 0.000 -8.714 0.000) 8.714 17.407 ( 0.000 10.154 0.000) 10.154 17.427 ( 0.000 2.750 0.000) 2.750 17.634 ( 0.000 -10.817 0.000) 10.817 18.014 ( 0.000 0.913 0.000) 0.913 18.156 ( 0.000 -12.800 0.000) 12.800 18.444 ( 0.000 4.268 0.000) 4.268 18.574 ( 0.000 -7.081 0.000) 7.081 19.053 ( 0.000 13.408 0.000) 13.408 19.294 ( 0.000 -8.758 0.000) 8.758 19.519 ( 0.000 6.923 0.000) 6.923 19.703 ( 0.000 -9.798 0.000) 9.798 20.087 ( 0.000 14.967 0.000) 14.967 20.113 ( 0.000 11.585 0.000) 11.585 20.342 ( 0.000 -9.065 0.000) 9.065 20.450 ( 0.000 -17.934 0.000) 17.934 22.370 ( 0.000 20.660 0.000) 20.660 22.788 ( 0.000 -16.892 0.000) 16.892 24.247 ( 0.000 5.008 0.000) 5.008 24.358 ( 0.000 -4.733 0.000) 4.733 25.059 ( 0.000 16.736 0.000) 16.736 25.387 ( 0.000 5.434 0.000) 5.434 25.418 ( 0.000 -15.056 0.000) 15.056 25.512 ( 0.000 -5.341 0.000) 5.341 26.593 ( 0.000 10.736 0.000) 10.736 26.796 ( 0.000 -5.508 0.000) 5.508 26.860 ( 0.000 0.176 0.000) 0.176 26.876 ( 0.000 -3.260 0.000) 3.260 27.564 ( 0.000 -0.558 0.000) 0.558 27.592 ( 0.000 -3.078 0.000) 3.078 28.001 ( 0.000 0.422 0.000) 0.422 28.008 ( 0.000 -0.283 0.000) 0.283 28.249 ( 0.000 3.678 0.000) 3.678 28.342 ( 0.000 -4.513 0.000) 4.513 29.408 ( 0.000 1.481 0.000) 1.481 29.445 ( 0.000 -1.708 0.000) 1.708 30.176 ( 0.000 13.625 0.000) 13.625 30.296 ( 0.000 1.287 0.000) 1.287 30.337 ( 0.000 -2.438 0.000) 2.438 30.440 ( 0.000 -9.409 0.000) 9.409 30.638 ( 0.000 1.308 0.000) 1.308 30.640 ( 0.000 1.033 0.000) 1.033 31.194 ( 0.000 -1.680 0.000) 1.680 31.200 ( 0.000 -2.537 0.000) 2.537 31.550 ( 0.000 2.955 0.000) 2.955 31.585 ( 0.000 -1.294 0.000) 1.294 31.686 ( 0.000 3.413 0.000) 3.413 31.825 ( 0.000 -7.149 0.000) 7.149 31.926 ( 0.000 6.667 0.000) 6.667 32.030 ( 0.000 -2.649 0.000) 2.649 32.621 ( 0.000 -0.867 0.000) 0.867 32.630 ( 0.000 -1.591 0.000) 1.591 33.547 ( 0.000 11.872 0.000) 11.872 33.788 ( 0.000 -9.679 0.000) 9.679 33.878 ( 0.000 4.009 0.000) 4.009 33.981 ( 0.000 -4.974 0.000) 4.974 34.526 ( 0.000 6.135 0.000) 6.135 34.657 ( 0.000 -5.371 0.000) 5.371 98.333 ( 0.000 0.305 0.000) 0.305 98.340 ( 0.000 -0.340 0.000) 0.340 98.449 ( 0.000 0.810 0.000) 0.810 98.467 ( 0.000 -0.850 0.000) 0.850 98.624 ( 0.000 3.123 0.000) 3.123 98.696 ( 0.000 -3.138 0.000) 3.138 98.818 ( 0.000 1.990 0.000) 1.990 98.868 ( 0.000 -2.354 0.000) 2.354 100.121 ( 0.000 2.575 0.000) 2.575 100.178 ( 0.000 -2.467 0.000) 2.467 100.446 ( 0.000 0.297 0.000) 0.297 100.447 ( 0.000 0.207 0.000) 0.207 100.701 ( 0.000 3.586 0.000) 3.586 100.789 ( 0.000 -4.263 0.000) 4.263 101.186 ( 0.000 3.974 0.000) 3.974 101.270 ( 0.000 -3.602 0.000) 3.602 102.417 ( 0.000 3.611 0.000) 3.611 102.502 ( 0.000 -3.923 0.000) 3.923 102.560 ( 0.000 2.937 0.000) 2.937 102.625 ( 0.000 -2.740 0.000) 2.740 102.801 ( 0.000 8.011 0.000) 8.011 102.970 ( 0.000 -6.987 0.000) 6.987 104.862 ( 0.000 2.614 0.000) 2.614 104.919 ( 0.000 -2.476 0.000) 2.476 ======================= Grid point 23 (14/72) ======================= q-point: ( 0.10 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.432 ( 31.414 17.587 0.000) 36.002 1.812 ( 25.071 -16.029 0.000) 29.757 2.004 ( 62.588 14.411 0.000) 64.225 2.311 ( 53.559 -12.938 0.000) 55.100 2.810 ( 4.210 54.399 0.000) 54.562 3.856 ( 3.751 -37.001 0.000) 37.191 4.208 ( 30.593 2.864 0.000) 30.727 4.259 ( 28.993 -4.655 0.000) 29.364 4.658 ( 5.120 30.894 0.000) 31.316 5.274 ( 4.280 -1.167 0.000) 4.436 5.290 ( 4.282 -2.355 0.000) 4.887 5.356 ( 0.604 -29.671 0.000) 29.677 7.040 ( -10.422 6.030 0.000) 12.041 7.146 ( -9.800 -2.733 0.000) 10.174 7.314 ( -7.513 4.504 0.000) 8.759 7.404 ( -8.182 -3.491 0.000) 8.895 7.433 ( 0.207 0.874 0.000) 0.898 7.485 ( -11.029 2.998 0.000) 11.429 7.486 ( 0.037 -3.803 0.000) 3.804 7.557 ( -7.257 -2.804 0.000) 7.780 7.884 ( -16.510 4.787 0.000) 17.190 7.991 ( -17.458 -4.701 0.000) 18.080 8.207 ( 1.724 4.080 0.000) 4.429 8.225 ( -14.026 10.282 0.000) 17.391 8.308 ( -2.342 -5.148 0.000) 5.656 8.435 ( -15.246 -8.340 0.000) 17.378 8.678 ( -2.638 1.108 0.000) 2.861 8.694 ( -8.468 7.668 0.000) 11.424 8.702 ( 0.590 -0.976 0.000) 1.140 8.870 ( -4.031 -7.623 0.000) 8.623 8.933 ( 10.717 2.078 0.000) 10.917 8.960 ( 10.263 -0.218 0.000) 10.265 9.203 ( 4.453 7.199 0.000) 8.465 9.368 ( 5.023 -6.431 0.000) 8.160 9.798 ( 10.130 3.871 0.000) 10.845 9.895 ( 7.597 -3.876 0.000) 8.528 10.356 ( 6.361 9.186 0.000) 11.173 10.520 ( 5.731 1.966 0.000) 6.059 10.569 ( 10.715 -9.152 0.000) 14.091 10.579 ( 4.601 -3.312 0.000) 5.669 11.033 ( 0.948 10.545 0.000) 10.588 11.312 ( -1.554 -14.752 0.000) 14.834 11.349 ( 13.670 8.360 0.000) 16.024 11.527 ( 12.280 -7.331 0.000) 14.302 11.797 ( -2.041 0.457 0.000) 2.091 11.867 ( 0.762 -5.718 0.000) 5.768 12.048 ( -4.611 5.955 0.000) 7.532 12.159 ( -7.573 -3.080 0.000) 8.176 12.310 ( -12.200 4.663 0.000) 13.061 12.400 ( -10.418 -1.564 0.000) 10.535 12.463 ( 7.440 8.029 0.000) 10.946 12.600 ( -14.736 0.652 0.000) 14.751 12.627 ( -12.288 -0.148 0.000) 12.289 12.662 ( 2.158 -7.782 0.000) 8.075 12.978 ( -3.564 1.854 0.000) 4.017 12.995 ( -4.369 2.672 0.000) 5.121 13.027 ( -0.833 -2.723 0.000) 2.848 13.031 ( -2.989 -0.454 0.000) 3.024 13.382 ( 10.817 4.878 0.000) 11.866 13.490 ( -12.730 7.450 0.000) 14.749 13.491 ( 9.803 -3.411 0.000) 10.380 13.595 ( -7.167 -1.311 0.000) 7.286 14.204 ( 7.919 6.969 0.000) 10.548 14.381 ( 1.888 -7.448 0.000) 7.684 14.729 ( -0.734 4.072 0.000) 4.137 14.850 ( -1.625 -6.226 0.000) 6.434 15.052 ( 3.943 0.240 0.000) 3.950 15.074 ( 3.628 2.341 0.000) 4.318 15.089 ( 3.595 -2.731 0.000) 4.515 15.142 ( 6.440 -3.494 0.000) 7.326 15.170 ( -0.344 5.614 0.000) 5.625 15.334 ( -0.758 -9.025 0.000) 9.057 15.763 ( -1.638 4.797 0.000) 5.068 15.797 ( -4.387 5.697 0.000) 7.190 15.854 ( -2.631 -3.241 0.000) 4.174 15.869 ( -3.289 0.053 0.000) 3.290 16.014 ( -4.499 2.654 0.000) 5.223 16.067 ( -0.761 7.831 0.000) 7.868 16.135 ( -3.420 -7.857 0.000) 8.569 16.297 ( -0.279 -10.794 0.000) 10.798 16.594 ( 4.783 3.224 0.000) 5.768 16.624 ( 10.017 0.972 0.000) 10.064 16.663 ( 2.552 -2.657 0.000) 3.684 16.674 ( 10.215 -2.944 0.000) 10.631 17.084 ( -4.074 10.541 0.000) 11.301 17.271 ( -6.051 -4.654 0.000) 7.633 17.368 ( 2.769 8.846 0.000) 9.269 17.434 ( 0.847 3.478 0.000) 3.579 17.487 ( 6.801 4.776 0.000) 8.310 17.653 ( 2.314 -9.066 0.000) 9.357 17.993 ( -2.179 0.822 0.000) 2.329 18.111 ( -4.022 -11.163 0.000) 11.866 18.417 ( -2.652 3.416 0.000) 4.324 18.542 ( -3.164 -7.059 0.000) 7.736 19.010 ( -4.511 13.642 0.000) 14.369 19.253 ( -4.663 -8.670 0.000) 9.844 19.539 ( 1.807 6.786 0.000) 7.023 19.708 ( 0.107 -7.982 0.000) 7.983 20.019 ( -6.890 13.651 0.000) 15.291 20.163 ( 4.997 8.903 0.000) 10.210 20.339 ( -11.105 -15.008 0.000) 18.670 20.356 ( 1.587 -7.812 0.000) 7.972 22.123 ( -25.404 14.197 0.000) 29.102 22.239 ( -39.967 5.935 0.000) 40.406 24.258 ( 1.030 4.076 0.000) 4.204 24.329 ( -1.881 -1.607 0.000) 2.474 25.139 ( 7.176 12.421 0.000) 14.345 25.352 ( -6.499 0.671 0.000) 6.534 25.430 ( 1.091 -12.923 0.000) 12.969 25.437 ( -3.952 -6.664 0.000) 7.748 26.554 ( -3.362 10.341 0.000) 10.874 26.711 ( -8.529 4.566 0.000) 9.674 26.821 ( 2.855 -5.765 0.000) 6.433 26.911 ( -0.080 -5.778 0.000) 5.779 27.500 ( -5.820 1.242 0.000) 5.951 27.563 ( -3.226 -4.454 0.000) 5.499 27.985 ( -1.698 0.859 0.000) 1.903 28.006 ( -0.827 -0.982 0.000) 1.284 28.166 ( -7.380 4.078 0.000) 8.432 28.266 ( -6.956 -4.797 0.000) 8.450 29.515 ( 9.045 3.711 0.000) 9.777 29.617 ( 12.545 -5.370 0.000) 13.646 30.238 ( 6.338 11.645 0.000) 13.258 30.312 ( 0.065 1.896 0.000) 1.897 30.349 ( -2.588 -0.992 0.000) 2.772 30.455 ( 2.056 -7.347 0.000) 7.629 30.535 ( -1.369 1.100 0.000) 1.756 30.577 ( -5.745 -2.251 0.000) 6.170 31.318 ( 12.002 1.042 0.000) 12.047 31.360 ( 11.602 -2.547 0.000) 11.879 31.636 ( 7.207 4.209 0.000) 8.346 31.670 ( 9.785 -0.067 0.000) 9.785 31.848 ( 11.425 -0.929 0.000) 11.463 31.969 ( 12.992 -10.006 0.000) 16.398 31.988 ( 5.932 5.449 0.000) 8.055 32.080 ( 4.746 -2.600 0.000) 5.411 32.625 ( 0.105 -0.144 0.000) 0.178 32.657 ( 3.219 -3.114 0.000) 4.479 33.536 ( -1.097 11.332 0.000) 11.385 33.764 ( -2.328 -8.945 0.000) 9.243 33.838 ( -4.026 4.195 0.000) 5.814 33.944 ( -3.581 -5.091 0.000) 6.224 34.475 ( -5.086 6.128 0.000) 7.964 34.606 ( -5.042 -5.426 0.000) 7.406 98.375 ( 2.928 0.378 0.000) 2.953 98.392 ( 2.762 -1.020 0.000) 2.944 98.494 ( 3.355 -0.120 0.000) 3.357 98.514 ( 7.544 -2.566 0.000) 7.968 98.619 ( -0.528 2.773 0.000) 2.822 98.681 ( -1.272 -2.731 0.000) 3.013 98.823 ( 0.414 2.525 0.000) 2.559 98.885 ( 1.600 -3.006 0.000) 3.405 100.136 ( 1.501 2.671 0.000) 3.063 100.196 ( 1.838 -2.712 0.000) 3.276 100.464 ( 1.997 0.616 0.000) 2.090 100.470 ( 2.132 0.051 0.000) 2.132 100.690 ( -1.035 3.951 0.000) 4.085 100.787 ( -0.235 -4.744 0.000) 4.750 101.154 ( -3.008 4.392 0.000) 5.324 101.243 ( -2.620 -3.666 0.000) 4.506 102.423 ( 0.715 3.845 0.000) 3.911 102.520 ( 1.624 -4.629 0.000) 4.906 102.572 ( 1.250 3.753 0.000) 3.956 102.650 ( 2.457 -3.050 0.000) 3.916 102.783 ( -1.649 7.911 0.000) 8.081 102.952 ( -1.785 -7.005 0.000) 7.229 104.625 ( -25.263 7.985 0.000) 26.495 104.707 ( -14.620 -1.017 0.000) 14.655 ======================= Grid point 24 (15/72) ======================= q-point: ( 0.20 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 2.168 ( 40.061 12.001 0.000) 41.819 2.443 ( 36.087 -12.138 0.000) 38.074 2.884 ( 13.728 46.783 0.000) 48.755 3.417 ( 65.347 9.360 0.000) 66.014 3.493 ( 57.911 -9.303 0.000) 58.654 3.945 ( 9.568 -35.697 0.000) 36.957 4.692 ( 10.692 27.891 0.000) 29.870 5.070 ( 46.574 -2.541 0.000) 46.643 5.131 ( 46.820 1.445 0.000) 46.842 5.373 ( 4.423 -0.000 0.000) 4.423 5.400 ( 5.795 -24.862 0.000) 25.528 5.404 ( 6.276 -2.610 0.000) 6.797 6.711 ( -20.014 6.025 0.000) 20.901 6.862 ( -17.518 -6.359 0.000) 18.637 7.087 ( -15.060 2.440 0.000) 15.257 7.119 ( -13.546 0.864 0.000) 13.573 7.216 ( -29.837 4.189 0.000) 30.129 7.339 ( -26.494 -6.769 0.000) 27.345 7.413 ( -2.201 2.281 0.000) 3.170 7.486 ( -2.378 -3.262 0.000) 4.037 7.560 ( -7.225 0.865 0.000) 7.277 7.587 ( -5.584 -1.346 0.000) 5.744 8.045 ( -5.279 6.795 0.000) 8.605 8.050 ( -16.280 1.823 0.000) 16.382 8.074 ( -10.937 0.066 0.000) 10.937 8.179 ( -7.903 -4.726 0.000) 9.208 8.628 ( -1.191 10.077 0.000) 10.148 8.805 ( 10.140 0.580 0.000) 10.157 8.831 ( 8.846 -1.587 0.000) 8.987 8.833 ( -0.953 -7.225 0.000) 7.287 9.183 ( 13.488 2.302 0.000) 13.683 9.194 ( -4.149 6.689 0.000) 7.872 9.216 ( 14.884 -0.425 0.000) 14.890 9.348 ( -5.017 -5.632 0.000) 7.543 10.007 ( 10.211 1.716 0.000) 10.354 10.089 ( 10.204 -4.946 0.000) 11.340 10.527 ( -7.405 2.603 0.000) 7.849 10.537 ( 11.421 13.792 0.000) 17.907 10.590 ( -6.480 -2.886 0.000) 7.093 10.837 ( 14.694 -12.592 0.000) 19.352 11.051 ( -0.652 6.855 0.000) 6.886 11.244 ( -6.108 -10.513 0.000) 12.158 11.669 ( 15.139 5.483 0.000) 16.101 11.752 ( -2.484 3.419 0.000) 4.226 11.770 ( 8.024 -2.426 0.000) 8.383 11.865 ( -2.864 -5.463 0.000) 6.168 11.921 ( -21.465 2.287 0.000) 21.586 11.990 ( -0.039 4.861 0.000) 4.861 12.016 ( -23.103 -4.561 0.000) 23.549 12.101 ( 4.136 -5.444 0.000) 6.837 12.342 ( -15.012 3.922 0.000) 15.516 12.426 ( -14.452 -3.400 0.000) 14.846 12.464 ( -8.145 6.515 0.000) 10.431 12.575 ( -6.874 -2.306 0.000) 7.250 12.813 ( -4.361 3.544 0.000) 5.620 12.931 ( -4.132 -6.845 0.000) 7.996 13.069 ( 12.738 4.987 0.000) 13.680 13.177 ( 14.660 -4.543 0.000) 15.348 13.369 ( 0.776 9.472 0.000) 9.503 13.524 ( 0.606 -3.852 0.000) 3.899 13.589 ( 9.227 3.244 0.000) 9.781 13.690 ( 9.624 -4.332 0.000) 10.554 14.284 ( -1.104 4.037 0.000) 4.185 14.386 ( -2.347 -4.323 0.000) 4.919 14.734 ( 2.171 6.007 0.000) 6.388 14.893 ( 5.276 -7.257 0.000) 8.972 15.074 ( -0.965 4.173 0.000) 4.283 15.146 ( 3.384 6.831 0.000) 7.623 15.159 ( 2.527 -2.489 0.000) 3.547 15.219 ( 4.359 2.490 0.000) 5.020 15.250 ( 4.008 -2.875 0.000) 4.933 15.327 ( 0.551 -6.227 0.000) 6.251 15.630 ( -10.186 5.581 0.000) 11.615 15.721 ( -2.430 4.958 0.000) 5.522 15.749 ( -6.335 -4.066 0.000) 7.528 15.797 ( -3.362 -0.909 0.000) 3.483 16.035 ( -2.097 8.607 0.000) 8.859 16.060 ( 6.490 0.320 0.000) 6.498 16.138 ( 3.835 -7.627 0.000) 8.537 16.298 ( 0.607 -12.360 0.000) 12.375 16.687 ( 3.458 2.605 0.000) 4.330 16.722 ( 3.181 -0.739 0.000) 3.265 16.776 ( 0.925 2.716 0.000) 2.869 16.839 ( 3.330 -2.359 0.000) 4.081 16.997 ( -1.071 8.224 0.000) 8.293 17.129 ( -5.682 -2.733 0.000) 6.305 17.357 ( -4.402 6.071 0.000) 7.499 17.470 ( 0.605 -1.635 0.000) 1.743 17.669 ( 10.770 1.070 0.000) 10.823 17.743 ( 6.827 -4.950 0.000) 8.433 17.910 ( -5.866 4.369 0.000) 7.314 18.046 ( -1.288 -7.311 0.000) 7.423 18.339 ( -5.120 2.385 0.000) 5.648 18.462 ( -4.143 -7.706 0.000) 8.749 18.849 ( -12.428 12.390 0.000) 17.549 19.063 ( -15.731 -6.800 0.000) 17.138 19.576 ( 1.570 5.736 0.000) 5.947 19.698 ( -1.022 -4.555 0.000) 4.669 19.822 ( -11.452 10.996 0.000) 15.876 20.047 ( -15.464 -8.402 0.000) 17.599 20.293 ( 6.738 4.870 0.000) 8.314 20.424 ( 5.995 -5.583 0.000) 8.192 21.422 ( -29.801 21.398 0.000) 36.688 21.694 ( -21.953 -3.427 0.000) 22.219 24.268 ( 0.210 5.460 0.000) 5.464 24.344 ( 3.788 -1.037 0.000) 3.927 25.162 ( -10.107 5.706 0.000) 11.606 25.308 ( 8.971 5.100 0.000) 10.320 25.365 ( -4.711 -12.567 0.000) 13.421 25.454 ( 1.256 -7.542 0.000) 7.645 26.455 ( -7.280 7.843 0.000) 10.701 26.525 ( -10.770 3.551 0.000) 11.340 26.913 ( 5.347 -3.879 0.000) 6.606 26.936 ( 4.651 -4.625 0.000) 6.559 27.366 ( -6.275 3.739 0.000) 7.304 27.480 ( -4.273 -6.406 0.000) 7.700 27.893 ( -9.265 2.453 0.000) 9.584 27.936 ( -5.915 -0.749 0.000) 5.962 28.039 ( -3.900 1.167 0.000) 4.071 28.103 ( -8.036 -4.029 0.000) 8.989 29.688 ( 7.190 5.784 0.000) 9.228 29.837 ( 8.643 -7.421 0.000) 11.392 30.161 ( -10.419 4.729 0.000) 11.442 30.265 ( -6.885 -4.351 0.000) 8.145 30.432 ( 12.703 7.164 0.000) 14.584 30.545 ( 7.217 -2.760 0.000) 7.727 30.553 ( 4.430 3.877 0.000) 5.887 30.653 ( 9.216 -4.850 0.000) 10.414 31.582 ( 12.518 2.253 0.000) 12.719 31.614 ( 14.078 -0.237 0.000) 14.080 31.819 ( 10.350 6.780 0.000) 12.373 31.927 ( 14.060 -1.787 0.000) 14.173 32.068 ( 10.542 0.822 0.000) 10.574 32.146 ( 9.164 2.419 0.000) 9.478 32.209 ( 7.964 -2.660 0.000) 8.396 32.211 ( 9.026 -10.848 0.000) 14.112 32.641 ( 2.125 2.858 0.000) 3.561 32.765 ( 7.510 -8.525 0.000) 11.361 33.503 ( -2.173 9.965 0.000) 10.199 33.701 ( -3.766 -7.534 0.000) 8.423 33.717 ( -8.049 5.252 0.000) 9.611 33.844 ( -6.258 -5.860 0.000) 8.573 34.327 ( -9.617 6.076 0.000) 11.376 34.458 ( -9.665 -5.521 0.000) 11.131 98.422 ( 1.532 0.546 0.000) 1.627 98.434 ( 2.194 -0.490 0.000) 2.249 98.586 ( 5.616 3.087 0.000) 6.409 98.605 ( -0.853 1.994 0.000) 2.169 98.651 ( -1.689 -2.075 0.000) 2.676 98.709 ( 9.738 -8.910 0.000) 13.199 98.833 ( 0.509 3.727 0.000) 3.761 98.923 ( 2.006 -4.251 0.000) 4.701 100.180 ( 2.972 2.895 0.000) 4.149 100.249 ( 3.431 -3.253 0.000) 4.728 100.522 ( 3.604 0.750 0.000) 3.681 100.527 ( 3.540 0.251 0.000) 3.549 100.660 ( -1.980 4.506 0.000) 4.922 100.773 ( -1.355 -5.549 0.000) 5.712 101.074 ( -4.833 5.016 0.000) 6.966 101.168 ( -4.727 -3.553 0.000) 5.913 102.447 ( 1.647 4.307 0.000) 4.611 102.557 ( 2.006 -5.259 0.000) 5.629 102.617 ( 3.345 5.143 0.000) 6.135 102.723 ( 4.884 -4.142 0.000) 6.404 102.742 ( -2.316 7.341 0.000) 7.698 102.903 ( -2.972 -6.827 0.000) 7.446 104.082 ( -26.341 17.609 0.000) 31.685 104.338 ( -20.747 -7.011 0.000) 21.900 ======================= Grid point 25 (16/72) ======================= q-point: ( 0.30 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.988 ( 41.380 9.246 0.000) 42.400 3.205 ( 39.421 -9.830 0.000) 40.628 3.216 ( 21.040 40.600 0.000) 45.728 4.060 ( 14.144 -34.085 0.000) 36.903 4.683 ( 56.059 1.988 0.000) 56.094 4.696 ( 44.172 2.028 0.000) 44.219 4.951 ( 22.045 19.673 0.000) 29.547 5.357 ( -9.317 5.574 0.000) 10.857 5.460 ( 6.347 -23.385 0.000) 24.231 5.482 ( -0.784 -5.221 0.000) 5.279 6.128 ( 49.043 1.654 0.000) 49.071 6.163 ( 52.298 -1.417 0.000) 52.317 6.360 ( -12.257 3.596 0.000) 12.774 6.509 ( -15.677 -9.002 0.000) 18.077 6.519 ( -34.911 5.026 0.000) 35.271 6.657 ( -34.119 -7.051 0.000) 34.840 6.790 ( -13.629 4.795 0.000) 14.448 6.892 ( -9.806 -2.586 0.000) 10.141 7.246 ( -15.111 3.917 0.000) 15.610 7.337 ( -12.665 -3.071 0.000) 13.032 7.498 ( -3.099 1.912 0.000) 3.642 7.537 ( -2.131 -1.855 0.000) 2.826 7.867 ( 0.113 6.005 0.000) 6.006 7.965 ( 1.100 -2.087 0.000) 2.359 8.028 ( 4.635 5.369 0.000) 7.093 8.132 ( 3.635 -3.137 0.000) 4.802 8.593 ( -2.819 9.971 0.000) 10.362 8.800 ( -3.156 -7.751 0.000) 8.369 8.959 ( 4.411 0.132 0.000) 4.413 8.972 ( 4.417 -1.169 0.000) 4.569 9.094 ( -4.071 6.694 0.000) 7.835 9.232 ( -5.379 -4.783 0.000) 7.198 9.435 ( 9.747 3.795 0.000) 10.459 9.506 ( 11.834 -2.258 0.000) 12.047 10.179 ( -27.394 3.126 0.000) 27.572 10.208 ( 9.987 1.090 0.000) 10.047 10.248 ( -27.535 -2.751 0.000) 27.672 10.275 ( 8.471 -4.315 0.000) 9.507 10.796 ( 13.814 13.957 0.000) 19.638 10.925 ( -12.530 3.369 0.000) 12.975 11.047 ( -12.495 -7.066 0.000) 14.355 11.118 ( 12.951 -14.009 0.000) 19.078 11.508 ( -18.816 3.090 0.000) 19.068 11.585 ( -18.533 -2.032 0.000) 18.644 11.688 ( -5.077 5.324 0.000) 7.357 11.793 ( -5.735 -3.985 0.000) 6.984 11.803 ( -0.257 2.273 0.000) 2.287 11.816 ( -0.501 1.241 0.000) 1.339 12.008 ( -7.060 3.838 0.000) 8.036 12.013 ( -13.875 1.486 0.000) 13.955 12.091 ( -11.413 -6.237 0.000) 13.006 12.110 ( -9.969 -4.941 0.000) 11.127 12.437 ( 13.796 8.290 0.000) 16.095 12.616 ( 14.544 -7.103 0.000) 16.186 12.927 ( 11.463 0.025 0.000) 11.463 12.996 ( 9.074 -5.815 0.000) 10.777 13.366 ( 13.008 3.913 0.000) 13.584 13.435 ( 4.608 7.416 0.000) 8.731 13.484 ( 13.080 -6.022 0.000) 14.400 13.574 ( 3.239 -4.325 0.000) 5.403 13.752 ( 8.308 5.127 0.000) 9.762 13.882 ( 10.280 -5.412 0.000) 11.617 14.197 ( -5.919 3.448 0.000) 6.850 14.283 ( -6.967 -3.985 0.000) 8.026 14.809 ( 4.089 8.984 0.000) 9.871 15.003 ( 4.606 -7.573 0.000) 8.864 15.063 ( 0.290 6.258 0.000) 6.265 15.195 ( 1.586 -3.906 0.000) 4.216 15.205 ( 2.352 8.024 0.000) 8.362 15.270 ( -0.915 1.155 0.000) 1.473 15.298 ( 0.912 -1.254 0.000) 1.551 15.325 ( -4.578 -1.698 0.000) 4.882 15.467 ( -1.623 7.179 0.000) 7.361 15.657 ( -0.820 -8.572 0.000) 8.611 15.721 ( 2.486 2.248 0.000) 3.352 15.748 ( -1.431 0.635 0.000) 1.566 16.006 ( -0.213 10.060 0.000) 10.063 16.202 ( 6.656 1.261 0.000) 6.775 16.237 ( 4.530 -2.446 0.000) 5.148 16.330 ( 2.749 -15.374 0.000) 15.618 16.640 ( -9.991 4.516 0.000) 10.965 16.720 ( -0.003 3.818 0.000) 3.818 16.730 ( -9.964 -2.577 0.000) 10.291 16.773 ( 1.443 -1.306 0.000) 1.946 17.045 ( 1.983 6.000 0.000) 6.319 17.160 ( 5.788 -3.026 0.000) 6.531 17.204 ( -10.396 4.593 0.000) 11.366 17.349 ( -12.877 -8.153 0.000) 15.241 17.836 ( -0.951 10.502 0.000) 10.545 17.873 ( 8.533 0.874 0.000) 8.578 17.922 ( 10.196 -3.233 0.000) 10.697 18.032 ( -1.892 -6.555 0.000) 6.822 18.236 ( -3.643 4.605 0.000) 5.872 18.401 ( -1.821 -9.430 0.000) 9.604 18.495 ( -22.610 7.791 0.000) 23.915 18.646 ( -22.344 -4.719 0.000) 22.837 19.595 ( 0.248 3.986 0.000) 3.994 19.642 ( -5.742 7.642 0.000) 9.559 19.675 ( -1.031 -2.843 0.000) 3.024 19.807 ( -8.085 -6.314 0.000) 10.259 20.403 ( 4.673 8.262 0.000) 9.492 20.598 ( 10.263 -8.292 0.000) 13.194 20.986 ( -15.590 20.104 0.000) 25.440 21.349 ( -12.895 -11.903 0.000) 17.549 24.304 ( 3.713 8.852 0.000) 9.599 24.461 ( 7.647 -4.682 0.000) 8.966 24.970 ( -9.290 10.352 0.000) 13.909 25.239 ( -7.827 -13.264 0.000) 15.401 25.465 ( 4.017 0.084 0.000) 4.018 25.497 ( 5.934 -2.310 0.000) 6.368 26.242 ( -14.349 3.938 0.000) 14.880 26.278 ( -12.758 0.847 0.000) 12.786 27.028 ( 6.616 1.985 0.000) 6.907 27.095 ( 9.606 -2.829 0.000) 10.014 27.303 ( 0.810 2.419 0.000) 2.551 27.425 ( -0.607 -7.192 0.000) 7.217 27.673 ( -11.322 4.752 0.000) 12.279 27.782 ( -8.988 -4.299 0.000) 9.963 27.935 ( -7.007 0.812 0.000) 7.054 27.981 ( -5.206 -2.674 0.000) 5.852 29.792 ( 3.385 6.572 0.000) 7.393 29.958 ( 3.723 -8.114 0.000) 8.927 29.979 ( -7.305 6.329 0.000) 9.666 30.128 ( -5.790 -7.077 0.000) 9.144 30.676 ( 6.767 7.761 0.000) 10.297 30.677 ( 9.777 5.243 0.000) 11.094 30.760 ( 14.221 -1.678 0.000) 14.319 30.849 ( 9.769 -7.660 0.000) 12.414 31.804 ( 9.880 6.365 0.000) 11.753 31.901 ( 13.708 -1.354 0.000) 13.774 32.016 ( 8.747 8.256 0.000) 12.028 32.149 ( 7.816 -1.155 0.000) 7.901 32.245 ( 4.273 -0.463 0.000) 4.298 32.320 ( 7.664 0.518 0.000) 7.682 32.360 ( 8.344 -8.670 0.000) 12.033 32.384 ( 8.715 -4.189 0.000) 9.670 32.742 ( 8.849 7.049 0.000) 11.314 32.949 ( 10.790 -11.004 0.000) 15.411 33.454 ( -2.509 8.255 0.000) 8.628 33.524 ( -10.778 7.998 0.000) 13.421 33.623 ( -3.783 -6.520 0.000) 7.538 33.704 ( -7.462 -7.781 0.000) 10.781 34.098 ( -13.017 5.749 0.000) 14.230 34.224 ( -13.552 -5.395 0.000) 14.586 98.454 ( 1.768 0.688 0.000) 1.897 98.474 ( 1.773 -1.101 0.000) 2.087 98.585 ( -1.067 1.141 0.000) 1.562 98.615 ( -1.844 -1.521 0.000) 2.390 98.697 ( 5.020 5.777 0.000) 7.653 98.841 ( 0.253 5.081 0.000) 5.088 98.870 ( 6.132 -10.178 0.000) 11.882 98.961 ( 1.690 -5.565 0.000) 5.816 100.253 ( 4.190 3.189 0.000) 5.266 100.331 ( 4.688 -3.842 0.000) 6.061 100.598 ( 3.946 1.249 0.000) 4.139 100.610 ( -3.097 4.673 0.000) 5.606 100.613 ( 4.845 0.058 0.000) 4.845 100.729 ( -3.098 -5.947 0.000) 6.706 100.970 ( -5.380 5.146 0.000) 7.445 101.062 ( -5.769 -3.094 0.000) 6.546 102.488 ( 2.417 4.583 0.000) 5.181 102.600 ( 2.298 -4.736 0.000) 5.264 102.695 ( -2.369 6.279 0.000) 6.711 102.704 ( 5.405 6.305 0.000) 8.304 102.838 ( -3.394 -6.240 0.000) 7.103 102.846 ( 7.375 -5.811 0.000) 9.389 103.616 ( -20.141 17.816 0.000) 26.890 103.923 ( -20.102 -10.169 0.000) 22.528 ======================= Grid point 26 (17/72) ======================= q-point: ( 0.40 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 3.721 ( 28.804 31.039 0.000) 42.345 3.806 ( 40.150 7.891 0.000) 40.918 3.997 ( 39.266 -8.881 0.000) 40.257 4.397 ( 19.236 -28.643 0.000) 34.503 4.966 ( -27.203 15.013 0.000) 31.071 5.035 ( 0.260 15.370 0.000) 15.372 5.299 ( -17.056 -13.810 0.000) 21.946 5.375 ( -11.259 -14.470 0.000) 18.334 5.676 ( 31.445 1.344 0.000) 31.474 5.715 ( 31.233 -1.294 0.000) 31.260 5.906 ( -15.184 7.086 0.000) 16.756 6.111 ( -7.611 -10.492 0.000) 12.963 6.184 ( -10.300 2.413 0.000) 10.578 6.296 ( -6.626 -7.527 0.000) 10.028 6.535 ( -12.440 5.438 0.000) 13.576 6.679 ( -13.904 -6.901 0.000) 15.522 6.991 ( -4.741 6.742 0.000) 8.242 7.006 ( 23.542 2.504 0.000) 23.675 7.056 ( 21.842 -1.705 0.000) 21.908 7.099 ( -7.636 -2.607 0.000) 8.069 7.534 ( 19.113 2.973 0.000) 19.343 7.590 ( 16.565 -2.193 0.000) 16.710 7.965 ( 7.282 6.182 0.000) 9.552 8.057 ( 6.023 -1.416 0.000) 6.188 8.271 ( 19.992 5.062 0.000) 20.623 8.338 ( 15.238 1.587 0.000) 15.321 8.527 ( -0.666 4.699 0.000) 4.746 8.696 ( -5.658 -7.688 0.000) 9.545 8.970 ( -4.509 -0.142 0.000) 4.511 8.980 ( -4.369 -0.953 0.000) 4.472 9.084 ( 3.115 4.323 0.000) 5.329 9.171 ( -0.106 -2.853 0.000) 2.855 9.405 ( -23.078 3.327 0.000) 23.316 9.485 ( -29.680 -2.236 0.000) 29.764 9.539 ( -20.978 2.519 0.000) 21.129 9.627 ( -24.078 -3.466 0.000) 24.327 10.400 ( 8.793 1.322 0.000) 8.891 10.444 ( 8.936 -2.695 0.000) 9.334 10.667 ( -9.068 5.346 0.000) 10.527 10.817 ( -9.482 -7.477 0.000) 12.075 11.057 ( 11.332 10.459 0.000) 15.421 11.191 ( -8.270 5.570 0.000) 9.971 11.314 ( -7.296 -3.916 0.000) 8.281 11.335 ( 7.550 -13.189 0.000) 15.197 11.582 ( -4.844 5.339 0.000) 7.209 11.694 ( -4.179 -4.738 0.000) 6.317 11.696 ( -11.146 4.024 0.000) 11.851 11.746 ( -9.857 0.416 0.000) 9.865 11.857 ( -4.022 0.050 0.000) 4.022 11.866 ( -2.861 2.194 0.000) 3.605 11.876 ( -4.345 -0.913 0.000) 4.440 11.955 ( -4.569 -5.526 0.000) 7.170 12.838 ( 21.345 4.297 0.000) 21.773 12.966 ( 16.911 -6.458 0.000) 18.102 13.140 ( 8.046 -0.610 0.000) 8.069 13.202 ( 8.787 -5.737 0.000) 10.494 13.509 ( 1.879 1.389 0.000) 2.336 13.514 ( 2.053 3.620 0.000) 4.161 13.605 ( -1.410 -4.109 0.000) 4.344 13.607 ( 0.223 -7.085 0.000) 7.088 13.965 ( 10.981 6.224 0.000) 12.622 14.089 ( 8.425 -4.830 0.000) 9.711 14.111 ( -1.220 2.885 0.000) 3.132 14.164 ( -3.528 -1.874 0.000) 3.995 14.874 ( 2.728 9.545 0.000) 9.927 15.050 ( 0.107 -5.289 0.000) 5.290 15.057 ( -3.117 6.983 0.000) 7.647 15.146 ( -7.971 0.796 0.000) 8.011 15.208 ( -0.790 1.921 0.000) 2.077 15.240 ( 1.101 5.471 0.000) 5.581 15.260 ( 2.198 -4.299 0.000) 4.829 15.306 ( 0.410 -1.037 0.000) 1.116 15.543 ( 5.899 7.456 0.000) 9.507 15.714 ( -2.262 5.874 0.000) 6.294 15.745 ( 8.059 -9.607 0.000) 12.540 15.809 ( 5.023 -3.097 0.000) 5.901 16.043 ( 3.660 10.479 0.000) 11.100 16.233 ( -4.788 3.801 0.000) 6.113 16.286 ( 0.026 -0.941 0.000) 0.942 16.396 ( 2.188 -18.007 0.000) 18.140 16.512 ( -0.075 4.895 0.000) 4.895 16.620 ( 0.619 -3.876 0.000) 3.925 16.685 ( -3.633 5.173 0.000) 6.321 16.774 ( -1.433 -3.233 0.000) 3.537 16.986 ( -8.953 3.677 0.000) 9.679 17.028 ( -3.426 7.615 0.000) 8.350 17.064 ( -11.731 -2.391 0.000) 11.972 17.223 ( -2.374 -9.187 0.000) 9.489 17.840 ( 1.105 5.511 0.000) 5.621 17.922 ( -7.978 7.692 0.000) 11.082 17.936 ( -6.445 -1.818 0.000) 6.697 18.038 ( -6.789 -1.650 0.000) 6.987 18.138 ( 1.402 4.564 0.000) 4.774 18.223 ( 0.848 3.522 0.000) 3.623 18.340 ( -5.464 -10.899 0.000) 12.192 18.378 ( -0.917 -9.850 0.000) 9.892 19.578 ( -1.213 5.692 0.000) 5.820 19.589 ( -0.659 3.274 0.000) 3.340 19.663 ( -0.173 -2.976 0.000) 2.981 19.704 ( -2.913 -5.125 0.000) 5.895 20.494 ( 4.669 14.185 0.000) 14.934 20.747 ( -9.183 19.691 0.000) 21.727 20.800 ( 9.586 -12.655 0.000) 15.875 21.142 ( -8.672 -15.425 0.000) 17.695 24.417 ( 7.420 11.158 0.000) 13.400 24.641 ( 10.179 -8.384 0.000) 13.187 24.783 ( -9.579 12.284 0.000) 15.577 25.060 ( -9.798 -12.016 0.000) 15.505 25.527 ( 4.361 4.922 0.000) 6.576 25.652 ( 8.139 -5.857 0.000) 10.027 25.929 ( -15.376 5.288 0.000) 16.260 26.034 ( -11.507 -4.058 0.000) 12.202 27.155 ( 6.101 6.832 0.000) 9.160 27.303 ( 10.650 -3.146 0.000) 11.105 27.379 ( 5.493 -0.332 0.000) 5.503 27.462 ( -9.659 6.090 0.000) 11.419 27.484 ( 7.070 -6.163 0.000) 9.379 27.606 ( -8.153 -6.380 0.000) 10.353 27.769 ( -9.622 2.811 0.000) 10.024 27.851 ( -8.022 -4.035 0.000) 8.980 29.832 ( 0.883 6.834 0.000) 6.891 29.875 ( -3.109 7.074 0.000) 7.727 30.002 ( 1.077 -8.274 0.000) 8.344 30.045 ( -2.564 -8.159 0.000) 8.552 30.799 ( 5.082 9.972 0.000) 11.193 30.826 ( 4.834 8.962 0.000) 10.182 31.014 ( 9.352 -7.488 0.000) 11.981 31.022 ( 6.956 -9.934 0.000) 12.128 31.977 ( 7.416 10.128 0.000) 12.552 32.137 ( 1.768 10.697 0.000) 10.842 32.142 ( 10.066 -2.777 0.000) 10.442 32.276 ( 4.262 4.113 0.000) 5.923 32.294 ( 4.860 -3.228 0.000) 5.834 32.440 ( 4.138 -1.127 0.000) 4.289 32.478 ( 2.438 -11.607 0.000) 11.860 32.509 ( 2.461 -5.657 0.000) 6.169 32.990 ( 13.869 8.578 0.000) 16.308 33.191 ( 13.102 -8.822 0.000) 15.795 33.317 ( -8.935 11.570 0.000) 14.619 33.423 ( 0.468 6.152 0.000) 6.170 33.560 ( -6.601 -10.047 0.000) 12.021 33.566 ( -1.226 -6.077 0.000) 6.200 33.818 ( -14.693 4.863 0.000) 15.477 33.926 ( -15.804 -4.720 0.000) 16.494 98.492 ( 2.069 0.316 0.000) 2.093 98.507 ( 1.542 -0.992 0.000) 1.833 98.562 ( -1.242 0.323 0.000) 1.283 98.577 ( -2.023 -0.966 0.000) 2.242 98.779 ( 3.147 6.827 0.000) 7.517 98.841 ( -0.340 6.206 0.000) 6.215 98.958 ( 2.865 -9.341 0.000) 9.770 98.987 ( 0.849 -6.842 0.000) 6.894 100.345 ( 4.905 3.549 0.000) 6.055 100.434 ( 5.466 -4.426 0.000) 7.033 100.537 ( -4.222 4.419 0.000) 6.111 100.650 ( -4.740 -5.700 0.000) 7.413 100.680 ( 4.234 2.303 0.000) 4.820 100.716 ( 5.398 -0.736 0.000) 5.448 100.864 ( -5.079 4.581 0.000) 6.840 100.944 ( -5.924 -2.433 0.000) 6.404 102.541 ( 2.758 4.601 0.000) 5.365 102.647 ( -2.457 5.255 0.000) 5.801 102.650 ( 2.693 -4.586 0.000) 5.318 102.771 ( -3.314 -5.456 0.000) 6.384 102.834 ( 7.702 8.491 0.000) 11.463 103.019 ( 10.067 -7.600 0.000) 12.614 103.270 ( -14.744 14.736 0.000) 20.846 103.551 ( -16.845 -10.417 0.000) 19.806 ======================= Grid point 27 (18/72) ======================= q-point: (-0.50 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.326 ( -29.101 20.529 0.000) 35.613 4.326 ( 29.101 20.529 0.000) 35.613 4.548 ( -27.591 4.485 0.000) 27.953 4.548 ( 27.591 4.485 0.000) 27.953 4.781 ( -27.502 -7.425 0.000) 28.487 4.781 ( 27.502 -7.425 0.000) 28.487 4.924 ( -8.721 -18.032 0.000) 20.030 4.924 ( 8.721 -18.032 0.000) 20.030 5.902 ( -14.780 8.880 0.000) 17.242 5.902 ( 14.780 8.880 0.000) 17.242 6.121 ( -11.887 -9.552 0.000) 15.249 6.121 ( 11.887 -9.552 0.000) 15.249 6.238 ( -19.041 2.838 0.000) 19.251 6.238 ( 19.041 2.838 0.000) 19.251 6.345 ( -18.904 -5.467 0.000) 19.678 6.345 ( 18.904 -5.467 0.000) 19.678 7.044 ( -6.329 3.220 0.000) 7.101 7.044 ( 6.329 3.220 0.000) 7.101 7.090 ( -4.610 -0.495 0.000) 4.637 7.090 ( 4.610 -0.495 0.000) 4.637 8.041 ( -8.570 3.905 0.000) 9.418 8.041 ( 8.570 3.905 0.000) 9.418 8.070 ( -10.848 1.098 0.000) 10.904 8.070 ( 10.848 1.098 0.000) 10.904 8.605 ( -27.838 4.329 0.000) 28.173 8.605 ( 27.838 4.329 0.000) 28.173 8.722 ( -16.093 -5.666 0.000) 17.061 8.722 ( 16.093 -5.666 0.000) 17.061 8.778 ( -27.166 4.700 0.000) 27.569 8.778 ( 27.166 4.700 0.000) 27.569 8.883 ( -24.678 -4.311 0.000) 25.052 8.883 ( 24.678 -4.311 0.000) 25.052 9.220 ( -11.872 1.712 0.000) 11.995 9.220 ( 11.872 1.712 0.000) 11.995 9.261 ( -11.148 -1.683 0.000) 11.274 9.261 ( 11.148 -1.683 0.000) 11.274 10.547 ( -5.798 3.746 0.000) 6.903 10.547 ( 5.798 3.746 0.000) 6.903 10.634 ( -9.601 -3.989 0.000) 10.397 10.634 ( 9.601 -3.989 0.000) 10.397 11.183 ( -0.824 5.738 0.000) 5.797 11.183 ( 0.824 5.738 0.000) 5.797 11.319 ( -6.122 -4.213 0.000) 7.431 11.319 ( 6.122 -4.213 0.000) 7.431 11.541 ( -3.977 2.485 0.000) 4.689 11.541 ( 3.977 2.485 0.000) 4.689 11.614 ( -3.256 -5.028 0.000) 5.990 11.614 ( 3.256 -5.028 0.000) 5.990 11.834 ( -0.789 1.998 0.000) 2.149 11.834 ( 0.789 1.998 0.000) 2.149 11.885 ( -2.241 -2.135 0.000) 3.095 11.885 ( 2.241 -2.135 0.000) 3.095 13.175 ( -8.105 -0.253 0.000) 8.109 13.175 ( 8.105 -0.253 0.000) 8.109 13.218 ( -7.781 -3.473 0.000) 8.521 13.218 ( 7.781 -3.473 0.000) 8.521 13.513 ( -0.372 0.175 0.000) 0.411 13.513 ( 0.372 0.175 0.000) 0.411 13.575 ( -1.296 -5.190 0.000) 5.350 13.575 ( 1.296 -5.190 0.000) 5.350 14.106 ( -2.636 3.124 0.000) 4.087 14.106 ( 2.636 3.124 0.000) 4.087 14.156 ( -1.103 -1.690 0.000) 2.019 14.156 ( 1.103 -1.690 0.000) 2.019 14.948 ( -5.261 7.516 0.000) 9.174 14.948 ( 5.261 7.516 0.000) 9.174 15.049 ( -1.471 -1.192 0.000) 1.893 15.049 ( 1.471 -1.192 0.000) 1.893 15.234 ( -1.695 4.126 0.000) 4.461 15.234 ( 1.696 4.126 0.000) 4.461 15.307 ( -1.128 -3.055 0.000) 3.257 15.307 ( 1.128 -3.055 0.000) 3.257 15.650 ( -4.276 9.157 0.000) 10.106 15.650 ( 4.276 9.157 0.000) 10.106 15.867 ( -1.219 -9.252 0.000) 9.331 15.867 ( 1.219 -9.252 0.000) 9.331 16.121 ( -4.388 7.959 0.000) 9.089 16.121 ( 4.388 7.959 0.000) 9.089 16.331 ( -6.194 -9.254 0.000) 11.136 16.331 ( 6.194 -9.254 0.000) 11.136 16.586 ( -5.409 5.311 0.000) 7.581 16.586 ( 5.409 5.311 0.000) 7.581 16.698 ( -5.331 -4.719 0.000) 7.120 16.698 ( 5.331 -4.719 0.000) 7.120 16.953 ( -2.341 4.782 0.000) 5.324 16.953 ( 2.341 4.782 0.000) 5.324 17.039 ( -10.911 -3.766 0.000) 11.542 17.039 ( 10.911 -3.766 0.000) 11.542 17.829 ( -2.106 5.916 0.000) 6.280 17.829 ( 2.106 5.916 0.000) 6.280 17.900 ( -5.007 -0.427 0.000) 5.025 17.900 ( 5.007 -0.427 0.000) 5.025 18.215 ( -2.333 1.814 0.000) 2.955 18.215 ( 2.333 1.814 0.000) 2.955 18.347 ( -2.288 -10.066 0.000) 10.323 18.347 ( 2.288 -10.066 0.000) 10.323 19.575 ( -0.539 4.144 0.000) 4.179 19.575 ( 0.539 4.144 0.000) 4.179 19.669 ( -0.894 -3.986 0.000) 4.085 19.669 ( 0.894 -3.986 0.000) 4.085 20.598 ( -6.005 18.175 0.000) 19.142 20.598 ( 6.005 18.175 0.000) 19.142 20.977 ( -8.275 -15.434 0.000) 17.512 20.977 ( 8.275 -15.434 0.000) 17.512 24.589 ( -9.499 12.353 0.000) 15.583 24.589 ( 9.499 12.353 0.000) 15.583 24.854 ( -10.713 -10.818 0.000) 15.225 24.854 ( 10.713 -10.818 0.000) 15.225 25.669 ( -10.127 6.987 0.000) 12.303 25.669 ( 10.127 6.987 0.000) 12.303 25.825 ( -9.413 -6.829 0.000) 11.629 25.825 ( 9.413 -6.829 0.000) 11.629 27.289 ( -7.601 7.158 0.000) 10.441 27.289 ( 7.601 7.158 0.000) 10.441 27.462 ( -6.397 -7.986 0.000) 10.233 27.462 ( 6.397 -7.986 0.000) 10.233 27.557 ( -11.167 4.250 0.000) 11.948 27.557 ( 11.167 4.250 0.000) 11.948 27.667 ( -9.923 -5.206 0.000) 11.206 27.667 ( 9.923 -5.206 0.000) 11.206 29.842 ( -0.620 7.112 0.000) 7.139 29.842 ( 0.620 7.112 0.000) 7.139 30.016 ( -0.729 -8.401 0.000) 8.432 30.016 ( 0.729 -8.401 0.000) 8.432 30.863 ( -0.979 10.655 0.000) 10.700 30.863 ( 0.979 10.655 0.000) 10.700 31.103 ( -0.389 -10.641 0.000) 10.648 31.103 ( 0.389 -10.641 0.000) 10.648 32.097 ( -4.457 12.263 0.000) 13.047 32.097 ( 4.457 12.263 0.000) 13.047 32.283 ( -3.432 -2.188 0.000) 4.071 32.283 ( 3.432 -2.188 0.000) 4.071 32.447 ( -6.784 -1.501 0.000) 6.948 32.447 ( 6.784 -1.501 0.000) 6.948 32.491 ( -0.140 -7.229 0.000) 7.230 32.491 ( 0.140 -7.229 0.000) 7.230 33.186 ( -5.548 11.130 0.000) 12.436 33.186 ( 5.548 11.130 0.000) 12.436 33.429 ( -8.436 -10.240 0.000) 13.267 33.429 ( 8.436 -10.240 0.000) 13.267 33.539 ( -11.541 4.200 0.000) 12.282 33.539 ( 11.541 4.200 0.000) 12.282 33.638 ( -10.533 -4.362 0.000) 11.400 33.638 ( 10.533 -4.362 0.000) 11.400 98.535 ( -2.096 -0.291 0.000) 2.116 98.535 ( 2.096 -0.291 0.000) 2.116 98.536 ( -1.434 -0.457 0.000) 1.505 98.536 ( 1.434 -0.457 0.000) 1.505 98.824 ( -1.450 6.848 0.000) 7.000 98.824 ( 1.450 6.848 0.000) 7.000 98.991 ( -0.603 -8.097 0.000) 8.119 98.991 ( 0.603 -8.097 0.000) 8.119 100.444 ( -4.922 3.978 0.000) 6.328 100.444 ( 4.922 3.978 0.000) 6.328 100.545 ( -5.561 -5.058 0.000) 7.517 100.545 ( 5.561 -5.058 0.000) 7.517 100.768 ( -4.590 3.498 0.000) 5.771 100.768 ( 4.590 3.498 0.000) 5.771 100.827 ( -5.715 -1.633 0.000) 5.944 100.827 ( 5.715 -1.633 0.000) 5.944 102.595 ( -2.682 4.701 0.000) 5.412 102.595 ( 2.682 4.701 0.000) 5.412 102.707 ( -3.034 -4.844 0.000) 5.716 102.707 ( 3.034 -4.844 0.000) 5.716 103.017 ( -10.721 11.393 0.000) 15.644 103.017 ( 10.721 11.393 0.000) 15.644 103.251 ( -13.233 -9.250 0.000) 16.146 103.251 ( 13.233 -9.250 0.000) 16.146 ======================= Grid point 55 (19/72) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.472 ( 0.000 0.000 26.459) 26.459 0.893 ( 0.000 0.000 45.706) 45.706 1.676 ( 0.000 0.000 85.760) 85.760 2.303 ( 0.000 0.000 17.306) 17.306 2.531 ( 0.000 0.000 49.031) 49.031 3.185 ( 0.000 0.000 -31.785) 31.785 3.676 ( 0.000 0.000 -13.776) 13.776 3.830 ( 0.000 0.000 -7.517) 7.517 4.914 ( 0.000 0.000 -3.568) 3.568 5.216 ( 0.000 0.000 -10.737) 10.737 5.739 ( 0.000 0.000 31.768) 31.768 6.264 ( 0.000 0.000 13.931) 13.931 6.892 ( 0.000 0.000 1.340) 1.340 7.023 ( 0.000 0.000 -32.129) 32.129 7.144 ( 0.000 0.000 -38.817) 38.817 7.267 ( 0.000 0.000 -0.159) 0.159 7.404 ( 0.000 0.000 -5.663) 5.663 7.545 ( 0.000 0.000 -2.323) 2.323 7.572 ( 0.000 0.000 -4.370) 4.370 7.649 ( 0.000 0.000 -15.712) 15.712 7.795 ( 0.000 0.000 -3.331) 3.331 7.824 ( 0.000 0.000 8.518) 8.518 7.947 ( 0.000 0.000 4.007) 4.007 8.301 ( 0.000 0.000 -7.861) 7.861 8.340 ( 0.000 0.000 -13.615) 13.615 8.422 ( 0.000 0.000 -11.748) 11.748 8.528 ( 0.000 0.000 -6.507) 6.507 8.592 ( 0.000 0.000 -18.735) 18.735 8.700 ( 0.000 0.000 -5.924) 5.924 9.047 ( 0.000 0.000 19.348) 19.348 9.104 ( 0.000 0.000 -3.555) 3.555 9.109 ( 0.000 0.000 29.312) 29.312 9.539 ( 0.000 0.000 28.750) 28.750 9.670 ( 0.000 0.000 23.088) 23.088 9.675 ( 0.000 0.000 22.520) 22.520 9.867 ( 0.000 0.000 -5.085) 5.085 10.281 ( 0.000 0.000 16.318) 16.318 10.669 ( 0.000 0.000 7.879) 7.879 10.715 ( 0.000 0.000 3.152) 3.152 10.759 ( 0.000 0.000 0.624) 0.624 10.827 ( 0.000 0.000 9.787) 9.787 10.974 ( 0.000 0.000 3.671) 3.671 11.575 ( 0.000 0.000 -13.789) 13.789 11.590 ( 0.000 0.000 -0.056) 0.056 11.902 ( 0.000 0.000 -12.842) 12.842 11.951 ( 0.000 0.000 2.689) 2.689 12.040 ( 0.000 0.000 -1.413) 1.413 12.052 ( 0.000 0.000 -15.183) 15.183 12.061 ( 0.000 0.000 -1.136) 1.136 12.096 ( 0.000 0.000 -4.346) 4.346 12.099 ( 0.000 0.000 4.279) 4.279 12.373 ( 0.000 0.000 -24.681) 24.681 12.407 ( 0.000 0.000 -24.480) 24.480 12.649 ( 0.000 0.000 -21.499) 21.499 12.739 ( 0.000 0.000 -12.478) 12.478 13.087 ( 0.000 0.000 -9.835) 9.835 13.186 ( 0.000 0.000 4.875) 4.875 13.215 ( 0.000 0.000 1.721) 1.721 13.353 ( 0.000 0.000 11.255) 11.255 13.395 ( 0.000 0.000 12.103) 12.103 13.718 ( 0.000 0.000 7.944) 7.944 13.790 ( 0.000 0.000 8.647) 8.647 13.871 ( 0.000 0.000 7.376) 7.376 14.507 ( 0.000 0.000 -7.255) 7.255 14.770 ( 0.000 0.000 -5.346) 5.346 14.806 ( 0.000 0.000 -12.795) 12.795 15.012 ( 0.000 0.000 -2.264) 2.264 15.027 ( 0.000 0.000 -5.939) 5.939 15.231 ( 0.000 0.000 2.894) 2.894 15.275 ( 0.000 0.000 5.177) 5.177 15.287 ( 0.000 0.000 8.490) 8.490 15.423 ( 0.000 0.000 11.133) 11.133 15.582 ( 0.000 0.000 5.381) 5.381 15.690 ( 0.000 0.000 0.732) 0.732 15.851 ( 0.000 0.000 1.599) 1.599 15.973 ( 0.000 0.000 -3.428) 3.428 16.072 ( 0.000 0.000 8.478) 8.478 16.203 ( 0.000 0.000 8.937) 8.937 16.267 ( 0.000 0.000 -8.698) 8.698 16.390 ( 0.000 0.000 -1.171) 1.171 16.514 ( 0.000 0.000 3.045) 3.045 16.554 ( 0.000 0.000 4.372) 4.372 16.704 ( 0.000 0.000 1.780) 1.780 16.735 ( 0.000 0.000 -7.190) 7.190 16.753 ( 0.000 0.000 2.647) 2.647 16.881 ( 0.000 0.000 0.361) 0.361 17.159 ( 0.000 0.000 8.595) 8.595 17.274 ( 0.000 0.000 -1.858) 1.858 17.531 ( 0.000 0.000 -5.571) 5.571 17.631 ( 0.000 0.000 -3.590) 3.590 17.942 ( 0.000 0.000 -0.418) 0.418 18.214 ( 0.000 0.000 -7.280) 7.280 18.273 ( 0.000 0.000 12.467) 12.467 18.627 ( 0.000 0.000 10.280) 10.280 18.909 ( 0.000 0.000 5.972) 5.972 19.030 ( 0.000 0.000 0.971) 0.971 19.399 ( 0.000 0.000 3.754) 3.754 19.578 ( 0.000 0.000 -1.204) 1.204 19.923 ( 0.000 0.000 2.659) 2.659 20.049 ( 0.000 0.000 2.989) 2.989 20.577 ( 0.000 0.000 2.484) 2.484 21.123 ( 0.000 0.000 -11.983) 11.983 21.124 ( 0.000 0.000 -7.801) 7.801 21.470 ( 0.000 0.000 -8.126) 8.126 24.122 ( 0.000 0.000 -0.989) 0.989 24.415 ( 0.000 0.000 -12.604) 12.604 25.495 ( 0.000 0.000 18.871) 18.871 25.663 ( 0.000 0.000 3.431) 3.431 25.760 ( 0.000 0.000 -1.906) 1.906 26.259 ( 0.000 0.000 -2.524) 2.524 26.285 ( 0.000 0.000 4.872) 4.872 26.397 ( 0.000 0.000 -0.748) 0.748 26.824 ( 0.000 0.000 -1.421) 1.421 27.068 ( 0.000 0.000 1.343) 1.343 27.544 ( 0.000 0.000 -6.623) 6.623 27.590 ( 0.000 0.000 -11.741) 11.741 28.005 ( 0.000 0.000 1.886) 1.886 28.044 ( 0.000 0.000 2.953) 2.953 28.208 ( 0.000 0.000 2.557) 2.557 28.448 ( 0.000 0.000 -2.533) 2.533 29.407 ( 0.000 0.000 2.383) 2.383 29.535 ( 0.000 0.000 4.513) 4.513 29.614 ( 0.000 0.000 -5.006) 5.006 30.246 ( 0.000 0.000 -13.616) 13.616 30.398 ( 0.000 0.000 9.761) 9.761 30.613 ( 0.000 0.000 7.456) 7.456 30.728 ( 0.000 0.000 7.189) 7.189 30.769 ( 0.000 0.000 -2.937) 2.937 31.316 ( 0.000 0.000 -3.029) 3.029 31.508 ( 0.000 0.000 -8.568) 8.568 31.626 ( 0.000 0.000 -0.859) 0.859 31.653 ( 0.000 0.000 17.460) 17.460 31.683 ( 0.000 0.000 -13.398) 13.398 31.826 ( 0.000 0.000 6.440) 6.440 32.281 ( 0.000 0.000 13.622) 13.622 32.602 ( 0.000 0.000 -11.092) 11.092 32.676 ( 0.000 0.000 -2.751) 2.751 33.068 ( 0.000 0.000 -9.151) 9.151 33.199 ( 0.000 0.000 4.801) 4.801 33.692 ( 0.000 0.000 -7.173) 7.173 33.968 ( 0.000 0.000 5.715) 5.715 34.220 ( 0.000 0.000 9.419) 9.419 34.379 ( 0.000 0.000 -2.955) 2.955 34.773 ( 0.000 0.000 -1.254) 1.254 98.327 ( 0.000 0.000 0.225) 0.225 98.352 ( 0.000 0.000 0.239) 0.239 98.405 ( 0.000 0.000 -0.727) 0.727 98.448 ( 0.000 0.000 -2.832) 2.832 98.590 ( 0.000 0.000 3.153) 3.153 98.764 ( 0.000 0.000 -0.770) 0.770 98.798 ( 0.000 0.000 2.378) 2.378 99.077 ( 0.000 0.000 -2.140) 2.140 100.255 ( 0.000 0.000 1.404) 1.404 100.333 ( 0.000 0.000 0.555) 0.555 100.422 ( 0.000 0.000 -1.179) 1.179 100.423 ( 0.000 0.000 -0.784) 0.784 100.633 ( 0.000 0.000 2.013) 2.013 100.851 ( 0.000 0.000 -1.497) 1.497 100.948 ( 0.000 0.000 0.028) 0.028 101.024 ( 0.000 0.000 -1.119) 1.119 102.490 ( 0.000 0.000 0.426) 0.426 102.567 ( 0.000 0.000 -0.904) 0.904 102.614 ( 0.000 0.000 0.332) 0.332 102.668 ( 0.000 0.000 -1.455) 1.455 102.909 ( 0.000 0.000 1.458) 1.458 103.060 ( 0.000 0.000 -1.026) 1.026 103.259 ( 0.000 0.000 11.897) 11.897 104.678 ( 0.000 0.000 -11.617) 11.617 ======================= Grid point 56 (20/72) ======================= q-point: ( 0.10 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.736 ( 23.321 0.000 18.614) 29.838 1.488 ( 36.856 0.000 37.033) 52.247 2.217 ( 53.809 0.000 56.697) 78.166 2.508 ( 17.159 0.000 24.880) 30.224 2.951 ( 40.284 0.000 34.001) 52.715 3.258 ( 7.470 0.000 -31.097) 31.982 4.030 ( 33.158 0.000 -14.331) 36.122 4.182 ( 33.214 0.000 -7.368) 34.021 4.899 ( -1.114 0.000 -3.131) 3.323 5.252 ( 3.287 0.000 -11.180) 11.653 5.749 ( 1.472 0.000 31.053) 31.088 6.247 ( -1.623 0.000 13.334) 13.433 6.811 ( -11.089 0.000 -12.364) 16.608 6.876 ( -13.433 0.000 -30.491) 33.319 7.012 ( -6.926 0.000 -22.195) 23.251 7.106 ( -18.750 0.000 -2.792) 18.957 7.367 ( -1.999 0.000 -0.616) 2.092 7.428 ( 0.545 0.000 -5.458) 5.485 7.546 ( -3.944 0.000 -4.662) 6.107 7.707 ( -3.183 0.000 -0.379) 3.206 7.813 ( 4.607 0.000 -4.622) 6.526 7.929 ( -1.505 0.000 4.564) 4.805 8.011 ( 8.398 0.000 -0.161) 8.399 8.167 ( -12.815 0.000 -0.272) 12.818 8.352 ( -1.541 0.000 -16.216) 16.290 8.404 ( -8.941 0.000 -9.857) 13.308 8.447 ( 8.188 0.000 -16.265) 18.209 8.626 ( -2.571 0.000 -11.827) 12.103 8.713 ( -0.713 0.000 4.098) 4.160 8.912 ( -13.240 0.000 21.913) 25.602 8.921 ( -10.946 0.000 19.604) 22.453 9.076 ( -5.255 0.000 4.522) 6.933 9.273 ( -6.010 0.000 8.926) 10.761 9.620 ( 0.289 0.000 14.965) 14.968 9.953 ( 11.720 0.000 7.943) 14.158 10.079 ( 13.531 0.000 18.694) 23.077 10.319 ( 2.109 0.000 10.480) 10.690 10.728 ( 3.115 0.000 2.047) 3.728 10.745 ( -3.755 0.000 6.064) 7.133 10.800 ( 3.624 0.000 10.984) 11.566 10.866 ( 15.313 0.000 9.196) 17.862 11.145 ( 16.033 0.000 2.109) 16.171 11.474 ( -3.019 0.000 -9.089) 9.577 11.715 ( 3.523 0.000 -12.765) 13.242 11.755 ( -5.041 0.000 -9.569) 10.815 11.830 ( -12.127 0.000 -5.128) 13.167 11.991 ( -3.241 0.000 5.744) 6.596 12.109 ( 8.052 0.000 -0.869) 8.099 12.159 ( 4.139 0.000 -6.765) 7.931 12.225 ( -4.207 0.000 -15.938) 16.484 12.249 ( 1.577 0.000 -12.054) 12.156 12.280 ( 10.046 0.000 -3.088) 10.510 12.410 ( -15.727 0.000 -16.879) 23.070 12.501 ( 5.907 0.000 -16.729) 17.742 12.565 ( -8.712 0.000 -1.983) 8.935 13.097 ( -13.973 0.000 6.056) 15.229 13.156 ( -7.393 0.000 -7.048) 10.214 13.297 ( -0.598 0.000 0.489) 0.773 13.313 ( 10.810 0.000 -6.870) 12.808 13.353 ( 5.255 0.000 3.859) 6.520 13.600 ( 0.117 0.000 19.216) 19.216 13.613 ( -18.918 0.000 11.173) 21.972 14.116 ( 15.174 0.000 -0.295) 15.177 14.446 ( -5.815 0.000 -1.973) 6.141 14.651 ( 2.968 0.000 -2.987) 4.211 14.754 ( -3.518 0.000 -5.225) 6.299 15.031 ( -1.048 0.000 -9.554) 9.612 15.134 ( -2.263 0.000 -0.305) 2.283 15.173 ( -3.179 0.000 7.619) 8.256 15.241 ( -1.234 0.000 6.493) 6.609 15.438 ( 6.654 0.000 -8.780) 11.016 15.444 ( 1.075 0.000 9.539) 9.600 15.621 ( 1.878 0.000 8.185) 8.397 15.681 ( 0.121 0.000 1.950) 1.954 15.835 ( -1.676 0.000 1.291) 2.115 15.969 ( -0.456 0.000 -3.316) 3.347 16.017 ( -3.855 0.000 12.718) 13.290 16.081 ( -4.571 0.000 3.164) 5.559 16.447 ( 9.718 0.000 -5.785) 11.309 16.502 ( 3.949 0.000 -7.755) 8.703 16.536 ( 1.055 0.000 -2.676) 2.876 16.558 ( -4.296 0.000 4.895) 6.513 16.648 ( 0.638 0.000 2.173) 2.265 16.793 ( 6.743 0.000 3.655) 7.670 16.849 ( 3.469 0.000 -10.805) 11.348 17.086 ( 12.301 0.000 -0.537) 12.313 17.266 ( -0.584 0.000 -2.104) 2.183 17.339 ( -11.276 0.000 1.128) 11.332 17.351 ( 19.253 0.000 -9.774) 21.592 17.774 ( 6.456 0.000 -7.925) 10.222 17.918 ( -1.790 0.000 -0.234) 1.805 18.192 ( -7.277 0.000 10.866) 13.077 18.208 ( -1.397 0.000 -7.845) 7.969 18.660 ( 2.886 0.000 8.111) 8.610 18.820 ( -8.479 0.000 6.377) 10.610 18.980 ( -5.177 0.000 0.232) 5.182 19.400 ( 0.501 0.000 3.248) 3.287 19.577 ( -0.145 0.000 -1.152) 1.161 19.924 ( -0.074 0.000 1.537) 1.539 20.180 ( 11.858 0.000 4.119) 12.553 20.374 ( -24.413 0.000 11.697) 27.071 20.619 ( -11.318 0.000 8.997) 14.459 21.248 ( -7.542 0.000 -2.959) 8.102 21.467 ( -0.225 0.000 -8.282) 8.285 24.165 ( 4.262 0.000 -0.761) 4.330 24.522 ( 1.426 0.000 -6.868) 7.014 24.845 ( -25.048 0.000 23.622) 34.430 25.516 ( -13.295 0.000 6.075) 14.617 25.701 ( -5.848 0.000 -4.331) 7.277 26.187 ( -7.508 0.000 0.957) 7.568 26.272 ( -0.809 0.000 1.632) 1.822 26.281 ( -0.674 0.000 11.103) 11.123 26.995 ( 4.553 0.000 -4.802) 6.617 27.109 ( 4.358 0.000 1.356) 4.564 27.415 ( -9.780 0.000 -7.276) 12.190 27.626 ( 0.749 0.000 -8.393) 8.427 27.982 ( -2.296 0.000 1.569) 2.781 28.064 ( 1.468 0.000 2.651) 3.030 28.101 ( -9.763 0.000 2.307) 10.031 28.385 ( -6.059 0.000 -1.854) 6.337 29.483 ( 6.089 0.000 2.657) 6.643 29.728 ( 11.021 0.000 -5.937) 12.519 29.753 ( 13.793 0.000 -4.655) 14.558 30.245 ( 0.842 0.000 -8.811) 8.851 30.398 ( -13.578 0.000 5.486) 14.644 30.495 ( 7.000 0.000 5.420) 8.853 30.720 ( 1.150 0.000 6.545) 6.645 30.823 ( -7.681 0.000 10.710) 13.179 31.243 ( 0.999 0.000 -6.231) 6.311 31.344 ( 2.958 0.000 -4.075) 5.035 31.681 ( 4.018 0.000 13.275) 13.870 31.730 ( 9.188 0.000 0.223) 9.190 31.819 ( 10.791 0.000 -8.072) 13.476 31.945 ( 7.897 0.000 9.258) 12.169 32.296 ( 0.960 0.000 8.826) 8.878 32.614 ( 1.580 0.000 -6.597) 6.784 32.702 ( 0.173 0.000 -0.843) 0.860 32.989 ( -2.055 0.000 -3.303) 3.891 33.257 ( 2.813 0.000 -2.989) 4.104 33.664 ( -2.824 0.000 -6.526) 7.111 33.929 ( -3.807 0.000 5.460) 6.656 34.179 ( -3.970 0.000 8.739) 9.599 34.303 ( -5.762 0.000 -1.308) 5.909 34.720 ( -5.185 0.000 -1.586) 5.422 98.374 ( 2.310 0.000 -0.067) 2.311 98.403 ( 0.111 0.000 -0.321) 0.340 98.469 ( 1.680 0.000 -2.641) 3.131 98.592 ( 0.124 0.000 2.889) 2.892 98.660 ( 10.107 0.000 -13.031) 16.491 98.789 ( 6.466 0.000 -5.753) 8.655 98.794 ( -0.437 0.000 2.682) 2.717 99.124 ( 3.913 0.000 -5.995) 7.159 100.244 ( -3.549 0.000 7.109) 7.946 100.287 ( 2.299 0.000 1.946) 3.012 100.425 ( 1.086 0.000 -0.929) 1.429 100.452 ( 2.056 0.000 -0.948) 2.264 100.624 ( -0.960 0.000 2.011) 2.228 100.834 ( -1.610 0.000 -1.345) 2.098 101.019 ( -0.580 0.000 -1.075) 1.221 101.090 ( 6.735 0.000 -9.830) 11.916 102.469 ( -1.360 0.000 0.582) 1.480 102.548 ( -3.545 0.000 1.126) 3.719 102.621 ( -4.889 0.000 5.440) 7.314 102.671 ( 4.934 0.000 -0.152) 4.936 102.731 ( -3.239 0.000 6.557) 7.314 103.026 ( -3.285 0.000 -1.083) 3.459 103.289 ( -0.819 0.000 8.856) 8.894 104.592 ( -8.332 0.000 -10.958) 13.766 ======================= Grid point 57 (21/72) ======================= q-point: ( 0.20 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.326 ( 34.655 0.000 12.398) 36.806 2.192 ( 35.338 0.000 29.286) 45.896 2.945 ( 25.901 0.000 19.501) 32.421 3.483 ( 26.524 0.000 -16.349) 31.158 3.529 ( 59.370 0.000 17.551) 61.910 3.947 ( 54.999 0.000 24.878) 60.364 4.864 ( 45.817 0.000 -18.196) 49.298 4.889 ( 1.384 0.000 -3.128) 3.420 5.041 ( 48.822 0.000 -8.354) 49.531 5.320 ( 2.478 0.000 -10.363) 10.655 5.792 ( 2.151 0.000 25.759) 25.849 6.181 ( -6.445 0.000 8.338) 10.539 6.465 ( -20.471 0.000 -25.666) 32.830 6.561 ( -16.772 0.000 -25.982) 30.925 6.724 ( -13.785 0.000 2.983) 14.104 6.900 ( -6.906 0.000 -2.313) 7.283 7.341 ( -3.532 0.000 -2.007) 4.062 7.359 ( -15.951 0.000 -7.042) 17.436 7.410 ( -1.968 0.000 -3.597) 4.100 7.663 ( -0.550 0.000 -2.133) 2.203 7.869 ( 1.494 0.000 2.219) 2.675 7.873 ( -9.313 0.000 -2.243) 9.579 7.893 ( -5.920 0.000 19.095) 19.992 7.987 ( -6.495 0.000 -1.216) 6.607 8.152 ( -13.770 0.000 6.137) 15.075 8.183 ( -26.636 0.000 31.163) 40.995 8.544 ( -9.174 0.000 12.624) 15.605 8.572 ( 11.628 0.000 -20.031) 23.161 8.717 ( 15.388 0.000 -20.165) 25.365 8.808 ( 2.574 0.000 -3.180) 4.091 8.918 ( 5.259 0.000 -4.371) 6.839 9.052 ( -0.442 0.000 -3.493) 3.521 9.226 ( -1.551 0.000 4.492) 4.752 9.531 ( -6.578 0.000 3.751) 7.572 10.230 ( 9.357 0.000 10.560) 14.109 10.264 ( 6.695 0.000 11.711) 13.490 10.382 ( 7.155 0.000 9.582) 11.959 10.611 ( -9.347 0.000 9.001) 12.977 10.719 ( -6.158 0.000 2.293) 6.571 10.922 ( 5.275 0.000 3.606) 6.390 11.190 ( 12.275 0.000 4.836) 13.193 11.407 ( -6.199 0.000 -9.897) 11.678 11.502 ( 14.397 0.000 -4.817) 15.181 11.608 ( -9.945 0.000 -11.088) 14.894 11.695 ( 0.092 0.000 -3.755) 3.756 11.697 ( -2.733 0.000 -12.061) 12.367 11.815 ( -23.087 0.000 -7.685) 24.333 11.981 ( -8.796 0.000 -6.344) 10.845 12.005 ( -1.650 0.000 3.780) 4.125 12.178 ( -11.730 0.000 -4.566) 12.588 12.327 ( -6.780 0.000 1.514) 6.947 12.334 ( -5.812 0.000 -6.357) 8.613 12.351 ( -0.961 0.000 -6.515) 6.586 12.498 ( 14.896 0.000 -0.831) 14.919 12.722 ( 16.788 0.000 -4.376) 17.349 12.924 ( 5.276 0.000 -7.748) 9.374 13.098 ( 0.980 0.000 7.620) 7.683 13.293 ( -3.811 0.000 6.816) 7.809 13.392 ( 6.857 0.000 -7.185) 9.932 13.429 ( 3.436 0.000 9.449) 10.054 13.556 ( 9.713 0.000 -10.243) 14.116 13.623 ( 1.661 0.000 1.326) 2.126 14.303 ( 3.424 0.000 -7.132) 7.912 14.348 ( -4.928 0.000 -1.643) 5.194 14.713 ( 1.649 0.000 1.479) 2.215 14.753 ( 4.569 0.000 11.184) 12.081 14.960 ( -4.668 0.000 -6.098) 7.679 15.063 ( -3.046 0.000 -1.335) 3.325 15.165 ( 1.412 0.000 6.653) 6.801 15.220 ( -0.802 0.000 5.761) 5.817 15.443 ( -1.537 0.000 8.806) 8.939 15.500 ( 0.238 0.000 -4.179) 4.185 15.641 ( 1.956 0.000 9.662) 9.858 15.693 ( -0.184 0.000 2.865) 2.871 15.796 ( -1.334 0.000 -0.381) 1.387 15.919 ( -5.768 0.000 12.378) 13.655 15.948 ( -1.570 0.000 -2.432) 2.894 16.060 ( 2.066 0.000 2.336) 3.119 16.413 ( -6.783 0.000 -1.872) 7.037 16.546 ( 0.083 0.000 -8.454) 8.454 16.568 ( 2.198 0.000 -9.685) 9.931 16.637 ( -0.355 0.000 1.238) 1.288 16.654 ( 2.665 0.000 -3.125) 4.107 16.831 ( -2.366 0.000 2.632) 3.539 16.954 ( 9.451 0.000 4.301) 10.384 17.115 ( -5.978 0.000 8.144) 10.103 17.229 ( -3.445 0.000 -1.653) 3.821 17.356 ( 10.475 0.000 -1.779) 10.625 17.736 ( 17.147 0.000 -19.893) 26.263 17.786 ( -4.629 0.000 -2.812) 5.416 17.926 ( 1.243 0.000 -7.340) 7.444 18.036 ( -6.586 0.000 5.063) 8.307 18.141 ( -5.247 0.000 -7.180) 8.893 18.606 ( -11.545 0.000 7.918) 13.999 18.691 ( -3.277 0.000 2.109) 3.897 18.825 ( -8.209 0.000 1.045) 8.275 19.427 ( 2.178 0.000 2.780) 3.532 19.568 ( -0.822 0.000 -0.276) 0.867 19.906 ( -2.010 0.000 0.216) 2.021 19.972 ( -13.876 0.000 14.545) 20.103 20.449 ( -8.464 0.000 2.430) 8.805 20.475 ( 16.647 0.000 4.537) 17.254 20.975 ( -17.074 0.000 10.866) 20.238 21.464 ( -0.073 0.000 -8.489) 8.489 24.257 ( -12.224 0.000 16.211) 20.303 24.293 ( 8.475 0.000 -0.279) 8.480 24.884 ( 4.824 0.000 -16.155) 16.860 25.266 ( -5.859 0.000 5.087) 7.759 25.536 ( -10.226 0.000 -9.669) 14.073 25.984 ( -12.099 0.000 1.512) 12.193 26.238 ( -3.275 0.000 1.924) 3.798 26.299 ( 1.157 0.000 10.275) 10.340 27.044 ( 1.877 0.000 -1.808) 2.606 27.188 ( -11.769 0.000 -4.281) 12.524 27.230 ( 7.379 0.000 2.005) 7.647 27.619 ( -1.074 0.000 -4.981) 5.095 27.863 ( -13.165 0.000 2.564) 13.413 27.915 ( -4.449 0.000 0.417) 4.469 28.086 ( 0.220 0.000 1.820) 1.834 28.225 ( -9.422 0.000 -0.557) 9.439 29.592 ( 4.233 0.000 2.523) 4.928 29.969 ( 6.096 0.000 -4.068) 7.329 30.021 ( 16.454 0.000 -9.160) 18.832 30.155 ( -8.739 0.000 6.432) 10.851 30.296 ( 5.175 0.000 -6.887) 8.614 30.581 ( 1.841 0.000 4.162) 4.551 30.617 ( -8.400 0.000 9.135) 12.410 30.866 ( 12.803 0.000 5.427) 13.905 31.430 ( 5.210 0.000 -5.101) 7.291 31.489 ( 16.972 0.000 -5.281) 17.774 31.793 ( 6.585 0.000 12.643) 14.255 31.953 ( 13.229 0.000 2.909) 13.545 32.057 ( 11.824 0.000 -5.949) 13.236 32.156 ( 12.522 0.000 2.116) 12.700 32.299 ( -0.339 0.000 0.493) 0.599 32.676 ( -2.028 0.000 3.104) 3.708 32.680 ( 4.848 0.000 1.144) 4.981 32.992 ( 1.488 0.000 -5.766) 5.955 33.312 ( 2.777 0.000 -3.831) 4.732 33.572 ( -6.858 0.000 -3.337) 7.627 33.823 ( -6.334 0.000 3.843) 7.409 34.073 ( -6.203 0.000 6.624) 9.075 34.158 ( -8.773 0.000 -0.512) 8.788 34.568 ( -10.000 0.000 -2.429) 10.291 98.417 ( 1.301 0.000 0.612) 1.438 98.434 ( 3.523 0.000 -0.384) 3.544 98.504 ( 1.662 0.000 -2.237) 2.787 98.595 ( 0.216 0.000 2.312) 2.322 98.686 ( -1.233 0.000 -2.318) 2.626 98.779 ( -1.140 0.000 3.432) 3.616 98.955 ( 6.465 0.000 -8.796) 10.917 99.192 ( 2.317 0.000 -8.350) 8.666 100.214 ( 0.384 0.000 7.658) 7.667 100.362 ( 4.863 0.000 0.935) 4.952 100.466 ( 2.906 0.000 -0.752) 3.002 100.500 ( 2.676 0.000 -0.961) 2.843 100.595 ( -1.926 0.000 2.102) 2.851 100.792 ( -2.460 0.000 -1.041) 2.671 100.997 ( -1.758 0.000 -0.907) 1.978 101.131 ( -1.942 0.000 -6.953) 7.219 102.452 ( -0.165 0.000 0.530) 0.556 102.460 ( -2.529 0.000 5.571) 6.118 102.589 ( -0.327 0.000 1.430) 1.466 102.735 ( 1.576 0.000 1.873) 2.448 102.792 ( 6.725 0.000 -1.319) 6.854 102.940 ( -4.778 0.000 -0.795) 4.844 103.231 ( -4.363 0.000 8.959) 9.965 104.361 ( -14.178 0.000 -9.292) 16.951 ======================= Grid point 58 (22/72) ======================= q-point: ( 0.30 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.090 ( 41.137 0.000 9.047) 42.120 2.908 ( 35.949 0.000 14.485) 38.757 3.516 ( 30.575 0.000 7.254) 31.424 3.897 ( 23.757 0.000 -25.581) 34.911 4.867 ( 59.494 0.000 21.483) 63.253 4.950 ( 8.268 0.000 -1.344) 8.376 4.999 ( 39.054 0.000 14.714) 41.734 5.194 ( -6.043 0.000 0.050) 6.043 5.657 ( 15.009 0.000 -31.192) 34.615 5.719 ( -10.309 0.000 -15.883) 18.935 5.908 ( 9.577 0.000 -1.567) 9.704 5.983 ( -6.788 0.000 -6.708) 9.543 6.253 ( 23.111 0.000 2.836) 23.284 6.414 ( 12.803 0.000 -5.265) 13.843 6.668 ( 5.772 0.000 10.635) 12.101 6.687 ( -15.043 0.000 -2.340) 15.224 6.989 ( -13.949 0.000 -1.451) 14.024 7.193 ( -9.474 0.000 -3.391) 10.063 7.339 ( -6.623 0.000 10.649) 12.540 7.574 ( -21.644 0.000 29.432) 36.533 7.693 ( -9.819 0.000 7.720) 12.490 7.721 ( -4.164 0.000 12.640) 13.308 7.790 ( -2.803 0.000 18.699) 18.908 7.890 ( 1.767 0.000 1.298) 2.192 7.951 ( 3.709 0.000 1.132) 3.878 7.980 ( -2.537 0.000 5.486) 6.044 8.454 ( 0.179 0.000 3.859) 3.863 8.778 ( 7.470 0.000 -10.758) 13.098 8.938 ( 7.839 0.000 -9.364) 12.212 8.939 ( 4.605 0.000 -4.093) 6.161 8.971 ( -6.594 0.000 -3.377) 7.408 9.056 ( 7.190 0.000 -18.242) 19.608 9.223 ( 0.991 0.000 -6.075) 6.155 9.432 ( -1.199 0.000 -7.027) 7.129 10.196 ( -26.033 0.000 7.845) 27.189 10.312 ( 2.423 0.000 6.145) 6.605 10.318 ( -11.876 0.000 3.086) 12.270 10.463 ( -9.512 0.000 8.224) 12.574 10.675 ( 9.776 0.000 3.613) 10.422 10.895 ( -11.675 0.000 1.929) 11.833 11.077 ( -15.289 0.000 -19.606) 24.862 11.252 ( -16.196 0.000 -11.093) 19.631 11.383 ( -12.645 0.000 -18.210) 22.170 11.483 ( -3.855 0.000 -12.124) 12.722 11.575 ( -1.807 0.000 0.919) 2.027 11.657 ( -16.439 0.000 -0.943) 16.466 11.725 ( 4.645 0.000 2.079) 5.089 11.820 ( -7.206 0.000 -1.824) 7.433 11.894 ( -6.709 0.000 -2.817) 7.276 11.942 ( -3.678 0.000 11.330) 11.913 12.238 ( 11.415 0.000 -2.634) 11.715 12.381 ( 9.677 0.000 13.061) 16.255 12.405 ( 0.977 0.000 -0.348) 1.037 12.879 ( 17.636 0.000 3.176) 17.920 13.042 ( 14.622 0.000 -9.790) 17.597 13.084 ( 8.228 0.000 0.798) 8.267 13.192 ( 6.709 0.000 -5.932) 8.955 13.454 ( 15.083 0.000 3.558) 15.497 13.529 ( 6.903 0.000 7.643) 10.299 13.546 ( 6.961 0.000 1.318) 7.085 13.696 ( 8.687 0.000 -18.749) 20.664 13.742 ( 8.784 0.000 -5.888) 10.575 14.216 ( -8.633 0.000 -2.190) 8.907 14.331 ( 1.123 0.000 -0.823) 1.392 14.712 ( -0.807 0.000 6.636) 6.685 14.881 ( 0.173 0.000 6.072) 6.074 14.885 ( 3.516 0.000 7.167) 7.983 15.026 ( -1.523 0.000 -2.252) 2.719 15.187 ( 0.052 0.000 6.899) 6.899 15.224 ( 1.743 0.000 4.233) 4.578 15.374 ( -5.363 0.000 5.688) 7.818 15.481 ( -1.404 0.000 2.179) 2.592 15.634 ( -3.024 0.000 6.348) 7.032 15.726 ( 2.098 0.000 5.575) 5.957 15.815 ( 3.291 0.000 -2.704) 4.259 15.821 ( -1.398 0.000 7.897) 8.020 15.920 ( -0.580 0.000 0.416) 0.714 16.129 ( 2.897 0.000 0.174) 2.902 16.231 ( -9.917 0.000 -2.976) 10.354 16.477 ( -5.265 0.000 -5.295) 7.467 16.504 ( -5.132 0.000 5.640) 7.625 16.643 ( 3.675 0.000 -8.817) 9.553 16.751 ( 2.709 0.000 -2.361) 3.593 16.807 ( 0.592 0.000 1.261) 1.393 17.020 ( -5.254 0.000 5.369) 7.512 17.109 ( -8.127 0.000 -1.742) 8.312 17.167 ( 10.878 0.000 3.528) 11.436 17.461 ( -8.413 0.000 -1.993) 8.646 17.675 ( 0.613 0.000 -0.694) 0.925 17.921 ( -0.042 0.000 -1.829) 1.829 17.981 ( 0.472 0.000 -9.325) 9.337 17.985 ( -3.303 0.000 -10.075) 10.603 18.044 ( 4.916 0.000 -13.255) 14.137 18.398 ( -20.168 0.000 -5.946) 21.026 18.417 ( -6.825 0.000 8.087) 10.582 18.757 ( -2.469 0.000 0.707) 2.568 19.481 ( 3.098 0.000 2.332) 3.877 19.557 ( 0.352 0.000 3.753) 3.770 19.788 ( -5.490 0.000 8.185) 9.856 19.840 ( -4.485 0.000 -0.572) 4.521 20.286 ( -7.104 0.000 2.262) 7.456 20.643 ( -15.100 0.000 18.327) 23.746 20.811 ( 16.247 0.000 3.024) 16.526 21.460 ( -0.612 0.000 -8.056) 8.079 24.125 ( -1.804 0.000 8.835) 9.018 24.501 ( 12.157 0.000 -0.240) 12.160 24.747 ( -12.674 0.000 -1.198) 12.730 25.320 ( -10.613 0.000 -13.523) 17.190 25.412 ( 14.232 0.000 -9.073) 16.878 25.735 ( -11.983 0.000 1.059) 12.029 26.103 ( -10.931 0.000 3.939) 11.619 26.291 ( -2.660 0.000 8.222) 8.641 27.007 ( -4.921 0.000 -0.877) 4.998 27.104 ( 4.705 0.000 -2.089) 5.148 27.397 ( 9.197 0.000 1.537) 9.324 27.592 ( -8.798 0.000 1.938) 9.009 27.608 ( -4.349 0.000 -0.893) 4.440 27.802 ( -6.916 0.000 -1.020) 6.990 28.028 ( -9.831 0.000 0.377) 9.838 28.057 ( -3.389 0.000 0.456) 3.419 29.648 ( 1.556 0.000 1.424) 2.109 29.918 ( -6.246 0.000 9.012) 10.965 30.150 ( 4.020 0.000 -2.967) 4.996 30.260 ( 7.110 0.000 -10.699) 12.846 30.498 ( -4.293 0.000 8.560) 9.576 30.539 ( 17.638 0.000 -8.388) 19.531 30.604 ( 1.118 0.000 -0.103) 1.123 31.155 ( 14.223 0.000 5.034) 15.088 31.536 ( 5.514 0.000 -3.822) 6.709 31.823 ( 15.389 0.000 -0.144) 15.390 31.927 ( 6.409 0.000 10.089) 11.953 32.190 ( 0.556 0.000 1.382) 1.490 32.260 ( 15.449 0.000 1.780) 15.551 32.384 ( 10.349 0.000 -3.486) 10.920 32.401 ( 11.542 0.000 -4.201) 12.283 32.657 ( 1.615 0.000 3.927) 4.246 32.780 ( 4.274 0.000 2.440) 4.922 33.031 ( 2.337 0.000 -6.430) 6.842 33.362 ( -14.504 0.000 3.253) 14.864 33.371 ( 3.321 0.000 -3.799) 5.046 33.712 ( -3.943 0.000 -0.204) 3.949 33.945 ( -6.445 0.000 3.748) 7.456 33.957 ( -11.138 0.000 1.039) 11.186 34.324 ( -14.245 0.000 -3.297) 14.622 98.453 ( 2.203 0.000 1.159) 2.489 98.506 ( 3.420 0.000 -0.741) 3.499 98.531 ( 1.000 0.000 -1.750) 2.016 98.601 ( 0.439 0.000 2.058) 2.105 98.660 ( -1.246 0.000 -1.419) 1.888 98.748 ( -1.983 0.000 4.263) 4.702 99.057 ( 4.177 0.000 -6.056) 7.357 99.216 ( 0.314 0.000 -7.132) 7.139 100.247 ( 2.608 0.000 6.040) 6.579 100.471 ( 5.359 0.000 0.115) 5.361 100.532 ( 3.195 0.000 -0.595) 3.250 100.550 ( -2.010 0.000 2.635) 3.314 100.562 ( 3.833 0.000 -1.069) 3.980 100.740 ( -2.617 0.000 -0.734) 2.718 100.947 ( -3.226 0.000 -0.675) 3.296 101.046 ( -5.940 0.000 -3.220) 6.757 102.448 ( 0.884 0.000 2.310) 2.474 102.465 ( 1.494 0.000 0.207) 1.509 102.581 ( -0.660 0.000 0.391) 0.767 102.778 ( 2.687 0.000 2.163) 3.450 102.809 ( -5.414 0.000 -2.092) 5.804 102.973 ( 8.690 0.000 -0.795) 8.726 103.130 ( -5.468 0.000 7.945) 9.645 104.049 ( -16.485 0.000 -7.239) 18.005 ======================= Grid point 59 (23/72) ======================= q-point: ( 0.40 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.943 ( 43.572 0.000 6.553) 44.062 3.616 ( 34.446 0.000 0.556) 34.450 4.144 ( 31.792 0.000 -6.120) 32.375 4.371 ( 18.643 0.000 -22.181) 28.975 4.598 ( -35.513 0.000 -0.566) 35.517 4.999 ( -1.049 0.000 -10.063) 10.117 5.335 ( -24.410 0.000 -27.613) 36.856 5.406 ( -10.237 0.000 -14.693) 17.907 5.788 ( -10.965 0.000 5.015) 12.058 5.944 ( 32.997 0.000 22.990) 40.216 5.976 ( 40.568 0.000 19.527) 45.023 6.125 ( 12.615 0.000 -13.235) 18.284 6.159 ( -20.431 0.000 -5.505) 21.159 6.659 ( -3.379 0.000 -9.371) 9.962 6.854 ( 1.544 0.000 21.568) 21.623 6.859 ( 9.029 0.000 10.870) 14.131 7.032 ( -2.682 0.000 14.451) 14.698 7.131 ( -5.726 0.000 13.976) 15.103 7.232 ( 5.333 0.000 17.852) 18.632 7.232 ( 7.084 0.000 25.012) 25.996 7.560 ( 8.571 0.000 8.576) 12.125 7.706 ( 5.559 0.000 1.442) 5.743 7.869 ( 9.132 0.000 9.644) 13.282 7.976 ( 3.585 0.000 0.154) 3.589 7.995 ( 6.201 0.000 3.460) 7.101 8.165 ( 18.253 0.000 -1.954) 18.357 8.554 ( 9.800 0.000 0.201) 9.802 8.828 ( -3.352 0.000 -3.466) 4.822 8.907 ( 2.502 0.000 -7.523) 7.928 8.969 ( -0.628 0.000 -1.325) 1.467 9.012 ( -0.724 0.000 -2.370) 2.478 9.078 ( -3.361 0.000 -9.493) 10.070 9.215 ( -4.652 0.000 -12.582) 13.415 9.435 ( -10.093 0.000 -13.815) 17.110 9.553 ( -30.108 0.000 6.969) 30.904 9.742 ( -33.636 0.000 7.607) 34.486 10.368 ( 2.684 0.000 2.489) 3.660 10.441 ( -0.647 0.000 -8.819) 8.843 10.515 ( -16.583 0.000 -7.370) 18.147 10.763 ( -14.845 0.000 -19.622) 24.605 10.788 ( 1.658 0.000 -9.519) 9.662 11.004 ( -4.387 0.000 -13.413) 14.113 11.115 ( -17.643 0.000 -28.971) 33.920 11.272 ( -12.361 0.000 -15.885) 20.128 11.475 ( 3.415 0.000 11.814) 12.297 11.559 ( -0.911 0.000 2.287) 2.462 11.803 ( 1.754 0.000 -2.074) 2.716 11.826 ( 4.700 0.000 8.465) 9.683 11.839 ( -0.144 0.000 0.801) 0.814 12.053 ( 10.120 0.000 23.436) 25.528 12.191 ( -8.127 0.000 13.503) 15.760 12.384 ( -3.515 0.000 13.560) 14.008 12.823 ( 24.604 0.000 2.874) 24.771 13.077 ( 4.055 0.000 -5.352) 6.715 13.181 ( 0.712 0.000 -10.130) 10.155 13.281 ( 7.678 0.000 -12.967) 15.070 13.415 ( 13.948 0.000 -8.871) 16.530 13.630 ( 3.783 0.000 -3.258) 4.993 13.643 ( 3.505 0.000 -1.390) 3.771 13.761 ( 10.849 0.000 3.976) 11.554 13.867 ( 0.812 0.000 2.995) 3.103 13.976 ( 15.976 0.000 -6.034) 17.078 14.048 ( -4.427 0.000 1.661) 4.728 14.357 ( 0.606 0.000 4.871) 4.909 14.726 ( 3.091 0.000 7.101) 7.745 14.844 ( -1.216 0.000 -2.929) 3.171 14.943 ( -2.863 0.000 14.743) 15.018 14.965 ( -4.907 0.000 2.591) 5.549 15.153 ( -1.940 0.000 6.089) 6.391 15.256 ( -5.074 0.000 2.844) 5.817 15.291 ( 4.205 0.000 1.037) 4.331 15.444 ( -2.779 0.000 2.880) 4.003 15.588 ( -0.406 0.000 5.346) 5.361 15.682 ( -3.511 0.000 8.044) 8.777 15.869 ( 1.266 0.000 -1.994) 2.362 15.921 ( -1.732 0.000 1.220) 2.119 15.947 ( 11.197 0.000 -0.069) 11.198 16.105 ( 6.666 0.000 -2.808) 7.233 16.260 ( 5.257 0.000 1.485) 5.463 16.376 ( -5.080 0.000 -1.884) 5.418 16.446 ( -0.930 0.000 6.756) 6.820 16.667 ( -0.709 0.000 1.662) 1.807 16.767 ( -0.583 0.000 -2.997) 3.053 16.862 ( -3.808 0.000 -2.676) 4.654 16.897 ( -6.334 0.000 0.918) 6.400 16.937 ( 1.408 0.000 -7.146) 7.283 17.070 ( -24.087 0.000 1.235) 24.119 17.387 ( 9.517 0.000 1.004) 9.570 17.722 ( -22.537 0.000 -8.338) 24.030 17.781 ( 5.620 0.000 -1.690) 5.868 17.873 ( -12.763 0.000 -1.092) 12.810 17.925 ( -0.685 0.000 -3.750) 3.812 18.049 ( 6.201 0.000 -7.662) 9.857 18.306 ( -5.209 0.000 3.975) 6.553 18.353 ( 9.634 0.000 -16.028) 18.701 18.675 ( -5.638 0.000 -6.889) 8.902 19.550 ( 3.792 0.000 1.413) 4.047 19.596 ( 3.265 0.000 8.400) 9.013 19.716 ( -2.507 0.000 6.130) 6.623 19.738 ( -5.387 0.000 -0.561) 5.416 20.192 ( -1.842 0.000 6.316) 6.579 20.384 ( -10.755 0.000 17.461) 20.507 21.104 ( 12.783 0.000 -0.168) 12.784 21.424 ( -3.353 0.000 -6.462) 7.280 24.158 ( 4.629 0.000 5.332) 7.061 24.499 ( -11.542 0.000 2.201) 11.750 24.763 ( 13.395 0.000 -2.444) 13.616 25.136 ( -7.544 0.000 -13.451) 15.422 25.543 ( -5.919 0.000 1.416) 6.086 25.706 ( 14.450 0.000 -7.832) 16.436 25.819 ( -15.868 0.000 6.457) 17.131 26.181 ( -8.201 0.000 3.700) 8.997 27.005 ( 4.125 0.000 1.097) 4.269 27.240 ( 8.709 0.000 -2.631) 9.098 27.350 ( -11.555 0.000 3.059) 11.953 27.590 ( 9.783 0.000 0.091) 9.784 27.625 ( 2.489 0.000 -0.339) 2.512 27.638 ( -9.292 0.000 -2.039) 9.513 27.845 ( -8.243 0.000 0.726) 8.275 27.950 ( -7.069 0.000 -0.726) 7.107 29.675 ( 1.704 0.000 2.748) 3.234 29.810 ( -4.661 0.000 9.045) 10.175 30.238 ( 4.717 0.000 0.213) 4.722 30.385 ( 6.070 0.000 -9.108) 10.945 30.419 ( -3.942 0.000 7.559) 8.525 30.578 ( -2.507 0.000 -2.102) 3.272 30.914 ( 16.915 0.000 -14.449) 22.246 31.316 ( -0.171 0.000 -8.188) 8.190 31.706 ( 11.923 0.000 9.729) 15.389 32.003 ( -0.499 0.000 10.735) 10.747 32.091 ( 11.429 0.000 2.850) 11.779 32.251 ( 9.039 0.000 3.275) 9.614 32.383 ( -1.959 0.000 2.815) 3.430 32.606 ( 10.556 0.000 -0.839) 10.589 32.661 ( 11.557 0.000 -4.855) 12.535 32.778 ( 7.634 0.000 -1.455) 7.771 32.813 ( -2.313 0.000 0.066) 2.313 33.015 ( -18.537 0.000 7.481) 19.989 33.117 ( 8.419 0.000 -6.542) 10.662 33.451 ( 4.396 0.000 -3.936) 5.901 33.676 ( 0.357 0.000 -1.493) 1.535 33.730 ( -10.687 0.000 2.528) 10.982 33.821 ( -5.783 0.000 1.177) 5.901 34.010 ( -16.650 0.000 -3.310) 16.976 98.498 ( 2.158 0.000 0.568) 2.232 98.542 ( 0.039 0.000 -1.428) 1.429 98.566 ( 2.555 0.000 -0.999) 2.743 98.616 ( 1.200 0.000 2.959) 3.193 98.636 ( -1.215 0.000 -1.198) 1.707 98.702 ( -2.540 0.000 4.779) 5.412 99.128 ( 3.022 0.000 -5.268) 6.073 99.209 ( -0.982 0.000 -5.951) 6.032 100.311 ( 3.731 0.000 4.524) 5.864 100.468 ( -3.524 0.000 2.126) 4.115 100.586 ( 2.421 0.000 -0.788) 2.546 100.620 ( 6.832 0.000 0.675) 6.865 100.649 ( 3.554 0.000 -1.515) 3.864 100.695 ( -0.806 0.000 0.047) 0.807 100.869 ( -4.507 0.000 -0.485) 4.534 100.911 ( -7.247 0.000 -1.216) 7.349 102.481 ( 2.097 0.000 0.477) 2.150 102.512 ( 3.203 0.000 -0.256) 3.213 102.560 ( -1.436 0.000 -0.139) 1.443 102.695 ( -5.599 0.000 -1.336) 5.756 102.841 ( 3.606 0.000 3.298) 4.886 103.021 ( -5.312 0.000 6.444) 8.351 103.175 ( 11.313 0.000 -2.237) 11.532 103.722 ( -15.856 0.000 -5.278) 16.712 ======================= Grid point 60 (24/72) ======================= q-point: (-0.50 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.807 ( -42.173 0.000 3.937) 42.356 3.807 ( 42.173 0.000 3.937) 42.356 4.250 ( -26.648 0.000 -12.374) 29.381 4.250 ( 26.648 0.000 -12.374) 29.381 4.773 ( -30.361 0.000 -19.279) 35.964 4.773 ( 30.361 0.000 -19.279) 35.964 5.197 ( -18.794 0.000 -13.712) 23.265 5.197 ( 18.794 0.000 -13.712) 23.265 5.729 ( -11.466 0.000 -1.070) 11.515 5.729 ( 11.466 0.000 -1.070) 11.515 6.340 ( -6.567 0.000 -5.034) 8.274 6.340 ( 6.567 0.000 -5.034) 8.274 6.611 ( -13.637 0.000 23.686) 27.331 6.611 ( 13.637 0.000 23.686) 27.331 6.700 ( -24.939 0.000 24.396) 34.887 6.700 ( 24.939 0.000 24.396) 34.887 7.079 ( -12.700 0.000 17.571) 21.680 7.079 ( 12.700 0.000 17.571) 21.680 7.218 ( -8.944 0.000 14.805) 17.297 7.218 ( 8.944 0.000 14.805) 17.297 7.852 ( -8.134 0.000 0.027) 8.134 7.852 ( 8.134 0.000 0.027) 8.134 7.981 ( -10.907 0.000 -0.408) 10.915 7.981 ( 10.907 0.000 -0.408) 10.915 8.507 ( -34.508 0.000 -1.059) 34.524 8.507 ( 34.508 0.000 -1.059) 34.524 8.633 ( -24.946 0.000 -4.363) 25.325 8.633 ( 24.946 0.000 -4.363) 25.325 8.917 ( -4.322 0.000 4.224) 6.043 8.917 ( 4.322 0.000 4.224) 6.043 8.957 ( -13.714 0.000 -4.752) 14.514 8.957 ( 13.714 0.000 -4.752) 14.514 9.202 ( -15.469 0.000 2.884) 15.736 9.202 ( 15.469 0.000 2.884) 15.736 9.223 ( -11.056 0.000 -5.938) 12.550 9.223 ( 11.056 0.000 -5.938) 12.550 10.393 ( -0.542 0.000 -6.836) 6.857 10.393 ( 0.542 0.000 -6.836) 6.857 10.516 ( -9.169 0.000 -21.709) 23.566 10.516 ( 9.169 0.000 -21.709) 23.566 10.851 ( -7.312 0.000 -22.113) 23.290 10.851 ( 7.312 0.000 -22.113) 23.290 11.062 ( -8.016 0.000 -11.616) 14.113 11.062 ( 8.016 0.000 -11.616) 14.113 11.537 ( -1.719 0.000 4.760) 5.061 11.537 ( 1.719 0.000 4.760) 5.061 11.827 ( -0.963 0.000 -1.008) 1.394 11.827 ( 0.963 0.000 -1.008) 1.394 11.992 ( -10.608 0.000 17.449) 20.421 11.992 ( 10.608 0.000 17.449) 20.421 12.256 ( -8.974 0.000 22.999) 24.688 12.256 ( 8.974 0.000 22.999) 24.688 13.145 ( -3.198 0.000 -13.334) 13.713 13.145 ( 3.198 0.000 -13.334) 13.713 13.235 ( -13.819 0.000 -6.840) 15.419 13.235 ( 13.819 0.000 -6.840) 15.419 13.629 ( -5.996 0.000 -5.896) 8.409 13.629 ( 5.996 0.000 -5.896) 8.409 13.707 ( -5.848 0.000 -3.116) 6.627 13.707 ( 5.848 0.000 -3.116) 6.627 13.988 ( -5.885 0.000 6.301) 8.622 13.988 ( 5.885 0.000 6.301) 8.622 14.267 ( -11.196 0.000 5.875) 12.643 14.267 ( 11.196 0.000 5.875) 12.643 14.838 ( -7.101 0.000 6.488) 9.619 14.838 ( 7.101 0.000 6.488) 9.619 14.844 ( -2.472 0.000 1.241) 2.766 14.844 ( 2.472 0.000 1.241) 2.766 15.175 ( -3.164 0.000 5.963) 6.750 15.175 ( 3.164 0.000 5.963) 6.750 15.372 ( -3.987 0.000 -0.057) 3.987 15.372 ( 3.987 0.000 -0.057) 3.987 15.619 ( -2.727 0.000 6.690) 7.225 15.619 ( 2.727 0.000 6.690) 7.225 15.892 ( -1.128 0.000 -0.153) 1.139 15.892 ( 1.128 0.000 -0.153) 1.139 16.207 ( -12.630 0.000 -1.880) 12.769 16.207 ( 12.630 0.000 -1.880) 12.769 16.281 ( -5.355 0.000 -1.185) 5.485 16.281 ( 5.355 0.000 -1.185) 5.485 16.585 ( -17.267 0.000 5.398) 18.091 16.585 ( 17.267 0.000 5.398) 18.091 16.698 ( -5.480 0.000 1.482) 5.677 16.698 ( 5.480 0.000 1.482) 5.677 16.807 ( -2.087 0.000 -1.782) 2.744 16.807 ( 2.087 0.000 -1.782) 2.744 17.197 ( -19.194 0.000 -8.340) 20.928 17.197 ( 19.194 0.000 -8.340) 20.928 17.655 ( -10.234 0.000 0.080) 10.234 17.655 ( 10.234 0.000 0.080) 10.234 17.877 ( -3.893 0.000 -3.538) 5.261 17.877 ( 3.893 0.000 -3.538) 5.261 18.188 ( -6.748 0.000 -1.772) 6.976 18.188 ( 6.748 0.000 -1.772) 6.976 18.536 ( -8.168 0.000 -12.940) 15.302 18.536 ( 8.168 0.000 -12.940) 15.302 19.635 ( -4.752 0.000 0.237) 4.758 19.635 ( 4.752 0.000 0.237) 4.758 19.664 ( -3.061 0.000 7.957) 8.525 19.664 ( 3.061 0.000 7.957) 8.525 20.223 ( -5.006 0.000 12.227) 13.212 20.223 ( 5.006 0.000 12.227) 13.212 21.313 ( -7.980 0.000 -3.711) 8.800 21.313 ( 7.980 0.000 -3.711) 8.800 24.294 ( -8.730 0.000 3.594) 9.441 24.294 ( 8.730 0.000 3.594) 9.441 24.991 ( -8.550 0.000 -9.107) 12.491 24.991 ( 8.550 0.000 -9.107) 12.491 25.556 ( -8.067 0.000 5.498) 9.763 25.556 ( 8.067 0.000 5.498) 9.763 25.975 ( -12.170 0.000 -2.427) 12.409 25.975 ( 12.170 0.000 -2.427) 12.409 27.142 ( -9.002 0.000 2.285) 9.287 27.142 ( 9.002 0.000 2.285) 9.287 27.436 ( -10.400 0.000 -2.632) 10.728 27.436 ( 10.400 0.000 -2.632) 10.728 27.706 ( -5.557 0.000 0.527) 5.582 27.706 ( 5.557 0.000 0.527) 5.582 27.784 ( -9.274 0.000 -0.848) 9.313 27.784 ( 9.274 0.000 -0.848) 9.313 29.727 ( -3.541 0.000 6.001) 6.968 29.727 ( 3.541 0.000 6.001) 6.968 30.334 ( -4.647 0.000 4.575) 6.521 30.334 ( 4.647 0.000 4.575) 6.521 30.500 ( -5.093 0.000 -6.189) 8.015 30.500 ( 5.093 0.000 -6.189) 8.015 31.193 ( -10.717 0.000 -14.478) 18.013 31.193 ( 10.717 0.000 -14.478) 18.013 31.917 ( -7.644 0.000 13.308) 15.347 31.917 ( 7.644 0.000 13.308) 15.347 32.281 ( -7.528 0.000 3.579) 8.336 32.281 ( 7.528 0.000 3.579) 8.336 32.553 ( -18.988 0.000 3.088) 19.238 32.553 ( 18.988 0.000 3.088) 19.238 32.787 ( -7.232 0.000 2.608) 7.687 32.787 ( 7.232 0.000 2.608) 7.687 32.812 ( -3.775 0.000 -4.903) 6.188 32.812 ( 3.775 0.000 -4.903) 6.188 33.379 ( -13.631 0.000 -4.407) 14.326 33.379 ( 13.631 0.000 -4.407) 14.326 33.710 ( -10.976 0.000 -0.319) 10.981 33.710 ( 10.976 0.000 -0.319) 10.981 33.721 ( -3.923 0.000 -0.668) 3.979 33.721 ( 3.923 0.000 -0.668) 3.979 98.532 ( -1.099 0.000 -0.787) 1.351 98.532 ( 1.099 0.000 -0.787) 1.351 98.608 ( -1.668 0.000 -1.122) 2.010 98.608 ( 1.668 0.000 -1.122) 2.010 98.652 ( -2.285 0.000 4.430) 4.984 98.652 ( 2.285 0.000 4.430) 4.984 99.179 ( -2.024 0.000 -5.325) 5.697 99.179 ( 2.024 0.000 -5.325) 5.697 100.391 ( -4.071 0.000 3.260) 5.215 100.391 ( 4.071 0.000 3.260) 5.215 100.633 ( -2.254 0.000 -1.019) 2.474 100.633 ( 2.254 0.000 -1.019) 2.474 100.763 ( -7.389 0.000 -0.163) 7.391 100.763 ( 7.389 0.000 -0.163) 7.391 100.771 ( -5.184 0.000 -0.304) 5.193 100.771 ( 5.184 0.000 -0.304) 5.193 102.524 ( -2.095 0.000 -0.201) 2.104 102.524 ( 2.095 0.000 -0.201) 2.104 102.591 ( -4.657 0.000 -0.776) 4.721 102.591 ( 4.657 0.000 -0.776) 4.721 102.922 ( -4.529 0.000 4.815) 6.611 102.922 ( 4.529 0.000 4.815) 6.611 103.425 ( -13.720 0.000 -3.617) 14.188 103.425 ( 13.720 0.000 -3.617) 14.188 ======================= Grid point 66 (25/72) ======================= q-point: ( 0.00 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.087 ( 0.000 15.743 37.408) 40.585 1.496 ( 0.000 58.376 9.160) 59.090 1.765 ( 0.000 9.157 79.497) 80.023 2.192 ( 0.000 -9.750 17.929) 20.408 2.453 ( 0.000 -6.991 52.222) 52.688 3.477 ( 0.000 24.200 -29.713) 38.321 3.682 ( 0.000 0.462 -13.893) 13.900 3.830 ( 0.000 0.507 -10.083) 10.095 4.663 ( 0.000 -22.484 -2.354) 22.607 5.102 ( 0.000 -10.207 -14.516) 17.745 5.722 ( 0.000 -0.757 33.539) 33.547 6.124 ( 0.000 -11.376 17.968) 21.266 6.972 ( 0.000 6.447 0.730) 6.488 7.053 ( 0.000 2.028 -32.673) 32.735 7.155 ( 0.000 0.829 -38.834) 38.843 7.271 ( 0.000 -0.445 -0.556) 0.712 7.409 ( 0.000 0.503 -3.263) 3.301 7.538 ( 0.000 -0.555 -2.459) 2.521 7.551 ( 0.000 -1.266 -4.603) 4.774 7.668 ( 0.000 -8.821 3.655) 9.548 7.701 ( 0.000 4.328 -14.786) 15.406 7.948 ( 0.000 8.289 -9.743) 12.793 8.067 ( 0.000 5.610 6.751) 8.777 8.210 ( 0.000 -8.072 -12.437) 14.827 8.318 ( 0.000 1.637 -6.490) 6.693 8.479 ( 0.000 2.369 -14.668) 14.858 8.556 ( 0.000 0.619 -5.738) 5.772 8.610 ( 0.000 -0.244 -17.787) 17.789 8.731 ( 0.000 3.391 -3.771) 5.071 9.065 ( 0.000 -2.334 19.702) 19.840 9.118 ( 0.000 1.513 0.981) 1.803 9.191 ( 0.000 6.590 23.015) 23.940 9.537 ( 0.000 -1.338 28.691) 28.722 9.559 ( 0.000 -7.950 21.414) 22.842 9.670 ( 0.000 1.108 18.310) 18.344 9.866 ( 0.000 -0.936 -1.799) 2.028 10.328 ( 0.000 3.789 15.607) 16.061 10.596 ( 0.000 -6.979 9.767) 12.004 10.659 ( 0.000 -3.061 4.152) 5.159 10.677 ( 0.000 -0.980 15.387) 15.418 10.841 ( 0.000 5.809 0.582) 5.838 11.052 ( 0.000 7.027 3.589) 7.890 11.546 ( 0.000 -3.615 1.272) 3.832 11.681 ( 0.000 -17.383 -2.495) 17.561 11.856 ( 0.000 6.497 -20.883) 21.870 11.929 ( 0.000 -5.060 -0.601) 5.096 11.994 ( 0.000 -3.629 -0.494) 3.663 11.995 ( 0.000 3.368 0.382) 3.390 12.171 ( 0.000 12.429 -14.763) 19.299 12.251 ( 0.000 7.516 -11.874) 14.052 12.289 ( 0.000 4.271 -11.843) 12.590 12.348 ( 0.000 -4.629 -22.195) 22.672 12.444 ( 0.000 6.287 -24.222) 25.025 12.657 ( 0.000 0.249 -22.190) 22.192 12.681 ( 0.000 -3.553 -9.020) 9.694 12.950 ( 0.000 -8.144 -5.780) 9.987 13.227 ( 0.000 4.028 6.783) 7.889 13.342 ( 0.000 6.612 0.514) 6.632 13.388 ( 0.000 -0.619 12.783) 12.798 13.400 ( 0.000 2.465 11.770) 12.025 13.728 ( 0.000 0.978 6.480) 6.553 13.743 ( 0.000 0.415 14.707) 14.713 13.930 ( 0.000 4.417 5.503) 7.056 14.467 ( 0.000 -4.093 -6.963) 8.076 14.678 ( 0.000 0.899 1.958) 2.154 14.801 ( 0.000 -0.072 -10.603) 10.603 15.052 ( 0.000 3.542 -2.032) 4.084 15.076 ( 0.000 -3.047 2.313) 3.825 15.206 ( 0.000 -6.224 9.142) 11.059 15.250 ( 0.000 -0.250 9.315) 9.319 15.349 ( 0.000 -4.307 12.137) 12.878 15.473 ( 0.000 11.859 -15.979) 19.899 15.573 ( 0.000 -9.250 1.250) 9.334 15.672 ( 0.000 5.694 -1.737) 5.953 15.770 ( 0.000 -1.400 2.413) 2.790 15.935 ( 0.000 -2.047 -1.372) 2.464 16.070 ( 0.000 -1.416 3.288) 3.580 16.192 ( 0.000 -3.623 -6.312) 7.278 16.204 ( 0.000 0.592 9.951) 9.969 16.363 ( 0.000 -0.657 -2.599) 2.681 16.460 ( 0.000 -8.719 -3.147) 9.270 16.595 ( 0.000 -7.913 -1.437) 8.042 16.633 ( 0.000 7.451 -4.535) 8.723 16.759 ( 0.000 -0.671 4.889) 4.935 16.764 ( 0.000 4.799 -1.833) 5.137 17.094 ( 0.000 12.278 2.485) 12.527 17.263 ( 0.000 7.168 5.794) 9.217 17.270 ( 0.000 -1.356 -5.420) 5.587 17.480 ( 0.000 -3.031 -4.298) 5.259 17.897 ( 0.000 -4.936 2.483) 5.525 18.150 ( 0.000 -1.181 10.148) 10.216 18.226 ( 0.000 13.764 -22.941) 26.753 18.361 ( 0.000 4.303 0.355) 4.318 18.750 ( 0.000 9.310 2.408) 9.616 18.784 ( 0.000 -8.687 5.480) 10.271 19.141 ( 0.000 4.197 -12.997) 13.658 19.443 ( 0.000 3.614 4.509) 5.779 19.700 ( 0.000 12.319 -0.697) 12.339 19.950 ( 0.000 -8.227 3.488) 8.936 20.005 ( 0.000 7.146 5.178) 8.825 20.525 ( 0.000 -4.620 3.245) 5.646 20.816 ( 0.000 -18.495 -5.199) 19.212 21.765 ( 0.000 35.854 -53.388) 64.310 21.772 ( 0.000 17.685 -13.231) 22.087 24.163 ( 0.000 4.327 0.460) 4.352 24.565 ( 0.000 12.375 -11.920) 17.182 25.297 ( 0.000 -35.030 23.489) 42.176 25.526 ( 0.000 2.953 18.641) 18.873 25.557 ( 0.000 -9.869 -1.777) 10.027 25.885 ( 0.000 -6.137 17.230) 18.291 26.356 ( 0.000 8.268 -2.213) 8.559 26.700 ( 0.000 6.083 -8.970) 10.838 26.824 ( 0.000 -0.064 -1.873) 1.874 27.001 ( 0.000 -5.793 1.212) 5.919 27.526 ( 0.000 -1.593 -6.786) 6.971 27.558 ( 0.000 -2.592 -10.755) 11.063 28.011 ( 0.000 0.492 2.025) 2.084 28.042 ( 0.000 -0.128 2.983) 2.986 28.223 ( 0.000 1.435 2.242) 2.662 28.426 ( 0.000 -2.350 -1.564) 2.823 29.408 ( 0.000 0.588 2.339) 2.412 29.520 ( 0.000 -1.319 4.275) 4.474 29.735 ( 0.000 8.951 -8.897) 12.620 30.204 ( 0.000 -3.546 -13.408) 13.869 30.421 ( 0.000 2.372 10.921) 11.176 30.652 ( 0.000 2.720 8.713) 9.128 30.729 ( 0.000 -0.053 7.615) 7.615 30.779 ( 0.000 0.835 1.251) 1.504 31.222 ( 0.000 -6.132 -5.276) 8.089 31.488 ( 0.000 -13.691 2.774) 13.970 31.549 ( 0.000 2.901 -0.898) 3.037 31.693 ( 0.000 0.543 -12.362) 12.374 31.728 ( 0.000 3.689 11.646) 12.217 31.827 ( 0.000 2.076 5.764) 6.127 32.065 ( 0.000 -24.061 38.526) 45.422 32.297 ( 0.000 -10.886 13.716) 17.511 32.567 ( 0.000 -1.957 -9.513) 9.712 32.700 ( 0.000 -4.979 2.888) 5.756 33.184 ( 0.000 9.035 -10.693) 13.999 33.678 ( 0.000 -1.739 -9.838) 9.990 34.073 ( 0.000 -0.314 7.288) 7.295 34.188 ( 0.000 -2.725 9.973) 10.339 34.397 ( 0.000 4.423 -1.198) 4.582 34.742 ( 0.000 -2.784 -1.058) 2.978 98.330 ( 0.000 0.183 0.238) 0.301 98.349 ( 0.000 -0.231 0.242) 0.334 98.416 ( 0.000 0.622 -1.336) 1.474 98.448 ( 0.000 -0.075 -2.640) 2.641 98.606 ( 0.000 1.486 3.016) 3.362 98.777 ( 0.000 1.164 -0.709) 1.363 98.779 ( 0.000 -1.819 2.365) 2.983 98.958 ( 0.000 -5.097 2.080) 5.505 100.147 ( 0.000 -2.540 6.059) 6.570 100.238 ( 0.000 -1.398 1.565) 2.099 100.426 ( 0.000 0.153 -1.112) 1.122 100.426 ( 0.000 0.281 -1.331) 1.361 100.654 ( 0.000 2.312 1.869) 2.973 100.891 ( 0.000 -3.738 0.828) 3.829 101.075 ( 0.000 3.158 -2.229) 3.865 101.166 ( 0.000 6.078 -12.577) 13.969 102.438 ( 0.000 -3.095 4.681) 5.612 102.507 ( 0.000 1.516 0.041) 1.517 102.582 ( 0.000 -2.623 0.443) 2.661 102.656 ( 0.000 -1.174 -1.235) 1.704 102.727 ( 0.000 5.840 8.845) 10.599 103.214 ( 0.000 -4.071 11.836) 12.516 104.233 ( 0.000 35.259 -46.323) 58.216 104.685 ( 0.000 0.555 -12.736) 12.748 ======================= Grid point 67 (26/72) ======================= q-point: ( 0.10 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.558 ( 19.311 35.938 18.147) 44.651 1.622 ( 23.463 28.361 25.735) 44.913 2.293 ( 52.361 7.004 53.250) 75.009 2.418 ( 18.420 -7.970 25.591) 32.523 2.877 ( 40.905 -6.242 35.470) 54.501 3.544 ( 6.834 23.807 -29.167) 38.265 4.030 ( 32.231 -0.292 -14.165) 35.207 4.175 ( 32.837 -0.495 -8.767) 33.991 4.660 ( 0.333 -21.141 -2.211) 21.258 5.138 ( 3.424 -10.211 -14.971) 18.442 5.738 ( 1.665 -0.631 31.917) 31.967 6.114 ( -1.040 -10.905 17.233) 20.420 6.837 ( -16.094 2.229 -23.158) 28.289 6.933 ( -12.333 3.930 -25.972) 29.018 7.015 ( -6.833 0.785 -16.707) 18.068 7.144 ( -15.276 2.433 -1.088) 15.507 7.360 ( -2.967 -0.208 -2.837) 4.111 7.442 ( 0.338 0.900 -1.783) 2.026 7.529 ( -3.715 -1.383 -4.689) 6.140 7.637 ( -1.277 -6.084 1.703) 6.445 7.877 ( -0.352 4.925 -9.933) 11.093 7.960 ( 4.902 3.503 -3.948) 7.203 8.060 ( -0.527 2.037 4.256) 4.748 8.185 ( -9.340 1.198 -0.748) 9.446 8.297 ( 4.209 -3.464 -13.310) 14.383 8.419 ( -8.577 1.407 -10.103) 13.327 8.488 ( 0.959 1.924 -14.102) 14.265 8.590 ( -5.205 -4.138 -6.904) 9.586 8.752 ( -0.565 4.327 1.846) 4.738 8.918 ( -8.270 0.475 15.557) 17.625 8.973 ( -17.736 1.461 23.511) 29.487 9.116 ( -2.968 4.628 5.236) 7.592 9.247 ( -2.776 -2.878 6.212) 7.387 9.615 ( -1.233 -1.444 10.920) 11.084 9.992 ( 15.411 2.474 11.122) 19.166 10.009 ( 12.047 -3.541 18.433) 22.303 10.355 ( 1.815 3.137 12.970) 13.467 10.668 ( 3.333 -3.865 11.190) 12.299 10.701 ( 3.891 -3.185 5.259) 7.276 10.764 ( 6.391 -0.663 3.258) 7.204 10.883 ( 7.998 2.155 4.899) 9.624 11.219 ( 14.497 6.095 3.365) 16.082 11.585 ( -2.780 -5.480 -5.231) 8.070 11.629 ( -0.021 -7.646 -2.067) 7.920 11.807 ( -4.523 4.694 -14.263) 15.682 11.841 ( -8.256 4.876 -11.036) 14.619 11.947 ( 0.304 -1.073 3.308) 3.491 12.074 ( 7.277 -4.856 1.235) 8.835 12.194 ( -1.472 1.186 -13.682) 13.812 12.230 ( -5.717 0.122 -17.228) 18.152 12.256 ( -6.943 2.792 -10.948) 13.261 12.363 ( -4.684 4.073 -9.536) 11.378 12.437 ( 5.684 2.889 -11.124) 12.822 12.467 ( -7.395 0.942 -13.116) 15.087 12.639 ( -0.470 2.614 -7.110) 7.590 13.055 ( 5.715 -7.280 -3.618) 9.938 13.164 ( -17.810 3.190 -0.984) 18.120 13.305 ( -5.821 3.175 5.965) 8.919 13.313 ( 5.342 0.255 -5.630) 7.766 13.424 ( 4.876 4.073 5.350) 8.306 13.555 ( -11.991 -2.210 14.150) 18.679 13.659 ( -3.545 2.828 11.860) 12.697 14.134 ( 11.707 2.126 0.380) 11.904 14.454 ( -0.521 -0.340 -1.472) 1.597 14.661 ( 1.542 1.515 -1.720) 2.762 14.802 ( -1.702 3.993 -5.574) 7.065 15.021 ( 0.925 -2.746 -4.656) 5.484 15.118 ( -1.154 0.112 6.918) 7.014 15.212 ( -1.532 -0.722 6.474) 6.692 15.254 ( 0.128 1.728 6.301) 6.535 15.376 ( 2.744 -4.578 11.355) 12.547 15.469 ( 0.149 3.953 -12.441) 13.055 15.576 ( 0.236 -7.016 4.144) 8.152 15.684 ( 0.393 2.702 -0.650) 2.807 15.788 ( 0.978 -0.988 1.611) 2.128 15.947 ( -0.145 -1.840 -0.989) 2.094 16.022 ( -4.596 0.727 4.678) 6.598 16.063 ( -2.462 -1.853 2.401) 3.906 16.327 ( 4.528 -6.797 1.942) 8.395 16.418 ( -2.055 -8.086 -4.720) 9.586 16.485 ( 9.226 -0.964 -2.946) 9.733 16.623 ( -0.649 5.795 -3.396) 6.748 16.715 ( 6.863 -3.370 -2.653) 8.093 16.741 ( 2.129 3.022 1.283) 3.913 16.796 ( 1.875 -0.334 -0.761) 2.051 17.173 ( 5.413 7.648 1.636) 9.512 17.230 ( -1.952 -0.229 -2.651) 3.300 17.343 ( 3.833 4.874 2.508) 6.688 17.469 ( 1.658 -1.449 -5.644) 6.059 17.861 ( -3.506 -4.650 1.852) 6.112 18.103 ( -3.944 0.417 5.816) 7.040 18.220 ( -1.684 9.880 -15.062) 18.092 18.320 ( -3.671 6.942 -2.129) 8.136 18.714 ( -6.017 -1.573 5.104) 8.046 18.735 ( -1.957 0.414 3.808) 4.301 19.081 ( -5.918 4.738 -12.227) 14.387 19.455 ( 1.187 4.199 3.924) 5.868 19.670 ( -2.387 9.290 -0.328) 9.597 19.935 ( -2.117 -1.212 4.569) 5.179 20.109 ( 8.552 -1.125 3.902) 9.468 20.490 ( -4.262 -0.516 1.366) 4.505 20.600 ( -18.430 -6.925 -0.074) 19.688 21.394 ( -20.903 23.855 -12.918) 34.248 21.725 ( -8.087 14.941 -12.894) 21.328 24.203 ( 3.826 3.812 0.803) 5.461 24.628 ( -6.383 7.085 1.735) 9.693 24.799 ( -11.548 -3.086 12.449) 17.259 25.450 ( -10.221 -6.488 0.593) 12.121 25.607 ( -3.071 -5.915 3.661) 7.604 25.937 ( 1.787 -11.902 15.340) 19.498 26.323 ( -2.978 7.281 -2.860) 8.370 26.509 ( -7.685 8.868 0.089) 11.735 26.959 ( 4.207 -3.057 -3.429) 6.229 27.022 ( 2.479 -6.751 1.532) 7.353 27.420 ( -7.872 0.262 -7.015) 10.547 27.582 ( 0.097 -3.743 -7.919) 8.759 27.986 ( -2.387 0.477 1.598) 2.912 28.053 ( 0.133 -0.878 2.637) 2.782 28.125 ( -8.519 1.964 1.995) 8.967 28.352 ( -6.650 -2.863 -1.229) 7.344 29.487 ( 6.822 0.943 2.548) 7.343 29.693 ( 12.147 -2.968 -1.693) 12.619 29.848 ( 10.312 7.312 -9.229) 15.652 30.224 ( 1.950 -1.896 -9.985) 10.348 30.434 ( -12.923 2.861 5.756) 14.434 30.491 ( 5.260 0.225 7.722) 9.346 30.725 ( 1.053 0.081 7.448) 7.522 30.791 ( -9.011 -2.903 10.914) 14.448 31.222 ( 9.275 0.015 -6.614) 11.392 31.381 ( 2.935 1.305 -1.387) 3.499 31.685 ( 7.475 0.721 9.254) 11.918 31.759 ( 6.261 1.934 -2.357) 6.964 31.836 ( 8.041 1.080 -1.145) 8.193 31.953 ( 9.307 1.013 5.788) 11.007 32.192 ( 4.253 -11.090 11.692) 16.667 32.423 ( 7.088 -14.530 4.968) 16.912 32.687 ( 0.115 -2.555 0.427) 2.593 32.712 ( 12.851 -14.418 0.053) 19.314 33.191 ( 0.692 7.770 -10.173) 12.820 33.653 ( -2.516 -1.418 -8.984) 9.437 34.008 ( -5.778 0.941 7.259) 9.325 34.146 ( -4.053 -2.766 9.320) 10.532 34.347 ( -4.838 4.568 -1.041) 6.735 34.690 ( -5.184 -2.784 -1.312) 6.029 98.372 ( 2.410 -0.063 -0.025) 2.411 98.402 ( 0.702 -0.196 -0.372) 0.818 98.468 ( 1.834 -0.139 -2.568) 3.159 98.561 ( 13.306 -6.242 -7.886) 16.680 98.608 ( 0.677 1.256 2.666) 3.024 98.763 ( 0.172 -1.432 1.065) 1.793 98.787 ( 0.162 0.154 0.940) 0.966 98.987 ( 2.614 -5.937 1.408) 6.638 100.158 ( 1.119 -1.731 5.945) 6.292 100.264 ( 2.425 -1.705 1.537) 3.339 100.434 ( 1.479 0.681 -1.207) 2.027 100.453 ( 1.995 0.050 -1.289) 2.376 100.641 ( -1.162 2.324 2.140) 3.367 100.893 ( -0.034 -3.134 0.370) 3.156 101.023 ( -3.844 4.459 -2.878) 6.553 101.182 ( 0.204 2.332 -9.603) 9.884 102.434 ( -0.377 -2.202 4.499) 5.023 102.496 ( -0.414 2.399 0.090) 2.436 102.616 ( 2.540 -3.554 0.004) 4.368 102.663 ( 0.090 1.760 0.710) 1.900 102.721 ( 0.615 3.551 5.985) 6.986 103.188 ( -2.575 -3.476 11.018) 11.837 103.886 ( -25.377 36.798 -24.083) 50.775 104.588 ( -9.362 -0.505 -11.899) 15.149 ======================= Grid point 68 (27/72) ======================= q-point: ( 0.20 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.897 ( 22.305 42.997 8.203) 49.128 2.264 ( 34.153 6.505 28.553) 44.989 2.873 ( 26.686 -6.367 20.407) 34.193 3.564 ( 67.914 4.054 29.198) 74.036 3.700 ( 19.781 14.533 -20.483) 31.969 3.944 ( 50.551 2.291 18.345) 53.825 4.614 ( 7.655 -20.510 -3.846) 22.227 4.920 ( 40.607 0.853 -15.362) 43.424 5.025 ( 48.796 -1.269 -10.172) 49.861 5.221 ( 4.149 -9.214 -14.569) 17.730 5.779 ( 1.673 -0.969 26.225) 26.296 6.066 ( -5.078 -9.452 12.074) 16.152 6.450 ( -20.289 0.341 -24.865) 32.094 6.590 ( -18.863 1.073 -24.300) 30.781 6.741 ( -16.126 1.769 0.200) 16.224 6.953 ( -6.576 3.041 -0.341) 7.253 7.268 ( -11.865 -2.595 -2.917) 12.491 7.388 ( -6.148 0.333 -8.196) 10.251 7.446 ( -2.663 2.112 -0.904) 3.517 7.607 ( -1.369 -4.726 -0.414) 4.938 7.809 ( -4.656 0.613 -1.803) 5.030 7.903 ( -6.451 1.606 17.427) 18.652 7.995 ( -8.541 2.950 11.796) 14.859 8.014 ( -5.744 2.856 -2.131) 6.760 8.131 ( -17.784 -0.544 13.255) 22.187 8.243 ( -16.897 2.173 12.269) 20.995 8.450 ( 1.188 -3.248 -3.457) 4.890 8.646 ( 7.761 0.196 -12.027) 14.315 8.705 ( 9.472 1.809 -11.767) 15.214 8.833 ( 1.405 1.636 -0.974) 2.367 8.946 ( 5.751 2.490 -6.355) 8.926 9.103 ( -0.951 4.672 -3.054) 5.662 9.218 ( -1.095 -1.854 3.495) 4.105 9.520 ( -6.491 -1.744 2.511) 7.175 10.178 ( 6.561 -2.625 11.553) 13.542 10.339 ( 13.837 -1.321 13.786) 19.577 10.388 ( 3.669 7.508 9.778) 12.862 10.606 ( -8.325 0.451 9.217) 12.428 10.699 ( -6.138 -1.790 3.969) 7.526 10.910 ( 5.838 0.096 -1.438) 6.013 11.146 ( 12.731 -4.780 6.825) 15.215 11.419 ( -10.730 -4.919 -3.975) 12.455 11.516 ( 11.157 1.916 -3.763) 11.930 11.632 ( -10.320 5.232 -21.846) 24.721 11.685 ( 0.372 -0.358 -8.444) 8.460 11.748 ( -1.656 3.101 -3.346) 4.853 11.823 ( -23.029 0.466 -8.556) 24.572 11.966 ( -6.343 -1.860 -3.728) 7.589 12.029 ( -2.074 1.817 2.854) 3.968 12.100 ( -9.122 -5.754 -1.684) 10.916 12.211 ( -7.498 -2.857 -8.325) 11.562 12.353 ( 2.911 -1.134 -5.991) 6.756 12.449 ( 3.985 3.406 1.870) 5.566 12.506 ( -3.670 1.596 -1.489) 4.270 12.743 ( 13.145 2.172 -3.003) 13.658 12.934 ( 1.839 0.654 -6.415) 6.706 13.140 ( 5.133 1.298 -1.969) 5.649 13.231 ( -3.210 -4.587 5.235) 7.665 13.317 ( 4.368 -1.159 -0.359) 4.533 13.502 ( 6.451 0.401 0.115) 6.464 13.548 ( 6.565 1.325 -7.995) 10.430 13.655 ( 0.009 2.002 5.560) 5.910 14.265 ( 2.300 0.899 0.096) 2.471 14.439 ( -3.109 3.207 -2.879) 5.314 14.740 ( 6.565 0.501 4.649) 8.060 14.787 ( 0.532 5.418 1.951) 5.783 15.034 ( -1.613 3.358 -8.039) 8.860 15.071 ( -1.478 -1.108 6.305) 6.570 15.169 ( -0.857 4.259 5.350) 6.892 15.260 ( 0.296 1.904 4.586) 4.975 15.416 ( 0.755 -2.398 9.918) 10.232 15.473 ( -0.074 -3.181 -3.570) 4.782 15.597 ( 2.014 -3.707 6.867) 8.059 15.665 ( -2.099 -0.627 1.159) 2.478 15.778 ( -1.713 -0.504 1.125) 2.111 15.880 ( -4.505 -0.970 6.297) 7.803 15.965 ( -2.160 1.366 0.132) 2.559 16.084 ( 3.490 0.079 1.489) 3.795 16.359 ( -0.842 -8.039 -2.066) 8.343 16.426 ( 1.255 -6.905 -2.806) 7.558 16.586 ( -1.735 3.951 -3.729) 5.703 16.644 ( 5.293 0.261 -3.638) 6.428 16.708 ( -4.436 2.783 -4.738) 7.062 16.850 ( 2.999 1.664 2.607) 4.308 16.919 ( 10.564 -1.740 1.355) 10.792 17.135 ( -5.906 -0.572 2.058) 6.281 17.254 ( -2.196 3.429 -1.790) 4.448 17.395 ( 7.365 4.772 -0.353) 8.783 17.623 ( 10.242 -4.705 -8.942) 14.387 17.759 ( -7.295 -4.205 -1.797) 8.610 18.005 ( -5.346 -0.034 4.972) 7.301 18.154 ( -4.029 4.009 -7.473) 9.388 18.240 ( -3.934 11.513 -7.226) 14.150 18.535 ( -10.698 -2.623 4.023) 11.726 18.706 ( -1.717 -2.686 4.197) 5.271 18.891 ( -13.593 5.234 -8.160) 16.695 19.489 ( 2.199 4.743 3.055) 6.055 19.615 ( -2.873 5.318 0.896) 6.110 19.858 ( -5.361 -1.992 6.081) 8.348 20.076 ( -12.756 2.397 -0.201) 12.980 20.385 ( -0.759 -2.860 7.159) 7.746 20.505 ( 8.050 0.628 2.455) 8.439 21.046 ( -15.941 9.955 7.452) 20.218 21.552 ( -7.535 5.544 -8.952) 12.948 24.283 ( -2.068 2.952 9.053) 9.744 24.358 ( -1.303 4.265 7.352) 8.599 24.907 ( 3.423 2.347 -14.908) 15.475 25.249 ( -4.874 -1.937 0.614) 5.281 25.492 ( -7.211 -2.956 -3.322) 8.472 25.883 ( -6.715 -8.588 9.706) 14.596 26.261 ( -3.625 4.415 -1.847) 6.004 26.395 ( -5.174 5.542 3.044) 8.170 27.003 ( 1.650 -3.197 -1.282) 3.819 27.085 ( 1.361 -6.457 0.538) 6.621 27.272 ( -3.661 1.828 -2.531) 4.811 27.565 ( -1.383 -4.770 -4.752) 6.874 27.875 ( -11.632 1.250 2.303) 11.923 27.930 ( -5.463 1.233 0.602) 5.633 28.069 ( -0.672 -1.327 1.714) 2.270 28.186 ( -9.480 -3.262 -0.483) 10.037 29.617 ( 5.241 2.298 2.291) 6.164 29.912 ( 8.390 -4.045 -3.885) 10.092 30.090 ( 11.113 4.594 -9.168) 15.122 30.180 ( -7.152 2.294 5.452) 9.281 30.314 ( 4.806 1.050 -6.867) 8.447 30.529 ( -3.312 -3.984 5.781) 7.763 30.646 ( -0.685 2.309 7.006) 7.409 30.854 ( 11.082 -1.080 6.665) 12.977 31.465 ( 8.179 3.134 -4.449) 9.824 31.547 ( 15.985 4.222 -3.080) 16.817 31.834 ( 7.114 3.611 12.014) 14.421 31.945 ( 12.504 -0.582 0.899) 12.549 32.044 ( 11.767 -0.425 -4.178) 12.493 32.167 ( 10.510 -1.227 -1.715) 10.719 32.254 ( 3.661 -2.459 5.126) 6.762 32.517 ( 3.280 -8.956 2.562) 9.876 32.677 ( 0.582 -2.834 3.495) 4.537 32.957 ( 9.208 -11.078 -3.041) 14.722 33.210 ( 1.288 3.472 -8.933) 9.670 33.575 ( -5.483 -0.181 -5.815) 7.994 33.864 ( -8.174 1.084 5.917) 10.149 34.037 ( -6.547 -3.051 7.295) 10.265 34.208 ( -8.899 4.340 -0.362) 9.908 34.537 ( -9.978 -2.764 -1.976) 10.541 98.418 ( 1.523 0.149 0.538) 1.622 98.435 ( 3.136 0.025 -0.367) 3.157 98.509 ( 2.171 0.539 -2.406) 3.285 98.605 ( -0.049 0.818 1.907) 2.076 98.687 ( 0.049 -0.437 -1.530) 1.592 98.777 ( -0.637 0.149 1.758) 1.876 98.875 ( 7.952 -7.046 -7.281) 12.881 99.049 ( 3.228 -7.697 -0.598) 8.368 100.192 ( 2.324 -0.334 5.562) 6.037 100.331 ( 4.193 -2.405 1.368) 5.024 100.484 ( 3.322 1.191 -1.185) 3.723 100.501 ( 2.862 0.226 -1.446) 3.214 100.611 ( -1.800 2.246 2.515) 3.822 100.876 ( -1.923 0.552 -0.662) 2.108 100.947 ( -3.651 0.852 -1.321) 3.975 101.151 ( -3.246 0.052 -6.128) 6.935 102.429 ( 0.131 -0.191 3.451) 3.459 102.502 ( 1.089 3.832 -0.117) 3.986 102.641 ( -1.401 4.532 2.957) 5.589 102.667 ( 2.220 -3.576 0.523) 4.241 102.791 ( 5.808 -1.106 0.628) 5.945 103.114 ( -4.708 -1.307 8.725) 10.001 103.448 ( -17.513 25.414 -7.278) 31.710 104.334 ( -15.365 -2.699 -9.826) 18.437 ======================= Grid point 69 (28/72) ======================= q-point: ( 0.30 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.457 ( 32.965 30.214 7.302) 45.309 2.963 ( 35.336 4.929 14.191) 38.396 3.457 ( 31.091 -5.195 8.246) 32.582 4.079 ( 21.234 15.386 -24.431) 35.840 4.718 ( 7.606 -19.259 -0.963) 20.729 4.883 ( 61.381 0.728 22.373) 65.336 5.013 ( 44.263 0.687 17.374) 47.556 5.187 ( -5.867 -1.532 -6.136) 8.626 5.655 ( 12.054 -0.283 -31.089) 33.345 5.703 ( -9.873 -0.900 -17.090) 19.757 5.819 ( 2.393 -8.044 -5.852) 10.232 5.936 ( 1.014 -3.005 2.103) 3.805 6.267 ( 22.435 1.189 2.530) 22.608 6.394 ( 11.557 -1.872 -4.655) 12.599 6.543 ( -5.647 -3.587 6.928) 9.631 6.835 ( -4.335 -3.365 6.812) 8.747 6.897 ( -16.720 3.484 -6.664) 18.334 7.229 ( -9.216 0.927 -4.143) 10.147 7.368 ( -6.794 2.303 12.157) 14.116 7.506 ( -14.807 -4.328 22.117) 26.966 7.689 ( -11.344 0.016 19.458) 22.523 7.718 ( -9.048 -1.976 17.954) 20.202 7.785 ( 1.611 2.369 6.793) 7.373 7.948 ( 0.279 3.527 2.258) 4.197 7.967 ( 3.029 2.543 3.545) 5.311 8.106 ( -0.331 6.716 1.522) 6.894 8.439 ( 0.080 0.074 1.071) 1.076 8.794 ( 4.746 -0.631 -10.322) 11.378 8.908 ( 5.726 -0.557 -8.957) 10.645 8.933 ( 6.069 -0.111 -4.181) 7.370 8.999 ( -3.960 1.928 -1.523) 4.660 9.089 ( 3.883 1.920 -16.620) 17.175 9.235 ( 2.219 0.990 -7.827) 8.195 9.424 ( -0.870 -1.137 -7.712) 7.844 10.209 ( -24.750 1.204 7.635) 25.929 10.283 ( -2.364 -0.811 4.963) 5.557 10.355 ( -10.969 0.648 6.490) 12.762 10.448 ( -7.152 -1.432 7.011) 10.117 10.683 ( 8.991 2.985 4.799) 10.620 10.887 ( -11.337 -0.180 0.417) 11.346 11.089 ( -14.674 -0.616 -12.493) 19.282 11.212 ( -13.552 -3.419 -10.413) 17.430 11.376 ( -12.507 -1.132 -26.265) 29.112 11.482 ( -6.045 0.918 -13.558) 14.873 11.599 ( -3.009 1.977 1.772) 4.013 11.659 ( -12.645 0.213 3.235) 13.054 11.759 ( 1.922 2.101 1.586) 3.259 11.814 ( -1.985 -0.056 -0.362) 2.018 11.878 ( -1.714 -4.140 5.948) 7.447 11.901 ( -12.981 -1.015 -2.024) 13.177 12.230 ( 7.277 -0.795 -1.630) 7.500 12.284 ( 3.255 -4.017 5.862) 7.816 12.495 ( 7.792 4.573 9.003) 12.755 12.821 ( 16.974 -4.367 3.358) 17.846 12.995 ( 11.606 -2.652 -3.792) 12.495 13.058 ( 8.193 -2.850 -2.140) 8.934 13.275 ( 7.985 3.675 -9.890) 13.231 13.391 ( 12.289 -1.233 5.097) 13.361 13.476 ( 11.296 -1.288 2.425) 11.625 13.632 ( 0.685 2.004 1.618) 2.665 13.640 ( 7.339 -5.234 -9.859) 13.359 13.725 ( 10.044 -0.194 -12.094) 15.722 14.266 ( -4.943 3.842 1.245) 6.383 14.336 ( -3.111 0.529 0.910) 3.284 14.798 ( 0.370 5.980 6.440) 8.796 14.883 ( 6.078 0.888 7.310) 9.548 14.972 ( -2.856 6.976 -3.572) 8.342 15.073 ( 0.093 0.499 0.663) 0.836 15.182 ( 1.785 3.726 4.934) 6.435 15.266 ( 0.394 0.926 4.999) 5.099 15.398 ( -2.684 2.435 7.005) 7.887 15.476 ( 0.471 -2.947 2.695) 4.021 15.568 ( -4.580 -1.554 8.649) 9.910 15.689 ( 3.471 -2.723 2.102) 4.887 15.748 ( -0.458 -2.749 0.905) 2.930 15.826 ( 0.543 -1.621 3.649) 4.030 15.929 ( -0.938 1.131 0.669) 1.614 16.168 ( 3.403 2.707 0.225) 4.354 16.291 ( -5.415 1.672 0.092) 5.668 16.433 ( -0.291 -3.272 -4.712) 5.744 16.547 ( -5.974 2.193 -2.083) 6.696 16.583 ( 0.664 -3.191 -3.532) 4.806 16.744 ( 2.462 -0.185 -4.790) 5.389 16.845 ( -2.589 4.162 3.321) 5.920 17.035 ( -3.454 -0.870 6.578) 7.480 17.126 ( -3.948 1.145 -0.880) 4.204 17.158 ( 6.017 0.761 -0.407) 6.079 17.506 ( -18.005 -4.850 -2.724) 18.845 17.577 ( 8.785 1.843 -4.308) 9.956 17.814 ( 7.644 -4.229 -8.748) 12.363 17.940 ( 0.039 -1.811 -3.289) 3.754 18.059 ( -7.708 1.519 -4.422) 9.015 18.185 ( -2.373 9.287 -9.158) 13.257 18.291 ( -13.350 -3.047 0.901) 13.723 18.568 ( -14.330 5.334 -1.151) 15.333 18.659 ( -3.621 -7.788 0.941) 8.640 19.531 ( 1.168 3.709 2.542) 4.646 19.577 ( 0.119 2.409 3.880) 4.568 19.756 ( -4.030 -1.324 4.734) 6.356 19.876 ( -7.240 -0.076 -0.607) 7.266 20.325 ( -3.095 3.842 4.225) 6.496 20.736 ( -9.546 8.274 13.039) 18.155 20.774 ( 10.051 -2.484 4.636) 11.344 21.438 ( -4.382 -2.550 -7.304) 8.891 24.200 ( -1.038 6.378 8.214) 10.452 24.514 ( 10.737 0.662 0.695) 10.780 24.787 ( -10.651 3.789 -1.991) 11.479 25.250 ( -4.939 -5.618 -13.548) 15.476 25.438 ( 7.167 1.985 -4.593) 8.740 25.717 ( -8.314 -2.119 5.223) 10.045 26.120 ( -11.513 1.680 -0.306) 11.639 26.280 ( -6.326 -0.994 4.254) 7.688 27.013 ( -0.986 0.475 -0.123) 1.101 27.101 ( 4.881 0.527 -1.594) 5.161 27.345 ( 7.895 -4.113 1.082) 8.968 27.547 ( 0.071 -5.030 -2.079) 5.444 27.624 ( -12.545 2.446 3.053) 13.141 27.813 ( -6.839 0.805 -0.656) 6.917 27.981 ( -9.618 -3.686 0.436) 10.309 28.033 ( -4.288 -2.059 0.014) 4.757 29.688 ( 2.143 3.524 1.575) 4.415 29.947 ( -4.594 2.118 6.878) 8.539 30.093 ( 2.632 -3.980 -0.256) 4.778 30.285 ( 3.972 0.500 -6.716) 7.819 30.428 ( 1.807 -2.233 2.152) 3.589 30.583 ( 14.143 0.892 -10.295) 17.516 30.668 ( 1.246 5.500 3.145) 6.457 31.105 ( 12.015 -4.332 4.631) 13.586 31.611 ( 7.581 6.525 -2.392) 10.284 31.873 ( 14.797 3.803 0.658) 15.292 31.976 ( 6.982 4.260 9.228) 12.331 32.164 ( 5.027 -1.158 1.930) 5.508 32.280 ( 11.171 -0.099 -0.265) 11.174 32.327 ( 10.267 -3.898 -2.072) 11.176 32.420 ( 10.261 1.244 -2.499) 10.634 32.587 ( 6.019 -5.497 3.881) 9.028 32.719 ( 2.676 -3.537 2.309) 5.000 33.087 ( 4.144 -0.711 -4.759) 6.351 33.246 ( 2.165 -3.491 -7.326) 8.399 33.416 ( -10.337 2.882 1.494) 10.835 33.714 ( -5.891 -0.931 1.132) 6.070 33.897 ( -7.183 -3.808 4.588) 9.335 34.001 ( -11.572 3.574 0.720) 12.133 34.295 ( -14.107 -2.623 -2.670) 14.595 98.455 ( 2.172 0.206 1.148) 2.465 98.493 ( 2.304 -0.844 -0.473) 2.499 98.551 ( 1.884 1.404 -1.664) 2.880 98.602 ( -0.132 0.367 0.692) 0.794 98.679 ( -0.327 1.082 1.250) 1.685 98.757 ( -1.318 1.413 1.797) 2.639 98.998 ( 4.596 -5.540 -6.541) 9.726 99.102 ( 1.934 -7.891 -2.918) 8.632 100.250 ( 3.402 0.731 4.858) 5.976 100.427 ( 5.280 -3.140 1.089) 6.238 100.536 ( 0.465 1.072 -0.453) 1.253 100.579 ( 1.469 1.537 0.177) 2.134 100.581 ( 3.367 1.691 0.286) 3.779 100.819 ( -3.498 4.577 -1.332) 5.912 100.874 ( -3.832 -4.083 0.242) 5.605 101.061 ( -5.500 -0.053 -3.483) 6.510 102.444 ( 1.415 1.161 2.095) 2.782 102.540 ( 2.624 5.228 -0.615) 5.882 102.611 ( -1.547 3.800 2.295) 4.701 102.716 ( 2.645 -3.599 0.476) 4.491 102.935 ( 8.256 -2.494 -1.033) 8.686 103.004 ( -5.959 3.284 5.065) 8.482 103.171 ( -10.664 11.200 -0.147) 15.466 104.003 ( -17.158 -4.380 -7.428) 19.203 ======================= Grid point 70 (29/72) ======================= q-point: ( 0.40 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.180 ( 38.469 20.310 5.660) 43.867 3.660 ( 33.974 3.974 0.295) 34.207 4.093 ( 32.010 -4.480 -4.682) 32.660 4.486 ( 12.905 9.800 -21.477) 26.905 4.698 ( -31.460 8.483 -2.215) 32.658 4.875 ( 8.139 -12.657 -3.808) 15.522 5.297 ( -24.666 -2.959 -24.083) 34.600 5.371 ( -13.457 -1.973 -18.366) 22.854 5.731 ( -11.828 -5.441 3.887) 13.588 5.885 ( 26.647 -8.263 0.789) 27.909 5.952 ( 34.045 -0.241 22.193) 40.641 6.053 ( 16.190 -3.031 4.857) 17.173 6.174 ( -13.640 0.858 -5.097) 14.586 6.533 ( -7.090 -8.991 -4.717) 12.384 6.841 ( 1.846 -0.352 17.831) 17.930 6.916 ( 9.235 3.077 12.106) 15.534 7.004 ( 2.232 -1.983 13.755) 14.075 7.134 ( -4.114 -0.619 12.924) 13.577 7.235 ( 5.395 1.623 22.849) 23.534 7.284 ( 5.481 2.506 18.165) 19.138 7.589 ( 8.347 2.101 8.654) 12.206 7.676 ( 8.751 -1.527 3.534) 9.560 7.885 ( 6.679 2.236 6.723) 9.737 8.032 ( 7.248 4.003 1.493) 8.413 8.114 ( 6.154 7.872 -0.184) 9.994 8.202 ( 14.766 3.778 -1.950) 15.366 8.520 ( 9.860 -2.810 -0.687) 10.276 8.783 ( -3.749 -4.199 -4.543) 7.233 8.926 ( -0.731 1.489 -5.973) 6.199 8.965 ( -1.694 -0.474 -1.603) 2.380 9.015 ( 1.550 0.548 -1.040) 1.945 9.093 ( -2.940 0.890 -8.818) 9.338 9.233 ( -5.741 1.837 -12.786) 14.135 9.430 ( -8.204 -0.909 -15.057) 17.171 9.568 ( -32.208 1.503 9.146) 33.515 9.729 ( -33.159 -1.164 7.757) 34.074 10.390 ( 1.370 0.812 1.076) 1.922 10.417 ( 0.171 -1.718 -7.224) 7.427 10.525 ( -13.470 1.368 -8.709) 16.099 10.752 ( -6.253 1.217 -16.756) 17.926 10.824 ( -8.108 0.717 -8.223) 11.570 10.962 ( -8.591 -2.545 -15.324) 17.751 11.102 ( -13.129 -0.989 -27.984) 30.926 11.263 ( -13.412 -1.470 -18.560) 22.946 11.508 ( 4.211 3.052 12.370) 13.419 11.597 ( -0.675 3.197 1.948) 3.804 11.785 ( 0.764 -1.109 1.685) 2.157 11.831 ( -0.168 -0.644 0.380) 0.767 11.854 ( 4.272 1.346 5.106) 6.792 11.990 ( 10.414 -5.309 22.588) 25.433 12.177 ( -6.968 -0.930 12.801) 14.605 12.324 ( -3.031 -4.796 13.525) 14.667 12.836 ( 20.828 1.633 4.517) 21.374 13.036 ( 6.012 -3.028 -5.420) 8.643 13.173 ( 1.435 -0.742 -6.409) 6.609 13.210 ( 7.870 -4.922 -9.854) 13.538 13.467 ( 10.271 1.569 -9.038) 13.771 13.563 ( 6.364 -3.232 5.459) 8.985 13.623 ( 1.369 -1.775 -7.180) 7.521 13.764 ( 8.927 -0.567 2.536) 9.297 13.766 ( 6.190 -6.571 1.090) 9.093 13.990 ( 14.476 -0.678 -6.328) 15.814 14.084 ( -9.079 3.945 -5.241) 11.201 14.328 ( -0.899 -1.597 8.408) 8.606 14.815 ( 1.631 5.354 8.086) 9.834 14.922 ( -1.647 6.604 -4.068) 7.929 14.941 ( -1.392 1.625 6.410) 6.758 15.039 ( -3.977 2.787 2.711) 5.561 15.221 ( 1.265 6.014 7.167) 9.441 15.262 ( -1.784 0.945 5.440) 5.802 15.349 ( 0.717 4.889 3.189) 5.881 15.472 ( -3.978 1.605 5.226) 6.761 15.507 ( 2.354 -4.176 4.713) 6.723 15.659 ( -3.820 -0.865 5.186) 6.499 15.851 ( 7.520 -3.520 -1.956) 8.531 15.918 ( 6.705 -3.523 1.284) 7.682 15.942 ( 2.881 1.916 0.783) 3.547 16.129 ( -2.382 3.746 -1.632) 4.730 16.298 ( 2.662 2.062 1.615) 3.734 16.398 ( -1.246 1.850 -2.990) 3.730 16.484 ( -0.319 2.751 1.618) 3.207 16.645 ( 3.768 -3.169 -1.095) 5.044 16.774 ( -2.179 2.122 0.879) 3.166 16.809 ( 2.742 -5.270 -3.616) 6.954 16.923 ( -8.864 -0.376 -1.145) 8.946 16.942 ( -7.297 3.325 2.037) 8.274 17.070 ( -19.623 -0.831 -1.889) 19.731 17.370 ( 4.505 -3.729 -0.091) 5.849 17.706 ( -0.828 -1.958 -4.948) 5.385 17.737 ( -15.022 3.226 -7.097) 16.924 17.874 ( -2.128 -0.671 -4.191) 4.748 17.941 ( -6.206 0.466 -4.420) 7.633 18.055 ( 5.170 0.636 -4.285) 6.745 18.264 ( 0.433 -0.575 -0.945) 1.188 18.409 ( -1.062 0.146 -5.932) 6.028 18.580 ( -4.401 -7.516 -3.945) 9.562 19.544 ( 1.164 1.204 4.278) 4.594 19.604 ( 0.711 0.058 5.085) 5.134 19.704 ( -0.976 0.300 2.209) 2.434 19.769 ( -3.662 -0.550 -0.557) 3.745 20.292 ( 0.300 8.895 6.723) 11.154 20.503 ( -9.897 10.836 14.473) 20.612 21.033 ( 11.648 -6.436 0.792) 13.331 21.351 ( -4.842 -6.646 -5.200) 9.729 24.244 ( 4.937 7.380 4.787) 10.087 24.571 ( -10.174 6.402 1.238) 12.084 24.751 ( 11.949 -1.712 -1.247) 12.136 25.108 ( -7.141 -3.000 -11.967) 14.255 25.536 ( -1.898 -0.223 2.626) 3.248 25.701 ( 9.769 -0.394 -5.211) 11.078 25.834 ( -15.109 1.316 2.911) 15.443 26.130 ( -8.917 -4.468 1.784) 10.132 27.048 ( 4.664 3.809 1.169) 6.134 27.253 ( 9.461 1.536 -2.208) 9.836 27.385 ( -11.112 3.150 2.825) 11.890 27.513 ( 7.530 -6.052 0.523) 9.674 27.589 ( 4.975 -3.713 -0.803) 6.260 27.655 ( -8.859 1.357 -1.602) 9.105 27.790 ( -8.946 -4.421 0.570) 9.996 27.918 ( -7.345 -2.843 -0.985) 7.937 29.723 ( 1.877 4.174 2.914) 5.425 29.853 ( -4.303 3.751 8.713) 10.417 30.163 ( 3.781 -5.960 1.015) 7.131 30.292 ( -1.917 -6.416 3.979) 7.789 30.499 ( 5.099 5.821 -5.997) 9.790 30.662 ( -1.676 6.770 -1.949) 7.241 30.903 ( 15.044 -1.670 -13.911) 20.558 31.246 ( 0.769 -6.166 -5.851) 8.535 31.797 ( 10.784 7.912 7.305) 15.240 32.050 ( 0.693 4.568 8.857) 9.990 32.141 ( 10.011 3.711 3.373) 11.196 32.261 ( 8.480 1.201 4.074) 9.484 32.375 ( -0.124 -1.098 2.544) 2.774 32.535 ( 9.505 -5.849 -0.069) 11.161 32.629 ( 6.489 -3.264 -1.413) 7.399 32.731 ( -0.365 -6.425 1.357) 6.577 32.808 ( 11.263 3.482 -2.787) 12.114 33.083 ( -10.901 4.863 1.084) 11.986 33.190 ( 2.970 5.761 -6.121) 8.915 33.382 ( 6.312 -5.457 -2.610) 8.743 33.645 ( -1.073 -3.086 -1.596) 3.636 33.745 ( -9.938 -0.059 2.195) 10.177 33.775 ( -8.294 -2.392 1.819) 8.821 33.985 ( -16.278 -2.192 -2.609) 16.631 98.500 ( 2.141 0.158 0.875) 2.318 98.525 ( 0.979 -0.863 -0.524) 1.406 98.576 ( 0.630 -0.134 0.712) 0.960 98.599 ( -0.307 -0.228 -0.209) 0.436 98.681 ( 0.598 2.823 1.746) 3.372 98.728 ( -1.482 2.898 1.305) 3.507 99.070 ( 2.746 -5.145 -5.223) 7.829 99.123 ( 0.166 -6.736 -4.032) 7.852 100.326 ( 4.100 1.413 3.979) 5.885 100.486 ( -3.076 1.769 2.026) 4.086 100.545 ( 5.394 -3.651 1.165) 6.617 100.619 ( 2.815 1.742 -0.933) 3.440 100.689 ( 5.318 1.265 -1.542) 5.680 100.748 ( -3.164 4.156 -0.874) 5.296 100.787 ( -4.758 -4.827 0.836) 6.829 100.942 ( -6.202 0.522 -2.035) 6.548 102.483 ( 2.334 1.756 1.207) 3.160 102.576 ( -1.888 2.702 1.300) 3.543 102.608 ( 4.078 6.593 -1.124) 7.834 102.762 ( 0.901 -0.825 -0.354) 1.272 102.885 ( -4.230 6.121 2.883) 7.980 103.002 ( -6.477 0.922 3.841) 7.586 103.130 ( 10.781 -4.002 -2.072) 11.685 103.668 ( -15.966 -4.972 -5.272) 17.533 ======================= Grid point 71 (30/72) ======================= q-point: (-0.50 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.960 ( -38.607 13.298 3.130) 40.953 3.960 ( 38.607 13.298 3.130) 40.953 4.289 ( -27.009 3.463 -12.554) 29.985 4.289 ( 27.009 3.463 -12.554) 29.985 4.730 ( -30.344 -3.637 -16.899) 34.923 4.730 ( 30.344 -3.637 -16.899) 34.923 5.178 ( -15.870 -4.007 -7.937) 18.191 5.178 ( 15.870 -4.007 -7.937) 18.191 5.675 ( -14.207 -2.471 -6.469) 15.805 5.675 ( 14.207 -2.471 -6.469) 15.805 6.221 ( -11.996 -9.998 -10.272) 18.692 6.221 ( 11.996 -9.998 -10.272) 18.692 6.580 ( -17.735 -1.232 29.922) 34.805 6.580 ( 17.735 -1.232 29.922) 34.805 6.688 ( -23.061 -1.509 24.776) 33.882 6.688 ( 23.061 -1.509 24.776) 33.882 7.129 ( -10.611 3.597 16.080) 19.598 7.129 ( 10.611 3.597 16.080) 19.598 7.239 ( -7.786 1.359 14.271) 16.313 7.239 ( 7.786 1.359 14.271) 16.313 7.909 ( -8.116 4.685 -1.391) 9.474 7.909 ( 8.116 4.685 -1.391) 9.474 8.008 ( -12.250 2.011 -1.127) 12.465 8.008 ( 12.250 2.011 -1.127) 12.465 8.520 ( -29.724 1.311 -1.816) 29.809 8.520 ( 29.724 1.311 -1.816) 29.809 8.652 ( -23.336 1.512 -4.209) 23.760 8.652 ( 23.336 1.512 -4.209) 23.760 8.883 ( -3.313 -2.809 3.322) 5.468 8.883 ( 3.313 -2.809 3.322) 5.468 8.936 ( -14.840 -1.576 -3.008) 15.223 8.936 ( 14.840 -1.576 -3.008) 15.223 9.207 ( -12.136 0.622 1.219) 12.213 9.207 ( 12.136 0.622 1.219) 12.213 9.239 ( -5.896 0.855 -2.709) 6.545 9.239 ( 5.896 0.855 -2.709) 6.545 10.403 ( -3.382 0.931 -10.849) 11.402 10.403 ( 3.382 0.931 -10.849) 11.402 10.539 ( -9.615 1.222 -18.247) 20.661 10.539 ( 9.615 1.222 -18.247) 20.661 10.812 ( -4.532 -1.881 -19.397) 20.008 10.812 ( 4.532 -1.881 -19.397) 20.008 11.057 ( -6.527 -1.274 -14.399) 15.861 11.057 ( 6.527 -1.274 -14.399) 15.861 11.578 ( -1.723 3.522 4.496) 5.965 11.578 ( 1.723 3.522 4.496) 5.965 11.813 ( -1.387 -1.235 0.647) 1.967 11.813 ( 1.387 -1.235 0.647) 1.967 11.998 ( -9.566 0.506 15.751) 18.435 11.998 ( 9.566 0.506 15.751) 18.435 12.197 ( -9.026 -4.871 22.531) 24.756 12.197 ( 9.026 -4.871 22.531) 24.756 13.117 ( -3.480 -1.891 -11.212) 11.891 13.117 ( 3.480 -1.891 -11.212) 11.891 13.203 ( -8.589 -2.204 -5.832) 10.613 13.203 ( 8.589 -2.204 -5.832) 10.613 13.604 ( -2.416 -2.022 -2.667) 4.127 13.604 ( 2.416 -2.022 -2.667) 4.127 13.701 ( -6.656 -2.840 1.808) 7.459 13.701 ( 6.656 -2.840 1.808) 7.459 13.958 ( -6.236 0.303 -2.488) 6.721 13.958 ( 6.236 0.303 -2.488) 6.721 14.236 ( -9.058 -2.715 3.506) 10.085 14.236 ( 9.058 -2.715 3.506) 10.085 14.855 ( -2.966 3.979 6.311) 8.028 14.855 ( 2.966 3.979 6.311) 8.028 14.953 ( -3.394 4.961 -0.305) 6.018 14.953 ( 3.394 4.961 -0.305) 6.018 15.236 ( -0.670 5.217 7.887) 9.480 15.236 ( 0.670 5.217 7.887) 9.480 15.399 ( -3.122 2.472 1.737) 4.345 15.399 ( 3.122 2.472 1.737) 4.345 15.578 ( -4.109 -1.952 5.149) 6.871 15.578 ( 4.109 -1.952 5.149) 6.871 15.945 ( -1.771 2.515 -0.067) 3.077 15.945 ( 1.771 2.515 -0.067) 3.077 16.088 ( -6.110 -5.515 -0.461) 8.243 16.088 ( 6.110 -5.515 -0.461) 8.243 16.366 ( -4.638 3.185 -3.963) 6.882 16.366 ( 4.638 3.185 -3.963) 6.882 16.578 ( -11.680 -0.400 6.027) 13.150 16.578 ( 11.680 -0.400 6.027) 13.150 16.739 ( -5.602 1.833 0.860) 5.957 16.739 ( 5.602 1.833 0.860) 5.957 16.833 ( -2.573 2.726 -2.188) 4.341 16.833 ( 2.573 2.726 -2.188) 4.341 17.114 ( -18.521 -6.504 -6.192) 20.584 17.114 ( 18.521 -6.504 -6.192) 20.584 17.698 ( -7.810 3.838 -0.550) 8.720 17.698 ( 7.810 3.838 -0.550) 8.720 17.843 ( -3.753 -1.819 -4.989) 6.502 17.843 ( 3.753 -1.819 -4.989) 6.502 18.189 ( -6.228 0.073 -1.777) 6.477 18.189 ( 6.228 0.073 -1.777) 6.477 18.482 ( -5.340 -5.247 -8.485) 11.316 18.482 ( 5.340 -5.247 -8.485) 11.316 19.581 ( -2.181 -0.591 4.956) 5.447 19.581 ( 2.181 -0.591 4.956) 5.447 19.718 ( -1.776 0.322 0.482) 1.868 19.718 ( 1.776 0.322 0.482) 1.868 20.349 ( -5.396 11.165 11.125) 16.659 20.349 ( 5.396 11.165 11.125) 16.659 21.228 ( -7.837 -7.625 -2.403) 11.195 21.228 ( 7.837 -7.625 -2.403) 11.195 24.382 ( -8.500 7.590 2.913) 11.762 24.382 ( 8.500 7.590 2.913) 11.762 24.962 ( -8.439 -3.188 -6.960) 11.394 24.962 ( 8.439 -3.188 -6.960) 11.394 25.579 ( -7.946 2.402 3.677) 9.079 25.579 ( 7.946 2.402 3.677) 9.079 25.928 ( -11.020 -4.091 -2.293) 11.976 25.928 ( 11.020 -4.091 -2.293) 11.976 27.185 ( -8.705 3.857 2.110) 9.752 27.185 ( 8.705 3.857 2.110) 9.752 27.458 ( -10.496 2.120 -2.393) 10.972 27.458 ( 10.496 2.120 -2.393) 10.972 27.636 ( -6.350 -5.810 0.786) 8.643 27.636 ( 6.350 -5.810 0.786) 8.643 27.749 ( -9.096 -3.239 -1.198) 9.730 27.749 ( 9.096 -3.239 -1.198) 9.730 29.775 ( -3.376 4.194 6.025) 8.080 29.775 ( 3.376 4.194 6.025) 8.080 30.237 ( -3.414 -6.943 4.182) 8.795 30.237 ( 3.414 -6.943 4.182) 8.795 30.599 ( -4.414 7.427 -5.596) 10.294 30.599 ( 4.414 7.427 -5.596) 10.294 31.151 ( -9.279 -4.275 -12.882) 16.441 31.151 ( 9.279 -4.275 -12.882) 16.441 31.982 ( -6.645 6.128 11.280) 14.455 31.982 ( 6.645 6.128 11.280) 14.455 32.301 ( -5.520 1.509 3.347) 6.629 32.301 ( 5.520 1.509 3.347) 6.629 32.525 ( -13.475 -2.074 2.905) 13.939 32.525 ( 13.475 -2.074 2.905) 13.939 32.692 ( -4.994 -6.351 1.859) 8.291 32.692 ( 4.994 -6.351 1.859) 8.291 32.927 ( -2.718 7.823 -3.614) 9.036 32.927 ( 2.718 7.823 -3.614) 9.036 33.390 ( -11.147 0.448 -5.947) 12.642 33.390 ( 11.147 0.448 -5.947) 12.642 33.642 ( -3.463 -4.495 1.198) 5.799 33.642 ( 3.463 -4.495 1.198) 5.799 33.710 ( -6.954 -1.975 -0.457) 7.243 33.710 ( 6.954 -1.975 -0.457) 7.243 98.530 ( -0.619 -0.015 -0.324) 0.698 98.530 ( 0.619 -0.015 -0.324) 0.698 98.587 ( -0.710 -1.303 1.495) 2.106 98.587 ( 0.710 -1.303 1.495) 2.106 98.700 ( -1.233 3.809 0.965) 4.119 98.700 ( 1.233 3.809 0.965) 4.119 99.111 ( -1.351 -5.684 -4.563) 7.413 99.111 ( 1.351 -5.684 -4.563) 7.413 100.409 ( -4.177 1.808 3.096) 5.504 100.409 ( 4.177 1.808 3.096) 5.504 100.650 ( -3.657 -1.276 -0.632) 3.924 100.650 ( 3.657 -1.276 -0.632) 3.924 100.695 ( -2.699 -0.349 0.320) 2.740 100.695 ( 2.699 -0.349 0.320) 2.740 100.818 ( -6.103 1.012 -1.312) 6.324 100.818 ( 6.103 1.012 -1.312) 6.324 102.532 ( -2.415 2.113 0.953) 3.347 102.532 ( 2.415 2.113 0.953) 3.347 102.702 ( -5.089 7.141 -1.727) 8.937 102.702 ( 5.089 7.141 -1.727) 8.937 102.897 ( -3.963 -1.252 4.405) 6.056 102.897 ( 3.963 -1.252 4.405) 6.056 103.373 ( -13.468 -4.740 -3.520) 14.705 103.373 ( 13.468 -4.740 -3.520) 14.705 ======================= Grid point 77 (31/72) ======================= q-point: ( 0.00 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.492 ( 0.000 19.506 26.986) 33.298 1.895 ( 0.000 -16.251 21.179) 26.696 1.969 ( 0.000 11.718 70.346) 71.316 2.239 ( 0.000 -11.841 60.269) 61.422 2.798 ( 0.000 54.634 2.516) 54.692 3.658 ( 0.000 -8.342 -10.745) 13.603 3.784 ( 0.000 0.611 -9.581) 9.600 3.987 ( 0.000 -32.657 -2.086) 32.724 4.165 ( 0.000 30.158 -31.121) 43.336 4.758 ( 0.000 -21.728 -24.910) 33.055 5.729 ( 0.000 2.270 34.031) 34.107 5.862 ( 0.000 -10.134 28.555) 30.300 7.108 ( 0.000 2.656 -33.136) 33.242 7.116 ( 0.000 4.559 -6.915) 8.283 7.172 ( 0.000 1.204 -31.139) 31.163 7.238 ( 0.000 -2.648 -2.285) 3.498 7.427 ( 0.000 1.437 -0.648) 1.576 7.500 ( 0.000 -5.712 0.742) 5.760 7.526 ( 0.000 -0.372 -3.192) 3.213 7.530 ( 0.000 -0.625 -5.215) 5.252 7.837 ( 0.000 7.738 -12.573) 14.764 8.022 ( 0.000 -8.725 -11.472) 14.413 8.099 ( 0.000 4.837 -6.903) 8.429 8.142 ( 0.000 0.877 1.443) 1.689 8.381 ( 0.000 4.306 -6.329) 7.655 8.485 ( 0.000 -3.634 -13.254) 13.744 8.549 ( 0.000 1.119 -9.616) 9.681 8.585 ( 0.000 -1.648 -15.281) 15.370 8.844 ( 0.000 6.214 4.193) 7.497 8.978 ( 0.000 -5.427 13.021) 14.107 9.181 ( 0.000 4.228 10.229) 11.068 9.271 ( 0.000 -1.516 17.510) 17.576 9.428 ( 0.000 -0.977 27.119) 27.137 9.477 ( 0.000 -3.248 28.895) 29.077 9.737 ( 0.000 3.990 9.410) 10.221 9.818 ( 0.000 -3.174 2.137) 3.826 10.421 ( 0.000 4.149 11.352) 12.087 10.497 ( 0.000 -3.097 6.334) 7.051 10.612 ( 0.000 -0.676 9.828) 9.851 10.637 ( 0.000 -2.350 15.948) 16.120 11.010 ( 0.000 9.631 -1.728) 9.785 11.206 ( 0.000 1.042 0.278) 1.078 11.344 ( 0.000 -7.213 2.370) 7.593 11.439 ( 0.000 -6.171 4.765) 7.797 11.857 ( 0.000 -0.962 2.642) 2.811 11.889 ( 0.000 -3.106 1.847) 3.614 12.013 ( 0.000 6.013 -19.511) 20.416 12.077 ( 0.000 2.578 -7.896) 8.306 12.225 ( 0.000 -4.580 -19.305) 19.841 12.232 ( 0.000 -2.761 -11.107) 11.445 12.400 ( 0.000 4.875 -13.568) 14.417 12.421 ( 0.000 4.600 -10.368) 11.343 12.568 ( 0.000 4.600 -25.682) 26.090 12.639 ( 0.000 1.307 -7.831) 7.939 12.641 ( 0.000 -1.971 -24.112) 24.193 12.767 ( 0.000 -8.295 -4.062) 9.236 13.325 ( 0.000 3.532 9.978) 10.585 13.370 ( 0.000 -1.094 12.674) 12.721 13.439 ( 0.000 1.225 11.953) 12.016 13.439 ( 0.000 1.876 5.638) 5.942 13.762 ( 0.000 1.793 5.543) 5.826 13.777 ( 0.000 0.968 9.644) 9.693 14.079 ( 0.000 9.426 -0.231) 9.429 14.310 ( 0.000 -9.969 -4.653) 11.002 14.771 ( 0.000 6.108 0.636) 6.141 14.823 ( 0.000 1.740 -7.159) 7.367 14.983 ( 0.000 -4.004 4.378) 5.933 15.026 ( 0.000 -8.173 11.064) 13.755 15.163 ( 0.000 6.019 2.248) 6.425 15.243 ( 0.000 -0.345 11.957) 11.962 15.284 ( 0.000 -1.414 10.554) 10.648 15.358 ( 0.000 -8.893 1.033) 8.953 15.700 ( 0.000 7.929 -13.829) 15.941 15.756 ( 0.000 0.908 -8.908) 8.955 15.783 ( 0.000 2.759 1.342) 3.068 15.907 ( 0.000 -3.656 0.029) 3.656 16.034 ( 0.000 2.549 -2.687) 3.704 16.155 ( 0.000 -2.312 -3.656) 4.325 16.227 ( 0.000 0.603 6.444) 6.472 16.254 ( 0.000 -6.543 -4.492) 7.937 16.369 ( 0.000 0.566 -4.782) 4.816 16.425 ( 0.000 -5.805 -5.620) 8.079 16.698 ( 0.000 0.851 7.815) 7.861 16.728 ( 0.000 -1.776 7.505) 7.712 16.961 ( 0.000 10.710 -11.327) 15.588 17.170 ( 0.000 -7.665 -11.543) 13.856 17.367 ( 0.000 7.904 0.505) 7.920 17.446 ( 0.000 -1.017 -1.888) 2.144 17.456 ( 0.000 12.599 5.269) 13.656 17.728 ( 0.000 -10.225 6.884) 12.326 18.167 ( 0.000 2.038 12.267) 12.435 18.246 ( 0.000 -4.630 4.325) 6.336 18.453 ( 0.000 4.908 1.866) 5.251 18.595 ( 0.000 -7.853 3.466) 8.584 18.964 ( 0.000 9.173 -8.007) 12.176 19.123 ( 0.000 -4.814 -13.726) 14.546 19.555 ( 0.000 6.897 4.203) 8.077 19.741 ( 0.000 -9.683 4.043) 10.493 20.033 ( 0.000 16.335 -1.392) 16.394 20.198 ( 0.000 9.554 4.946) 10.758 20.373 ( 0.000 -10.648 3.675) 11.265 20.427 ( 0.000 -14.966 -2.186) 15.125 22.112 ( 0.000 11.822 -24.192) 26.926 22.209 ( 0.000 5.400 -43.433) 43.767 24.330 ( 0.000 11.134 7.018) 13.161 24.674 ( 0.000 -21.130 19.671) 28.869 24.900 ( 0.000 17.006 -10.454) 19.962 25.269 ( 0.000 -15.753 -7.231) 17.333 25.626 ( 0.000 5.868 18.138) 19.063 25.763 ( 0.000 -6.101 17.131) 18.185 26.583 ( 0.000 11.450 -1.777) 11.587 26.773 ( 0.000 1.601 -7.432) 7.603 26.813 ( 0.000 -1.050 -2.974) 3.154 26.828 ( 0.000 -9.264 1.747) 9.427 27.491 ( 0.000 -0.991 -7.085) 7.154 27.501 ( 0.000 -1.918 -8.592) 8.804 28.024 ( 0.000 0.635 2.405) 2.488 28.036 ( 0.000 -0.430 2.820) 2.853 28.273 ( 0.000 3.105 1.402) 3.406 28.353 ( 0.000 -3.879 0.176) 3.883 29.436 ( 0.000 1.861 2.841) 3.396 29.481 ( 0.000 -2.054 3.645) 4.184 29.940 ( 0.000 8.736 -13.043) 15.698 30.100 ( 0.000 -5.893 -13.859) 15.060 30.513 ( 0.000 5.824 13.035) 14.277 30.640 ( 0.000 -4.455 12.500) 13.270 30.764 ( 0.000 2.896 9.086) 9.536 30.795 ( 0.000 0.171 7.422) 7.423 31.120 ( 0.000 -1.771 -6.229) 6.475 31.195 ( 0.000 -9.050 1.283) 9.140 31.624 ( 0.000 3.625 -1.774) 4.036 31.686 ( 0.000 -1.580 -7.823) 7.981 31.755 ( 0.000 1.016 13.223) 13.262 31.810 ( 0.000 -4.473 19.856) 20.354 31.957 ( 0.000 7.579 4.598) 8.865 32.127 ( 0.000 -7.725 7.060) 10.465 32.554 ( 0.000 1.048 -6.433) 6.518 32.609 ( 0.000 -3.636 -2.397) 4.355 33.404 ( 0.000 10.062 -12.902) 16.362 33.592 ( 0.000 -6.465 -13.485) 14.955 34.062 ( 0.000 0.869 11.498) 11.531 34.115 ( 0.000 -3.453 11.259) 11.776 34.525 ( 0.000 6.302 -0.370) 6.313 34.653 ( 0.000 -5.145 -0.583) 5.178 98.335 ( 0.000 0.309 0.256) 0.401 98.342 ( 0.000 -0.336 0.251) 0.419 98.430 ( 0.000 0.642 -1.627) 1.749 98.442 ( 0.000 -0.458 -2.113) 2.162 98.655 ( 0.000 2.849 2.670) 3.904 98.723 ( 0.000 -3.076 2.464) 3.941 98.815 ( 0.000 2.202 -0.460) 2.250 98.873 ( 0.000 -3.107 0.278) 3.119 100.152 ( 0.000 1.739 3.081) 3.538 100.198 ( 0.000 -2.153 2.042) 2.967 100.430 ( 0.000 0.174 -1.616) 1.626 100.431 ( 0.000 0.114 -1.609) 1.613 100.721 ( 0.000 3.577 2.092) 4.144 100.805 ( 0.000 -3.965 1.700) 4.314 101.142 ( 0.000 2.847 -4.166) 5.045 101.193 ( 0.000 -1.422 -7.050) 7.192 102.444 ( 0.000 2.343 2.263) 3.257 102.512 ( 0.000 -3.451 1.031) 3.602 102.555 ( 0.000 2.714 -0.468) 2.754 102.615 ( 0.000 -2.481 -0.876) 2.631 102.901 ( 0.000 8.864 10.123) 13.455 103.085 ( 0.000 -7.435 11.394) 13.605 104.623 ( 0.000 6.997 -26.681) 27.583 104.690 ( 0.000 -0.593 -16.758) 16.769 ======================= Grid point 78 (32/72) ======================= q-point: ( 0.10 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.864 ( 26.657 14.182 31.662) 43.752 2.175 ( 21.501 -13.327 27.924) 37.678 2.447 ( 45.270 12.473 45.335) 65.270 2.691 ( 44.039 -10.112 40.662) 60.787 2.846 ( 7.237 50.868 5.435) 51.667 3.830 ( 7.847 -30.557 -3.292) 31.720 4.099 ( 24.276 9.151 -13.146) 29.084 4.159 ( 25.449 -6.450 -9.756) 28.008 4.250 ( 13.393 17.327 -25.635) 33.716 4.794 ( 3.591 -21.593 -24.751) 33.042 5.744 ( 1.390 1.996 32.059) 32.151 5.865 ( 0.297 -9.433 27.011) 28.612 6.899 ( -17.851 3.233 -30.417) 35.416 6.960 ( -17.069 -1.655 -33.025) 37.212 7.084 ( -5.691 4.592 -2.316) 7.671 7.161 ( -8.797 -1.670 0.326) 8.960 7.391 ( -4.642 3.301 -3.739) 6.814 7.461 ( -2.555 0.157 -0.797) 2.681 7.482 ( -1.825 -2.293 -2.734) 4.008 7.520 ( 0.269 -3.718 0.995) 3.858 7.977 ( 1.954 4.732 -8.871) 10.242 8.059 ( 2.500 2.940 -12.885) 13.451 8.068 ( -5.292 -0.754 1.864) 5.661 8.141 ( 5.984 -3.969 -12.920) 14.781 8.316 ( -6.851 4.983 3.374) 9.119 8.449 ( -7.186 -3.541 -3.601) 8.784 8.467 ( -4.483 -0.675 -8.602) 9.724 8.504 ( -6.125 -1.511 -10.040) 11.857 8.874 ( -1.342 5.658 5.936) 8.310 8.940 ( -5.216 0.151 11.768) 12.873 8.969 ( -13.132 1.140 17.761) 22.118 9.086 ( -1.651 -6.894 9.261) 11.663 9.328 ( -3.277 9.184 4.663) 10.809 9.519 ( -2.293 -7.206 6.840) 10.197 9.982 ( 12.899 1.064 17.948) 22.128 10.015 ( 15.106 -0.911 15.031) 21.330 10.465 ( 4.793 6.511 9.886) 12.770 10.591 ( 8.127 -4.179 5.611) 10.724 10.658 ( 3.331 0.083 8.411) 9.047 10.708 ( 6.287 -3.738 12.801) 14.743 11.006 ( 0.549 9.009 -2.498) 9.365 11.261 ( 0.784 -12.482 -3.560) 13.003 11.401 ( 8.423 5.657 4.085) 10.938 11.540 ( 7.890 -5.188 1.804) 9.613 11.846 ( -0.959 1.224 2.987) 3.367 11.918 ( -1.213 -3.753 0.669) 4.000 11.938 ( -3.338 3.840 -13.523) 14.449 12.013 ( -4.019 -0.504 -10.831) 11.564 12.168 ( -2.872 -0.295 -13.420) 13.727 12.213 ( -2.597 -2.416 -17.476) 17.832 12.352 ( -14.633 4.892 -13.047) 20.206 12.416 ( -14.220 -0.187 -12.468) 18.913 12.507 ( 0.334 2.384 -12.031) 12.269 12.523 ( 5.874 2.324 -9.262) 11.211 12.686 ( 4.706 3.994 -6.534) 8.989 12.853 ( 7.606 -9.697 -3.381) 12.779 13.249 ( -13.620 3.689 0.159) 14.112 13.307 ( -5.332 -1.355 -1.565) 5.720 13.383 ( -5.076 3.429 3.682) 7.147 13.451 ( -1.013 -2.327 3.190) 4.077 13.593 ( -5.768 5.466 12.047) 14.432 13.682 ( -3.255 -1.543 10.016) 10.644 14.231 ( 9.080 6.592 1.178) 11.282 14.384 ( 5.281 -6.032 -0.142) 8.018 14.739 ( -0.580 5.544 0.212) 5.578 14.885 ( 2.393 -5.407 -3.572) 6.908 14.931 ( -0.841 4.552 2.951) 5.489 15.084 ( 3.044 -7.094 6.669) 10.201 15.202 ( 1.492 5.235 3.106) 6.267 15.284 ( 2.859 1.053 10.687) 11.113 15.310 ( 2.976 -1.719 10.794) 11.328 15.368 ( 1.398 -8.923 3.741) 9.776 15.630 ( -5.207 7.171 -12.960) 15.701 15.715 ( -3.179 -0.629 -6.612) 7.363 15.812 ( 2.033 3.162 0.308) 3.771 15.916 ( -0.309 -3.071 0.970) 3.235 16.014 ( -1.605 0.867 -1.756) 2.532 16.091 ( -2.218 0.631 -0.352) 2.333 16.153 ( -4.143 -3.682 2.188) 5.959 16.266 ( -0.104 -6.689 -1.469) 6.849 16.490 ( 9.765 1.704 -5.244) 11.214 16.563 ( 8.892 -4.861 -5.081) 11.337 16.733 ( 3.388 1.612 6.731) 7.706 16.767 ( 3.840 -1.164 6.057) 7.265 16.932 ( -2.620 10.267 -11.926) 15.954 17.132 ( -3.316 -7.072 -10.307) 12.932 17.406 ( 1.687 6.731 0.234) 6.943 17.450 ( 1.905 0.436 -3.450) 3.965 17.481 ( 2.061 9.011 3.483) 9.878 17.706 ( -2.092 -8.901 6.157) 11.024 18.138 ( -2.777 2.409 10.394) 11.025 18.215 ( -3.207 -4.403 6.008) 8.110 18.429 ( -2.202 4.188 1.937) 5.113 18.559 ( -3.368 -7.240 2.882) 8.489 18.918 ( -4.859 9.233 -8.384) 13.385 19.076 ( -4.969 -4.487 -13.922) 15.449 19.574 ( 1.699 6.943 3.855) 8.121 19.747 ( 0.115 -7.515 3.752) 8.401 19.989 ( -4.994 12.493 -1.087) 13.498 20.194 ( -1.856 3.317 1.215) 3.990 20.344 ( -3.786 -10.118 2.313) 11.048 20.401 ( 0.786 -6.380 3.803) 7.469 21.878 ( -23.659 13.871 -24.227) 36.594 21.970 ( -17.578 5.003 -21.714) 28.382 24.339 ( 1.007 8.437 6.632) 10.779 24.554 ( -9.173 -10.126 17.624) 22.300 24.945 ( 3.774 12.829 -12.009) 17.974 25.230 ( -3.579 -12.352 -7.926) 15.106 25.577 ( -4.630 3.348 15.059) 16.106 25.717 ( -3.065 -8.529 16.321) 18.668 26.523 ( -4.848 9.849 -3.551) 11.537 26.653 ( -7.462 2.173 -5.683) 9.628 26.849 ( 3.519 -4.542 2.904) 6.438 26.891 ( 2.325 -4.704 -0.872) 5.319 27.432 ( -4.939 1.211 -6.733) 8.438 27.489 ( -2.039 -3.973 -7.069) 8.361 28.004 ( -2.049 1.074 1.913) 3.002 28.030 ( -1.103 -1.180 2.385) 2.881 28.185 ( -7.778 3.454 1.118) 8.584 28.271 ( -7.308 -4.166 -0.042) 8.412 29.533 ( 8.189 3.106 2.020) 8.988 29.613 ( 10.314 -3.929 0.703) 11.060 30.019 ( 7.418 7.429 -12.426) 16.267 30.154 ( 4.839 -4.680 -12.540) 14.232 30.503 ( -11.442 2.811 7.440) 13.935 30.519 ( -1.218 1.591 10.933) 11.116 30.705 ( -2.863 -1.453 8.745) 9.316 30.721 ( -1.920 -2.592 9.321) 9.863 31.266 ( 14.199 3.626 -3.279) 15.017 31.355 ( 10.558 -3.591 -0.066) 11.152 31.724 ( 8.316 2.629 1.320) 8.821 31.773 ( 7.659 -1.178 -4.672) 9.049 31.854 ( 7.206 1.046 8.158) 10.934 31.923 ( 10.440 -6.364 11.018) 16.459 32.032 ( 7.472 4.602 6.604) 10.983 32.185 ( 5.862 -8.486 6.322) 12.098 32.584 ( 2.617 -0.682 -5.002) 5.686 32.619 ( 1.584 -3.082 -2.610) 4.338 33.398 ( -0.628 9.621 -12.453) 15.749 33.576 ( -1.580 -5.995 -12.818) 14.239 34.014 ( -4.632 1.207 11.026) 12.020 34.072 ( -4.229 -3.544 10.695) 12.035 34.474 ( -5.052 6.214 -0.365) 8.017 34.601 ( -5.166 -5.129 -0.700) 7.313 98.375 ( 2.822 0.339 -0.015) 2.842 98.389 ( 2.730 -0.874 -0.231) 2.876 98.465 ( 2.842 0.068 -2.316) 3.667 98.479 ( 5.637 -1.487 -2.810) 6.472 98.653 ( -0.108 2.615 2.844) 3.865 98.714 ( -0.607 -2.755 2.799) 3.974 98.820 ( 0.473 2.491 -0.407) 2.568 98.888 ( 1.392 -3.655 0.040) 3.911 100.168 ( 1.603 1.829 3.188) 4.010 100.217 ( 1.891 -2.358 2.094) 3.677 100.448 ( 1.943 0.472 -1.649) 2.592 100.453 ( 2.026 -0.040 -1.707) 2.650 100.712 ( -0.881 3.856 2.226) 4.539 100.803 ( -0.254 -4.336 1.653) 4.647 101.113 ( -2.761 3.502 -4.029) 6.010 101.176 ( -1.814 -2.029 -6.217) 6.787 102.449 ( 0.557 2.693 2.181) 3.510 102.528 ( 1.465 -3.960 0.853) 4.307 102.566 ( 1.082 3.365 -0.565) 3.580 102.637 ( 2.149 -2.735 -1.062) 3.637 102.879 ( -2.028 8.710 9.585) 13.108 103.062 ( -2.228 -7.440 10.894) 13.379 104.398 ( -19.800 12.544 -20.919) 31.417 104.553 ( -12.851 -3.294 -14.988) 20.016 ======================= Grid point 79 (33/72) ======================= q-point: ( 0.20 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.445 ( 31.482 10.465 25.805) 42.030 2.681 ( 28.627 -10.292 22.784) 38.007 2.937 ( 12.431 46.659 5.404) 48.588 3.683 ( 62.278 6.296 26.534) 67.987 3.716 ( 44.457 -12.530 18.757) 49.853 3.991 ( 20.043 -28.585 7.288) 35.665 4.351 ( 11.871 25.510 -24.447) 37.274 4.887 ( 13.835 -18.724 -20.271) 30.869 4.953 ( 39.110 -0.458 -18.023) 43.065 4.989 ( 47.201 -1.924 -13.312) 49.080 5.772 ( 0.626 1.067 25.622) 25.652 5.859 ( -1.779 -7.340 20.629) 21.968 6.495 ( -20.962 3.290 -24.504) 32.414 6.569 ( -20.361 -2.810 -24.078) 31.658 6.819 ( -17.149 5.154 1.369) 17.958 6.936 ( -13.633 -4.487 1.973) 14.488 7.295 ( -8.069 4.256 -5.379) 10.590 7.374 ( -5.680 -2.029 -7.013) 9.250 7.475 ( -0.876 0.927 0.031) 1.276 7.515 ( -0.572 -3.028 0.801) 3.184 7.854 ( -7.068 3.056 4.832) 9.091 7.918 ( -6.766 -1.792 9.044) 11.436 8.031 ( -16.858 3.090 13.651) 21.911 8.086 ( -13.675 0.499 13.708) 19.369 8.129 ( -6.359 1.550 1.053) 6.629 8.207 ( -7.863 -4.149 6.221) 10.851 8.469 ( 6.048 4.067 -11.725) 13.806 8.574 ( 9.546 -4.748 -15.645) 18.933 8.798 ( 2.599 4.258 -1.506) 5.211 8.851 ( 1.324 -0.490 -0.916) 1.683 9.018 ( 5.105 4.188 -5.603) 8.660 9.131 ( 1.718 -5.427 0.142) 5.694 9.253 ( -3.290 8.361 -0.508) 8.999 9.428 ( -5.554 -6.634 0.991) 8.709 10.172 ( 7.170 2.248 13.281) 15.259 10.255 ( 7.809 -4.583 13.945) 16.627 10.576 ( -1.786 4.979 4.787) 7.134 10.647 ( -5.144 -2.255 5.387) 7.783 10.698 ( 5.433 9.350 13.255) 17.107 10.902 ( 10.626 -5.017 3.829) 12.359 11.048 ( 2.831 1.163 1.470) 3.396 11.216 ( -4.692 -10.941 -3.052) 12.290 11.577 ( 4.487 3.411 -4.906) 7.473 11.649 ( -2.342 -2.402 -11.111) 11.606 11.768 ( -7.598 3.682 -15.027) 17.237 11.792 ( -9.974 0.632 -11.136) 14.963 11.845 ( -10.535 1.933 -4.022) 11.441 11.903 ( -4.561 -3.079 -2.404) 6.005 12.034 ( -10.820 0.135 -2.681) 11.148 12.054 ( -7.839 -0.183 2.118) 8.122 12.194 ( -2.956 1.482 -4.835) 5.857 12.275 ( 6.409 -4.748 -4.127) 8.981 12.514 ( -0.250 2.312 -0.108) 2.328 12.538 ( -6.727 0.459 -0.076) 6.743 12.830 ( 6.015 5.587 -1.922) 8.431 12.936 ( -3.636 -1.838 -2.722) 4.900 13.081 ( 7.076 -2.327 -5.613) 9.327 13.132 ( 4.447 -5.051 -2.713) 7.256 13.378 ( 3.126 5.217 -9.612) 11.375 13.476 ( 3.306 -2.885 -14.169) 14.833 13.603 ( 3.071 3.482 11.211) 12.134 13.667 ( -0.308 -1.402 11.330) 11.421 14.343 ( 2.060 5.194 3.720) 6.713 14.443 ( -1.022 -2.846 2.786) 4.112 14.784 ( 5.355 4.338 2.607) 7.368 14.906 ( 2.294 -2.635 2.584) 4.345 14.973 ( 2.492 3.652 -3.961) 5.936 15.122 ( 0.139 -4.518 1.233) 4.685 15.203 ( -0.189 3.494 4.706) 5.864 15.299 ( -0.731 -1.401 3.972) 4.274 15.395 ( 4.575 1.081 10.319) 11.339 15.414 ( 2.304 -1.326 6.231) 6.774 15.559 ( -1.075 2.979 -5.142) 6.039 15.649 ( -2.937 -2.454 -3.730) 5.344 15.807 ( -3.064 2.457 1.565) 4.228 15.860 ( -4.956 -1.694 4.702) 7.038 16.021 ( 0.802 3.286 -1.554) 3.722 16.098 ( 3.343 3.326 3.218) 5.709 16.138 ( 3.741 -8.250 -0.743) 9.089 16.263 ( 0.110 -8.459 -1.404) 8.576 16.639 ( 1.085 1.333 -2.162) 2.762 16.661 ( 1.794 -0.155 -4.678) 5.012 16.797 ( -2.085 3.870 -0.377) 4.412 16.867 ( 7.555 -1.931 1.614) 7.963 16.928 ( 4.741 5.300 -4.600) 8.470 17.065 ( -2.386 -5.335 -5.748) 8.198 17.372 ( -4.769 5.960 -1.065) 7.707 17.490 ( -1.241 -2.901 -1.122) 3.348 17.560 ( 6.390 4.216 -5.141) 9.222 17.666 ( -0.330 -3.775 0.013) 3.789 18.056 ( -5.549 3.477 6.826) 9.459 18.133 ( -4.285 -3.404 4.457) 7.058 18.373 ( -3.335 2.994 3.794) 5.872 18.479 ( -4.210 -5.516 2.027) 7.229 18.751 ( -12.126 7.856 -8.972) 17.007 18.902 ( -13.101 -4.284 -11.935) 18.233 19.609 ( 1.485 6.056 3.210) 7.013 19.730 ( -1.851 -2.228 2.794) 4.025 19.838 ( -8.896 6.087 1.584) 10.895 20.016 ( -12.550 -6.897 -2.183) 14.485 20.376 ( 4.608 2.759 7.277) 9.044 20.466 ( 6.265 -4.004 4.498) 8.690 21.385 ( -21.805 15.873 -5.054) 27.440 21.600 ( -17.613 -2.988 -9.754) 20.354 24.369 ( 0.658 3.987 7.595) 8.603 24.418 ( -1.833 0.239 8.775) 8.968 24.997 ( -0.432 5.877 -11.761) 13.155 25.149 ( -3.318 -6.985 -8.910) 11.798 25.495 ( -2.220 4.479 9.972) 11.155 25.666 ( -2.279 -9.949 13.092) 16.601 26.399 ( -8.261 6.651 -5.827) 12.101 26.479 ( -10.421 0.607 -4.758) 11.472 26.936 ( 4.079 -1.941 1.926) 4.911 26.958 ( 6.336 -4.001 2.785) 7.995 27.323 ( -4.773 3.433 -4.173) 7.210 27.433 ( -2.803 -6.286 -4.484) 8.215 27.916 ( -8.583 2.253 2.079) 9.114 27.951 ( -6.429 -0.144 1.380) 6.577 28.049 ( -4.315 0.455 0.804) 4.413 28.103 ( -8.467 -3.738 -0.212) 9.258 29.693 ( 6.798 4.546 1.022) 8.242 29.805 ( 7.915 -5.332 -1.504) 9.661 30.189 ( 4.671 3.947 -7.480) 9.662 30.234 ( 0.146 0.932 -2.279) 2.466 30.334 ( 0.362 1.989 -2.095) 2.912 30.425 ( -3.076 -5.121 3.667) 7.009 30.721 ( 4.554 4.346 7.630) 9.892 30.810 ( 7.685 -3.154 7.890) 11.457 31.554 ( 12.555 4.326 -1.851) 13.407 31.610 ( 15.654 0.250 0.171) 15.657 31.926 ( 10.675 3.010 5.042) 12.184 31.945 ( 9.800 0.875 0.655) 9.860 32.034 ( 9.436 0.078 -4.860) 10.614 32.103 ( 8.130 -2.895 4.231) 9.611 32.229 ( 11.002 0.583 8.063) 13.653 32.333 ( 7.414 -7.326 5.059) 11.586 32.627 ( 2.343 0.099 -1.725) 2.911 32.714 ( 7.439 -7.798 -4.221) 11.574 33.378 ( -1.415 8.487 -11.273) 14.181 33.530 ( -3.023 -4.648 -10.959) 12.282 33.882 ( -8.408 1.815 9.916) 13.127 33.953 ( -7.397 -4.111 9.070) 12.405 34.327 ( -9.490 5.908 -0.262) 11.182 34.450 ( -9.846 -5.021 -0.996) 11.097 98.424 ( 1.824 0.367 0.268) 1.880 98.432 ( 2.289 -0.324 -0.151) 2.317 98.537 ( 3.898 2.194 -2.970) 5.369 98.601 ( 2.845 -2.675 -2.978) 4.911 98.667 ( 2.146 0.699 2.267) 3.199 98.721 ( 2.690 -3.849 1.812) 5.033 98.831 ( 0.648 3.101 -0.416) 3.195 98.921 ( 1.727 -4.779 -0.469) 5.103 100.215 ( 3.014 2.099 3.340) 4.964 100.271 ( 3.466 -2.820 2.178) 4.971 100.504 ( 3.381 0.552 -1.772) 3.857 100.508 ( 3.467 0.195 -1.902) 3.959 100.686 ( -1.732 4.265 2.496) 5.236 100.789 ( -1.280 -4.969 1.655) 5.392 101.040 ( -4.374 4.377 -3.326) 7.025 101.119 ( -3.812 -2.728 -4.668) 6.615 102.469 ( 1.412 3.490 1.926) 4.229 102.565 ( 2.115 -4.809 0.839) 5.320 102.603 ( 2.812 4.858 -1.110) 5.722 102.696 ( 3.432 -2.693 -1.448) 4.596 102.833 ( -2.000 7.044 8.053) 10.884 103.002 ( -3.625 -7.193 9.615) 12.543 103.954 ( -22.408 17.701 -12.255) 31.075 104.225 ( -18.718 -7.847 -11.222) 23.192 ======================= Grid point 80 (34/72) ======================= q-point: ( 0.30 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.101 ( 33.412 9.532 11.701) 36.663 3.242 ( 23.591 22.619 5.518) 33.145 3.326 ( 30.232 7.014 10.714) 32.832 4.086 ( 14.170 -32.274 2.603) 35.344 4.542 ( 15.123 19.681 -21.824) 33.051 4.874 ( 44.505 -4.828 10.110) 45.894 5.014 ( 50.184 -0.386 19.555) 53.861 5.070 ( 16.555 -7.920 -8.399) 20.183 5.642 ( 1.663 -0.590 -21.738) 21.810 5.660 ( -2.857 -3.127 -20.265) 20.703 5.731 ( -2.971 3.102 -1.706) 4.621 5.842 ( 2.536 -5.585 1.745) 6.377 6.299 ( 20.085 1.630 0.318) 20.153 6.341 ( 12.799 -2.364 -1.888) 13.151 6.537 ( -9.437 2.815 6.217) 11.646 6.655 ( -12.673 -7.671 5.103) 15.669 7.068 ( -10.324 7.377 -4.259) 13.385 7.195 ( -10.116 -3.935 -4.261) 11.660 7.412 ( -7.589 1.351 15.663) 17.457 7.438 ( -10.297 -1.650 20.196) 22.730 7.687 ( -9.713 -0.452 22.040) 24.089 7.688 ( -9.679 -0.269 20.262) 22.456 7.865 ( 2.735 4.448 -0.330) 5.232 7.952 ( 3.292 -2.600 -1.695) 4.525 8.071 ( 1.026 5.312 5.721) 7.874 8.160 ( 2.062 -1.943 4.282) 5.135 8.529 ( -0.587 7.608 -6.032) 9.727 8.700 ( 1.409 -6.881 -9.796) 12.054 8.934 ( 6.388 1.139 -5.918) 8.782 8.938 ( 5.462 0.383 -2.603) 6.063 9.052 ( -3.830 3.030 -3.543) 6.033 9.106 ( -0.160 -1.005 -11.977) 12.021 9.276 ( 4.092 3.235 -10.820) 12.012 9.366 ( 1.223 -4.034 -9.245) 10.160 10.250 ( -17.727 2.591 7.124) 19.280 10.304 ( -12.217 2.224 6.250) 13.902 10.321 ( -8.105 -2.472 8.571) 12.053 10.387 ( -5.431 -3.828 6.706) 9.440 10.848 ( -0.017 9.546 1.828) 9.720 10.919 ( -8.591 4.476 -1.499) 9.802 10.999 ( -11.403 -6.304 -5.346) 14.084 11.102 ( -5.448 -7.676 -4.696) 10.519 11.388 ( -12.724 2.599 -26.786) 29.768 11.461 ( -7.463 -3.171 -17.445) 19.238 11.655 ( -8.522 3.283 3.708) 9.857 11.702 ( -5.613 3.370 1.210) 6.658 11.747 ( -6.687 -2.842 3.883) 8.238 11.808 ( -5.327 -2.880 -3.037) 6.775 11.830 ( -2.627 0.787 -0.875) 2.879 11.849 ( -3.868 -1.875 0.863) 4.384 12.212 ( 2.282 -0.265 1.087) 2.541 12.228 ( -1.050 -1.510 3.550) 3.998 12.613 ( 12.641 6.005 11.121) 17.876 12.728 ( 15.893 -4.152 7.613) 18.105 12.948 ( 7.559 -1.194 -0.816) 7.697 12.974 ( 6.643 -3.604 -1.615) 7.729 13.289 ( 10.663 1.842 -9.588) 14.457 13.393 ( 12.643 -6.119 -8.058) 16.193 13.491 ( 6.697 4.855 -1.086) 8.343 13.544 ( 4.116 -1.251 -10.826) 11.649 13.666 ( 1.671 1.090 3.496) 4.025 13.705 ( 8.419 -1.912 -4.556) 9.762 14.338 ( -2.603 1.995 7.465) 8.154 14.352 ( -6.339 0.526 3.576) 7.297 14.905 ( 4.605 4.246 8.051) 10.200 14.956 ( 1.935 4.000 -3.837) 5.871 15.025 ( 2.978 -2.311 -0.962) 3.891 15.086 ( -2.960 -0.754 -3.546) 4.680 15.224 ( 2.162 0.911 5.705) 6.169 15.289 ( 0.590 -1.028 4.653) 4.801 15.452 ( 2.052 5.298 1.078) 5.783 15.475 ( 2.172 3.728 10.002) 10.892 15.560 ( -0.755 -1.885 8.800) 9.031 15.626 ( 1.678 -4.578 -2.037) 5.285 15.731 ( -3.095 1.304 0.202) 3.365 15.766 ( -2.880 -2.294 3.440) 5.039 16.016 ( 0.266 8.243 0.585) 8.268 16.219 ( 6.334 1.816 1.750) 6.817 16.248 ( 5.855 -6.303 -1.240) 8.692 16.280 ( 1.769 -7.882 -1.635) 8.242 16.571 ( -5.605 1.670 -5.008) 7.700 16.590 ( -6.123 0.405 -4.235) 7.456 16.777 ( -1.064 4.030 -0.342) 4.182 16.901 ( -4.131 -4.748 7.091) 9.481 17.016 ( 1.895 4.678 -2.473) 5.620 17.117 ( 5.895 -2.504 -2.710) 6.954 17.224 ( -9.014 4.246 0.681) 9.988 17.337 ( -12.720 -6.439 -1.342) 14.320 17.704 ( 6.442 5.047 -8.936) 12.117 17.762 ( 8.838 -1.245 -8.439) 12.284 17.944 ( -4.314 2.476 -0.001) 4.974 18.028 ( -7.163 -3.780 -2.676) 8.530 18.288 ( -8.326 3.222 1.459) 9.046 18.370 ( -6.847 3.782 -0.306) 7.828 18.484 ( -11.299 -3.690 -3.233) 12.319 18.579 ( -15.383 -4.291 -2.648) 16.188 19.626 ( 0.070 4.286 2.701) 5.067 19.668 ( -3.847 5.242 2.578) 6.995 19.712 ( -2.897 -2.330 2.909) 4.720 19.809 ( -7.419 -5.401 0.253) 9.180 20.460 ( 4.133 8.025 5.835) 10.748 20.641 ( 9.914 -7.607 4.501) 13.282 21.035 ( -13.737 15.018 3.616) 20.672 21.314 ( -11.015 -9.304 -4.035) 14.973 24.366 ( 1.736 7.653 6.239) 10.025 24.493 ( 6.552 -3.283 3.234) 8.010 24.913 ( -6.487 7.437 -5.230) 11.169 25.093 ( -3.844 -8.274 -10.367) 13.810 25.506 ( 2.943 4.528 3.671) 6.530 25.627 ( -1.120 -5.686 9.046) 10.743 26.178 ( -13.613 3.282 -6.196) 15.312 26.244 ( -12.274 -2.406 -3.451) 12.975 27.043 ( 6.339 2.785 1.488) 7.082 27.112 ( 8.668 -1.637 1.696) 8.983 27.286 ( 1.688 1.398 -1.630) 2.731 27.403 ( 0.287 -7.262 -2.120) 7.570 27.701 ( -11.284 4.431 2.663) 12.412 27.799 ( -8.788 -3.354 1.596) 9.541 27.927 ( -7.911 0.438 -0.855) 7.969 27.975 ( -5.587 -2.938 -0.663) 6.347 29.793 ( 3.338 5.691 1.011) 6.675 29.921 ( 3.899 -5.243 -0.663) 6.567 30.087 ( -5.796 4.382 8.271) 11.010 30.210 ( -4.186 -5.818 5.742) 9.184 30.472 ( 9.546 4.482 -9.519) 14.207 30.561 ( 12.368 -2.898 -11.569) 17.181 30.815 ( 3.967 7.436 3.266) 9.039 30.977 ( 7.636 -6.950 3.893) 11.035 31.790 ( 11.540 8.663 0.119) 14.430 31.922 ( 14.604 -1.526 2.295) 14.862 32.098 ( 7.374 6.186 6.855) 11.817 32.157 ( 8.920 0.226 0.417) 8.933 32.213 ( 9.136 -2.553 -5.308) 10.870 32.259 ( 6.249 -4.382 3.149) 8.256 32.432 ( 7.731 0.064 4.489) 8.940 32.475 ( 7.879 -3.860 5.689) 10.457 32.711 ( 7.169 4.452 -3.014) 8.961 32.895 ( 10.382 -10.917 -4.427) 15.702 33.343 ( -1.947 6.964 -9.897) 12.257 33.453 ( -4.962 -1.471 -7.564) 9.166 33.696 ( -9.271 1.401 7.394) 11.941 33.788 ( -8.696 -5.567 6.857) 12.394 34.102 ( -12.780 5.219 0.019) 13.804 34.213 ( -13.641 -4.638 -1.272) 14.464 98.462 ( 2.052 0.431 0.855) 2.265 98.475 ( 1.959 -0.731 0.202) 2.100 98.584 ( 0.436 1.515 -0.636) 1.700 98.609 ( -0.594 -0.390 -0.447) 0.839 98.711 ( 2.808 2.996 1.550) 4.389 98.808 ( 2.971 -1.022 -2.719) 4.155 98.855 ( 2.585 -1.762 -1.334) 3.401 98.952 ( 1.278 -5.932 -1.182) 6.182 100.287 ( 4.093 2.532 3.296) 5.833 100.353 ( 4.653 -3.357 2.175) 6.136 100.570 ( 2.836 1.559 -1.897) 3.751 100.591 ( 4.548 -0.228 -2.038) 4.988 100.645 ( -1.880 3.964 2.642) 5.121 100.749 ( -2.787 -5.206 1.859) 6.191 100.945 ( -4.989 4.676 -2.484) 7.275 101.028 ( -5.108 -2.790 -3.248) 6.665 102.506 ( 2.280 4.229 1.678) 5.089 102.611 ( 2.580 -4.568 1.230) 5.389 102.677 ( 4.394 5.591 -1.965) 7.378 102.725 ( -1.449 4.626 2.195) 5.321 102.856 ( 5.206 -3.001 1.876) 6.295 102.926 ( -3.707 -6.138 8.013) 10.753 103.546 ( -18.099 16.952 -6.887) 25.737 103.846 ( -18.517 -10.203 -7.683) 22.495 ======================= Grid point 81 (35/72) ======================= q-point: ( 0.40 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.733 ( 29.283 23.829 0.735) 37.761 3.786 ( 31.533 8.610 -0.613) 32.693 3.977 ( 32.924 -3.142 0.691) 33.080 4.425 ( 18.664 -26.384 2.735) 32.433 4.752 ( 0.771 12.294 -20.239) 23.693 4.891 ( -18.691 4.105 -13.887) 23.645 5.234 ( -24.965 0.260 -6.610) 25.827 5.344 ( -18.378 -2.888 -10.903) 21.563 5.579 ( -8.206 -4.758 -8.205) 12.542 5.659 ( 11.703 -9.485 -18.013) 23.482 5.965 ( 32.444 1.249 21.950) 39.192 6.003 ( 28.957 -2.034 18.580) 34.465 6.224 ( -14.186 3.958 -3.455) 15.128 6.347 ( -11.402 -7.170 -2.680) 13.733 6.851 ( 1.970 1.598 17.129) 17.316 6.909 ( 5.036 -3.151 14.621) 15.782 7.021 ( 6.348 3.304 11.685) 13.702 7.092 ( 2.953 -2.876 11.225) 11.958 7.284 ( 4.754 2.317 20.896) 21.555 7.315 ( 4.160 -0.057 18.278) 18.746 7.629 ( 9.305 1.401 7.667) 12.138 7.652 ( 10.434 -0.834 5.911) 12.021 7.978 ( 6.758 5.297 2.450) 8.929 8.065 ( 6.355 -1.571 1.654) 6.752 8.254 ( 18.034 5.254 -1.194) 18.821 8.324 ( 12.727 2.205 -1.206) 12.973 8.485 ( 0.189 3.259 -3.805) 5.014 8.647 ( -4.371 -7.904 -5.185) 10.414 8.948 ( -5.401 0.383 -3.030) 6.204 8.956 ( -2.836 -0.277 -2.149) 3.569 9.048 ( 2.143 2.396 -2.416) 4.021 9.094 ( -1.019 -1.145 -6.177) 6.364 9.297 ( -6.455 3.765 -13.513) 15.441 9.381 ( -6.770 -3.423 -14.682) 16.526 9.622 ( -33.653 3.183 10.319) 35.343 9.689 ( -33.229 -2.543 8.921) 34.500 10.377 ( -1.168 -0.849 -5.829) 6.005 10.382 ( 3.137 -1.278 -3.859) 5.135 10.598 ( -10.875 5.035 -8.176) 14.508 10.734 ( -10.796 -6.820 -9.183) 15.729 10.847 ( -4.918 6.665 -14.318) 16.541 10.965 ( -6.069 -1.341 -10.951) 12.592 11.085 ( -14.843 1.910 -29.177) 32.791 11.189 ( -14.759 -5.107 -21.554) 26.617 11.607 ( 5.122 5.727 14.136) 16.090 11.685 ( -0.182 4.457 0.853) 4.541 11.734 ( 2.420 -4.291 10.253) 11.375 11.784 ( -0.301 -4.127 -0.234) 4.144 11.872 ( 4.363 0.285 4.837) 6.521 11.886 ( 8.055 -2.084 13.157) 15.567 12.170 ( -5.155 0.714 12.417) 13.464 12.220 ( -3.583 -3.821 13.525) 14.504 12.908 ( 14.278 4.520 6.110) 16.175 12.981 ( 9.398 -1.872 -1.136) 9.650 13.110 ( 6.778 -2.983 -7.031) 10.212 13.129 ( 5.569 -3.342 -2.396) 6.923 13.448 ( 6.198 0.255 -6.300) 8.841 13.525 ( 2.593 -5.062 -4.882) 7.495 13.570 ( 2.387 0.751 1.807) 3.087 13.625 ( 2.539 -3.763 1.805) 4.885 13.830 ( 11.758 4.855 -6.068) 14.094 13.933 ( 12.376 -3.949 -8.396) 15.468 14.192 ( -7.707 4.912 -0.610) 9.159 14.282 ( -4.323 -3.041 7.523) 9.194 14.932 ( 0.180 5.210 4.627) 6.970 14.988 ( 0.144 1.481 -1.366) 2.020 15.027 ( -2.783 1.333 -2.504) 3.974 15.051 ( -1.125 -1.188 0.572) 1.734 15.285 ( 3.749 2.628 7.871) 9.106 15.341 ( 4.035 -0.332 7.629) 8.637 15.439 ( -3.572 4.011 11.118) 12.348 15.485 ( -1.391 3.226 6.869) 7.715 15.545 ( 2.489 3.417 3.922) 5.767 15.687 ( -2.032 3.806 -2.708) 5.094 15.723 ( 6.546 -8.271 -1.592) 10.667 15.788 ( 4.034 -5.387 -2.022) 7.027 16.064 ( 4.419 10.039 1.942) 11.139 16.241 ( -3.578 4.696 1.290) 6.043 16.307 ( -0.574 -2.300 1.034) 2.586 16.362 ( 4.374 -9.695 -2.632) 10.956 16.509 ( 2.278 1.494 -0.641) 2.799 16.561 ( 3.291 -1.444 -2.235) 4.232 16.724 ( -3.229 -0.409 -1.725) 3.684 16.783 ( -7.242 -3.846 3.568) 8.943 16.959 ( -6.394 5.590 -2.329) 8.807 17.032 ( -9.927 2.977 -0.338) 10.369 17.055 ( -8.208 1.025 -0.315) 8.278 17.212 ( -3.859 -8.974 -1.126) 9.834 17.751 ( -1.162 4.834 -7.388) 8.905 17.826 ( -5.880 0.092 -10.472) 12.010 17.897 ( -2.531 3.013 -4.180) 5.741 17.931 ( -1.573 -0.887 -6.760) 6.997 18.090 ( 0.080 4.755 -0.900) 4.840 18.286 ( -4.360 -10.136 -2.894) 11.407 18.300 ( -3.047 4.027 2.350) 5.570 18.423 ( -4.467 -6.318 1.758) 7.935 19.610 ( -0.740 4.342 2.855) 5.249 19.629 ( -0.926 2.051 3.398) 4.076 19.679 ( -0.722 -2.233 1.430) 2.748 19.712 ( -2.825 -4.128 0.677) 5.047 20.549 ( 4.895 13.318 5.704) 15.292 20.809 ( -6.568 11.940 5.242) 14.601 20.835 ( 6.338 -7.793 3.726) 10.714 21.135 ( -7.558 -12.808 -1.127) 14.914 24.449 ( 6.192 10.295 3.257) 12.447 24.650 ( 8.623 -6.920 0.814) 11.086 24.768 ( -7.812 9.919 -1.383) 12.702 24.983 ( -6.789 -8.438 -6.868) 12.824 25.569 ( 2.895 3.563 3.026) 5.498 25.662 ( 5.256 -3.662 1.209) 6.519 25.893 ( -13.704 4.227 -3.417) 14.742 26.008 ( -11.079 -5.923 -2.524) 12.813 27.167 ( 6.197 6.863 1.272) 9.334 27.304 ( 10.460 -0.312 -0.089) 10.465 27.370 ( 5.346 -2.785 -0.558) 6.054 27.465 ( 3.525 -3.767 -0.989) 5.253 27.492 ( -6.515 3.196 2.113) 7.558 27.624 ( -8.270 -5.781 1.692) 10.231 27.749 ( -9.924 2.737 -1.918) 10.472 27.836 ( -8.375 -4.305 -1.536) 9.541 29.845 ( 2.433 6.644 2.870) 7.635 29.959 ( -1.434 3.664 6.076) 7.239 30.019 ( 0.477 -4.590 4.290) 6.301 30.133 ( -3.438 -7.564 7.013) 10.873 30.655 ( 8.401 7.766 -9.481) 14.859 30.805 ( 9.960 -3.245 -11.125) 15.281 30.860 ( 1.246 6.851 -3.281) 7.698 31.067 ( 0.679 -9.504 -3.388) 10.112 32.013 ( 10.147 10.426 4.656) 15.275 32.167 ( 8.471 0.646 3.400) 9.151 32.218 ( 3.913 4.964 6.261) 8.897 32.303 ( 5.834 2.462 3.100) 7.050 32.329 ( 4.221 -2.661 2.899) 5.771 32.396 ( 7.693 -5.319 -0.278) 9.357 32.542 ( 2.224 -3.393 2.484) 4.757 32.570 ( 1.137 -6.421 5.184) 8.331 32.939 ( 13.582 7.842 -4.772) 16.393 33.108 ( 9.305 -5.473 -6.100) 12.400 33.313 ( -0.510 3.455 -8.387) 9.085 33.331 ( -5.538 3.521 -2.750) 7.115 33.564 ( -2.989 -2.439 2.154) 4.418 33.629 ( -6.241 -6.584 4.526) 10.138 33.829 ( -14.102 3.967 0.578) 14.660 33.917 ( -15.424 -3.815 -1.061) 15.924 98.504 ( 2.124 0.230 1.146) 2.424 98.511 ( 1.707 -0.425 0.657) 1.878 98.573 ( -1.069 0.273 1.011) 1.497 98.588 ( -1.458 -0.863 0.887) 1.912 98.770 ( 2.643 5.473 -0.631) 6.111 98.825 ( -0.204 5.465 -1.487) 5.667 98.921 ( 2.871 -7.363 -3.339) 8.579 98.968 ( 0.276 -6.824 -2.099) 7.145 100.376 ( 4.710 3.072 3.022) 6.384 100.454 ( 5.334 -3.897 2.021) 6.908 100.556 ( -3.575 3.978 1.833) 5.654 100.648 ( -1.069 -2.628 -0.684) 2.918 100.676 ( 2.559 0.461 -0.164) 2.605 100.710 ( 2.931 -1.572 -0.159) 3.330 100.846 ( -4.829 4.228 -1.876) 6.687 100.920 ( -5.554 -2.366 -2.314) 6.465 102.558 ( 2.834 4.708 1.708) 5.754 102.668 ( 2.936 -4.229 1.832) 5.464 102.675 ( -2.711 5.403 2.859) 6.687 102.760 ( 1.987 1.937 -1.339) 3.081 102.880 ( 1.105 0.336 4.815) 4.951 103.005 ( 9.224 -6.970 -1.334) 11.638 103.231 ( -13.512 13.820 -3.825) 19.702 103.502 ( -15.713 -10.175 -5.021) 19.381 ======================= Grid point 82 (36/72) ======================= q-point: (-0.50 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.317 ( -26.198 15.046 -3.199) 30.380 4.317 ( 26.198 15.046 -3.199) 30.380 4.386 ( -25.447 4.434 -13.674) 29.226 4.386 ( 25.447 4.434 -13.674) 29.226 4.657 ( -26.780 0.286 -7.518) 27.817 4.657 ( 26.780 0.286 -7.518) 27.817 4.926 ( -21.177 -17.489 1.929) 27.533 4.926 ( 21.177 -17.489 1.929) 27.533 5.737 ( -19.800 8.000 -14.522) 25.825 5.737 ( 19.800 8.000 -14.522) 25.825 5.967 ( -17.080 -11.909 -13.690) 24.919 5.967 ( 17.080 -11.909 -13.690) 24.919 6.583 ( -19.660 1.475 29.981) 35.883 6.583 ( 19.660 1.475 29.981) 35.883 6.635 ( -21.063 -2.876 27.287) 34.590 6.635 ( 21.063 -2.876 27.287) 34.590 7.206 ( -8.618 3.047 14.817) 17.409 7.206 ( 8.618 3.047 14.817) 17.409 7.250 ( -7.491 -0.743 13.899) 15.806 7.250 ( 7.491 -0.743 13.899) 15.806 8.013 ( -10.486 3.615 -2.770) 11.432 8.013 ( 10.486 3.615 -2.770) 11.432 8.044 ( -13.202 0.641 -2.536) 13.458 8.044 ( 13.202 0.641 -2.536) 13.458 8.573 ( -16.194 3.635 -3.129) 16.889 8.573 ( 16.194 3.635 -3.129) 16.889 8.656 ( -8.440 -2.488 -4.517) 9.891 8.656 ( 8.440 -2.488 -4.517) 9.891 8.843 ( -9.911 0.656 2.439) 10.227 8.843 ( 9.911 0.656 2.439) 10.228 8.891 ( -16.078 -2.550 -0.292) 16.282 8.891 ( 16.078 -2.550 -0.292) 16.282 9.227 ( -9.201 1.057 1.119) 9.329 9.227 ( 9.201 1.057 1.119) 9.329 9.245 ( -5.649 -0.378 -0.117) 5.663 9.245 ( 5.649 -0.378 -0.117) 5.663 10.440 ( -7.172 2.620 -14.618) 16.492 10.440 ( 7.172 2.620 -14.618) 16.492 10.513 ( -10.498 -3.387 -15.912) 19.362 10.513 ( 10.498 -3.387 -15.912) 19.362 10.851 ( -5.574 5.400 -16.796) 18.503 10.851 ( 5.574 5.400 -16.796) 18.503 10.984 ( -5.387 -5.351 -16.522) 18.183 10.984 ( 5.387 -5.351 -16.522) 18.183 11.675 ( -1.295 4.863 3.744) 6.272 11.675 ( 1.295 4.863 3.744) 6.272 11.768 ( -1.234 -3.148 2.327) 4.104 11.768 ( 1.234 -3.148 2.327) 4.104 12.018 ( -9.022 1.548 16.083) 18.506 12.018 ( 9.022 1.548 16.083) 18.506 12.083 ( -9.409 -4.546 20.251) 22.788 12.083 ( 9.409 -4.546 20.251) 22.788 13.100 ( -3.610 0.952 -7.630) 8.494 13.100 ( 3.610 0.952 -7.630) 8.494 13.150 ( -2.856 -2.768 -5.465) 6.759 13.150 ( 2.856 -2.768 -5.465) 6.759 13.563 ( -3.718 -0.887 1.524) 4.115 13.563 ( 3.718 -0.887 1.524) 4.115 13.597 ( -4.739 -4.178 3.603) 7.273 13.597 ( 4.739 -4.178 3.603) 7.273 14.037 ( -8.148 5.351 -5.652) 11.268 14.037 ( 8.148 5.351 -5.652) 11.268 14.153 ( -8.503 -4.762 -0.980) 9.795 14.153 ( 8.503 -4.762 -0.980) 9.795 14.958 ( -2.728 4.197 2.769) 5.721 14.958 ( 2.728 4.197 2.769) 5.721 15.008 ( -1.949 -0.063 -0.641) 2.053 15.008 ( 1.949 -0.063 -0.641) 2.053 15.358 ( -3.295 4.944 9.528) 11.228 15.358 ( 3.295 4.944 9.528) 11.228 15.432 ( -3.259 -1.225 9.273) 9.905 15.432 ( 3.259 -1.225 9.273) 9.905 15.625 ( -3.919 7.331 -2.307) 8.627 15.625 ( 3.919 7.331 -2.307) 8.627 15.830 ( -1.966 -9.711 -3.200) 10.412 15.830 ( 1.966 -9.711 -3.200) 10.412 16.156 ( -4.178 8.650 3.184) 10.120 16.156 ( 4.178 8.650 3.184) 10.120 16.344 ( -4.906 -6.098 0.301) 7.833 16.344 ( 4.906 -6.098 0.301) 7.833 16.592 ( -4.031 2.506 1.011) 4.853 16.592 ( 4.031 2.506 1.011) 4.853 16.688 ( -2.195 -5.456 -0.824) 5.939 16.688 ( 2.195 -5.456 -0.824) 5.939 16.927 ( -2.133 4.614 -2.459) 5.646 16.927 ( 2.133 4.614 -2.459) 5.646 17.004 ( -9.694 -2.964 -3.267) 10.651 17.004 ( 9.694 -2.964 -3.267) 10.651 17.794 ( -3.501 3.626 -3.069) 5.901 17.794 ( 3.501 3.626 -3.069) 5.901 17.828 ( -0.848 -0.047 -5.780) 5.842 17.828 ( 0.848 -0.047 -5.780) 5.842 18.206 ( -6.449 2.501 -1.253) 7.030 18.206 ( 6.449 2.501 -1.253) 7.030 18.326 ( -5.053 -7.682 -2.369) 9.495 18.326 ( 5.053 -7.682 -2.369) 9.495 19.611 ( -0.682 2.727 3.132) 4.209 19.611 ( 0.682 2.727 3.132) 4.209 19.679 ( -0.721 -3.031 0.898) 3.243 19.679 ( 0.721 -3.031 0.898) 3.243 20.661 ( -6.373 15.764 6.080) 18.058 20.661 ( 6.373 15.764 6.080) 18.058 20.991 ( -7.311 -13.512 1.076) 15.400 20.991 ( 7.311 -13.512 1.076) 15.400 24.598 ( -8.315 11.217 0.969) 13.997 24.598 ( 8.316 11.217 0.969) 13.997 24.829 ( -8.468 -8.886 -2.439) 12.514 24.829 ( 8.468 -8.886 -2.439) 12.514 25.669 ( -8.041 5.669 0.184) 9.840 25.669 ( 8.041 5.669 0.184) 9.840 25.808 ( -8.846 -6.410 -1.704) 11.056 25.808 ( 8.846 -6.410 -1.704) 11.056 27.306 ( -7.891 6.969 1.718) 10.667 27.306 ( 7.891 6.969 1.718) 10.667 27.475 ( -6.545 -7.727 1.274) 10.206 27.475 ( 6.545 -7.727 1.274) 10.206 27.536 ( -10.954 4.353 -2.052) 11.964 27.536 ( 10.954 4.353 -2.052) 11.964 27.650 ( -9.749 -5.392 -1.681) 11.267 27.650 ( 9.749 -5.392 -1.681) 11.267 29.901 ( -3.143 6.958 5.880) 9.637 29.901 ( 3.143 6.958 5.880) 9.637 30.068 ( -3.124 -7.986 5.204) 10.031 30.068 ( 3.124 -7.986 5.204) 10.031 30.793 ( -5.084 9.747 -6.855) 12.955 30.793 ( 5.084 9.747 -6.855) 12.955 31.003 ( -6.707 -8.757 -9.398) 14.491 31.003 ( 6.707 -8.757 -9.398) 14.491 32.168 ( -5.012 9.641 6.640) 12.734 32.168 ( 5.012 9.641 6.640) 12.734 32.315 ( -3.091 -1.813 3.346) 4.903 32.315 ( 3.091 -1.813 3.346) 4.903 32.482 ( -6.360 -1.128 3.063) 7.149 32.482 ( 6.360 -1.128 3.063) 7.149 32.533 ( -4.451 -6.455 3.847) 8.734 32.533 ( 4.451 -6.455 3.847) 8.734 33.132 ( -4.965 10.173 -5.048) 12.394 33.132 ( 4.965 10.173 -5.048) 12.394 33.334 ( -0.954 -6.850 -7.554) 10.242 33.334 ( 0.954 -6.850 -7.554) 10.242 33.586 ( -7.200 0.809 2.783) 7.761 33.586 ( 7.200 0.809 2.783) 7.761 33.645 ( -9.505 -3.488 0.557) 10.140 33.645 ( 9.505 -3.488 0.557) 10.140 98.537 ( -0.343 0.654 0.704) 1.020 98.537 ( 0.343 0.654 0.704) 1.020 98.558 ( -0.778 -1.248 1.647) 2.208 98.558 ( 0.778 -1.248 1.647) 2.208 98.810 ( -1.358 6.088 -1.275) 6.367 98.810 ( 1.358 6.088 -1.275) 6.367 98.960 ( -1.140 -7.334 -2.987) 8.001 98.960 ( 1.140 -7.334 -2.987) 8.001 100.470 ( -4.645 3.650 2.590) 6.450 100.470 ( 4.645 3.650 2.590) 6.450 100.563 ( -5.283 -4.559 1.716) 7.186 100.563 ( 5.283 -4.559 1.716) 7.186 100.753 ( -4.327 3.233 -1.501) 5.606 100.753 ( 4.327 3.233 -1.501) 5.606 100.810 ( -5.420 -1.668 -1.753) 5.935 100.810 ( 5.420 -1.668 -1.753) 5.935 102.617 ( -2.986 5.147 2.145) 6.325 102.617 ( 2.986 5.147 2.145) 6.325 102.731 ( -3.051 -4.329 2.207) 5.738 102.731 ( 3.051 -4.329 2.207) 5.738 103.002 ( -9.382 10.043 -1.337) 13.808 103.002 ( 9.382 10.043 -1.337) 13.808 103.221 ( -12.375 -8.902 -3.051) 15.546 103.221 ( 12.375 -8.902 -3.051) 15.546 ======================= Grid point 110 (37/72) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 72 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.041 ( 0.000 0.000 32.656) 32.656 1.750 ( 0.000 0.000 42.843) 42.843 2.475 ( 0.000 0.000 -39.240) 39.240 2.730 ( 0.000 0.000 25.199) 25.199 3.123 ( 0.000 0.000 -19.142) 19.142 3.269 ( 0.000 0.000 73.850) 73.850 3.631 ( 0.000 0.000 -8.646) 8.646 3.808 ( 0.000 0.000 55.388) 55.388 4.849 ( 0.000 0.000 -2.232) 2.232 5.012 ( 0.000 0.000 -8.995) 8.995 6.079 ( 0.000 0.000 -60.262) 60.262 6.204 ( 0.000 0.000 -55.096) 55.096 6.417 ( 0.000 0.000 35.798) 35.798 6.561 ( 0.000 0.000 15.528) 15.528 6.923 ( 0.000 0.000 -1.408) 1.408 7.252 ( 0.000 0.000 -2.996) 2.996 7.318 ( 0.000 0.000 -1.594) 1.594 7.471 ( 0.000 0.000 -7.184) 7.184 7.512 ( 0.000 0.000 -1.560) 1.560 7.563 ( 0.000 0.000 4.417) 4.417 7.717 ( 0.000 0.000 -5.819) 5.819 7.916 ( 0.000 0.000 -7.180) 7.180 7.980 ( 0.000 0.000 7.285) 7.285 8.112 ( 0.000 0.000 -8.609) 8.609 8.160 ( 0.000 0.000 -6.836) 6.836 8.199 ( 0.000 0.000 -17.870) 17.870 8.212 ( 0.000 0.000 -8.658) 8.658 8.330 ( 0.000 0.000 -10.307) 10.307 8.718 ( 0.000 0.000 5.444) 5.444 9.000 ( 0.000 0.000 -6.878) 6.878 9.348 ( 0.000 0.000 12.635) 12.635 9.708 ( 0.000 0.000 8.180) 8.180 9.786 ( 0.000 0.000 20.082) 20.082 10.118 ( 0.000 0.000 30.043) 30.043 10.172 ( 0.000 0.000 26.018) 26.018 10.218 ( 0.000 0.000 31.237) 31.237 10.614 ( 0.000 0.000 12.170) 12.170 10.784 ( 0.000 0.000 2.729) 2.729 10.785 ( 0.000 0.000 5.862) 5.862 10.834 ( 0.000 0.000 5.342) 5.342 11.035 ( 0.000 0.000 3.052) 3.052 11.063 ( 0.000 0.000 11.186) 11.186 11.222 ( 0.000 0.000 -20.197) 20.197 11.442 ( 0.000 0.000 -19.335) 19.335 11.551 ( 0.000 0.000 -22.866) 22.866 11.713 ( 0.000 0.000 -22.823) 22.823 11.737 ( 0.000 0.000 -11.253) 11.253 11.973 ( 0.000 0.000 -5.789) 5.789 12.010 ( 0.000 0.000 0.784) 0.784 12.018 ( 0.000 0.000 -3.982) 3.982 12.079 ( 0.000 0.000 -8.651) 8.651 12.120 ( 0.000 0.000 -21.621) 21.621 12.249 ( 0.000 0.000 4.817) 4.817 12.252 ( 0.000 0.000 4.773) 4.773 12.536 ( 0.000 0.000 -8.866) 8.866 12.820 ( 0.000 0.000 -16.388) 16.388 13.265 ( 0.000 0.000 3.636) 3.636 13.271 ( 0.000 0.000 4.464) 4.464 13.424 ( 0.000 0.000 -1.339) 1.339 13.456 ( 0.000 0.000 -3.236) 3.236 13.947 ( 0.000 0.000 12.948) 12.948 13.993 ( 0.000 0.000 9.351) 9.351 14.020 ( 0.000 0.000 6.802) 6.802 14.351 ( 0.000 0.000 -8.610) 8.610 14.655 ( 0.000 0.000 -2.632) 2.632 14.706 ( 0.000 0.000 -0.706) 0.706 14.868 ( 0.000 0.000 -10.761) 10.761 14.890 ( 0.000 0.000 -7.869) 7.869 15.289 ( 0.000 0.000 3.392) 3.392 15.377 ( 0.000 0.000 7.601) 7.601 15.392 ( 0.000 0.000 1.242) 1.242 15.569 ( 0.000 0.000 3.692) 3.692 15.754 ( 0.000 0.000 6.373) 6.373 15.770 ( 0.000 0.000 7.599) 7.599 15.881 ( 0.000 0.000 -5.326) 5.326 15.919 ( 0.000 0.000 5.044) 5.044 16.110 ( 0.000 0.000 -7.047) 7.047 16.289 ( 0.000 0.000 13.868) 13.868 16.303 ( 0.000 0.000 -7.993) 7.993 16.379 ( 0.000 0.000 8.214) 8.214 16.579 ( 0.000 0.000 2.161) 2.161 16.604 ( 0.000 0.000 0.988) 0.988 16.677 ( 0.000 0.000 2.690) 2.690 16.746 ( 0.000 0.000 3.260) 3.260 16.864 ( 0.000 0.000 -2.557) 2.557 16.865 ( 0.000 0.000 7.509) 7.509 17.220 ( 0.000 0.000 -3.840) 3.840 17.315 ( 0.000 0.000 7.352) 7.352 17.327 ( 0.000 0.000 -14.221) 14.221 17.544 ( 0.000 0.000 -5.059) 5.059 17.977 ( 0.000 0.000 2.955) 2.955 18.107 ( 0.000 0.000 -4.257) 4.257 18.531 ( 0.000 0.000 12.639) 12.639 18.755 ( 0.000 0.000 2.287) 2.287 19.020 ( 0.000 0.000 4.475) 4.475 19.053 ( 0.000 0.000 1.303) 1.303 19.474 ( 0.000 0.000 3.092) 3.092 19.548 ( 0.000 0.000 -1.790) 1.790 20.061 ( 0.000 0.000 12.767) 12.767 20.184 ( 0.000 0.000 11.883) 11.883 20.685 ( 0.000 0.000 8.024) 8.024 20.807 ( 0.000 0.000 -19.856) 19.856 20.894 ( 0.000 0.000 -14.724) 14.724 21.252 ( 0.000 0.000 -13.925) 13.925 24.102 ( 0.000 0.000 -0.777) 0.777 24.206 ( 0.000 0.000 -8.079) 8.079 25.726 ( 0.000 0.000 2.261) 2.261 25.737 ( 0.000 0.000 -0.337) 0.337 25.857 ( 0.000 0.000 16.518) 16.518 26.195 ( 0.000 0.000 -4.075) 4.075 26.376 ( 0.000 0.000 3.664) 3.664 26.394 ( 0.000 0.000 0.672) 0.672 26.837 ( 0.000 0.000 4.260) 4.260 27.114 ( 0.000 0.000 3.641) 3.641 27.316 ( 0.000 0.000 -15.825) 15.825 27.383 ( 0.000 0.000 -9.255) 9.255 28.061 ( 0.000 0.000 3.884) 3.884 28.124 ( 0.000 0.000 5.215) 5.215 28.217 ( 0.000 0.000 -1.908) 1.908 28.365 ( 0.000 0.000 -5.901) 5.901 29.463 ( 0.000 0.000 2.980) 2.980 29.542 ( 0.000 0.000 -2.272) 2.272 29.653 ( 0.000 0.000 7.455) 7.455 30.003 ( 0.000 0.000 -11.159) 11.159 30.578 ( 0.000 0.000 7.422) 7.422 30.710 ( 0.000 0.000 -2.712) 2.712 30.788 ( 0.000 0.000 9.574) 9.574 30.854 ( 0.000 0.000 5.929) 5.929 31.256 ( 0.000 0.000 -3.416) 3.416 31.337 ( 0.000 0.000 -8.586) 8.586 31.490 ( 0.000 0.000 -5.513) 5.513 31.575 ( 0.000 0.000 -4.455) 4.455 31.956 ( 0.000 0.000 7.269) 7.269 32.038 ( 0.000 0.000 21.177) 21.177 32.357 ( 0.000 0.000 -12.729) 12.729 32.500 ( 0.000 0.000 8.593) 8.593 32.637 ( 0.000 0.000 -1.191) 1.191 32.819 ( 0.000 0.000 -16.218) 16.218 33.304 ( 0.000 0.000 5.679) 5.679 33.550 ( 0.000 0.000 -7.311) 7.311 34.078 ( 0.000 0.000 5.806) 5.806 34.299 ( 0.000 0.000 -5.071) 5.071 34.426 ( 0.000 0.000 10.828) 10.828 34.724 ( 0.000 0.000 -4.030) 4.030 98.336 ( 0.000 0.000 0.763) 0.763 98.359 ( 0.000 0.000 0.507) 0.507 98.388 ( 0.000 0.000 -0.939) 0.939 98.397 ( 0.000 0.000 -2.379) 2.379 98.651 ( 0.000 0.000 2.993) 2.993 98.742 ( 0.000 0.000 -1.597) 1.597 98.860 ( 0.000 0.000 3.871) 3.871 99.019 ( 0.000 0.000 -3.686) 3.686 100.292 ( 0.000 0.000 2.390) 2.390 100.349 ( 0.000 0.000 1.126) 1.126 100.389 ( 0.000 0.000 -2.160) 2.160 100.402 ( 0.000 0.000 -1.326) 1.326 100.685 ( 0.000 0.000 3.194) 3.194 100.810 ( 0.000 0.000 -2.710) 2.710 100.953 ( 0.000 0.000 0.493) 0.493 100.997 ( 0.000 0.000 -1.561) 1.561 102.502 ( 0.000 0.000 0.835) 0.835 102.546 ( 0.000 0.000 -1.267) 1.267 102.622 ( 0.000 0.000 0.467) 0.467 102.644 ( 0.000 0.000 -0.897) 0.897 102.946 ( 0.000 0.000 2.244) 2.244 103.032 ( 0.000 0.000 -1.858) 1.858 103.564 ( 0.000 0.000 18.992) 18.992 104.370 ( 0.000 0.000 -19.419) 19.419 ======================= Grid point 111 (38/72) ======================= q-point: ( 0.10 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.209 ( 16.451 0.000 29.510) 33.786 2.202 ( 35.782 0.000 37.232) 51.638 2.570 ( 9.640 0.000 -37.691) 38.905 3.015 ( 23.368 0.000 27.269) 35.912 3.478 ( 32.556 0.000 -15.505) 36.060 3.497 ( 24.141 0.000 68.045) 72.201 3.964 ( 31.081 0.000 -13.966) 34.075 4.004 ( 21.169 0.000 43.197) 48.105 4.848 ( 0.165 0.000 -1.370) 1.380 5.040 ( 2.676 0.000 -9.429) 9.801 6.014 ( -5.263 0.000 -51.452) 51.720 6.101 ( -9.381 0.000 -43.744) 44.738 6.419 ( 0.048 0.000 31.106) 31.107 6.568 ( -0.012 0.000 14.458) 14.458 6.919 ( -0.082 0.000 -1.362) 1.365 7.087 ( -17.197 0.000 -1.182) 17.238 7.324 ( -1.017 0.000 -4.004) 4.131 7.366 ( -1.346 0.000 -0.588) 1.469 7.441 ( -7.258 0.000 -5.566) 9.146 7.604 ( -4.941 0.000 -10.038) 11.188 7.740 ( 5.262 0.000 -3.194) 6.156 7.911 ( -0.459 0.000 -7.090) 7.104 8.015 ( -5.946 0.000 -6.630) 8.906 8.050 ( -2.257 0.000 -0.603) 2.336 8.094 ( 4.012 0.000 -4.328) 5.902 8.209 ( 2.678 0.000 -7.258) 7.736 8.304 ( -0.936 0.000 -4.497) 4.593 8.337 ( 5.888 0.000 -13.660) 14.875 8.767 ( 4.034 0.000 3.793) 5.537 8.983 ( -1.351 0.000 -5.127) 5.302 9.350 ( -0.751 0.000 11.400) 11.425 9.501 ( -19.127 0.000 34.879) 39.779 9.667 ( -5.315 0.000 -4.151) 6.744 9.693 ( -26.255 0.000 33.932) 42.904 10.330 ( 12.385 0.000 24.142) 27.133 10.451 ( 5.001 0.000 17.151) 17.865 10.569 ( -2.651 0.000 9.436) 9.801 10.706 ( -5.142 0.000 -10.885) 12.038 10.748 ( -2.335 0.000 1.186) 2.619 11.056 ( -0.320 0.000 8.568) 8.574 11.078 ( 14.392 0.000 10.622) 17.887 11.208 ( 2.817 0.000 -11.378) 11.722 11.225 ( 13.429 0.000 7.308) 15.289 11.399 ( -4.748 0.000 -17.743) 18.367 11.494 ( -1.265 0.000 -16.462) 16.511 11.722 ( -1.000 0.000 -14.501) 14.535 11.815 ( 3.194 0.000 -8.514) 9.094 11.896 ( -8.584 0.000 -14.278) 16.660 11.921 ( 3.691 0.000 -14.051) 14.528 12.084 ( 3.421 0.000 -13.041) 13.482 12.142 ( 2.283 0.000 6.593) 6.978 12.258 ( 7.360 0.000 -4.646) 8.704 12.294 ( 6.189 0.000 2.925) 6.846 12.328 ( 9.426 0.000 4.857) 10.604 12.577 ( -1.135 0.000 -0.044) 1.136 12.889 ( 5.771 0.000 -17.137) 18.083 13.073 ( -1.289 0.000 -9.678) 9.763 13.086 ( -21.810 0.000 -4.119) 22.196 13.401 ( -9.552 0.000 6.133) 11.352 13.459 ( 4.181 0.000 3.415) 5.399 13.762 ( -17.798 0.000 4.349) 18.321 13.888 ( -4.381 0.000 4.362) 6.182 14.121 ( 7.208 0.000 6.616) 9.784 14.402 ( -1.826 0.000 -2.373) 2.995 14.622 ( 3.426 0.000 -0.009) 3.426 14.701 ( 4.323 0.000 -2.854) 5.180 14.906 ( 1.949 0.000 -2.507) 3.175 15.047 ( 7.332 0.000 -8.707) 11.383 15.275 ( -0.700 0.000 3.709) 3.774 15.315 ( -3.393 0.000 3.485) 4.864 15.423 ( 1.564 0.000 4.258) 4.536 15.589 ( 1.615 0.000 4.363) 4.652 15.755 ( 1.060 0.000 6.107) 6.198 15.817 ( 2.902 0.000 7.411) 7.959 15.842 ( -3.316 0.000 -3.820) 5.059 15.913 ( -0.709 0.000 2.555) 2.651 16.112 ( -0.013 0.000 -2.403) 2.403 16.233 ( -4.949 0.000 9.776) 10.957 16.313 ( 0.462 0.000 -9.902) 9.912 16.364 ( -0.973 0.000 -0.158) 0.985 16.497 ( -5.136 0.000 -0.004) 5.136 16.623 ( 0.141 0.000 -0.992) 1.002 16.751 ( -2.618 0.000 8.900) 9.277 16.793 ( 9.190 0.000 3.860) 9.967 16.857 ( 7.713 0.000 3.480) 8.462 17.070 ( 11.069 0.000 -1.772) 11.210 17.214 ( -0.596 0.000 -3.440) 3.492 17.272 ( -2.991 0.000 -7.962) 8.505 17.362 ( 4.975 0.000 4.759) 6.884 17.609 ( 4.474 0.000 -8.262) 9.395 17.952 ( -2.702 0.000 3.199) 4.187 18.094 ( -1.669 0.000 -4.454) 4.756 18.433 ( -9.479 0.000 13.123) 16.188 18.750 ( -1.092 0.000 -0.235) 1.116 18.937 ( -7.826 0.000 4.780) 9.170 18.991 ( -6.174 0.000 0.669) 6.210 19.470 ( 0.175 0.000 3.380) 3.385 19.552 ( 0.454 0.000 -1.461) 1.529 20.001 ( -3.558 0.000 7.233) 8.061 20.343 ( 12.415 0.000 13.444) 18.299 20.406 ( -18.388 0.000 -5.571) 19.213 20.716 ( -6.560 0.000 5.544) 8.589 21.064 ( 6.341 0.000 -15.082) 16.361 21.246 ( -0.485 0.000 -14.041) 14.049 24.151 ( 4.834 0.000 -0.359) 4.848 24.290 ( 7.703 0.000 -9.963) 12.594 25.322 ( -31.705 0.000 17.792) 36.356 25.618 ( -11.107 0.000 -4.130) 11.850 25.689 ( -12.986 0.000 12.331) 17.908 26.119 ( -8.058 0.000 -6.469) 10.334 26.357 ( -1.076 0.000 4.779) 4.899 26.408 ( 1.239 0.000 2.852) 3.110 26.941 ( 5.781 0.000 0.298) 5.789 27.160 ( 4.797 0.000 4.069) 6.290 27.228 ( -6.425 0.000 -11.215) 12.925 27.443 ( 3.603 0.000 -9.820) 10.460 28.022 ( -3.638 0.000 2.574) 4.457 28.118 ( -8.885 0.000 -0.831) 8.924 28.134 ( 0.573 0.000 4.448) 4.484 28.324 ( -4.053 0.000 -4.326) 5.928 29.541 ( 6.396 0.000 3.017) 7.072 29.636 ( 8.777 0.000 -3.286) 9.373 29.760 ( 8.787 0.000 3.933) 9.627 30.046 ( 3.790 0.000 -10.105) 10.792 30.511 ( -10.628 0.000 5.905) 12.158 30.615 ( 2.248 0.000 3.822) 4.434 30.836 ( 0.473 0.000 6.348) 6.366 30.983 ( 2.507 0.000 7.398) 7.811 31.121 ( -4.704 0.000 -6.709) 8.194 31.259 ( 1.871 0.000 -5.235) 5.559 31.647 ( 12.918 0.000 -3.547) 13.396 31.710 ( 10.737 0.000 -2.305) 10.981 32.065 ( 7.275 0.000 4.145) 8.373 32.067 ( 2.487 0.000 20.241) 20.394 32.296 ( -3.270 0.000 -7.451) 8.137 32.593 ( 6.612 0.000 4.055) 7.757 32.660 ( 2.131 0.000 -2.729) 3.462 32.818 ( -0.139 0.000 -13.526) 13.527 33.289 ( -0.817 0.000 4.987) 5.053 33.530 ( -1.860 0.000 -7.031) 7.273 34.039 ( -3.928 0.000 5.775) 6.985 34.247 ( -4.726 0.000 -4.253) 6.358 34.373 ( -5.236 0.000 10.339) 11.589 34.666 ( -5.760 0.000 -4.244) 7.155 98.375 ( 2.043 0.000 0.268) 2.061 98.397 ( 1.167 0.000 -0.195) 1.183 98.424 ( 2.233 0.000 -1.844) 2.896 98.472 ( 9.831 0.000 -5.393) 11.213 98.647 ( -0.281 0.000 2.820) 2.834 98.740 ( 0.298 0.000 -1.929) 1.951 98.863 ( 0.186 0.000 4.229) 4.233 99.037 ( 1.527 0.000 -4.289) 4.553 100.312 ( 1.773 0.000 2.318) 2.919 100.347 ( 0.197 0.000 2.858) 2.865 100.398 ( 1.295 0.000 -1.817) 2.231 100.427 ( 2.006 0.000 -1.595) 2.563 100.675 ( -0.966 0.000 3.170) 3.314 100.796 ( -1.307 0.000 -2.536) 2.853 100.989 ( 2.687 0.000 -2.147) 3.439 100.994 ( -0.343 0.000 -1.317) 1.361 102.485 ( -1.233 0.000 1.029) 1.606 102.533 ( -1.241 0.000 -1.311) 1.805 102.652 ( 0.549 0.000 0.377) 0.666 102.666 ( 3.886 0.000 -0.318) 3.899 102.866 ( -5.837 0.000 5.310) 7.891 102.995 ( -3.434 0.000 -2.101) 4.026 103.548 ( -2.198 0.000 17.205) 17.345 104.302 ( -6.687 0.000 -18.335) 19.516 ======================= Grid point 112 (39/72) ======================= q-point: ( 0.20 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.676 ( 29.543 0.000 23.583) 37.802 2.823 ( 22.801 0.000 3.052) 23.005 2.892 ( 23.531 0.000 -0.194) 23.532 3.447 ( 18.234 0.000 31.031) 35.992 4.249 ( 37.844 0.000 -22.895) 44.230 4.282 ( 52.454 0.000 45.255) 69.278 4.671 ( 27.598 0.000 -23.404) 36.186 4.675 ( 43.744 0.000 26.006) 50.890 4.905 ( 11.312 0.000 -1.208) 11.376 5.115 ( 4.848 0.000 -9.592) 10.747 5.918 ( -4.311 0.000 -20.675) 21.120 5.962 ( 3.825 0.000 -30.319) 30.559 6.398 ( -3.443 0.000 22.635) 22.895 6.449 ( -17.971 0.000 11.922) 21.566 6.778 ( -5.998 0.000 1.726) 6.242 6.904 ( -3.171 0.000 3.153) 4.472 7.120 ( -16.815 0.000 -14.541) 22.230 7.293 ( -8.433 0.000 -3.047) 8.967 7.364 ( 0.686 0.000 -2.258) 2.360 7.562 ( 3.830 0.000 -9.783) 10.506 7.802 ( 0.390 0.000 -6.920) 6.931 7.876 ( -3.229 0.000 1.397) 3.518 7.978 ( 2.967 0.000 -7.450) 8.019 7.996 ( -0.950 0.000 3.566) 3.690 8.182 ( -4.245 0.000 -0.940) 4.348 8.225 ( 5.830 0.000 -13.034) 14.279 8.406 ( 9.811 0.000 -7.208) 12.175 8.467 ( 7.556 0.000 -4.143) 8.617 8.845 ( 3.223 0.000 2.368) 3.999 8.943 ( -3.265 0.000 -1.262) 3.500 9.119 ( -17.900 0.000 34.250) 38.645 9.179 ( -20.389 0.000 35.445) 40.891 9.315 ( -6.383 0.000 5.036) 8.130 9.512 ( -9.956 0.000 -3.721) 10.629 10.470 ( 0.238 0.000 1.141) 1.166 10.482 ( -0.808 0.000 9.635) 9.669 10.529 ( -1.550 0.000 7.650) 7.805 10.562 ( -9.214 0.000 -25.912) 27.502 10.672 ( -7.306 0.000 -0.889) 7.359 11.057 ( 2.406 0.000 7.898) 8.257 11.090 ( -8.382 0.000 -2.901) 8.870 11.244 ( -9.644 0.000 -16.802) 19.373 11.416 ( -6.998 0.000 -1.734) 7.210 11.432 ( 6.529 0.000 5.675) 8.650 11.538 ( 5.107 0.000 -3.346) 6.105 11.684 ( 0.301 0.000 -0.077) 0.311 11.701 ( -1.205 0.000 -2.750) 3.002 11.877 ( 2.771 0.000 -2.360) 3.639 12.057 ( -11.072 0.000 -1.915) 11.237 12.099 ( 8.363 0.000 -15.997) 18.051 12.178 ( -0.624 0.000 3.558) 3.612 12.300 ( -6.150 0.000 -4.614) 7.688 12.356 ( 9.976 0.000 7.008) 12.191 12.536 ( 12.955 0.000 5.606) 14.116 12.683 ( 9.195 0.000 0.211) 9.198 12.773 ( -2.392 0.000 -5.053) 5.590 13.068 ( 9.964 0.000 -18.977) 21.434 13.163 ( 5.500 0.000 -16.587) 17.475 13.254 ( 0.081 0.000 5.090) 5.090 13.401 ( 1.804 0.000 -4.135) 4.511 13.628 ( 0.966 0.000 8.265) 8.322 13.758 ( -8.396 0.000 5.572) 10.077 14.222 ( 3.285 0.000 -0.309) 3.300 14.315 ( -5.310 0.000 -1.827) 5.615 14.757 ( 6.489 0.000 2.542) 6.969 14.783 ( 2.698 0.000 -4.371) 5.136 14.998 ( 7.498 0.000 7.776) 10.802 15.096 ( -0.566 0.000 2.111) 2.185 15.280 ( 1.136 0.000 3.059) 3.263 15.283 ( -0.174 0.000 -0.219) 0.280 15.459 ( 2.026 0.000 2.743) 3.410 15.620 ( 1.209 0.000 7.701) 7.795 15.760 ( -4.596 0.000 -2.746) 5.354 15.791 ( 1.967 0.000 7.191) 7.455 15.853 ( 0.488 0.000 8.397) 8.411 15.898 ( -0.512 0.000 -0.349) 0.619 16.110 ( -6.876 0.000 6.216) 9.270 16.125 ( 1.934 0.000 1.956) 2.751 16.316 ( -0.141 0.000 -11.808) 11.809 16.317 ( -4.941 0.000 -5.879) 7.680 16.419 ( -2.208 0.000 -4.521) 5.032 16.566 ( -5.033 0.000 -5.969) 7.808 16.747 ( 1.346 0.000 8.877) 8.979 16.918 ( 1.644 0.000 4.678) 4.959 17.029 ( 9.475 0.000 4.585) 10.526 17.190 ( -2.138 0.000 -1.771) 2.776 17.227 ( -0.039 0.000 1.688) 1.689 17.297 ( 8.656 0.000 -4.682) 9.841 17.525 ( 10.898 0.000 -3.157) 11.346 17.689 ( 3.658 0.000 -8.635) 9.378 17.853 ( -7.836 0.000 2.902) 8.356 18.026 ( -5.185 0.000 -4.778) 7.050 18.187 ( -13.542 0.000 10.277) 17.001 18.639 ( -12.789 0.000 -7.657) 14.906 18.742 ( -10.669 0.000 5.549) 12.025 18.843 ( -6.740 0.000 -0.210) 6.743 19.493 ( 2.026 0.000 3.661) 4.184 19.572 ( 1.811 0.000 0.153) 1.818 19.925 ( -4.225 0.000 2.187) 4.758 20.073 ( -14.004 0.000 -1.405) 14.074 20.564 ( -7.611 0.000 9.629) 12.274 20.617 ( 13.991 0.000 9.733) 17.043 21.090 ( -3.271 0.000 -0.719) 3.349 21.240 ( 0.134 0.000 -13.764) 13.765 24.291 ( 8.973 0.000 0.426) 8.983 24.437 ( 2.736 0.000 -4.657) 5.401 24.802 ( -14.712 0.000 13.739) 20.130 25.340 ( -15.349 0.000 -10.659) 18.687 25.418 ( -11.849 0.000 10.450) 15.798 25.891 ( -13.534 0.000 -9.808) 16.714 26.335 ( -1.914 0.000 6.280) 6.565 26.432 ( 0.614 0.000 3.055) 3.116 27.009 ( 1.805 0.000 -1.250) 2.196 27.089 ( -6.847 0.000 -5.218) 8.608 27.289 ( 7.285 0.000 4.078) 8.349 27.505 ( 2.564 0.000 -6.408) 6.902 27.905 ( -11.690 0.000 1.563) 11.794 27.921 ( -6.316 0.000 0.215) 6.320 28.130 ( -1.491 0.000 2.492) 2.904 28.207 ( -7.465 0.000 -1.300) 7.577 29.657 ( 4.406 0.000 4.023) 5.967 29.859 ( 12.213 0.000 -7.176) 14.165 29.935 ( 7.928 0.000 0.846) 7.973 30.137 ( 5.827 0.000 -8.311) 10.150 30.322 ( -8.156 0.000 10.127) 13.003 30.616 ( -1.578 0.000 -1.843) 2.426 30.791 ( -8.442 0.000 8.415) 11.919 30.950 ( 9.625 0.000 2.469) 9.936 31.346 ( 7.043 0.000 -3.314) 7.784 31.391 ( 19.204 0.000 -4.507) 19.726 31.933 ( 14.257 0.000 -0.573) 14.269 31.970 ( 14.638 0.000 -0.855) 14.663 32.123 ( 3.525 0.000 13.628) 14.076 32.202 ( 6.763 0.000 1.801) 6.999 32.273 ( 1.078 0.000 -0.106) 1.084 32.703 ( 1.590 0.000 -0.898) 1.826 32.719 ( 5.558 0.000 1.820) 5.848 32.817 ( 0.321 0.000 -11.868) 11.872 33.291 ( 1.139 0.000 2.377) 2.636 33.481 ( -3.010 0.000 -5.515) 6.283 33.924 ( -7.477 0.000 5.983) 9.576 34.124 ( -7.474 0.000 -3.210) 8.134 34.226 ( -9.023 0.000 8.555) 12.434 34.498 ( -10.901 0.000 -4.810) 11.915 98.428 ( 3.049 0.000 -0.217) 3.057 98.432 ( 2.137 0.000 0.601) 2.220 98.475 ( 2.565 0.000 -0.211) 2.574 98.609 ( 2.629 0.000 -5.321) 5.935 98.644 ( 0.058 0.000 2.764) 2.765 98.790 ( 5.092 0.000 -6.321) 8.116 98.863 ( -0.301 0.000 5.016) 5.025 99.069 ( 1.404 0.000 -5.413) 5.592 100.339 ( 1.002 0.000 5.067) 5.166 100.388 ( 3.911 0.000 1.664) 4.250 100.444 ( 3.245 0.000 -1.439) 3.550 100.473 ( 2.448 0.000 -1.883) 3.089 100.648 ( -1.760 0.000 3.176) 3.631 100.761 ( -2.097 0.000 -2.167) 3.016 100.978 ( -1.402 0.000 -0.779) 1.604 101.021 ( -0.081 0.000 -3.962) 3.963 102.466 ( -0.451 0.000 0.899) 1.006 102.500 ( -1.734 0.000 -0.285) 1.757 102.648 ( -1.258 0.000 3.505) 3.724 102.757 ( 4.300 0.000 -2.246) 4.851 102.795 ( -0.309 0.000 3.996) 4.008 102.915 ( -3.518 0.000 -1.836) 3.968 103.467 ( -5.686 0.000 14.986) 16.029 104.114 ( -11.630 0.000 -15.641) 19.491 ======================= Grid point 113 (40/72) ======================= q-point: ( 0.30 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.354 ( 37.367 0.000 18.292) 41.604 3.285 ( 23.185 0.000 6.842) 24.173 3.366 ( 24.867 0.000 -10.003) 26.804 3.778 ( 15.954 0.000 19.986) 25.573 4.645 ( -0.470 0.000 -35.823) 35.826 4.809 ( -2.324 0.000 -17.516) 17.669 5.178 ( 3.636 0.000 -17.635) 18.006 5.250 ( 5.920 0.000 -9.577) 11.259 5.432 ( 58.424 0.000 31.694) 66.468 5.639 ( 47.214 0.000 26.914) 54.347 5.960 ( -20.141 0.000 5.570) 20.897 6.152 ( -0.253 0.000 10.173) 10.176 6.252 ( 7.841 0.000 -6.240) 10.022 6.314 ( 26.977 0.000 -7.097) 27.895 6.660 ( -8.949 0.000 2.424) 9.272 6.778 ( 2.327 0.000 -1.726) 2.898 7.013 ( 5.346 0.000 5.707) 7.820 7.139 ( -2.394 0.000 0.953) 2.577 7.441 ( 6.333 0.000 0.891) 6.396 7.704 ( 8.179 0.000 -4.238) 9.212 7.782 ( -1.757 0.000 -1.297) 2.184 7.813 ( -3.221 0.000 7.580) 8.236 7.995 ( 1.148 0.000 3.553) 3.734 8.023 ( -3.999 0.000 -1.465) 4.259 8.123 ( 3.034 0.000 4.670) 5.569 8.259 ( -3.989 0.000 -3.912) 5.587 8.618 ( 8.387 0.000 -11.051) 13.873 8.648 ( 9.918 0.000 7.842) 12.644 8.812 ( -8.641 0.000 28.863) 30.129 8.817 ( -7.259 0.000 11.822) 13.873 8.905 ( 1.329 0.000 -2.752) 3.056 8.905 ( -6.080 0.000 -2.283) 6.494 9.168 ( -8.575 0.000 -0.120) 8.576 9.287 ( -11.892 0.000 -7.039) 13.820 10.309 ( -17.240 0.000 -7.614) 18.847 10.347 ( -11.796 0.000 -33.378) 35.401 10.391 ( -11.968 0.000 3.409) 12.444 10.429 ( -13.934 0.000 -7.716) 15.927 10.532 ( -1.035 0.000 1.671) 1.966 10.747 ( -21.976 0.000 3.915) 22.322 10.959 ( -21.868 0.000 4.069) 22.243 11.052 ( -13.377 0.000 -7.616) 15.393 11.056 ( -9.968 0.000 -11.968) 15.575 11.273 ( -19.391 0.000 -9.457) 21.574 11.628 ( 2.309 0.000 3.747) 4.401 11.726 ( 2.640 0.000 -0.196) 2.647 11.756 ( -11.226 0.000 4.502) 12.095 11.836 ( -2.905 0.000 -3.989) 4.935 11.857 ( 9.334 0.000 8.606) 12.697 12.236 ( 12.431 0.000 9.158) 15.440 12.253 ( 8.888 0.000 4.998) 10.197 12.404 ( 9.554 0.000 5.390) 10.970 12.636 ( 15.042 0.000 12.828) 19.769 12.792 ( 11.656 0.000 -10.613) 15.764 12.808 ( 3.184 0.000 -11.231) 11.674 12.851 ( 8.920 0.000 -8.642) 12.420 13.289 ( 11.316 0.000 -14.312) 18.245 13.319 ( 9.284 0.000 -15.960) 18.464 13.477 ( 16.391 0.000 9.030) 18.714 13.586 ( -4.871 0.000 3.939) 6.265 13.619 ( 10.603 0.000 -1.656) 10.731 13.698 ( 10.897 0.000 3.442) 11.428 14.192 ( -6.952 0.000 -0.374) 6.962 14.280 ( 2.931 0.000 -3.992) 4.952 14.813 ( 0.854 0.000 -0.726) 1.120 14.832 ( 1.302 0.000 4.485) 4.670 15.099 ( 1.000 0.000 8.195) 8.256 15.157 ( 6.823 0.000 9.380) 11.600 15.285 ( 0.451 0.000 0.105) 0.463 15.303 ( 0.703 0.000 1.122) 1.324 15.497 ( 1.499 0.000 2.533) 2.943 15.567 ( -8.191 0.000 14.692) 16.821 15.735 ( 3.519 0.000 -4.850) 5.992 15.784 ( -3.466 0.000 8.635) 9.304 15.862 ( 1.180 0.000 7.493) 7.585 15.906 ( 1.917 0.000 -1.723) 2.578 15.981 ( -5.441 0.000 5.846) 7.986 16.140 ( -10.249 0.000 -0.683) 10.272 16.202 ( 4.290 0.000 0.772) 4.358 16.316 ( 0.204 0.000 -10.195) 10.197 16.436 ( 4.880 0.000 -9.305) 10.507 16.490 ( -1.795 0.000 -7.797) 8.001 16.763 ( -0.502 0.000 4.657) 4.684 16.886 ( -3.913 0.000 3.894) 5.520 17.075 ( -7.598 0.000 -0.740) 7.634 17.137 ( -8.632 0.000 4.036) 9.529 17.244 ( 9.554 0.000 5.092) 10.826 17.431 ( -1.995 0.000 -0.494) 2.055 17.659 ( -6.253 0.000 -1.922) 6.542 17.742 ( 6.895 0.000 -9.523) 11.758 17.776 ( 5.667 0.000 -5.549) 7.931 17.900 ( -5.291 0.000 -5.381) 7.546 17.961 ( -7.953 0.000 2.579) 8.361 18.259 ( -21.806 0.000 -9.285) 23.701 18.543 ( -9.006 0.000 5.176) 10.388 18.710 ( -7.597 0.000 -4.185) 8.673 19.541 ( 2.517 0.000 3.660) 4.442 19.626 ( 3.388 0.000 1.624) 3.757 19.830 ( -5.137 0.000 -0.162) 5.140 19.859 ( -7.503 0.000 0.125) 7.504 20.448 ( -3.310 0.000 14.190) 14.571 20.873 ( 11.141 0.000 1.715) 11.273 20.961 ( -8.946 0.000 11.969) 14.943 21.252 ( 0.743 0.000 -12.113) 12.136 24.343 ( -5.798 0.000 11.972) 13.302 24.494 ( 10.708 0.000 -0.339) 10.713 24.710 ( -3.740 0.000 -1.174) 3.920 25.057 ( -11.855 0.000 -13.620) 18.057 25.327 ( 5.015 0.000 1.265) 5.172 25.631 ( -11.143 0.000 -9.585) 14.698 26.239 ( -8.646 0.000 8.244) 11.947 26.397 ( -5.070 0.000 2.067) 5.475 26.993 ( -1.677 0.000 -0.239) 1.694 27.053 ( 3.572 0.000 -2.882) 4.590 27.437 ( 7.578 0.000 2.540) 7.993 27.552 ( 2.379 0.000 -3.080) 3.892 27.665 ( -12.055 0.000 3.604) 12.582 27.773 ( -8.498 0.000 -1.966) 8.722 28.040 ( -8.889 0.000 0.794) 8.924 28.063 ( -5.235 0.000 0.031) 5.235 29.719 ( 2.396 0.000 5.833) 6.306 30.052 ( 6.864 0.000 -10.520) 12.561 30.075 ( 5.009 0.000 4.884) 6.996 30.193 ( -3.419 0.000 9.309) 9.917 30.339 ( 14.376 0.000 -9.907) 17.459 30.569 ( -3.251 0.000 -5.299) 6.217 30.679 ( -4.027 0.000 10.174) 10.942 31.102 ( 3.309 0.000 -9.159) 9.739 31.577 ( 16.557 0.000 6.534) 17.800 31.795 ( 19.873 0.000 -3.007) 20.099 32.125 ( 5.250 0.000 8.145) 9.690 32.261 ( 6.388 0.000 6.860) 9.373 32.281 ( 16.234 0.000 -1.258) 16.282 32.341 ( 6.774 0.000 -0.872) 6.830 32.348 ( 9.543 0.000 1.566) 9.671 32.716 ( 0.155 0.000 2.175) 2.180 32.801 ( 2.296 0.000 -0.663) 2.390 32.838 ( 1.728 0.000 -13.188) 13.301 33.332 ( 2.924 0.000 0.297) 2.939 33.400 ( -6.020 0.000 -0.100) 6.021 33.752 ( -8.679 0.000 4.707) 9.873 33.950 ( -9.893 0.000 -2.249) 10.145 34.033 ( -9.725 0.000 5.179) 11.018 34.239 ( -14.648 0.000 -5.161) 15.530 98.476 ( 2.065 0.000 0.597) 2.150 98.489 ( 2.978 0.000 -0.812) 3.087 98.517 ( 1.507 0.000 0.962) 1.788 98.620 ( -0.517 0.000 -2.646) 2.697 98.656 ( 1.370 0.000 3.791) 4.031 98.847 ( -1.308 0.000 5.815) 5.960 98.901 ( 5.174 0.000 -8.815) 10.222 99.087 ( 0.314 0.000 -6.323) 6.331 100.367 ( 1.815 0.000 5.842) 6.118 100.480 ( 4.782 0.000 0.810) 4.850 100.514 ( 2.740 0.000 -1.358) 3.058 100.531 ( 4.142 0.000 -2.034) 4.614 100.610 ( -1.640 0.000 3.329) 3.711 100.717 ( -2.208 0.000 -1.767) 2.828 100.935 ( -2.973 0.000 -0.365) 2.995 100.981 ( -3.694 0.000 -2.964) 4.736 102.471 ( 0.951 0.000 0.351) 1.014 102.478 ( -0.270 0.000 0.524) 0.589 102.613 ( -2.010 0.000 2.959) 3.577 102.754 ( -4.216 0.000 -3.446) 5.445 102.835 ( 3.575 0.000 3.464) 4.978 102.948 ( 6.605 0.000 -1.892) 6.871 103.333 ( -7.396 0.000 12.540) 14.558 103.856 ( -13.793 0.000 -12.335) 18.504 ======================= Grid point 114 (41/72) ======================= q-point: ( 0.40 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.133 ( 39.547 0.000 13.180) 41.686 3.698 ( 18.735 0.000 8.819) 20.706 3.898 ( 24.021 0.000 -24.557) 34.352 4.109 ( 17.497 0.000 3.514) 17.846 4.418 ( -19.290 0.000 -19.873) 27.695 4.675 ( -6.321 0.000 -20.470) 21.423 5.025 ( -26.579 0.000 -1.001) 26.598 5.228 ( -1.099 0.000 -5.042) 5.161 5.736 ( -19.362 0.000 -8.743) 21.245 5.797 ( 10.116 0.000 -12.851) 16.355 6.081 ( -16.696 0.000 4.473) 17.285 6.392 ( -8.882 0.000 -5.416) 10.403 6.545 ( 45.801 0.000 29.743) 54.611 6.651 ( 37.130 0.000 27.006) 45.913 7.116 ( 23.605 0.000 12.779) 26.842 7.140 ( 21.527 0.000 7.568) 22.819 7.264 ( 19.988 0.000 10.538) 22.596 7.296 ( 18.648 0.000 7.466) 20.087 7.573 ( 6.762 0.000 7.734) 10.274 7.711 ( -6.000 0.000 3.182) 6.791 7.715 ( -8.025 0.000 14.246) 16.351 7.768 ( -2.653 0.000 12.947) 13.216 7.956 ( 3.804 0.000 -1.767) 4.194 8.107 ( 7.656 0.000 0.559) 7.677 8.177 ( -1.085 0.000 14.134) 14.175 8.190 ( 4.685 0.000 10.101) 11.134 8.617 ( 1.163 0.000 7.178) 7.271 8.631 ( -6.103 0.000 -10.183) 11.872 8.819 ( -5.709 0.000 -2.730) 6.328 8.828 ( 0.245 0.000 -14.455) 14.457 8.928 ( 9.833 0.000 -9.002) 13.331 8.979 ( 5.700 0.000 4.507) 7.267 9.010 ( -3.222 0.000 -0.101) 3.224 9.071 ( -7.887 0.000 -17.161) 18.886 9.761 ( -33.828 0.000 11.643) 35.775 9.900 ( -31.786 0.000 4.921) 32.165 10.113 ( -11.025 0.000 -31.629) 33.496 10.125 ( -13.224 0.000 -34.426) 36.878 10.306 ( -23.192 0.000 -11.133) 25.725 10.401 ( -23.827 0.000 -5.489) 24.451 10.602 ( -0.933 0.000 -1.195) 1.516 10.794 ( -9.014 0.000 -2.222) 9.284 10.874 ( -4.110 0.000 -4.389) 6.013 10.994 ( -7.910 0.000 -13.198) 15.387 11.635 ( -0.590 0.000 4.620) 4.657 11.656 ( -0.865 0.000 6.595) 6.651 11.769 ( 1.694 0.000 -1.519) 2.275 11.813 ( -0.581 0.000 -3.033) 3.088 12.102 ( 13.211 0.000 18.645) 22.851 12.393 ( 2.543 0.000 8.781) 9.142 12.514 ( 12.977 0.000 17.257) 21.592 12.568 ( 6.662 0.000 9.772) 11.827 12.847 ( 1.162 0.000 -13.017) 13.069 12.917 ( 11.899 0.000 5.904) 13.283 12.974 ( 3.835 0.000 -13.269) 13.812 13.014 ( 6.255 0.000 -12.873) 14.312 13.425 ( -0.216 0.000 9.643) 9.646 13.476 ( 6.999 0.000 -12.185) 14.052 13.483 ( 3.990 0.000 -13.564) 14.139 13.741 ( 2.629 0.000 -4.402) 5.128 13.952 ( 22.138 0.000 2.160) 22.243 13.982 ( 8.714 0.000 6.848) 11.083 14.086 ( 0.193 0.000 1.383) 1.397 14.335 ( 1.909 0.000 -5.730) 6.039 14.837 ( 2.255 0.000 2.927) 3.695 14.862 ( 3.412 0.000 5.471) 6.448 15.094 ( -2.450 0.000 9.601) 9.909 15.222 ( -3.883 0.000 6.743) 7.781 15.270 ( -4.412 0.000 1.582) 4.687 15.309 ( 2.122 0.000 -0.540) 2.189 15.364 ( -7.305 0.000 14.695) 16.411 15.492 ( -3.263 0.000 3.589) 4.851 15.716 ( -1.202 0.000 6.386) 6.498 15.819 ( 3.549 0.000 -2.902) 4.585 15.836 ( -4.504 0.000 6.396) 7.823 15.942 ( -3.814 0.000 0.561) 3.855 15.976 ( 6.639 0.000 3.757) 7.628 16.042 ( 8.214 0.000 -3.114) 8.785 16.292 ( 2.413 0.000 1.303) 2.743 16.307 ( -2.057 0.000 -5.086) 5.486 16.517 ( 5.663 0.000 -1.927) 5.983 16.624 ( 12.940 0.000 -7.975) 15.200 16.727 ( -2.220 0.000 0.887) 2.391 16.797 ( -3.602 0.000 -0.106) 3.604 16.869 ( -11.151 0.000 -0.748) 11.176 16.920 ( -11.726 0.000 0.643) 11.743 17.128 ( -20.527 0.000 5.765) 21.321 17.404 ( -2.473 0.000 0.120) 2.476 17.541 ( -11.382 0.000 -8.480) 14.193 17.695 ( 4.047 0.000 -7.565) 8.580 17.841 ( -9.339 0.000 -1.690) 9.491 17.852 ( -3.429 0.000 -2.685) 4.355 17.948 ( 10.568 0.000 -2.077) 10.770 18.102 ( 9.362 0.000 -9.584) 13.397 18.368 ( -8.993 0.000 2.917) 9.454 18.534 ( -9.889 0.000 -6.612) 11.895 19.591 ( 2.533 0.000 2.824) 3.793 19.688 ( 2.404 0.000 0.486) 2.453 19.730 ( -4.709 0.000 -0.099) 4.710 19.759 ( -2.947 0.000 -0.475) 2.985 20.446 ( 3.192 0.000 18.649) 18.920 20.761 ( -10.413 0.000 18.744) 21.442 21.061 ( 7.856 0.000 -6.006) 9.889 21.251 ( -1.317 0.000 -10.500) 10.582 24.305 ( 1.877 0.000 9.631) 9.812 24.565 ( -8.948 0.000 4.775) 10.142 24.680 ( 6.965 0.000 -6.519) 9.539 24.884 ( -5.892 0.000 -12.174) 13.525 25.511 ( 0.833 0.000 -2.556) 2.688 25.565 ( 16.071 0.000 -5.947) 17.136 25.987 ( -15.610 0.000 9.219) 18.129 26.212 ( -13.031 0.000 -0.997) 13.069 27.039 ( 5.840 0.000 2.411) 6.318 27.173 ( 8.338 0.000 -3.977) 9.238 27.423 ( -11.717 0.000 4.153) 12.431 27.573 ( -5.023 0.000 -2.911) 5.806 27.604 ( 2.843 0.000 -0.207) 2.851 27.618 ( 4.007 0.000 -0.435) 4.031 27.866 ( -8.199 0.000 1.426) 8.322 27.929 ( -7.796 0.000 -1.430) 7.926 29.781 ( 4.254 0.000 7.995) 9.056 30.021 ( -6.380 0.000 12.251) 13.813 30.185 ( 7.094 0.000 -11.237) 13.289 30.292 ( 8.745 0.000 5.347) 10.250 30.472 ( -5.751 0.000 -8.710) 10.437 30.591 ( -5.260 0.000 10.225) 11.499 30.650 ( 14.686 0.000 -12.471) 19.267 31.076 ( -5.274 0.000 -14.051) 15.008 31.941 ( 16.845 0.000 11.630) 20.469 32.141 ( 14.155 0.000 1.369) 14.221 32.210 ( 1.878 0.000 10.024) 10.199 32.349 ( 7.287 0.000 7.200) 10.244 32.429 ( 0.945 0.000 0.219) 0.970 32.569 ( 9.790 0.000 -3.288) 10.328 32.610 ( 13.502 0.000 1.619) 13.599 32.729 ( 0.471 0.000 -3.093) 3.128 32.791 ( -3.950 0.000 -2.416) 4.631 32.933 ( 11.039 0.000 -11.551) 15.978 33.189 ( -14.916 0.000 9.444) 17.655 33.395 ( 1.964 0.000 -2.183) 2.937 33.650 ( -0.568 0.000 -0.640) 0.855 33.739 ( -10.062 0.000 -2.036) 10.266 33.851 ( -8.383 0.000 1.807) 8.575 33.937 ( -14.567 0.000 -3.435) 14.966 98.510 ( 1.334 0.000 0.403) 1.394 98.533 ( 0.205 0.000 0.811) 0.837 98.542 ( 2.262 0.000 -1.318) 2.618 98.604 ( -0.993 0.000 -1.982) 2.216 98.699 ( 2.715 0.000 5.545) 6.174 98.811 ( -2.330 0.000 6.366) 6.779 98.988 ( 3.642 0.000 -8.496) 9.244 99.080 ( -0.978 0.000 -7.057) 7.124 100.411 ( 2.577 0.000 5.300) 5.893 100.518 ( -1.693 0.000 2.781) 3.256 100.560 ( 2.140 0.000 -2.033) 2.952 100.613 ( 2.368 0.000 -2.155) 3.201 100.639 ( 5.158 0.000 1.267) 5.311 100.689 ( 0.739 0.000 -0.789) 1.081 100.860 ( -4.401 0.000 -0.262) 4.409 100.884 ( -5.770 0.000 -1.381) 5.933 102.490 ( 1.377 0.000 0.437) 1.445 102.506 ( 2.549 0.000 -0.399) 2.580 102.571 ( -2.173 0.000 1.412) 2.591 102.659 ( -4.778 0.000 -2.315) 5.309 102.925 ( 5.242 0.000 5.051) 7.280 103.114 ( 9.593 0.000 -4.029) 10.404 103.183 ( -7.418 0.000 9.845) 12.326 103.580 ( -13.452 0.000 -9.129) 16.257 ======================= Grid point 115 (42/72) ======================= q-point: (-0.50 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 54 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.883 ( -33.730 0.000 2.718) 33.839 3.883 ( 33.730 0.000 2.718) 33.839 4.021 ( -11.184 0.000 -9.568) 14.718 4.021 ( 11.184 0.000 -9.568) 14.718 4.504 ( -22.713 0.000 -5.702) 23.418 4.504 ( 22.713 0.000 -5.702) 23.418 4.878 ( -25.090 0.000 -17.522) 30.603 4.878 ( 25.090 0.000 -17.522) 30.603 5.745 ( -14.059 0.000 3.249) 14.429 5.745 ( 14.059 0.000 3.249) 14.429 6.088 ( -16.588 0.000 -13.810) 21.584 6.088 ( 16.588 0.000 -13.810) 21.584 7.232 ( -20.157 0.000 24.848) 31.996 7.232 ( 20.157 0.000 24.848) 31.996 7.247 ( -16.668 0.000 29.488) 33.873 7.247 ( 16.668 0.000 29.488) 33.873 7.471 ( -14.878 0.000 22.626) 27.079 7.471 ( 14.878 0.000 22.626) 27.079 7.504 ( -10.444 0.000 15.742) 18.892 7.504 ( 10.444 0.000 15.742) 18.892 7.861 ( -15.892 0.000 1.768) 15.990 7.861 ( 15.892 0.000 1.768) 15.990 7.991 ( -17.643 0.000 3.090) 17.912 7.991 ( 17.643 0.000 3.090) 17.912 8.475 ( -24.833 0.000 -2.613) 24.970 8.475 ( 24.833 0.000 -2.613) 24.970 8.495 ( -16.832 0.000 -11.563) 20.421 8.495 ( 16.832 0.000 -11.563) 20.421 8.788 ( -11.382 0.000 -10.910) 15.766 8.788 ( 11.382 0.000 -10.910) 15.766 8.875 ( -9.280 0.000 -13.146) 16.091 8.875 ( 9.280 0.000 -13.146) 16.091 9.204 ( -17.234 0.000 8.811) 19.356 9.204 ( 17.234 0.000 8.811) 19.356 9.317 ( -23.800 0.000 8.800) 25.375 9.317 ( 23.800 0.000 8.800) 25.375 10.004 ( -3.758 0.000 -27.505) 27.761 10.004 ( 3.758 0.000 -27.505) 27.761 10.031 ( -7.341 0.000 -25.873) 26.894 10.031 ( 7.341 0.000 -25.873) 26.894 10.664 ( -4.860 0.000 0.749) 4.917 10.664 ( 4.860 0.000 0.749) 4.917 10.884 ( -3.499 0.000 -7.938) 8.675 10.884 ( 3.499 0.000 -7.938) 8.675 11.640 ( -0.795 0.000 5.522) 5.579 11.640 ( 0.795 0.000 5.522) 5.579 11.797 ( -1.090 0.000 -2.237) 2.489 11.797 ( 1.090 0.000 -2.237) 2.489 12.329 ( -8.294 0.000 17.168) 19.067 12.329 ( 8.294 0.000 17.168) 19.067 12.652 ( -0.564 0.000 14.401) 14.413 12.652 ( 0.564 0.000 14.401) 14.413 12.918 ( -6.333 0.000 -8.716) 10.774 12.918 ( 6.333 0.000 -8.716) 10.774 13.063 ( -2.224 0.000 -9.567) 9.822 13.063 ( 2.224 0.000 -9.567) 9.822 13.486 ( -3.722 0.000 -5.731) 6.834 13.486 ( 3.722 0.000 -5.731) 6.834 13.643 ( -9.292 0.000 -4.765) 10.442 13.643 ( 9.292 0.000 -4.765) 10.442 14.095 ( -4.074 0.000 4.889) 6.364 14.095 ( 4.074 0.000 4.889) 6.364 14.287 ( -9.214 0.000 -3.326) 9.796 14.287 ( 9.214 0.000 -3.326) 9.796 14.963 ( -11.875 0.000 8.355) 14.520 14.963 ( 11.875 0.000 8.355) 14.520 14.988 ( -7.562 0.000 7.203) 10.444 14.988 ( 7.562 0.000 7.203) 10.444 15.288 ( -2.616 0.000 5.753) 6.320 15.288 ( 2.616 0.000 5.753) 6.320 15.384 ( -5.557 0.000 1.373) 5.724 15.384 ( 5.557 0.000 1.373) 5.724 15.749 ( -3.579 0.000 5.579) 6.628 15.749 ( 3.579 0.000 5.579) 6.628 15.879 ( -2.685 0.000 -1.512) 3.081 15.879 ( 2.685 0.000 -1.512) 3.081 16.177 ( -10.848 0.000 -0.500) 10.859 16.177 ( 10.848 0.000 -0.500) 10.859 16.243 ( -7.826 0.000 -2.416) 8.191 16.243 ( 7.826 0.000 -2.416) 8.191 16.705 ( -7.147 0.000 5.224) 8.853 16.705 ( 7.147 0.000 5.224) 8.853 16.726 ( -1.792 0.000 1.023) 2.063 16.726 ( 1.792 0.000 1.023) 2.063 16.773 ( -8.577 0.000 -0.383) 8.586 16.773 ( 8.577 0.000 -0.383) 8.586 17.004 ( -21.155 0.000 -10.145) 23.461 17.004 ( 21.155 0.000 -10.145) 23.461 17.657 ( -9.125 0.000 0.308) 9.130 17.657 ( 9.125 0.000 0.308) 9.130 17.777 ( -4.104 0.000 -6.040) 7.302 17.777 ( 4.104 0.000 -6.040) 7.302 18.171 ( -10.814 0.000 0.417) 10.822 18.171 ( 10.814 0.000 0.417) 10.822 18.322 ( -11.151 0.000 -8.485) 14.012 18.322 ( 11.151 0.000 -8.485) 14.012 19.648 ( -3.381 0.000 1.285) 3.617 19.648 ( 3.381 0.000 1.285) 3.617 19.722 ( -1.283 0.000 -0.772) 1.498 19.722 ( 1.283 0.000 -0.772) 1.498 20.567 ( -8.433 0.000 20.642) 22.298 20.567 ( 8.433 0.000 20.642) 22.299 21.189 ( -4.871 0.000 -9.515) 10.689 21.189 ( 4.871 0.000 -9.515) 10.689 24.399 ( -7.013 0.000 7.249) 10.086 24.399 ( 7.013 0.000 7.249) 10.086 24.785 ( -4.579 0.000 -11.488) 12.367 24.785 ( 4.579 0.000 -11.488) 12.367 25.674 ( -13.895 0.000 6.456) 15.321 25.674 ( 13.895 0.000 6.456) 15.321 25.905 ( -16.975 0.000 -4.741) 17.624 25.905 ( 16.975 0.000 -4.741) 17.624 27.202 ( -10.002 0.000 3.820) 10.706 27.202 ( 10.002 0.000 3.820) 10.706 27.368 ( -10.638 0.000 -4.153) 11.420 27.368 ( 10.638 0.000 -4.153) 11.420 27.720 ( -6.264 0.000 0.927) 6.332 27.720 ( 6.264 0.000 0.927) 6.332 27.764 ( -8.508 0.000 -1.193) 8.591 27.764 ( 8.508 0.000 -1.193) 8.591 29.890 ( -6.322 0.000 10.415) 12.184 29.890 ( 6.322 0.000 10.415) 12.184 30.334 ( -7.561 0.000 -10.555) 12.983 30.334 ( 7.561 0.000 -10.555) 12.983 30.461 ( -7.730 0.000 8.549) 11.525 30.461 ( 7.730 0.000 8.549) 11.525 30.911 ( -10.916 0.000 -14.181) 17.896 30.911 ( 10.916 0.000 -14.181) 17.896 32.165 ( -5.999 0.000 11.824) 13.259 32.165 ( 5.999 0.000 11.824) 13.259 32.358 ( -7.564 0.000 3.445) 8.311 32.358 ( 7.564 0.000 3.445) 8.311 32.601 ( -14.102 0.000 1.100) 14.145 32.601 ( 14.102 0.000 1.100) 14.145 32.692 ( -3.962 0.000 -6.726) 7.806 32.692 ( 3.962 0.000 -6.726) 7.806 32.883 ( -13.920 0.000 7.682) 15.899 32.883 ( 13.920 0.000 7.682) 15.899 33.252 ( -16.248 0.000 -8.517) 18.345 33.252 ( 16.248 0.000 -8.517) 18.345 33.704 ( -7.456 0.000 -0.279) 7.461 33.704 ( 7.456 0.000 -0.279) 7.461 33.708 ( -5.541 0.000 -0.594) 5.573 33.708 ( 5.541 0.000 -0.594) 5.573 98.529 ( -0.579 0.000 0.493) 0.760 98.529 ( 0.579 0.000 0.493) 0.760 98.580 ( -1.499 0.000 -1.672) 2.245 98.580 ( 1.499 0.000 -1.672) 2.245 98.757 ( -2.936 0.000 6.406) 7.046 98.757 ( 2.936 0.000 6.406) 7.046 99.047 ( -2.280 0.000 -7.783) 8.110 99.047 ( 2.280 0.000 -7.783) 8.110 100.467 ( -2.892 0.000 4.271) 5.159 100.467 ( 2.892 0.000 4.271) 5.159 100.601 ( -1.899 0.000 -2.275) 2.963 100.601 ( 1.899 0.000 -2.275) 2.963 100.760 ( -6.406 0.000 -0.126) 6.408 100.760 ( 6.406 0.000 -0.126) 6.408 100.764 ( -5.013 0.000 -0.323) 5.024 100.764 ( 5.013 0.000 -0.323) 5.024 102.527 ( -2.136 0.000 0.578) 2.213 102.527 ( 2.136 0.000 0.578) 2.213 102.571 ( -3.917 0.000 -1.281) 4.121 102.571 ( 3.917 0.000 -1.281) 4.121 103.042 ( -6.512 0.000 7.267) 9.758 103.042 ( 6.512 0.000 7.267) 9.758 103.327 ( -11.722 0.000 -6.356) 13.335 103.327 ( 11.722 0.000 -6.356) 13.335 ======================= Grid point 121 (43/72) ======================= q-point: ( 0.00 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.742 ( 0.000 49.588 18.078) 52.781 1.854 ( 0.000 8.971 40.202) 41.190 2.602 ( 0.000 -4.327 15.965) 16.541 2.865 ( 0.000 25.646 -23.927) 35.074 3.172 ( 0.000 4.250 -17.678) 18.182 3.315 ( 0.000 4.168 74.220) 74.337 3.590 ( 0.000 -3.538 -11.804) 12.323 3.739 ( 0.000 -5.996 56.005) 56.325 4.629 ( 0.000 -19.979 -0.305) 19.982 4.842 ( 0.000 -15.551 -11.183) 19.154 6.062 ( 0.000 -1.320 -53.015) 53.031 6.165 ( 0.000 -3.638 -49.232) 49.366 6.459 ( 0.000 3.092 28.896) 29.061 6.547 ( 0.000 -0.638 12.116) 12.133 6.965 ( 0.000 3.912 -2.931) 4.888 7.230 ( 0.000 -1.464 -3.251) 3.566 7.377 ( 0.000 3.287 -0.436) 3.316 7.476 ( 0.000 0.226 -4.944) 4.949 7.547 ( 0.000 -1.515 3.569) 3.877 7.559 ( 0.000 4.416 -2.560) 5.104 7.722 ( 0.000 -9.706 1.621) 9.840 7.766 ( 0.000 4.168 -9.804) 10.654 8.007 ( 0.000 -4.761 -8.251) 9.526 8.086 ( 0.000 -2.431 -8.686) 9.019 8.191 ( 0.000 2.687 -6.446) 6.983 8.228 ( 0.000 3.569 -3.931) 5.309 8.248 ( 0.000 3.402 -15.955) 16.314 8.401 ( 0.000 2.962 -8.486) 8.989 8.772 ( 0.000 5.527 6.151) 8.269 9.055 ( 0.000 5.195 -6.108) 8.018 9.323 ( 0.000 -3.498 10.297) 10.875 9.644 ( 0.000 -6.147 -0.929) 6.217 9.835 ( 0.000 4.705 29.877) 30.245 10.118 ( 0.000 -2.261 29.054) 29.141 10.125 ( 0.000 -1.269 26.471) 26.502 10.180 ( 0.000 -2.569 30.194) 30.303 10.617 ( 0.000 -0.223 7.751) 7.754 10.725 ( 0.000 -6.922 3.130) 7.597 10.790 ( 0.000 2.226 9.797) 10.047 10.848 ( 0.000 4.057 2.418) 4.723 10.965 ( 0.000 -2.036 7.173) 7.456 11.191 ( 0.000 9.385 12.439) 15.582 11.418 ( 0.000 7.316 -22.415) 23.578 11.473 ( 0.000 2.791 -13.970) 14.246 11.631 ( 0.000 -12.207 -3.135) 12.603 11.642 ( 0.000 7.146 -29.886) 30.728 11.718 ( 0.000 -1.473 -13.457) 13.538 11.876 ( 0.000 6.114 -13.323) 14.659 11.931 ( 0.000 -7.570 -14.562) 16.412 12.053 ( 0.000 2.323 0.836) 2.469 12.057 ( 0.000 -3.467 -9.683) 10.285 12.190 ( 0.000 -0.899 -18.572) 18.594 12.245 ( 0.000 1.767 4.497) 4.831 12.278 ( 0.000 2.536 1.315) 2.857 12.528 ( 0.000 -0.534 -7.352) 7.371 12.749 ( 0.000 -5.292 -13.839) 14.816 13.341 ( 0.000 5.739 5.580) 8.005 13.365 ( 0.000 7.369 2.122) 7.668 13.481 ( 0.000 1.893 -1.174) 2.228 13.501 ( 0.000 5.254 -0.129) 5.255 13.927 ( 0.000 -1.414 11.992) 12.075 13.984 ( 0.000 -0.838 8.817) 8.857 14.026 ( 0.000 0.196 4.233) 4.237 14.314 ( 0.000 -3.429 -8.404) 9.077 14.681 ( 0.000 2.411 -1.589) 2.887 14.703 ( 0.000 1.876 2.153) 2.856 14.913 ( 0.000 4.207 -10.688) 11.487 15.010 ( 0.000 7.729 -11.463) 13.825 15.300 ( 0.000 1.549 2.472) 2.917 15.375 ( 0.000 -0.354 8.911) 8.918 15.410 ( 0.000 1.206 2.892) 3.134 15.546 ( 0.000 -2.518 5.785) 6.310 15.666 ( 0.000 -7.951 9.484) 12.375 15.737 ( 0.000 -2.826 5.912) 6.553 15.847 ( 0.000 -3.769 5.626) 6.772 15.865 ( 0.000 -1.011 -5.126) 5.225 16.045 ( 0.000 -3.008 -7.163) 7.769 16.164 ( 0.000 -7.840 7.823) 11.075 16.340 ( 0.000 -9.786 -10.957) 14.691 16.387 ( 0.000 -2.173 5.324) 5.751 16.388 ( 0.000 -4.633 1.622) 4.908 16.474 ( 0.000 5.698 -4.182) 7.068 16.618 ( 0.000 -9.512 5.427) 10.951 16.852 ( 0.000 6.635 6.797) 9.499 16.880 ( 0.000 -0.139 5.470) 5.471 17.097 ( 0.000 12.608 -2.892) 12.935 17.145 ( 0.000 -5.635 -6.275) 8.434 17.344 ( 0.000 1.342 -8.601) 8.705 17.391 ( 0.000 6.615 8.295) 10.610 17.844 ( 0.000 18.612 -15.713) 24.358 17.971 ( 0.000 -1.251 4.715) 4.878 18.176 ( 0.000 4.724 -4.443) 6.485 18.531 ( 0.000 0.847 12.152) 12.182 18.767 ( 0.000 0.909 -1.035) 1.377 18.897 ( 0.000 -7.519 5.222) 9.154 19.033 ( 0.000 -3.873 -2.373) 4.542 19.563 ( 0.000 6.189 6.681) 9.107 19.698 ( 0.000 12.152 -0.441) 12.160 20.088 ( 0.000 -7.909 11.592) 14.033 20.147 ( 0.000 7.544 12.319) 14.446 20.626 ( 0.000 -8.953 -3.281) 9.535 20.696 ( 0.000 -8.991 3.684) 9.716 21.036 ( 0.000 18.000 -29.926) 34.922 21.420 ( 0.000 9.438 -21.926) 23.871 24.182 ( 0.000 8.102 1.755) 8.289 24.363 ( 0.000 12.944 -8.409) 15.436 25.489 ( 0.000 -21.593 3.396) 21.858 25.545 ( 0.000 -14.499 -0.027) 14.499 25.886 ( 0.000 2.805 16.869) 17.100 26.201 ( 0.000 -5.140 13.972) 14.887 26.286 ( 0.000 7.587 -5.290) 9.250 26.556 ( 0.000 4.526 -6.485) 7.908 26.836 ( 0.000 -0.102 4.592) 4.593 27.053 ( 0.000 -5.221 4.382) 6.816 27.304 ( 0.000 -0.895 -14.819) 14.846 27.359 ( 0.000 -1.979 -9.809) 10.007 28.070 ( 0.000 0.728 3.987) 4.053 28.123 ( 0.000 -0.148 5.243) 5.245 28.228 ( 0.000 1.069 -2.015) 2.281 28.358 ( 0.000 -0.938 -5.343) 5.424 29.468 ( 0.000 1.001 3.585) 3.722 29.608 ( 0.000 5.082 -4.575) 6.838 29.632 ( 0.000 -1.870 7.070) 7.313 29.966 ( 0.000 -3.247 -10.803) 11.280 30.615 ( 0.000 3.528 7.842) 8.599 30.752 ( 0.000 3.337 -2.201) 3.997 30.830 ( 0.000 2.757 6.757) 7.298 30.876 ( 0.000 2.498 9.088) 9.425 31.130 ( 0.000 -7.536 -3.061) 8.134 31.423 ( 0.000 4.070 -9.568) 10.398 31.442 ( 0.000 -6.082 -3.870) 7.209 31.534 ( 0.000 -1.850 -5.057) 5.384 31.956 ( 0.000 0.633 8.097) 8.122 32.090 ( 0.000 4.317 21.449) 21.880 32.353 ( 0.000 0.300 -11.451) 11.455 32.444 ( 0.000 -5.552 7.788) 9.564 32.554 ( 0.000 -7.801 6.043) 9.868 32.871 ( 0.000 -24.421 15.864) 29.122 32.906 ( 0.000 7.056 -17.597) 18.959 33.463 ( 0.000 -6.976 -12.547) 14.355 34.196 ( 0.000 4.731 5.586) 7.320 34.358 ( 0.000 5.713 -2.771) 6.349 34.402 ( 0.000 -2.099 11.047) 11.244 34.698 ( 0.000 -2.392 -3.799) 4.490 98.339 ( 0.000 0.205 0.778) 0.804 98.357 ( 0.000 -0.188 0.569) 0.599 98.391 ( 0.000 0.234 -1.187) 1.209 98.399 ( 0.000 0.131 -2.325) 2.329 98.666 ( 0.000 1.389 2.990) 3.297 98.756 ( 0.000 1.288 -1.537) 2.005 98.837 ( 0.000 -2.050 3.467) 4.028 98.958 ( 0.000 -4.319 -1.750) 4.660 100.257 ( 0.000 -3.670 4.975) 6.182 100.280 ( 0.000 -1.018 2.665) 2.853 100.389 ( 0.000 -0.053 -2.424) 2.425 100.393 ( 0.000 -0.664 -2.298) 2.392 100.712 ( 0.000 2.774 4.170) 5.009 100.916 ( 0.000 -2.492 1.832) 3.093 100.957 ( 0.000 6.695 -8.886) 11.126 101.021 ( 0.000 1.343 -3.167) 3.440 102.488 ( 0.000 -2.046 1.224) 2.384 102.507 ( 0.000 0.665 -0.079) 0.670 102.595 ( 0.000 -2.163 0.872) 2.333 102.634 ( 0.000 -1.124 -1.077) 1.557 102.943 ( 0.000 7.953 12.510) 14.824 103.520 ( 0.000 -4.059 19.185) 19.610 103.572 ( 0.000 28.733 -24.228) 37.585 104.353 ( 0.000 -1.726 -20.667) 20.739 ======================= Grid point 122 (44/72) ======================= q-point: ( 0.10 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.834 ( 9.820 45.804 18.434) 50.342 2.286 ( 34.348 7.478 35.997) 50.314 2.834 ( 15.397 11.782 -11.983) 22.792 3.002 ( 16.467 8.842 6.955) 19.943 3.515 ( 29.518 3.369 8.850) 30.999 3.547 ( 26.481 4.225 45.177) 52.536 3.915 ( 27.574 -4.465 1.624) 27.981 3.953 ( 25.309 -4.286 25.120) 35.916 4.635 ( 1.056 -19.178 0.440) 19.212 4.871 ( 2.892 -15.346 -11.508) 19.399 5.993 ( -5.768 -1.632 -45.659) 46.051 6.073 ( -8.533 -2.914 -43.718) 44.639 6.443 ( -1.566 2.005 29.681) 29.790 6.560 ( 0.647 -0.407 12.521) 12.544 6.959 ( -0.433 3.672 -2.106) 4.255 7.130 ( -14.761 2.797 -1.562) 15.105 7.309 ( -2.252 -0.060 -1.773) 2.866 7.414 ( -1.247 2.489 -2.013) 3.435 7.434 ( -7.739 -0.535 -4.417) 8.927 7.599 ( -7.224 -1.705 -8.821) 11.529 7.731 ( 5.904 0.285 -2.940) 6.601 7.832 ( 3.703 -4.091 -6.270) 8.353 7.941 ( -5.419 -2.774 -10.839) 12.431 8.085 ( 1.556 -3.304 -4.883) 6.097 8.159 ( -2.922 4.632 -6.257) 8.315 8.253 ( 1.216 2.630 -7.275) 7.831 8.286 ( 3.918 3.230 -4.352) 6.688 8.409 ( 1.995 2.188 -7.871) 8.409 8.811 ( 3.201 4.664 4.836) 7.442 9.042 ( -1.323 5.128 -4.590) 7.008 9.325 ( -0.658 -3.276 9.026) 9.625 9.524 ( -19.841 2.150 34.587) 39.932 9.555 ( -12.620 -6.791 9.690) 17.299 9.725 ( -17.259 -0.346 20.114) 26.506 10.355 ( 9.129 -0.100 20.535) 22.473 10.413 ( 9.016 0.834 19.533) 21.529 10.610 ( -2.548 -0.102 5.048) 5.655 10.716 ( 0.672 1.641 -6.393) 6.634 10.750 ( -3.073 0.935 4.444) 5.484 10.903 ( 2.119 -5.645 7.111) 9.323 11.049 ( 10.278 -2.414 7.938) 13.209 11.339 ( 5.932 6.283 3.494) 9.321 11.363 ( -0.186 3.881 -12.163) 12.769 11.455 ( -5.101 6.401 -9.138) 12.268 11.515 ( -1.849 2.019 -13.238) 13.518 11.719 ( 0.711 -3.505 -2.409) 4.312 11.755 ( 5.781 -0.303 -20.052) 20.871 11.866 ( -4.459 -2.658 -15.197) 16.059 11.912 ( 4.732 0.572 -12.438) 13.320 12.084 ( -3.186 -2.731 -6.169) 7.461 12.150 ( 2.628 1.780 -2.784) 4.222 12.185 ( 7.277 -3.396 -4.728) 9.319 12.306 ( 8.070 1.304 -1.230) 8.267 12.362 ( 6.712 1.463 3.077) 7.528 12.577 ( 1.879 -0.187 -2.609) 3.220 12.834 ( 7.558 -4.307 -14.992) 17.333 13.124 ( -8.567 4.300 -5.470) 11.036 13.158 ( -20.418 5.094 -4.322) 21.483 13.391 ( -11.746 -1.073 4.135) 12.498 13.494 ( -3.071 1.087 0.293) 3.271 13.759 ( -11.613 1.276 7.890) 14.097 13.925 ( -2.065 2.792 7.458) 8.227 14.133 ( 7.778 1.215 3.899) 8.785 14.416 ( 3.195 -0.183 -2.925) 4.335 14.649 ( 1.469 3.162 0.768) 3.570 14.741 ( 3.889 4.114 -2.157) 6.058 14.949 ( 2.397 2.199 -2.372) 4.026 15.102 ( 5.885 5.490 -11.811) 14.293 15.279 ( -1.571 1.063 4.340) 4.736 15.343 ( -2.165 1.402 5.517) 6.090 15.417 ( 0.647 -0.456 4.122) 4.197 15.564 ( 1.429 -2.870 5.648) 6.494 15.681 ( 1.272 -6.851 7.921) 10.549 15.754 ( 0.677 -4.071 5.501) 6.877 15.845 ( 0.179 -1.030 1.317) 1.681 15.878 ( 0.440 -1.499 -1.368) 2.076 16.056 ( -0.555 -3.682 -3.594) 5.175 16.095 ( -3.044 -5.578 2.865) 6.971 16.309 ( -2.293 -8.872 -6.839) 11.434 16.364 ( -1.331 -2.766 -1.018) 3.234 16.478 ( 4.377 -2.243 1.741) 5.217 16.500 ( 4.677 4.588 -2.452) 6.995 16.717 ( 7.331 -8.603 4.363) 12.116 16.825 ( -2.464 3.581 6.289) 7.645 16.881 ( 2.104 3.578 6.069) 7.352 17.107 ( -1.291 -5.514 -8.237) 9.996 17.222 ( 6.393 6.940 -0.567) 9.453 17.319 ( -0.978 2.203 -8.337) 8.679 17.410 ( 1.852 5.007 6.151) 8.145 17.845 ( -0.055 15.142 -13.753) 20.456 17.951 ( -2.386 -0.338 4.557) 5.155 18.164 ( -1.604 4.705 -4.293) 6.568 18.451 ( -7.874 2.675 11.793) 14.430 18.743 ( -3.140 -0.766 -2.264) 3.946 18.837 ( -5.482 -6.786 5.470) 10.297 18.974 ( -5.550 -3.056 -2.392) 6.772 19.557 ( -0.228 6.208 5.859) 8.539 19.672 ( -1.952 9.981 -0.084) 10.171 20.019 ( -4.124 -0.543 5.963) 7.270 20.249 ( 1.631 -3.207 8.917) 9.615 20.481 ( -6.223 -0.345 -3.206) 7.009 20.652 ( -3.655 -4.209 9.458) 10.979 21.082 ( 2.007 7.573 -18.355) 19.957 21.391 ( -2.967 7.761 -20.723) 22.326 24.227 ( 4.337 7.334 1.924) 8.735 24.428 ( 5.972 11.439 -9.820) 16.216 25.195 ( -24.472 -11.700 15.010) 31.002 25.426 ( -9.538 -12.596 -2.123) 15.942 25.775 ( -10.374 4.227 12.502) 16.787 26.156 ( -7.911 -1.157 2.834) 8.482 26.269 ( 0.651 0.278 1.408) 1.576 26.483 ( -3.651 3.039 -2.935) 5.584 26.928 ( 4.805 -0.973 1.215) 5.051 27.073 ( 2.008 -5.997 3.363) 7.162 27.248 ( -3.467 0.623 -9.514) 10.145 27.403 ( 2.796 -3.383 -9.887) 10.817 28.029 ( -3.728 0.722 2.778) 4.705 28.118 ( -3.201 -0.603 3.005) 4.431 28.140 ( -5.477 1.053 0.227) 5.582 28.304 ( -5.060 -1.915 -3.814) 6.620 29.549 ( 6.770 1.109 3.542) 7.721 29.692 ( 7.820 3.681 -3.228) 9.226 29.738 ( 8.737 -1.247 2.192) 9.094 30.018 ( 4.599 -2.533 -10.045) 11.334 30.548 ( -10.820 3.130 5.652) 12.602 30.637 ( 1.048 2.272 4.487) 5.138 30.847 ( 1.000 0.589 5.897) 6.010 30.951 ( -10.765 -5.130 5.803) 13.262 31.120 ( 13.623 3.925 -2.872) 14.466 31.326 ( 0.465 3.796 -5.289) 6.527 31.623 ( 12.931 -2.186 -4.522) 13.873 31.698 ( 11.078 -1.270 -3.528) 11.696 32.046 ( 6.491 -0.784 4.850) 8.140 32.115 ( 2.124 3.631 20.227) 20.659 32.291 ( -2.338 0.440 -4.532) 5.118 32.495 ( 4.128 -7.147 4.845) 9.570 32.642 ( 5.164 -3.439 -1.122) 6.304 32.858 ( 0.451 -6.766 -0.305) 6.788 32.967 ( 4.450 -9.397 -2.416) 10.674 33.452 ( -1.087 -6.400 -11.813) 13.480 34.138 ( -5.435 4.635 6.064) 9.370 34.311 ( -4.611 5.564 -2.676) 7.706 34.350 ( -5.161 -1.986 10.556) 11.917 34.641 ( -5.629 -2.288 -3.963) 7.254 98.375 ( 2.202 0.014 0.339) 2.228 98.396 ( 1.495 -0.212 -0.217) 1.525 98.423 ( 2.195 -0.057 -1.863) 2.879 98.450 ( 7.789 -1.435 -3.612) 8.704 98.664 ( -0.121 1.494 2.842) 3.213 98.752 ( -0.072 1.177 -1.491) 1.901 98.839 ( 0.200 -1.999 3.679) 4.192 98.975 ( 1.434 -4.495 -2.268) 5.235 100.269 ( 1.221 -2.866 5.047) 5.931 100.305 ( 2.270 -1.385 2.661) 3.762 100.400 ( 1.550 0.108 -2.286) 2.764 100.417 ( 1.918 -0.636 -2.380) 3.122 100.703 ( -0.928 2.771 4.177) 5.098 100.894 ( -2.094 2.260 -1.961) 3.652 100.949 ( -0.532 0.624 -2.797) 2.915 101.036 ( 0.868 1.323 -5.061) 5.303 102.484 ( -0.389 -1.696 1.218) 2.125 102.498 ( -0.467 1.482 0.057) 1.554 102.622 ( 2.179 -2.763 0.605) 3.571 102.654 ( 2.093 -0.924 -0.831) 2.434 102.908 ( -3.103 7.998 11.510) 14.355 103.406 ( -9.706 16.443 -4.230) 19.557 103.535 ( -3.742 5.681 3.957) 7.869 104.277 ( -7.347 -2.387 -19.390) 20.872 ======================= Grid point 123 (45/72) ======================= q-point: ( 0.20 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.146 ( 21.441 37.132 17.729) 46.398 2.913 ( 25.817 5.483 36.479) 45.026 3.133 ( 17.462 22.122 -29.711) 40.952 3.397 ( 18.464 -3.920 30.804) 36.127 4.280 ( 39.415 2.138 -12.322) 41.351 4.316 ( 48.421 2.729 33.687) 59.049 4.531 ( 24.187 -12.218 8.318) 28.346 4.675 ( 38.114 -2.067 -4.761) 38.466 4.768 ( 22.888 -10.028 -0.766) 25.000 4.958 ( 6.133 -14.024 -11.298) 19.024 5.896 ( -2.327 -1.928 -20.866) 21.083 5.937 ( 2.189 -2.173 -28.947) 29.110 6.357 ( -10.353 -0.435 22.772) 25.019 6.509 ( -8.846 1.743 13.537) 16.265 6.797 ( -10.920 2.659 2.795) 11.582 6.959 ( -0.341 3.775 1.601) 4.115 7.118 ( -20.580 0.039 -12.457) 24.056 7.271 ( -5.533 -1.320 -2.292) 6.133 7.389 ( -0.732 1.605 -4.382) 4.724 7.540 ( 2.862 -2.130 -7.903) 8.671 7.775 ( -0.480 -1.516 0.288) 1.616 7.866 ( -1.271 -1.754 -10.730) 10.946 7.932 ( 5.253 -0.528 -7.507) 9.177 8.100 ( -0.656 5.734 3.393) 6.695 8.178 ( 4.553 -4.592 -14.558) 15.929 8.212 ( -3.184 2.801 0.794) 4.314 8.433 ( 9.246 2.955 -5.696) 11.254 8.494 ( 5.985 0.969 -2.355) 6.505 8.868 ( 1.727 2.861 3.971) 5.189 8.991 ( -4.405 3.463 1.125) 5.715 9.133 ( -18.406 0.650 32.326) 37.205 9.165 ( -17.384 0.069 30.051) 34.717 9.288 ( -5.246 -3.070 4.022) 7.289 9.498 ( -10.196 -1.802 -1.847) 10.518 10.408 ( -0.276 -2.600 8.154) 8.563 10.511 ( -6.893 -1.838 -12.307) 14.225 10.517 ( -1.779 2.840 -5.198) 6.185 10.646 ( -6.232 4.122 3.221) 8.136 10.711 ( -4.994 3.407 -3.657) 7.065 10.979 ( 6.842 -3.394 11.136) 13.504 11.161 ( -8.571 3.789 -2.170) 9.619 11.174 ( -9.330 -6.048 -15.086) 18.741 11.415 ( -0.455 0.578 0.179) 0.757 11.465 ( -8.595 2.223 -0.917) 8.926 11.554 ( 4.599 1.388 -1.576) 5.056 11.664 ( -0.993 -1.356 0.426) 1.733 11.737 ( 2.299 2.396 -3.482) 4.811 11.890 ( 0.312 1.041 -0.804) 1.351 12.045 ( -0.900 -3.018 -9.705) 10.203 12.078 ( -1.491 -4.810 -1.616) 5.289 12.144 ( 5.539 1.549 -0.137) 5.754 12.257 ( -0.354 1.691 -0.158) 1.735 12.468 ( 5.032 4.143 -0.624) 6.548 12.512 ( 11.171 -1.700 5.375) 12.513 12.696 ( 7.991 1.509 -1.579) 8.284 12.784 ( -4.540 1.003 -5.927) 7.533 13.043 ( 10.611 -2.046 -16.461) 19.691 13.092 ( 0.549 -4.936 -10.575) 11.683 13.222 ( -0.441 -2.915 -2.685) 3.988 13.327 ( -0.193 -5.995 -5.681) 8.261 13.710 ( 0.717 6.679 9.764) 11.852 13.839 ( -6.221 6.139 8.118) 11.928 14.252 ( 4.510 2.736 -0.099) 5.276 14.377 ( -5.444 4.102 -2.820) 7.377 14.771 ( 7.792 0.991 1.776) 8.053 14.826 ( 3.884 4.463 -3.227) 6.739 15.010 ( 3.574 1.437 6.418) 7.486 15.185 ( 2.667 6.252 -1.722) 7.012 15.245 ( -0.841 -0.733 5.677) 5.786 15.328 ( 0.188 1.698 2.223) 2.804 15.439 ( 1.527 -1.755 2.704) 3.567 15.591 ( 1.337 -3.795 5.585) 6.883 15.702 ( -0.121 -6.011 5.385) 8.072 15.753 ( -0.360 -2.767 4.684) 5.453 15.816 ( -3.148 -1.987 2.429) 4.445 15.882 ( 0.099 -1.470 -0.898) 1.725 15.992 ( -3.281 -3.238 -0.468) 4.633 16.127 ( 4.036 0.010 0.927) 4.141 16.278 ( -0.326 -6.267 -4.253) 7.581 16.323 ( -2.667 -0.856 -8.453) 8.906 16.509 ( -2.018 7.905 -0.482) 8.173 16.602 ( 2.339 1.273 -3.296) 4.237 16.743 ( -1.064 -2.004 8.619) 8.913 16.904 ( 0.219 1.181 4.179) 4.349 16.941 ( 10.166 -4.175 1.432) 11.083 17.104 ( 1.059 -6.816 -4.615) 8.299 17.237 ( -1.812 0.687 -2.175) 2.913 17.387 ( 4.354 4.956 -4.264) 7.855 17.473 ( 4.537 -1.284 -0.616) 4.755 17.808 ( -6.507 2.373 1.826) 7.163 17.876 ( -2.979 6.168 -6.618) 9.525 18.100 ( -4.942 4.244 -4.329) 7.822 18.252 ( -10.360 7.288 8.111) 15.041 18.574 ( -13.472 -3.881 -2.672) 14.272 18.743 ( -4.220 -4.360 1.221) 6.189 18.813 ( -10.577 -1.078 -1.745) 10.774 19.565 ( 1.089 5.481 4.310) 7.057 19.639 ( -0.944 6.086 0.958) 6.233 19.923 ( -5.553 -0.997 2.299) 6.093 20.055 ( -12.714 -2.047 -2.525) 13.122 20.550 ( -1.997 -0.619 10.959) 11.156 20.627 ( 9.763 0.803 9.951) 13.964 21.077 ( -2.586 1.569 -4.693) 5.584 21.311 ( -4.472 3.607 -15.363) 16.402 24.348 ( 7.599 5.225 2.397) 9.528 24.534 ( 0.142 7.645 -3.293) 8.326 24.782 ( -10.790 -1.773 10.294) 15.018 25.201 ( -11.505 -8.437 -5.981) 15.470 25.535 ( -11.716 6.842 7.755) 15.628 25.929 ( -13.071 2.449 -5.620) 14.437 26.275 ( -1.327 -4.354 4.275) 6.245 26.424 ( -3.098 -1.418 -0.676) 3.474 26.985 ( 1.898 -1.339 -0.085) 2.324 27.070 ( -2.849 -1.285 -2.663) 4.106 27.254 ( 4.703 -2.651 1.801) 5.691 27.453 ( 2.115 -4.629 -6.422) 8.194 27.916 ( -9.493 1.232 1.660) 9.715 27.940 ( -7.853 1.531 0.292) 8.006 28.107 ( -2.196 -1.918 2.024) 3.550 28.170 ( -7.994 -3.078 -1.107) 8.638 29.679 ( 5.380 1.986 4.098) 7.048 29.882 ( 9.748 -0.515 -1.364) 9.856 29.920 ( 9.060 1.124 -5.020) 10.419 30.127 ( 6.403 -1.210 -8.721) 10.887 30.360 ( -7.609 3.325 9.686) 12.758 30.630 ( -1.849 0.732 0.846) 2.161 30.753 ( -6.327 -2.395 5.823) 8.926 30.940 ( 7.208 -1.287 1.320) 7.440 31.400 ( 10.353 5.047 -1.695) 11.642 31.485 ( 17.409 7.300 -3.507) 19.200 31.911 ( 14.966 -2.258 -1.981) 15.265 31.950 ( 13.962 -1.899 -1.240) 14.145 32.130 ( 2.349 0.289 9.491) 9.781 32.201 ( 6.686 0.747 6.142) 9.109 32.307 ( 3.167 3.506 2.114) 5.176 32.588 ( 4.546 -6.751 3.517) 8.866 32.698 ( 1.088 -4.304 -1.435) 4.665 32.896 ( 2.617 3.793 -9.053) 10.159 33.064 ( 4.990 -13.702 1.253) 14.636 33.422 ( -1.837 -5.072 -9.567) 10.982 33.994 ( -8.826 3.988 6.718) 11.787 34.181 ( -8.254 4.322 -1.694) 9.470 34.204 ( -9.035 -1.544 8.273) 12.348 34.477 ( -10.688 -2.002 -4.408) 11.734 98.429 ( 2.755 0.126 -0.140) 2.761 98.434 ( 2.631 0.153 0.816) 2.759 98.473 ( 2.642 -0.007 -0.823) 2.767 98.586 ( 3.787 -1.988 -4.744) 6.387 98.668 ( 0.829 1.819 1.839) 2.717 98.774 ( 2.900 -0.529 -3.491) 4.569 98.840 ( -0.228 -1.924 4.264) 4.684 99.006 ( 1.484 -4.734 -3.429) 6.031 100.304 ( 2.250 -1.687 5.511) 6.187 100.366 ( 3.841 -1.601 2.213) 4.713 100.452 ( 3.535 0.471 -2.091) 4.134 100.463 ( 2.605 -0.519 -2.521) 3.662 100.676 ( -1.708 2.733 4.079) 5.199 100.842 ( -2.979 4.486 -3.204) 6.267 100.931 ( -1.445 -2.586 0.265) 2.974 101.035 ( -1.237 0.038 -5.207) 5.352 102.475 ( -0.262 -0.136 1.378) 1.409 102.499 ( 0.607 2.607 -0.256) 2.689 102.669 ( 2.349 -2.009 1.080) 3.275 102.704 ( 1.967 -0.274 0.716) 2.111 102.855 ( -0.737 5.260 6.848) 8.666 103.194 ( -10.462 18.088 -6.499) 21.883 103.430 ( -6.510 -2.139 11.780) 13.628 104.075 ( -12.365 -3.726 -16.251) 20.757 ======================= Grid point 124 (46/72) ======================= q-point: ( 0.30 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.676 ( 30.895 26.889 15.588) 43.823 3.359 ( 20.123 4.553 26.166) 33.322 3.556 ( 24.255 18.021 -27.345) 40.753 3.739 ( 16.712 -3.390 20.883) 26.961 4.631 ( 2.314 -6.662 -21.812) 22.924 4.721 ( -0.577 -4.727 -21.002) 21.535 5.069 ( 1.337 -7.776 -25.427) 26.623 5.136 ( 12.518 -10.605 -14.483) 21.884 5.447 ( 52.962 1.477 30.065) 60.919 5.622 ( 47.425 -1.568 27.163) 54.676 5.957 ( -20.681 0.731 10.655) 23.276 6.146 ( 7.679 -1.287 10.620) 13.168 6.273 ( 8.861 1.357 -4.694) 10.119 6.293 ( 17.588 -0.905 -7.706) 19.224 6.633 ( -7.524 -1.338 2.500) 8.041 6.754 ( -6.029 -3.870 -7.199) 10.156 7.024 ( 7.443 2.994 11.774) 14.247 7.169 ( -0.092 1.342 1.404) 1.944 7.457 ( 6.136 1.494 -0.477) 6.333 7.638 ( 4.671 -4.038 -0.325) 6.183 7.772 ( 0.415 -0.160 0.990) 1.085 7.851 ( -0.140 0.871 -2.461) 2.615 8.030 ( 3.304 1.736 -6.158) 7.201 8.065 ( -2.679 4.558 6.781) 8.598 8.161 ( -0.620 2.603 7.197) 7.678 8.229 ( -1.474 -1.905 -4.804) 5.374 8.583 ( 1.947 -1.967 3.992) 4.858 8.662 ( 11.534 0.311 -2.973) 11.915 8.796 ( -9.800 -0.428 24.363) 26.264 8.845 ( -4.631 1.440 8.404) 9.703 8.912 ( -1.721 1.824 -1.048) 2.718 8.968 ( -3.813 4.066 0.382) 5.588 9.156 ( -7.692 -1.269 -0.960) 7.855 9.280 ( -11.108 -1.001 -6.321) 12.820 10.298 ( -15.553 -0.777 -16.315) 22.554 10.320 ( -10.258 -2.338 -21.731) 24.144 10.380 ( -13.147 0.808 -0.414) 13.179 10.488 ( -11.296 4.592 -6.762) 13.943 10.564 ( -9.008 0.906 4.442) 10.085 10.779 ( -21.493 1.795 -1.508) 21.621 10.934 ( -17.742 -1.156 3.543) 18.129 11.013 ( -10.643 -2.942 -9.118) 14.320 11.060 ( -15.200 0.374 -5.635) 16.215 11.261 ( -17.908 -0.907 -9.141) 20.127 11.647 ( 2.382 1.583 3.211) 4.300 11.725 ( 1.498 0.509 0.114) 1.586 11.788 ( -7.121 0.582 -0.789) 7.188 11.825 ( -1.797 1.121 3.503) 4.093 11.884 ( 4.514 1.014 5.939) 7.528 12.164 ( 12.467 -3.922 12.868) 18.341 12.272 ( 4.893 0.002 4.766) 6.831 12.362 ( 10.345 -3.054 7.575) 13.180 12.675 ( 13.793 1.591 5.566) 14.959 12.756 ( 11.589 -1.716 -4.738) 12.637 12.806 ( 3.279 0.738 -11.867) 12.334 12.856 ( 8.489 0.588 -12.501) 15.122 13.256 ( 12.418 -5.334 -12.473) 18.391 13.269 ( 9.118 -1.591 -11.348) 14.644 13.391 ( 16.349 -6.890 -0.623) 17.752 13.506 ( 12.081 -7.055 -3.499) 14.421 13.698 ( -0.849 5.640 9.345) 10.948 13.761 ( 1.698 6.725 5.984) 9.161 14.228 ( -9.242 3.004 -1.641) 9.856 14.333 ( 3.660 3.431 -3.528) 6.133 14.874 ( 2.056 5.930 2.001) 6.587 14.898 ( 3.051 3.663 0.716) 4.821 15.069 ( 2.083 -0.553 9.274) 9.521 15.244 ( 3.555 3.751 9.003) 10.380 15.262 ( 1.884 -0.030 1.596) 2.470 15.328 ( -0.305 1.342 1.240) 1.852 15.464 ( 0.213 -1.444 2.820) 3.175 15.610 ( -1.119 -3.584 8.413) 9.213 15.652 ( -4.150 -1.569 2.940) 5.322 15.725 ( -0.442 -2.748 -1.287) 3.066 15.793 ( 1.317 -5.949 3.634) 7.094 15.891 ( 0.962 -2.024 1.179) 2.533 15.943 ( -1.283 1.481 2.077) 2.855 16.209 ( -0.935 3.254 3.747) 5.050 16.265 ( 1.652 1.440 -6.442) 6.804 16.320 ( 2.375 -2.494 -3.993) 5.273 16.418 ( -2.717 4.899 -4.037) 6.905 16.586 ( -2.484 5.150 -5.263) 7.772 16.722 ( -1.820 -4.271 6.461) 7.956 16.879 ( -2.354 1.984 1.381) 3.374 17.067 ( -5.716 -1.401 -1.854) 6.170 17.158 ( 5.959 -1.564 0.482) 6.179 17.185 ( -1.276 -1.400 3.051) 3.591 17.454 ( -7.372 -11.682 -5.703) 14.944 17.489 ( 0.838 4.508 -0.035) 4.586 17.691 ( 3.471 -1.768 -0.294) 3.907 17.835 ( -2.502 1.488 -8.602) 9.081 17.944 ( -12.134 1.312 -7.712) 14.437 18.094 ( -5.109 9.360 1.544) 10.775 18.266 ( -14.004 1.795 -3.356) 14.512 18.584 ( -10.852 0.674 1.344) 10.956 18.637 ( -6.765 -5.437 -2.286) 8.975 19.591 ( 1.128 3.827 3.307) 5.182 19.645 ( 1.515 2.146 2.068) 3.344 19.808 ( -5.382 -1.729 1.212) 5.782 19.858 ( -7.110 -0.691 -1.329) 7.266 20.499 ( -1.158 4.557 13.607) 14.396 20.850 ( 10.187 -1.978 3.799) 11.050 20.976 ( -7.260 1.589 7.844) 10.806 21.241 ( -2.277 -1.275 -12.129) 12.406 24.404 ( -4.959 5.035 11.359) 13.378 24.532 ( 8.652 2.812 1.134) 9.168 24.733 ( -2.574 2.023 -2.451) 4.090 25.009 ( -7.732 -3.887 -11.745) 14.589 25.403 ( 0.919 6.522 1.992) 6.881 25.682 ( -10.497 4.418 -7.507) 13.641 26.180 ( -8.639 -5.521 5.737) 11.748 26.329 ( -6.963 -6.114 0.178) 9.268 27.014 ( 0.887 1.766 0.307) 2.000 27.063 ( 4.080 1.905 -2.154) 4.992 27.379 ( 7.141 -4.922 2.397) 8.998 27.495 ( 2.392 -5.043 -3.130) 6.399 27.691 ( -11.682 2.259 3.475) 12.396 27.791 ( -8.205 1.663 -1.658) 8.535 27.993 ( -9.264 -3.848 0.918) 10.073 28.030 ( -5.674 -2.772 -0.461) 6.332 29.759 ( 3.129 3.392 5.716) 7.347 30.040 ( 6.246 -2.936 3.648) 7.807 30.087 ( 7.187 2.736 -9.549) 12.261 30.211 ( -3.297 1.446 7.591) 8.401 30.348 ( 11.699 0.843 -7.173) 13.749 30.577 ( -2.910 -0.938 2.477) 3.935 30.679 ( -2.663 1.730 1.792) 3.646 31.057 ( 2.853 -4.045 -8.659) 9.974 31.658 ( 16.150 6.904 6.167) 18.615 31.864 ( 18.383 5.592 -2.197) 19.340 32.146 ( 6.551 1.664 6.178) 9.157 32.236 ( 11.872 -1.485 3.691) 12.520 32.252 ( 12.573 -3.938 0.818) 13.201 32.352 ( 8.703 0.648 1.738) 8.899 32.387 ( 5.344 4.690 2.368) 7.494 32.661 ( 2.933 -4.289 3.184) 6.094 32.720 ( 1.185 -4.886 -2.670) 5.693 32.937 ( 1.349 5.906 -11.610) 13.096 33.161 ( 4.405 -11.952 1.051) 12.781 33.377 ( -2.870 -3.315 -5.151) 6.764 33.794 ( -10.597 2.730 6.354) 12.654 33.989 ( -10.717 2.700 -0.767) 11.079 34.007 ( -10.259 -1.721 4.804) 11.458 34.223 ( -14.388 -1.585 -4.668) 15.210 98.476 ( 2.193 0.084 0.451) 2.240 98.494 ( 2.813 0.305 0.751) 2.928 98.523 ( 2.255 0.638 -0.364) 2.372 98.610 ( -0.087 -0.515 -0.990) 1.120 98.689 ( 1.030 2.483 1.274) 2.975 98.826 ( -1.006 -1.649 4.615) 5.003 98.860 ( 4.578 -3.163 -6.686) 8.698 99.027 ( 0.547 -4.710 -4.694) 6.672 100.356 ( 2.858 -0.375 5.578) 6.279 100.455 ( 4.920 -1.883 1.801) 5.568 100.512 ( 2.481 0.154 -1.998) 3.190 100.540 ( 4.691 0.446 -2.476) 5.323 100.638 ( -1.858 2.482 3.750) 4.865 100.779 ( -3.206 4.301 -2.791) 6.047 100.886 ( -3.090 -3.314 1.093) 4.661 100.984 ( -3.730 -0.555 -3.965) 5.471 102.481 ( 0.871 1.453 1.504) 2.265 102.524 ( 1.949 4.060 -0.944) 4.602 102.675 ( -2.197 4.888 3.916) 6.637 102.738 ( 2.282 -2.516 1.333) 3.649 102.914 ( 5.614 -0.338 -0.649) 5.661 103.012 ( -7.006 12.382 -3.663) 14.691 103.287 ( -7.540 -3.834 11.457) 14.241 103.805 ( -14.153 -4.683 -12.527) 19.472 ======================= Grid point 125 (47/72) ======================= q-point: ( 0.40 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.343 ( 34.603 17.854 11.392) 40.570 3.739 ( 17.943 3.376 8.950) 20.334 4.034 ( 18.830 11.524 -23.458) 32.213 4.089 ( 18.774 -1.674 5.459) 19.623 4.455 ( -17.024 2.696 -22.472) 28.321 4.670 ( -0.852 -0.858 -18.072) 18.112 5.057 ( -20.659 1.442 0.284) 20.711 5.123 ( 1.583 -8.548 -4.343) 9.718 5.655 ( 8.166 -11.197 -10.993) 17.689 5.740 ( -22.802 0.465 -7.919) 24.142 5.996 ( -20.224 -6.681 1.534) 21.354 6.307 ( -13.014 -7.109 -7.356) 16.553 6.559 ( 43.768 1.041 29.543) 52.816 6.643 ( 38.820 -0.569 29.361) 48.676 7.085 ( 26.336 -0.800 9.486) 28.003 7.187 ( 30.751 -0.892 5.043) 31.174 7.238 ( 12.866 2.295 16.690) 21.198 7.332 ( 15.020 1.216 9.429) 17.776 7.578 ( 5.726 0.711 6.467) 8.667 7.673 ( -1.797 -2.566 11.421) 11.843 7.722 ( -5.039 1.261 3.301) 6.154 7.800 ( -6.029 1.744 12.827) 14.280 8.053 ( 5.391 6.976 -4.283) 9.802 8.133 ( 0.238 1.854 7.269) 7.506 8.170 ( 1.444 1.222 9.794) 9.975 8.199 ( 7.468 0.206 5.911) 9.526 8.558 ( 0.592 -4.071 4.226) 5.898 8.615 ( -5.592 -2.518 -6.233) 8.744 8.823 ( -1.870 -0.127 -13.300) 13.431 8.845 ( -5.769 1.432 -2.542) 6.465 8.919 ( 6.771 0.566 -8.364) 10.776 9.018 ( 5.636 2.098 -0.465) 6.032 9.030 ( 0.758 1.526 2.929) 3.388 9.075 ( -8.264 0.226 -15.398) 17.477 9.789 ( -33.274 2.418 11.878) 35.413 9.894 ( -30.708 -0.279 4.701) 31.067 10.097 ( -11.169 -1.137 -31.022) 32.991 10.139 ( -14.859 0.712 -33.598) 36.744 10.305 ( -22.373 0.075 -10.478) 24.705 10.390 ( -22.052 -1.045 -7.389) 23.280 10.641 ( -3.462 3.370 -1.945) 5.209 10.782 ( -6.733 -0.754 0.049) 6.776 10.864 ( -4.728 -0.989 -4.811) 6.817 10.979 ( -8.502 -1.404 -11.837) 14.641 11.659 ( -0.286 1.907 3.460) 3.961 11.680 ( -1.171 2.101 5.447) 5.954 11.769 ( 1.299 -0.173 -1.358) 1.887 11.807 ( -0.564 -0.628 -2.798) 2.923 12.106 ( 12.796 0.764 18.849) 22.795 12.366 ( 2.674 -1.637 8.707) 9.254 12.448 ( 12.475 -5.351 18.856) 23.234 12.526 ( 5.948 -3.639 11.362) 13.331 12.832 ( 1.751 -0.577 -12.645) 12.779 12.915 ( 6.745 -1.698 -7.651) 10.340 12.949 ( 7.323 -1.028 -7.341) 10.420 13.030 ( 5.679 2.105 -7.966) 10.007 13.404 ( 7.698 -2.893 -7.934) 11.427 13.470 ( 3.215 0.730 3.011) 4.465 13.518 ( 4.638 1.347 -9.298) 10.478 13.813 ( 6.040 4.067 -0.956) 7.344 13.848 ( 16.940 -5.853 5.852) 18.854 13.900 ( 11.792 -7.417 -3.475) 14.358 14.027 ( -8.376 -0.541 3.792) 9.211 14.375 ( -0.909 0.664 -4.667) 4.801 14.907 ( 2.130 6.023 3.485) 7.277 14.939 ( 2.751 4.749 5.425) 7.717 15.088 ( -0.741 0.134 8.377) 8.411 15.212 ( -7.956 -2.228 8.455) 11.822 15.328 ( 1.344 2.586 1.747) 3.398 15.338 ( 3.663 5.082 2.088) 6.603 15.403 ( -4.864 4.076 4.197) 7.609 15.550 ( -4.866 3.946 3.332) 7.096 15.605 ( 2.000 -6.589 4.052) 7.990 15.780 ( -1.705 -3.236 5.701) 6.774 15.804 ( 4.104 -3.240 -2.506) 5.799 15.940 ( 2.427 -4.613 0.392) 5.227 15.976 ( 6.412 2.531 3.842) 7.892 16.127 ( -2.025 7.616 1.198) 7.971 16.297 ( -1.934 0.618 -2.971) 3.599 16.333 ( 0.948 1.783 -1.980) 2.828 16.512 ( 6.528 -0.582 -0.327) 6.562 16.620 ( 9.522 -0.531 -4.524) 10.556 16.684 ( -0.686 -3.640 0.307) 3.717 16.812 ( -4.029 2.568 -0.993) 4.880 16.892 ( -9.874 1.579 -1.048) 10.054 16.981 ( -12.708 3.191 -2.090) 13.268 17.082 ( -17.536 -3.688 6.262) 18.983 17.344 ( -6.479 -6.178 -3.332) 9.553 17.578 ( -3.516 3.480 -6.685) 8.317 17.609 ( 1.581 -2.753 -4.631) 5.615 17.792 ( -0.008 -2.436 -3.874) 4.577 17.829 ( -1.173 -1.413 -5.303) 5.612 18.040 ( 1.476 4.889 1.439) 5.306 18.159 ( 2.403 3.704 -5.759) 7.256 18.386 ( -8.968 -0.439 0.503) 8.993 18.485 ( -8.219 -3.584 -4.970) 10.252 19.613 ( 1.306 1.855 2.980) 3.745 19.677 ( 0.816 -0.206 1.655) 1.856 19.724 ( -2.875 -0.724 0.137) 2.968 19.755 ( -3.328 -0.562 -0.956) 3.508 20.522 ( 3.575 6.599 16.036) 17.705 20.805 ( -8.931 3.919 14.628) 17.581 21.025 ( 7.069 -3.476 -2.986) 8.424 21.203 ( -2.151 -4.234 -9.581) 10.694 24.376 ( 2.093 6.042 8.662) 10.766 24.610 ( -6.479 3.858 2.628) 7.986 24.705 ( 5.601 1.450 -3.739) 6.889 24.878 ( -5.090 -0.815 -11.137) 12.272 25.528 ( 4.529 1.800 -1.630) 5.139 25.594 ( 7.756 2.969 -5.201) 9.800 25.943 ( -14.036 -3.979 7.056) 16.205 26.136 ( -12.150 -6.735 -1.547) 13.978 27.081 ( 5.994 3.799 2.255) 7.446 27.197 ( 8.774 2.421 -3.332) 9.693 27.452 ( -10.919 2.492 3.745) 11.810 27.526 ( 6.869 -5.340 0.745) 8.733 27.570 ( 3.839 -3.783 -1.067) 5.494 27.610 ( -8.774 1.711 -2.833) 9.377 27.812 ( -8.605 -4.590 1.652) 9.892 27.890 ( -8.083 -3.402 -1.860) 8.965 29.830 ( 4.428 4.219 7.967) 10.044 30.053 ( -4.890 2.774 11.314) 12.634 30.221 ( 5.065 0.682 -4.688) 6.935 30.233 ( 7.026 -2.436 0.672) 7.467 30.514 ( -2.945 0.317 1.879) 3.508 30.568 ( 0.786 1.643 -4.296) 4.666 30.662 ( 8.145 0.393 -8.861) 12.042 31.035 ( -4.714 -3.827 -13.523) 14.824 31.999 ( 15.610 5.174 10.922) 19.741 32.169 ( 11.211 2.851 2.674) 11.873 32.254 ( 4.221 3.450 7.655) 9.398 32.377 ( 6.679 2.011 7.457) 10.211 32.427 ( 1.230 -0.329 2.218) 2.557 32.535 ( 11.967 -3.907 -1.569) 12.686 32.599 ( 8.996 -0.735 1.009) 9.082 32.708 ( -1.136 -2.280 -3.982) 4.728 32.760 ( 5.447 -0.435 -1.702) 5.724 32.986 ( 6.562 4.089 -11.925) 14.213 33.156 ( -8.678 -3.354 4.616) 10.386 33.340 ( 1.062 -4.392 -2.699) 5.263 33.636 ( -3.315 -0.821 1.353) 3.673 33.762 ( -11.074 1.927 -1.494) 11.339 33.813 ( -8.748 -3.209 2.599) 9.674 33.924 ( -14.518 -1.251 -3.240) 14.927 98.514 ( 1.531 0.359 0.527) 1.659 98.534 ( 0.987 0.436 1.452) 1.809 98.563 ( 1.749 1.366 -1.337) 2.591 98.604 ( -0.436 -0.221 -0.466) 0.676 98.715 ( 1.668 1.754 2.989) 3.846 98.796 ( -1.893 -1.014 5.133) 5.564 98.942 ( 3.458 -3.868 -7.339) 8.988 99.026 ( -0.739 -4.480 -5.818) 7.380 100.417 ( 3.284 0.768 5.086) 6.103 100.531 ( -0.184 1.067 2.207) 2.458 100.564 ( 3.868 -0.779 -0.189) 3.950 100.598 ( 1.626 0.396 -0.655) 1.797 100.660 ( 4.351 0.880 -0.909) 4.531 100.721 ( -2.012 2.774 -1.929) 3.932 100.809 ( -4.497 -3.268 1.414) 5.736 100.893 ( -5.202 -0.374 -2.775) 5.908 102.511 ( 2.109 2.651 1.597) 3.745 102.578 ( 3.398 5.512 -1.689) 6.692 102.620 ( -2.912 4.638 3.050) 6.268 102.745 ( -2.772 4.191 -1.961) 5.394 102.930 ( 1.037 2.638 2.723) 3.930 103.074 ( 8.904 -3.460 -3.584) 10.203 103.138 ( -7.142 -3.838 9.274) 12.319 103.526 ( -13.399 -4.866 -9.059) 16.891 ======================= Grid point 126 (48/72) ======================= q-point: (-0.50 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.993 ( -26.602 8.607 -1.177) 27.984 3.993 ( 26.602 8.607 -1.177) 27.984 4.063 ( -10.572 3.590 -9.051) 14.373 4.063 ( 10.572 3.590 -9.051) 14.373 4.519 ( -25.173 2.237 -1.615) 25.324 4.519 ( 25.173 2.238 -1.615) 25.324 4.943 ( -22.853 5.185 -15.210) 27.937 4.943 ( 22.853 5.185 -15.210) 27.937 5.622 ( -13.659 -10.125 1.773) 17.095 5.622 ( 13.659 -10.125 1.773) 17.095 5.960 ( -18.054 -10.767 -13.811) 25.152 5.960 ( 18.054 -10.767 -13.811) 25.152 7.206 ( -16.874 -0.859 27.845) 32.570 7.206 ( 16.874 -0.859 27.845) 32.570 7.263 ( -19.289 -0.008 29.379) 35.145 7.263 ( 19.289 -0.008 29.379) 35.145 7.492 ( -8.231 1.571 19.549) 21.270 7.492 ( 8.231 1.571 19.549) 21.270 7.533 ( -5.202 1.870 16.850) 17.734 7.533 ( 5.202 1.870 16.851) 17.734 7.880 ( -14.722 2.143 -0.460) 14.884 7.880 ( 14.722 2.143 -0.460) 14.884 7.997 ( -15.108 0.312 1.633) 15.199 7.997 ( 15.108 0.312 1.633) 15.199 8.454 ( -12.494 -0.335 -7.116) 14.382 8.454 ( 12.494 -0.335 -7.116) 14.382 8.543 ( -15.754 2.537 -7.125) 17.476 8.543 ( 15.754 2.537 -7.125) 17.476 8.752 ( -13.554 -2.237 -11.994) 18.236 8.752 ( 13.554 -2.237 -11.994) 18.236 8.872 ( -7.716 -0.962 -10.626) 13.167 8.872 ( 7.716 -0.962 -10.626) 13.167 9.231 ( -18.220 2.410 8.578) 20.282 9.231 ( 18.220 2.410 8.578) 20.282 9.337 ( -21.980 1.274 9.356) 23.923 9.337 ( 21.980 1.274 9.356) 23.923 9.986 ( -4.434 -0.560 -26.230) 26.608 9.986 ( 4.434 -0.560 -26.230) 26.608 10.049 ( -6.853 0.516 -27.494) 28.340 10.049 ( 6.853 0.516 -27.494) 28.340 10.676 ( -4.180 1.292 1.178) 4.531 10.676 ( 4.180 1.292 1.178) 4.531 10.866 ( -3.397 -1.682 -7.194) 8.131 10.866 ( 3.397 -1.682 -7.194) 8.131 11.664 ( -0.657 2.006 4.380) 4.862 11.664 ( 0.657 2.006 4.380) 4.862 11.793 ( -0.961 -0.522 -2.011) 2.290 11.793 ( 0.961 -0.522 -2.011) 2.290 12.320 ( -7.293 -0.322 16.541) 18.080 12.320 ( 7.293 -0.322 16.541) 18.080 12.586 ( -0.816 -5.292 15.282) 16.193 12.586 ( 0.816 -5.292 15.282) 16.193 12.904 ( -5.124 -0.705 -9.824) 11.102 12.904 ( 5.124 -0.705 -9.824) 11.102 13.055 ( -2.334 -0.975 -8.981) 9.330 13.055 ( 2.334 -0.975 -8.981) 9.330 13.501 ( -0.480 1.709 -3.612) 4.025 13.501 ( 0.480 1.709 -3.612) 4.025 13.696 ( -12.488 3.242 -5.050) 13.855 13.696 ( 12.488 3.242 -5.050) 13.855 13.978 ( -0.942 -7.521 5.370) 9.289 13.978 ( 0.942 -7.521 5.370) 9.289 14.240 ( -12.965 -4.353 -3.653) 14.156 14.240 ( 12.965 -4.353 -3.653) 14.156 15.006 ( -8.061 3.221 7.874) 11.720 15.006 ( 8.061 3.221 7.874) 11.720 15.030 ( -4.036 2.704 7.244) 8.722 15.030 ( 4.036 2.704 7.244) 8.722 15.341 ( -1.370 3.903 1.524) 4.408 15.341 ( 1.370 3.903 1.524) 4.408 15.439 ( -5.637 5.359 2.350) 8.125 15.439 ( 5.637 5.359 2.350) 8.125 15.685 ( -5.109 -4.182 5.673) 8.705 15.685 ( 5.109 -4.182 5.673) 8.705 15.918 ( -4.465 -0.192 -3.097) 5.437 15.918 ( 4.465 -0.192 -3.097) 5.437 16.119 ( -4.105 -0.650 4.081) 5.825 16.119 ( 4.105 -0.650 4.081) 5.825 16.291 ( -2.795 2.168 -3.909) 5.272 16.291 ( 2.795 2.168 -3.909) 5.272 16.670 ( -8.499 -2.773 2.494) 9.281 16.670 ( 8.499 -2.773 2.494) 9.281 16.749 ( -1.638 0.510 -1.513) 2.287 16.749 ( 1.638 0.510 -1.513) 2.287 16.802 ( -8.068 2.654 1.346) 8.600 16.802 ( 8.068 2.654 1.346) 8.600 16.975 ( -18.589 -2.361 -6.885) 19.963 16.975 ( 18.589 -2.361 -6.885) 19.963 17.681 ( -2.837 2.145 -1.029) 3.703 17.681 ( 2.837 2.145 -1.029) 3.703 17.746 ( -2.408 -1.492 -4.435) 5.262 17.746 ( 2.408 -1.492 -4.435) 5.262 18.164 ( -7.414 -0.426 0.052) 7.426 18.164 ( 7.414 -0.426 0.052) 7.426 18.324 ( -6.613 -0.978 -7.269) 9.876 18.324 ( 6.613 -0.978 -7.269) 9.876 19.648 ( -2.276 0.365 2.349) 3.291 19.648 ( 2.276 0.365 2.349) 3.291 19.716 ( -1.020 -0.618 -0.935) 1.516 19.716 ( 1.020 -0.618 -0.935) 1.516 20.636 ( -7.473 5.974 16.870) 19.394 20.636 ( 7.473 5.974 16.870) 19.394 21.139 ( -4.396 -4.511 -7.229) 9.588 21.139 ( 4.396 -4.511 -7.229) 9.588 24.468 ( -6.537 5.939 6.079) 10.722 24.468 ( 6.537 5.939 6.079) 10.722 24.796 ( -3.764 0.401 -9.614) 10.332 24.796 ( 3.764 0.401 -9.614) 10.332 25.666 ( -11.281 -0.381 5.124) 12.396 25.666 ( 11.281 -0.381 5.124) 12.396 25.864 ( -14.295 -3.574 -4.293) 15.347 25.864 ( 14.295 -3.574 -4.293) 15.347 27.241 ( -9.613 3.474 3.543) 10.818 27.241 ( 9.613 3.474 3.543) 10.818 27.395 ( -10.580 2.542 -3.863) 11.546 27.395 ( 10.580 2.542 -3.863) 11.546 27.657 ( -6.725 -5.307 1.378) 8.677 27.657 ( 6.725 -5.307 1.378) 8.677 27.720 ( -8.504 -3.842 -1.697) 9.485 27.720 ( 8.504 -3.842 -1.697) 9.485 29.937 ( -5.981 4.121 10.330) 12.628 29.937 ( 5.981 4.121 10.330) 12.628 30.307 ( -1.522 -3.240 -0.916) 3.695 30.307 ( 1.522 -3.240 -0.916) 3.695 30.497 ( -2.940 4.050 -0.700) 5.053 30.497 ( 2.940 4.050 -0.700) 5.053 30.884 ( -10.099 -2.749 -13.971) 17.457 30.884 ( 10.099 -2.749 -13.971) 17.457 32.206 ( -5.236 3.777 11.119) 12.858 32.206 ( 5.236 3.777 11.119) 12.858 32.378 ( -5.930 1.569 3.698) 7.163 32.378 ( 5.930 1.569 3.698) 7.163 32.571 ( -9.516 -2.076 1.277) 9.823 32.571 ( 9.516 -2.076 1.277) 9.823 32.693 ( -2.321 -1.807 -3.660) 4.696 32.693 ( 2.321 -1.807 -3.660) 4.696 32.906 ( -12.059 3.344 4.058) 13.156 32.906 ( 12.059 3.344 4.058) 13.156 33.242 ( -13.590 -1.276 -9.076) 16.392 33.242 ( 13.590 -1.276 -9.076) 16.392 33.663 ( -1.572 -2.548 0.919) 3.131 33.663 ( 1.572 -2.548 0.919) 3.131 33.697 ( -3.919 -1.582 -0.818) 4.305 33.697 ( 3.919 -1.582 -0.818) 4.305 98.536 ( -0.606 0.697 0.909) 1.296 98.536 ( 0.606 0.697 0.909) 1.296 98.591 ( -0.994 0.676 -1.054) 1.599 98.591 ( 0.994 0.676 -1.054) 1.599 98.754 ( -2.184 0.158 4.633) 5.124 98.754 ( 2.184 0.158 4.633) 5.124 98.997 ( -2.088 -4.195 -6.747) 8.215 98.997 ( 2.088 -4.195 -6.747) 8.215 100.484 ( -3.234 1.587 4.275) 5.591 100.484 ( 3.234 1.587 4.275) 5.591 100.622 ( -1.625 1.280 -2.306) 3.098 100.622 ( 1.625 1.280 -2.306) 3.098 100.712 ( -3.887 -2.119 1.377) 4.636 100.712 ( 3.887 -2.119 1.377) 4.636 100.785 ( -5.319 0.032 -2.026) 5.692 100.785 ( 5.319 0.032 -2.026) 5.692 102.561 ( -2.799 3.618 2.059) 5.016 102.561 ( 2.799 3.618 2.059) 5.016 102.660 ( -4.617 6.679 -2.559) 8.513 102.660 ( 4.617 6.679 -2.559) 8.513 103.008 ( -5.679 -2.777 6.738) 9.239 103.008 ( 5.679 -2.777 6.738) 9.239 103.278 ( -11.378 -4.426 -6.135) 13.663 103.278 ( 11.378 -4.426 -6.135) 13.663 ======================= Grid point 132 (49/72) ======================= q-point: ( 0.00 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.108 ( 0.000 13.222 34.583) 37.024 2.395 ( 0.000 -11.932 28.660) 31.045 2.863 ( 0.000 47.364 7.744) 47.993 3.290 ( 0.000 5.413 -15.051) 15.995 3.422 ( 0.000 2.378 64.200) 64.244 3.516 ( 0.000 3.538 -11.206) 11.751 3.555 ( 0.000 -11.300 57.398) 58.499 3.607 ( 0.000 34.951 -22.353) 41.488 3.998 ( 0.000 -35.019 6.351) 35.591 4.343 ( 0.000 -29.285 -17.381) 34.054 6.040 ( 0.000 -0.141 -43.107) 43.108 6.075 ( 0.000 -3.453 -40.736) 40.882 6.520 ( 0.000 1.977 17.135) 17.249 6.542 ( 0.000 -0.223 9.464) 9.467 7.080 ( 0.000 5.775 -4.911) 7.581 7.183 ( 0.000 -3.202 -4.241) 5.314 7.424 ( 0.000 1.747 0.407) 1.793 7.490 ( 0.000 -3.768 1.519) 4.062 7.498 ( 0.000 1.806 -0.212) 1.819 7.559 ( 0.000 -4.488 2.698) 5.237 7.691 ( 0.000 7.222 -4.427) 8.471 7.859 ( 0.000 -7.666 -6.104) 9.799 7.880 ( 0.000 5.717 -14.398) 15.492 8.002 ( 0.000 -5.036 -15.066) 15.885 8.260 ( 0.000 2.862 -5.516) 6.215 8.286 ( 0.000 0.817 -3.203) 3.306 8.324 ( 0.000 3.604 -9.879) 10.516 8.400 ( 0.000 -2.607 -7.072) 7.537 8.957 ( 0.000 10.246 7.018) 12.419 9.178 ( 0.000 -9.137 8.577) 12.532 9.226 ( 0.000 9.900 -4.118) 10.722 9.457 ( 0.000 -10.279 -2.347) 10.543 9.951 ( 0.000 4.866 29.794) 30.189 10.038 ( 0.000 -3.508 28.128) 28.345 10.126 ( 0.000 0.181 27.499) 27.500 10.138 ( 0.000 -1.093 28.732) 28.753 10.605 ( 0.000 -0.608 5.131) 5.167 10.616 ( 0.000 -2.451 3.292) 4.104 10.852 ( 0.000 2.979 6.142) 6.826 10.916 ( 0.000 -2.711 6.133) 6.705 10.987 ( 0.000 9.145 6.571) 11.261 11.245 ( 0.000 -12.819 7.285) 14.745 11.424 ( 0.000 6.464 4.092) 7.650 11.522 ( 0.000 -0.510 0.460) 0.687 11.576 ( 0.000 5.264 -19.336) 20.040 11.688 ( 0.000 -2.477 -21.087) 21.232 11.789 ( 0.000 -1.855 -15.684) 15.793 11.835 ( 0.000 8.909 -24.903) 26.448 11.906 ( 0.000 -6.224 -9.436) 11.303 12.047 ( 0.000 -6.459 -6.226) 8.971 12.074 ( 0.000 6.271 -13.717) 15.083 12.133 ( 0.000 -0.444 -11.146) 11.155 12.299 ( 0.000 1.880 -3.634) 4.091 12.317 ( 0.000 0.498 -2.891) 2.934 12.534 ( 0.000 1.937 -6.120) 6.419 12.624 ( 0.000 -5.597 -10.185) 11.622 13.464 ( 0.000 4.147 5.599) 6.967 13.498 ( 0.000 1.670 3.072) 3.496 13.533 ( 0.000 4.092 2.217) 4.654 13.581 ( 0.000 0.917 2.333) 2.507 13.909 ( 0.000 0.261 8.881) 8.885 13.943 ( 0.000 -2.391 6.764) 7.175 14.070 ( 0.000 4.495 -0.736) 4.555 14.202 ( 0.000 -6.408 -6.133) 8.870 14.758 ( 0.000 3.979 0.589) 4.022 14.783 ( 0.000 3.019 2.645) 4.014 15.035 ( 0.000 5.610 -9.143) 10.727 15.090 ( 0.000 -0.173 -2.318) 2.324 15.342 ( 0.000 -2.731 13.353) 13.630 15.345 ( 0.000 -1.233 0.314) 1.272 15.469 ( 0.000 -2.644 7.323) 7.786 15.471 ( 0.000 -0.789 0.800) 1.123 15.509 ( 0.000 4.302 9.730) 10.638 15.658 ( 0.000 -4.685 0.626) 4.727 15.830 ( 0.000 2.389 3.270) 4.050 15.870 ( 0.000 1.596 -5.298) 5.533 15.999 ( 0.000 -6.462 1.202) 6.573 16.020 ( 0.000 -3.239 -9.159) 9.715 16.121 ( 0.000 -2.471 -8.708) 9.052 16.244 ( 0.000 -9.268 -5.718) 10.890 16.380 ( 0.000 1.894 4.038) 4.460 16.448 ( 0.000 -4.652 8.332) 9.543 16.653 ( 0.000 8.367 -10.031) 13.063 16.818 ( 0.000 -5.828 -4.525) 7.378 16.959 ( 0.000 3.625 9.714) 10.369 17.033 ( 0.000 -3.825 3.533) 5.207 17.316 ( 0.000 5.716 -5.712) 8.081 17.367 ( 0.000 0.112 -6.251) 6.252 17.608 ( 0.000 12.950 10.606) 16.739 17.870 ( 0.000 -8.848 8.413) 12.209 18.149 ( 0.000 8.818 -12.993) 15.702 18.242 ( 0.000 0.097 -5.536) 5.537 18.590 ( 0.000 4.450 9.742) 10.710 18.725 ( 0.000 -7.580 7.406) 10.597 18.810 ( 0.000 3.674 -6.433) 7.408 18.921 ( 0.000 -5.675 -6.214) 8.415 19.703 ( 0.000 7.054 10.660) 12.782 19.886 ( 0.000 -9.432 11.442) 14.828 20.002 ( 0.000 14.415 -3.047) 14.734 20.321 ( 0.000 -14.792 -7.230) 16.464 20.355 ( 0.000 10.239 13.546) 16.980 20.555 ( 0.000 -7.422 14.282) 16.095 21.414 ( 0.000 13.028 -37.756) 39.940 21.547 ( 0.000 0.729 -32.043) 32.051 24.467 ( 0.000 17.725 6.758) 18.970 24.725 ( 0.000 19.039 -7.697) 20.536 24.943 ( 0.000 -24.918 9.049) 26.510 25.160 ( 0.000 -19.649 -4.598) 20.180 25.979 ( 0.000 5.372 17.287) 18.103 26.099 ( 0.000 -5.086 16.606) 17.368 26.479 ( 0.000 8.555 -8.888) 12.336 26.594 ( 0.000 -1.255 -10.113) 10.191 26.840 ( 0.000 0.982 6.498) 6.572 26.916 ( 0.000 -6.047 7.011) 9.258 27.291 ( 0.000 0.026 -12.664) 12.664 27.312 ( 0.000 -1.859 -10.919) 11.076 28.091 ( 0.000 1.099 4.383) 4.518 28.113 ( 0.000 -0.803 4.961) 5.025 28.265 ( 0.000 2.221 -2.563) 3.391 28.319 ( 0.000 -2.419 -3.817) 4.519 29.511 ( 0.000 2.753 4.689) 5.437 29.577 ( 0.000 -2.980 6.017) 6.714 29.737 ( 0.000 6.294 -8.060) 10.226 29.869 ( 0.000 -5.429 -9.961) 11.344 30.729 ( 0.000 6.339 8.111) 10.295 30.835 ( 0.000 4.040 -0.854) 4.129 30.837 ( 0.000 -2.254 5.559) 5.999 30.945 ( 0.000 -4.833 7.326) 8.777 31.023 ( 0.000 6.200 0.781) 6.249 31.235 ( 0.000 -10.917 3.145) 11.361 31.489 ( 0.000 1.938 -10.502) 10.679 31.514 ( 0.000 -0.606 -8.804) 8.825 32.020 ( 0.000 5.851 10.349) 11.888 32.209 ( 0.000 6.223 22.008) 22.871 32.221 ( 0.000 -12.132 11.480) 16.702 32.362 ( 0.000 -7.765 22.726) 24.016 32.399 ( 0.000 4.252 -9.005) 9.959 32.539 ( 0.000 -8.631 -3.599) 9.351 33.089 ( 0.000 8.981 -19.374) 21.355 33.285 ( 0.000 -8.734 -18.515) 20.471 34.271 ( 0.000 3.077 9.682) 10.160 34.341 ( 0.000 -3.181 11.157) 11.602 34.501 ( 0.000 6.285 -2.412) 6.732 34.621 ( 0.000 -4.567 -3.141) 5.543 98.345 ( 0.000 0.301 0.771) 0.828 98.351 ( 0.000 -0.289 0.688) 0.746 98.397 ( 0.000 0.245 -1.633) 1.652 98.400 ( 0.000 -0.045 -2.070) 2.071 98.711 ( 0.000 2.701 2.938) 3.990 98.778 ( 0.000 -3.105 2.999) 4.317 98.798 ( 0.000 2.540 -1.325) 2.865 98.867 ( 0.000 -3.730 -1.063) 3.879 100.228 ( 0.000 0.406 4.454) 4.472 100.252 ( 0.000 -1.423 3.390) 3.677 100.384 ( 0.000 -0.074 -3.085) 3.086 100.386 ( 0.000 -0.172 -2.936) 2.941 100.784 ( 0.000 3.385 4.434) 5.578 100.855 ( 0.000 -3.053 3.471) 4.623 101.038 ( 0.000 1.389 -8.243) 8.359 101.043 ( 0.000 0.585 -5.668) 5.699 102.487 ( 0.000 1.578 1.970) 2.524 102.538 ( 0.000 -2.768 1.564) 3.179 102.542 ( 0.000 2.283 -0.921) 2.462 102.595 ( 0.000 -2.277 -1.199) 2.574 103.170 ( 0.000 11.011 17.272) 20.484 103.385 ( 0.000 -8.132 19.144) 20.799 104.060 ( 0.000 15.188 -28.798) 32.558 104.278 ( 0.000 -5.769 -24.301) 24.977 ======================= Grid point 133 (50/72) ======================= q-point: ( 0.10 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.482 ( 30.267 11.227 32.802) 46.023 2.723 ( 26.975 -9.734 28.519) 40.444 2.919 ( 5.689 46.768 9.587) 48.078 3.574 ( 16.243 16.044 4.069) 23.191 3.624 ( 14.908 5.168 16.133) 22.566 3.658 ( 25.355 4.681 25.111) 35.991 3.779 ( 17.390 1.088 25.417) 30.816 3.852 ( 31.083 -2.803 -17.593) 35.826 4.068 ( 10.040 -26.549 7.244) 29.294 4.382 ( 4.141 -28.390 -16.874) 33.285 5.965 ( -6.535 -0.370 -38.672) 39.222 5.994 ( -7.280 -3.106 -38.218) 39.029 6.499 ( -2.026 2.715 20.412) 20.691 6.545 ( -0.262 -1.306 13.287) 13.354 7.064 ( -1.778 5.150 -3.149) 6.292 7.148 ( -6.124 -1.815 -2.688) 6.929 7.344 ( -7.562 2.944 -0.553) 8.134 7.404 ( -6.224 -1.974 -3.168) 7.257 7.462 ( -3.206 1.807 -1.154) 3.857 7.521 ( -3.450 -3.893 -2.068) 5.598 7.779 ( 0.711 2.867 -9.398) 9.851 7.794 ( 2.695 0.180 -9.604) 9.977 7.889 ( -3.139 -0.977 -12.152) 12.588 7.960 ( 1.308 -6.104 -9.488) 11.358 8.275 ( -2.416 4.848 -4.624) 7.122 8.315 ( -0.659 2.112 -4.548) 5.058 8.341 ( 5.966 1.283 -4.338) 7.487 8.398 ( 2.166 -2.761 -4.681) 5.850 8.976 ( 1.471 9.533 5.944) 11.330 9.182 ( -0.369 -4.483 6.161) 7.628 9.201 ( -2.678 4.215 -0.114) 4.996 9.387 ( -8.318 -8.338 5.965) 13.202 9.592 ( -20.518 3.695 30.254) 36.741 9.676 ( -18.230 -3.571 24.270) 30.563 10.359 ( 6.899 1.975 18.574) 19.912 10.425 ( 11.068 -2.314 21.736) 24.502 10.601 ( -0.364 1.455 -1.389) 2.045 10.668 ( 3.619 -3.874 -1.224) 5.441 10.829 ( -0.099 4.498 1.100) 4.631 10.911 ( 0.733 0.181 5.649) 5.699 11.011 ( 3.139 4.120 7.608) 9.203 11.230 ( -2.383 -11.122 3.684) 11.956 11.499 ( 5.252 4.821 2.138) 7.443 11.541 ( 1.489 0.944 -9.058) 9.228 11.588 ( -2.036 4.336 -5.437) 7.246 11.666 ( -0.859 -2.146 -11.076) 11.314 11.794 ( -0.645 1.621 -10.829) 10.968 11.878 ( 4.881 5.918 -18.873) 20.373 11.886 ( -1.891 -4.316 -6.353) 7.910 12.011 ( 0.176 -3.703 -12.997) 13.515 12.130 ( 5.728 1.016 -5.151) 7.770 12.182 ( 2.604 -1.399 -9.891) 10.324 12.344 ( 5.130 1.664 -3.190) 6.266 12.371 ( 4.757 -0.628 0.026) 4.798 12.604 ( 6.355 3.568 -5.364) 9.050 12.718 ( 8.160 -5.905 -10.287) 14.397 13.223 ( -13.518 3.887 -1.482) 14.143 13.255 ( -20.188 2.275 0.245) 20.317 13.370 ( -15.829 0.637 -2.331) 16.013 13.446 ( -16.745 -4.472 -3.461) 17.674 13.853 ( 0.532 5.921 12.276) 13.639 13.950 ( 2.016 -1.844 13.803) 14.071 14.205 ( 8.115 5.771 -3.829) 10.669 14.347 ( 7.663 -5.805 -4.381) 10.564 14.766 ( 1.715 6.304 3.594) 7.456 14.849 ( 5.017 1.693 1.510) 5.506 14.996 ( -0.974 5.308 -0.216) 5.401 15.160 ( 3.833 -4.068 -5.793) 8.049 15.331 ( -1.792 -0.065 9.523) 9.690 15.365 ( 1.793 0.513 -0.215) 1.878 15.426 ( -3.331 4.470 -0.111) 5.576 15.485 ( 1.290 -2.320 3.172) 4.136 15.538 ( 2.755 -2.263 11.807) 12.334 15.646 ( -1.028 -6.219 2.470) 6.770 15.848 ( 1.148 1.979 1.399) 2.682 15.872 ( -0.446 0.636 -5.176) 5.234 15.964 ( -1.843 -2.728 -3.691) 4.946 16.031 ( 2.042 -6.597 -1.067) 6.988 16.141 ( 1.576 0.543 -4.777) 5.060 16.247 ( 0.189 -6.284 -2.828) 6.893 16.457 ( 6.698 1.095 1.553) 6.962 16.535 ( 7.909 -6.337 3.714) 10.794 16.682 ( 2.412 8.561 -10.015) 13.394 16.833 ( 1.775 -3.645 -3.179) 5.152 16.946 ( -1.948 1.705 10.128) 10.454 16.985 ( -3.353 -3.537 1.910) 5.235 17.330 ( -0.920 2.448 -6.925) 7.402 17.351 ( -0.013 0.433 -7.106) 7.119 17.616 ( 0.661 12.593 10.136) 16.179 17.858 ( -1.569 -7.755 9.260) 12.180 18.127 ( -2.406 8.683 -11.358) 14.498 18.227 ( -2.105 -0.239 -5.073) 5.498 18.546 ( -4.115 4.968 8.383) 10.578 18.676 ( -4.559 -7.114 7.133) 11.057 18.758 ( -5.531 3.283 -6.671) 9.267 18.871 ( -4.859 -5.739 -6.389) 9.867 19.701 ( -0.218 7.108 8.848) 11.352 19.853 ( -2.781 -2.912 6.800) 7.903 19.974 ( -3.388 6.586 -0.884) 7.459 20.185 ( -9.658 -7.581 -3.437) 12.750 20.447 ( 5.809 3.341 11.135) 12.996 20.565 ( 1.128 -5.050 13.980) 14.907 21.340 ( -6.466 11.593 -29.039) 31.929 21.481 ( -6.228 -0.697 -27.981) 28.675 24.474 ( 0.731 14.818 6.856) 16.343 24.741 ( 1.160 15.556 -7.761) 17.423 24.850 ( -8.216 -17.331 10.563) 21.896 25.107 ( -4.640 -16.061 -5.246) 17.522 25.884 ( -8.361 5.957 16.236) 19.210 26.030 ( -5.917 -7.006 15.458) 17.973 26.402 ( -6.672 7.438 -8.992) 13.443 26.509 ( -6.514 -1.460 -8.975) 11.186 26.911 ( 4.396 -0.181 4.543) 6.324 26.949 ( 3.278 -4.206 6.459) 8.376 27.262 ( -2.323 1.219 -10.198) 10.530 27.317 ( 0.225 -3.740 -10.123) 10.794 28.055 ( -3.281 1.579 3.262) 4.889 28.092 ( -2.281 -1.596 3.878) 4.774 28.181 ( -7.219 2.559 -1.736) 7.853 28.246 ( -6.515 -3.095 -2.726) 7.711 29.594 ( 7.081 2.898 4.209) 8.732 29.665 ( 7.401 -3.227 4.537) 9.262 29.820 ( 7.428 5.623 -8.241) 12.438 29.937 ( 6.010 -4.751 -9.657) 12.327 30.639 ( -10.854 4.919 5.989) 13.337 30.704 ( -3.812 2.011 6.580) 7.866 30.818 ( -6.110 -3.572 2.503) 7.508 30.840 ( -0.454 -2.543 3.559) 4.397 31.251 ( 15.577 6.508 2.480) 17.063 31.361 ( 9.792 -2.106 1.059) 10.072 31.587 ( 10.195 0.732 -8.897) 13.552 31.648 ( 10.378 -3.246 -7.106) 12.990 32.079 ( 4.982 4.571 7.609) 10.179 32.189 ( 0.157 0.307 16.988) 16.992 32.307 ( 5.945 -3.389 12.196) 13.985 32.331 ( 1.039 -1.540 6.142) 6.417 32.524 ( 8.155 -6.225 7.398) 12.648 32.552 ( 1.265 -6.701 -3.437) 7.636 33.095 ( 0.531 8.671 -18.507) 20.444 33.285 ( -0.090 -8.367 -17.505) 19.403 34.218 ( -5.216 3.256 9.513) 11.327 34.289 ( -5.134 -3.179 10.848) 12.415 34.449 ( -5.098 6.112 -2.498) 8.342 34.566 ( -5.392 -4.470 -3.242) 7.718 98.377 ( 2.570 0.270 0.389) 2.613 98.387 ( 2.574 -0.524 0.108) 2.629 98.423 ( 2.384 0.064 -1.880) 3.037 98.428 ( 3.723 -0.521 -2.212) 4.362 98.711 ( 0.009 2.712 2.974) 4.025 98.772 ( -0.273 -1.984 2.747) 3.399 98.805 ( 0.496 1.710 -0.907) 1.998 98.877 ( 0.894 -4.078 -1.363) 4.392 100.246 ( 1.769 0.499 4.526) 4.885 100.272 ( 1.959 -1.543 3.413) 4.227 100.403 ( 1.891 0.136 -3.044) 3.587 100.407 ( 1.913 -0.284 -3.012) 3.579 100.776 ( -0.769 3.553 4.404) 5.710 100.851 ( -0.394 -3.211 3.328) 4.641 101.010 ( -2.143 2.384 -6.449) 7.202 101.043 ( -0.666 -0.648 -6.588) 6.653 102.491 ( 0.502 1.967 1.996) 2.847 102.547 ( 0.956 1.100 -0.125) 1.463 102.555 ( 1.229 -1.437 0.650) 2.000 102.613 ( 1.822 -2.623 -1.371) 3.476 103.132 ( -3.582 10.947 16.159) 19.844 103.347 ( -3.658 -8.102 18.087) 20.153 103.937 ( -11.361 16.012 -24.619) 31.489 104.181 ( -9.232 -7.009 -22.214) 25.057 ======================= Grid point 134 (51/72) ======================= q-point: ( 0.20 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.016 ( 19.203 22.340 25.064) 38.678 3.119 ( 16.699 27.817 21.029) 38.663 3.238 ( 21.959 -6.262 31.486) 38.895 3.767 ( 11.794 26.487 -17.561) 33.897 3.979 ( 9.458 -28.961 -0.475) 30.470 4.323 ( 35.045 -7.925 22.294) 42.284 4.415 ( 38.390 4.015 -5.328) 38.965 4.563 ( 22.840 -15.431 3.005) 27.727 4.588 ( 36.717 -4.355 -21.894) 42.970 4.609 ( 40.228 -4.266 7.869) 41.212 5.859 ( -0.394 -0.778 -20.846) 20.864 5.878 ( 0.817 -2.417 -23.796) 23.933 6.402 ( -9.694 3.937 19.933) 22.512 6.489 ( -7.295 -3.101 15.472) 17.384 6.892 ( -14.416 5.027 2.766) 15.515 6.983 ( -9.460 -2.472 0.098) 9.779 7.163 ( -13.038 4.150 -6.094) 14.978 7.239 ( -6.130 -2.140 -4.293) 7.784 7.426 ( 0.423 1.921 -5.461) 5.804 7.479 ( 2.017 -2.898 -5.583) 6.606 7.762 ( -0.026 0.586 -3.931) 3.975 7.804 ( -0.744 -2.973 -9.490) 9.972 7.962 ( 7.504 2.915 -14.425) 16.519 8.055 ( 6.683 -5.347 -14.479) 16.819 8.224 ( -2.485 4.578 4.587) 6.940 8.269 ( -2.690 0.982 4.067) 4.974 8.481 ( 7.412 0.933 -4.024) 8.485 8.494 ( 6.214 -0.540 -0.941) 6.308 8.986 ( -2.269 7.271 6.882) 10.266 9.059 ( -9.727 2.733 13.946) 17.222 9.099 ( -16.310 -2.545 27.647) 32.201 9.169 ( -3.797 -6.922 3.911) 8.810 9.261 ( -10.768 6.742 11.107) 16.875 9.413 ( -10.001 -5.991 2.099) 11.846 10.402 ( -1.287 1.944 4.874) 5.403 10.462 ( -4.601 -2.709 -4.516) 6.993 10.567 ( -4.444 2.405 -6.215) 8.010 10.645 ( -5.199 -4.191 -4.613) 8.116 10.809 ( -4.361 6.451 -7.983) 11.152 10.968 ( -1.421 -5.931 -4.285) 7.454 11.076 ( 2.970 5.443 10.399) 12.107 11.201 ( -4.071 -2.002 6.854) 8.219 11.438 ( -9.111 1.333 -3.251) 9.765 11.476 ( -14.638 -1.649 -2.769) 14.988 11.596 ( 4.507 2.282 -0.181) 5.055 11.638 ( 3.034 -1.183 -1.053) 3.422 11.796 ( 1.919 2.877 -1.941) 3.965 11.870 ( -0.137 -4.040 -0.232) 4.049 11.965 ( 1.625 1.501 -2.792) 3.562 12.026 ( -3.729 -2.623 -5.894) 7.452 12.213 ( 3.383 3.337 1.227) 4.907 12.270 ( 3.306 -1.276 -1.548) 3.867 12.494 ( 10.182 0.546 0.982) 10.244 12.511 ( 9.163 -0.022 -2.110) 9.403 12.760 ( 5.933 3.987 -5.663) 9.119 12.808 ( -5.763 0.493 -8.646) 10.402 12.981 ( 3.558 -2.576 -9.493) 10.461 12.996 ( -1.520 -3.544 -1.887) 4.293 13.162 ( -2.669 -1.294 -11.654) 12.026 13.196 ( -1.708 -4.476 -9.278) 10.442 13.870 ( -0.343 6.560 13.061) 14.620 13.941 ( -2.789 1.136 14.204) 14.520 14.328 ( 4.110 4.449 -5.725) 8.334 14.419 ( -1.037 -1.868 -5.447) 5.851 14.838 ( 5.690 6.300 4.861) 9.782 14.951 ( 4.507 2.112 2.490) 5.566 15.021 ( 3.109 2.252 5.910) 7.047 15.197 ( -0.940 -7.973 0.911) 8.079 15.292 ( -0.329 3.855 4.962) 6.292 15.378 ( -0.833 -1.521 4.364) 4.696 15.406 ( 1.441 6.074 -1.924) 6.532 15.516 ( 1.768 -1.116 -0.740) 2.217 15.587 ( 1.839 -3.625 5.742) 7.035 15.623 ( -0.928 -7.341 2.864) 7.934 15.821 ( -3.412 1.215 -3.622) 5.123 15.849 ( -1.410 -1.339 -4.548) 4.946 15.998 ( 3.667 2.981 1.526) 4.966 16.107 ( 5.255 -5.718 1.242) 7.865 16.173 ( 2.306 1.565 0.980) 2.954 16.252 ( 0.494 -4.360 -1.586) 4.665 16.601 ( 4.511 1.936 -0.599) 4.945 16.662 ( 1.092 -3.465 3.374) 4.958 16.716 ( 0.750 7.357 -4.197) 8.503 16.884 ( 2.210 -6.106 -4.705) 8.019 16.918 ( 4.315 1.379 4.406) 6.319 16.971 ( 1.962 -2.673 1.494) 3.637 17.274 ( -3.371 2.733 -8.108) 9.197 17.350 ( -1.293 -4.053 -9.692) 10.585 17.618 ( -0.914 9.653 7.979) 12.557 17.782 ( -6.331 -4.215 9.521) 12.186 18.037 ( -6.915 6.666 -8.512) 12.834 18.135 ( -7.385 -1.615 -4.324) 8.708 18.454 ( -4.274 7.301 3.536) 9.170 18.533 ( -10.899 0.997 1.209) 11.011 18.613 ( -7.189 -3.663 -1.936) 8.297 18.729 ( -9.237 -6.849 -5.600) 12.790 19.695 ( -0.363 6.129 5.329) 8.130 19.787 ( -3.678 3.151 2.550) 5.473 19.869 ( -6.261 -0.692 1.437) 6.461 19.975 ( -10.074 -5.190 -2.374) 11.578 20.566 ( 4.277 2.173 12.774) 13.645 20.620 ( 5.904 -1.904 12.282) 13.760 21.196 ( -7.282 7.779 -14.237) 17.783 21.327 ( -8.301 -2.818 -17.878) 19.911 24.501 ( 2.160 7.877 6.717) 10.575 24.643 ( -8.309 -2.822 11.194) 14.223 24.796 ( 1.442 7.195 -8.004) 10.859 24.999 ( -5.559 -9.681 -7.014) 13.184 25.708 ( -7.919 8.988 12.113) 17.036 25.900 ( -6.689 -6.648 10.654) 14.228 26.242 ( -9.186 3.105 -9.536) 13.600 26.351 ( -9.213 -5.049 -8.188) 13.320 26.987 ( 3.908 1.699 3.564) 5.556 27.039 ( 5.169 -2.117 4.855) 7.401 27.224 ( -0.753 1.471 -5.379) 5.627 27.323 ( 0.526 -6.358 -6.571) 9.158 27.960 ( -7.236 2.466 2.121) 7.933 27.981 ( -8.002 1.573 1.392) 8.273 28.059 ( -4.589 -1.658 0.218) 4.884 28.091 ( -8.436 -3.604 -1.019) 9.230 29.740 ( 6.650 3.379 3.902) 8.418 29.819 ( 7.359 -3.635 3.098) 8.773 29.996 ( 9.343 4.103 -9.375) 13.857 30.078 ( 7.767 -3.160 -9.484) 12.659 30.458 ( -6.793 5.371 9.695) 12.999 30.580 ( -6.070 -5.097 9.366) 12.270 30.775 ( 0.450 4.321 -2.275) 4.904 30.879 ( 3.296 -4.205 -1.355) 5.512 31.548 ( 14.088 7.419 1.893) 16.035 31.634 ( 17.107 3.030 1.957) 17.483 31.838 ( 13.920 -1.973 -6.278) 15.398 31.889 ( 13.425 -3.630 -3.740) 14.401 32.173 ( 3.884 4.140 6.791) 8.851 32.238 ( 5.032 0.961 10.045) 11.276 32.391 ( 4.907 1.822 3.607) 6.357 32.448 ( 7.112 -3.868 7.603) 11.106 32.584 ( 2.024 -3.231 -1.708) 4.177 32.693 ( 8.394 -11.079 6.912) 15.524 33.105 ( 0.323 7.959 -16.455) 18.281 33.279 ( -0.496 -7.545 -14.952) 16.755 34.071 ( -9.238 3.300 9.130) 13.401 34.143 ( -9.258 -3.138 9.800) 13.842 34.302 ( -9.381 5.476 -2.575) 11.163 34.409 ( -10.170 -4.082 -3.487) 11.500 98.432 ( 2.448 0.162 0.333) 2.476 98.436 ( 2.859 -0.070 0.964) 3.018 98.485 ( 3.620 1.275 -2.277) 4.463 98.530 ( 4.931 -2.673 -3.707) 6.723 98.716 ( 0.678 2.498 2.634) 3.693 98.772 ( 0.292 -1.916 2.839) 3.438 98.814 ( 0.345 1.991 -1.111) 2.306 98.897 ( 0.991 -4.754 -2.062) 5.276 100.296 ( 3.109 0.799 4.674) 5.670 100.327 ( 3.491 -1.809 3.417) 5.210 100.458 ( 3.195 0.022 -3.220) 4.537 100.459 ( 3.449 0.056 -2.916) 4.517 100.752 ( -1.676 3.838 4.258) 5.972 100.835 ( -1.324 -3.525 3.062) 4.853 100.955 ( -3.306 3.219 -5.156) 6.919 101.013 ( -2.367 -1.920 -5.712) 6.475 102.509 ( 1.313 2.985 2.068) 3.862 102.578 ( 2.197 4.023 -1.429) 4.801 102.591 ( 2.340 -3.894 1.714) 4.856 102.666 ( 3.317 -3.340 -1.768) 5.029 103.042 ( -4.989 10.153 13.230) 17.407 103.249 ( -5.923 -7.785 15.369) 18.218 103.661 ( -14.989 16.114 -16.837) 27.710 103.938 ( -14.146 -9.118 -17.494) 24.275 ======================= Grid point 135 (52/72) ======================= q-point: ( 0.30 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.370 ( 19.213 28.668 13.197) 36.948 3.489 ( 17.993 8.559 22.658) 30.172 3.647 ( 20.462 -1.311 22.507) 30.446 4.069 ( 17.733 23.534 -19.297) 35.223 4.188 ( 12.463 -26.566 2.321) 29.436 4.600 ( 3.909 -16.442 -21.567) 27.400 4.891 ( 9.939 -3.283 -33.545) 35.140 4.937 ( 0.478 -4.815 -36.806) 37.122 5.499 ( 49.101 3.074 28.817) 57.016 5.570 ( 48.616 -3.080 28.176) 56.275 6.012 ( -13.954 3.809 15.013) 20.847 6.093 ( 3.236 -3.218 11.685) 12.544 6.273 ( 23.996 0.769 -4.422) 24.412 6.304 ( 3.088 -0.686 -2.709) 4.165 6.619 ( -10.731 0.100 -1.060) 10.784 6.652 ( -11.914 -3.512 -6.641) 14.084 7.114 ( 5.961 3.852 10.669) 12.815 7.171 ( 2.652 -1.272 5.328) 6.086 7.504 ( 5.731 2.558 -1.682) 6.497 7.562 ( 4.666 -2.859 -0.103) 5.474 7.782 ( 1.858 1.360 -2.740) 3.579 7.829 ( 2.632 -2.356 -5.706) 6.711 8.073 ( 1.930 2.424 -7.126) 7.771 8.137 ( -1.257 -3.124 -3.679) 4.987 8.184 ( 0.285 4.997 7.997) 9.434 8.243 ( 1.810 0.394 7.148) 7.384 8.567 ( -1.537 1.180 8.341) 8.563 8.627 ( 3.054 -3.204 3.790) 5.828 8.823 ( -4.829 2.247 12.221) 13.331 8.857 ( -3.518 -0.506 7.970) 8.727 8.972 ( -3.027 3.486 0.037) 4.617 9.037 ( -7.362 -0.451 0.640) 7.404 9.140 ( -4.240 2.166 -3.004) 5.630 9.227 ( -8.328 -3.852 -4.674) 10.297 10.284 ( -12.215 -0.367 -23.330) 26.337 10.287 ( -12.123 -0.580 -19.693) 23.132 10.426 ( -11.820 3.415 5.381) 13.429 10.518 ( -9.595 -3.942 9.532) 14.088 10.617 ( -16.196 5.935 -12.728) 21.437 10.743 ( -19.452 -4.797 -8.691) 21.839 10.948 ( -15.235 0.811 2.109) 15.402 10.959 ( -12.533 -1.103 -0.769) 12.605 11.114 ( -17.175 5.082 -4.419) 18.449 11.221 ( -17.153 -3.358 -7.696) 19.098 11.687 ( 2.557 1.907 1.450) 3.504 11.726 ( 2.666 -1.150 -0.214) 2.911 11.794 ( -2.869 1.115 -2.807) 4.166 11.830 ( -5.834 -1.547 -1.666) 6.261 11.940 ( 6.313 4.879 16.733) 18.538 12.066 ( 10.157 -5.575 19.413) 22.608 12.272 ( 2.759 0.535 6.108) 6.724 12.302 ( 6.504 -2.010 6.334) 9.299 12.676 ( 9.470 1.016 -8.331) 12.654 12.731 ( 9.465 -2.565 -7.169) 12.148 12.879 ( 6.024 5.395 -3.983) 9.014 12.902 ( 11.727 3.329 -12.060) 17.148 13.124 ( 14.249 -5.253 -8.154) 17.237 13.159 ( 6.210 -7.937 -4.307) 10.960 13.302 ( 15.170 0.158 -10.798) 18.621 13.357 ( 14.313 -4.976 -6.706) 16.571 13.833 ( -2.871 5.416 12.789) 14.182 13.881 ( -1.839 2.010 12.594) 12.885 14.313 ( -7.619 4.393 -6.260) 10.795 14.376 ( -0.568 -0.362 -5.365) 5.407 14.963 ( 5.292 3.736 4.372) 7.815 15.012 ( 1.550 3.461 3.856) 5.409 15.085 ( 2.140 1.094 8.319) 8.659 15.166 ( -0.461 -5.839 6.061) 8.429 15.329 ( 3.419 2.034 3.488) 5.291 15.393 ( 2.710 -1.153 5.979) 6.665 15.425 ( 0.531 5.082 -2.071) 5.513 15.550 ( 1.152 0.507 -2.792) 3.063 15.616 ( 1.477 -2.979 1.142) 3.516 15.624 ( 1.097 -8.289 0.091) 8.362 15.743 ( -3.719 3.001 -1.952) 5.162 15.821 ( -1.540 -3.795 -1.349) 4.312 16.049 ( 2.028 7.165 4.898) 8.913 16.209 ( 4.369 -6.335 1.088) 7.772 16.269 ( 3.506 1.498 1.851) 4.238 16.279 ( 5.584 0.254 -1.726) 5.850 16.529 ( -7.380 3.293 1.745) 8.267 16.599 ( -4.695 -3.909 6.077) 8.616 16.735 ( -1.772 7.374 -3.732) 8.452 16.923 ( -1.863 -6.117 -6.095) 8.834 16.994 ( 1.614 2.131 2.515) 3.670 17.085 ( 6.990 -3.561 -0.188) 7.847 17.212 ( -3.668 2.040 -3.391) 5.396 17.274 ( -7.271 -4.346 -5.771) 10.250 17.598 ( -0.164 4.765 0.173) 4.771 17.668 ( -1.412 -1.349 0.429) 1.999 17.869 ( -8.414 2.025 -7.554) 11.487 17.922 ( -13.566 -2.468 -7.775) 15.829 18.284 ( -11.675 6.959 1.061) 13.633 18.375 ( -4.757 8.354 -0.986) 9.663 18.450 ( -9.313 -8.419 0.987) 12.593 18.552 ( -7.362 -6.016 -1.962) 9.708 19.684 ( -0.874 4.212 2.962) 5.223 19.718 ( -2.659 3.716 1.990) 4.983 19.763 ( -3.957 -2.158 2.125) 4.982 19.812 ( -6.155 -3.446 -0.187) 7.056 20.631 ( 3.310 6.780 11.779) 13.988 20.770 ( 7.545 -5.359 8.569) 12.613 21.056 ( -6.755 5.582 -2.653) 9.156 21.179 ( -6.181 -4.588 -9.938) 12.570 24.523 ( -1.714 4.727 9.142) 10.433 24.576 ( 3.720 0.221 5.112) 6.326 24.798 ( -1.728 4.041 -5.980) 7.421 24.905 ( -3.738 -5.245 -8.962) 11.036 25.600 ( -2.488 10.787 6.053) 12.617 25.771 ( -5.928 -0.193 4.447) 7.414 26.041 ( -10.615 -2.936 -6.070) 12.575 26.152 ( -10.392 -8.939 -5.812) 14.889 27.082 ( 5.521 4.639 2.349) 7.584 27.145 ( 5.567 3.396 0.843) 6.575 27.258 ( 4.427 -3.705 -0.384) 5.786 27.350 ( 2.475 -7.471 -3.211) 8.500 27.762 ( -10.795 4.045 3.268) 11.982 27.831 ( -8.129 0.288 1.186) 8.220 27.906 ( -9.515 -2.034 -0.842) 9.766 27.954 ( -6.813 -3.808 -1.568) 7.960 29.852 ( 4.825 4.726 5.189) 8.517 29.955 ( 6.406 -4.484 4.239) 8.895 30.159 ( 6.172 3.442 -7.743) 10.483 30.219 ( 3.629 -1.421 -3.404) 5.174 30.398 ( 2.977 4.023 4.048) 6.437 30.503 ( -1.376 -4.828 8.530) 9.897 30.782 ( -0.503 6.607 -6.398) 9.211 30.935 ( 1.311 -6.725 -7.790) 10.375 31.847 ( 15.854 9.362 5.527) 19.223 31.980 ( 16.350 1.614 2.820) 16.670 32.122 ( 14.037 -3.189 -2.412) 14.595 32.160 ( 12.608 -2.505 0.093) 12.855 32.264 ( 5.699 3.888 6.957) 9.798 32.352 ( 5.577 -2.101 5.394) 8.038 32.494 ( 4.701 3.269 1.108) 5.832 32.579 ( 5.142 -4.169 2.923) 7.237 32.647 ( 5.681 3.734 -0.663) 6.831 32.860 ( 8.450 -12.437 3.399) 15.415 33.104 ( -0.360 7.187 -14.172) 15.894 33.263 ( -1.196 -6.656 -11.597) 13.425 33.858 ( -11.679 3.243 8.460) 14.781 33.935 ( -11.096 -3.571 7.806) 14.028 34.082 ( -12.478 4.325 -2.458) 13.433 34.168 ( -13.679 -3.345 -3.576) 14.529 98.482 ( 2.448 0.406 1.027) 2.686 98.492 ( 2.743 -0.458 1.894) 3.365 98.552 ( 2.809 1.960 -2.218) 4.081 98.594 ( 1.345 -1.351 -1.797) 2.620 98.743 ( 1.742 1.759 1.110) 2.713 98.785 ( 0.969 -2.479 1.470) 3.040 98.821 ( 0.542 1.867 -2.036) 2.815 98.912 ( 0.381 -5.293 -2.919) 6.056 100.367 ( 3.932 1.379 4.666) 6.256 100.409 ( 4.560 -2.208 3.358) 6.078 100.525 ( 3.492 0.835 -2.920) 4.628 100.541 ( 4.449 -0.443 -3.120) 5.452 100.709 ( -2.501 3.791 3.926) 6.003 100.796 ( -2.679 -3.784 2.911) 5.474 100.880 ( -4.115 3.621 -3.993) 6.782 100.950 ( -3.892 -2.495 -4.509) 6.458 102.545 ( 2.354 4.200 2.274) 5.324 102.635 ( 3.414 4.999 -1.776) 6.309 102.649 ( 3.448 -4.134 1.890) 5.706 102.736 ( 3.005 -2.219 -1.204) 3.924 102.956 ( -2.759 6.417 8.378) 10.908 103.123 ( -6.342 -6.778 11.888) 15.083 103.372 ( -13.443 13.992 -10.443) 22.035 103.645 ( -14.660 -10.012 -12.562) 21.748 ======================= Grid point 136 (53/72) ======================= q-point: ( 0.40 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.777 ( 20.372 13.866 5.203) 25.187 3.830 ( 16.332 4.351 6.484) 18.103 4.096 ( 24.532 7.812 11.096) 28.035 4.310 ( 0.629 8.731 -19.867) 21.710 4.488 ( -8.883 -1.072 -21.127) 22.944 4.539 ( 19.642 -13.396 2.069) 23.865 4.920 ( 5.834 0.495 -21.998) 22.764 5.083 ( 2.440 -6.676 -13.767) 15.494 5.471 ( -14.694 1.195 2.897) 15.024 5.658 ( -22.280 -10.136 8.299) 25.846 5.945 ( -26.834 5.009 -13.561) 30.480 6.118 ( -20.804 -9.190 -10.957) 25.246 6.587 ( 41.682 1.546 30.671) 51.773 6.623 ( 40.229 -1.418 30.949) 50.776 7.091 ( 30.184 1.340 8.336) 31.342 7.136 ( 32.034 -2.486 7.018) 32.888 7.305 ( 11.493 2.279 16.388) 20.146 7.336 ( 11.864 -0.699 13.063) 17.661 7.603 ( 3.739 1.241 5.731) 6.954 7.629 ( 1.598 -1.383 8.050) 8.323 7.767 ( -3.208 2.613 3.902) 5.687 7.811 ( -4.672 -0.911 9.268) 10.419 8.122 ( 4.051 1.146 5.486) 6.915 8.160 ( 4.029 -1.990 5.143) 6.830 8.261 ( 6.115 6.906 2.211) 9.485 8.280 ( 3.518 5.696 -1.330) 6.825 8.462 ( -1.331 -3.665 4.308) 5.810 8.515 ( -6.427 -6.114 -2.779) 9.296 8.831 ( -4.779 0.831 -10.907) 11.937 8.851 ( -5.376 -0.686 -6.855) 8.739 8.967 ( 3.183 3.128 -7.789) 8.977 9.027 ( 5.887 -1.781 -6.008) 8.598 9.063 ( -1.672 1.576 -0.381) 2.329 9.082 ( -3.138 0.026 -3.684) 4.839 9.851 ( -31.726 2.711 10.519) 33.534 9.888 ( -30.306 -0.618 6.999) 31.109 10.086 ( -12.395 0.762 -29.998) 32.467 10.127 ( -15.672 -1.984 -28.208) 32.330 10.319 ( -20.831 1.321 -12.545) 24.353 10.357 ( -20.488 -1.828 -12.390) 24.013 10.725 ( -5.381 3.328 -1.196) 6.439 10.773 ( -2.826 -0.781 -0.582) 2.989 10.852 ( -7.480 1.437 -4.238) 8.717 10.926 ( -9.261 -3.562 -8.414) 13.010 11.706 ( 0.332 2.240 1.144) 2.537 11.735 ( -1.290 2.355 1.247) 2.961 11.751 ( 0.541 -1.487 -0.738) 1.746 11.781 ( -0.771 -1.718 -1.673) 2.519 12.162 ( 11.988 4.821 21.299) 24.912 12.305 ( 11.007 -7.184 23.040) 26.525 12.361 ( 3.695 1.523 9.377) 10.193 12.430 ( 4.776 -4.352 10.573) 12.391 12.834 ( 5.441 0.964 -11.850) 13.075 12.884 ( 5.956 -2.655 -12.677) 14.256 12.947 ( 2.403 3.893 -10.312) 11.281 13.054 ( 0.512 -2.639 -8.441) 8.859 13.364 ( 15.434 0.946 -2.419) 15.651 13.430 ( 11.801 -3.263 2.129) 12.428 13.544 ( 6.652 1.767 -4.614) 8.286 13.658 ( 12.535 -8.667 -2.935) 15.520 13.830 ( 4.467 2.709 6.253) 8.148 13.891 ( 3.831 -1.306 6.257) 7.452 14.125 ( -10.150 8.865 -5.342) 14.496 14.311 ( -6.606 -6.464 -5.280) 10.644 15.021 ( 1.566 2.741 5.910) 6.700 15.028 ( 0.931 2.955 6.192) 6.924 15.107 ( -0.029 1.386 7.544) 7.671 15.150 ( -2.736 -2.727 7.230) 8.197 15.396 ( 2.393 2.855 1.264) 3.934 15.441 ( 1.826 1.930 -4.070) 4.861 15.492 ( 5.662 1.879 5.876) 8.373 15.547 ( -0.460 6.156 -0.950) 6.246 15.607 ( -2.539 -1.607 -6.569) 7.224 15.678 ( 2.618 -5.599 5.528) 8.293 15.734 ( 3.591 -1.451 0.741) 3.944 15.790 ( -0.782 -6.297 3.364) 7.182 16.118 ( 4.986 8.866 4.468) 11.110 16.278 ( -1.217 5.157 1.177) 5.428 16.281 ( 0.957 -3.625 -0.869) 3.848 16.352 ( -1.249 -1.083 0.138) 1.659 16.505 ( 6.803 0.928 0.979) 6.936 16.568 ( 3.416 -4.042 2.747) 5.962 16.656 ( -2.943 3.107 -4.640) 6.312 16.791 ( -9.451 -7.056 -4.778) 12.726 16.952 ( -5.869 5.484 2.578) 8.436 17.009 ( -11.046 0.237 -0.894) 11.085 17.065 ( -10.528 2.119 0.987) 10.785 17.178 ( -7.790 -7.677 -2.630) 11.249 17.626 ( 2.543 2.799 -4.270) 5.704 17.649 ( -0.831 1.656 -5.322) 5.635 17.774 ( 2.990 0.243 -7.629) 8.198 17.801 ( -0.439 -1.118 -6.171) 6.287 18.125 ( -3.204 4.199 3.536) 6.356 18.234 ( -6.000 -0.955 -0.896) 6.141 18.311 ( -6.029 -0.603 -1.531) 6.250 18.406 ( -7.701 -4.567 -3.256) 9.527 19.666 ( -0.516 2.780 2.494) 3.770 19.689 ( -0.811 0.926 2.103) 2.437 19.706 ( -1.783 -0.741 1.303) 2.329 19.725 ( -2.664 -2.112 0.589) 3.451 20.708 ( 4.391 9.451 10.153) 14.550 20.899 ( 4.236 -6.120 4.153) 8.524 20.928 ( -4.939 5.201 4.072) 8.248 21.078 ( -4.192 -6.752 -5.156) 9.473 24.538 ( 3.150 7.762 5.832) 10.208 24.669 ( 4.557 -2.671 1.067) 5.389 24.738 ( -3.753 4.415 -1.530) 5.993 24.835 ( -3.468 -3.318 -7.803) 9.161 25.611 ( 2.942 5.846 1.586) 6.734 25.688 ( -1.258 3.414 0.054) 3.639 25.834 ( -9.567 -3.451 -1.005) 10.220 25.946 ( -10.005 -9.436 -3.776) 14.262 27.201 ( 6.540 6.852 2.076) 9.697 27.286 ( 8.735 5.176 -1.835) 10.318 27.374 ( 6.244 -7.231 1.033) 9.610 27.436 ( 6.245 -6.438 -1.737) 9.136 27.550 ( -9.858 4.802 3.485) 11.506 27.660 ( -8.647 -1.326 1.027) 8.808 27.706 ( -10.378 -0.672 -1.494) 10.506 27.794 ( -8.977 -4.952 -2.704) 10.603 29.949 ( 5.138 6.137 7.615) 11.048 30.077 ( 5.290 -4.199 7.032) 9.751 30.172 ( -3.445 2.730 8.792) 9.830 30.247 ( -0.023 -1.943 1.072) 2.220 30.513 ( 4.959 2.153 -1.566) 5.628 30.584 ( 9.725 -2.762 -9.534) 13.896 30.741 ( -3.610 7.257 -9.057) 12.154 30.910 ( -3.946 -7.282 -11.615) 14.266 32.151 ( 13.056 7.839 8.473) 17.427 32.248 ( 9.739 2.331 4.178) 10.851 32.336 ( 5.834 2.658 4.245) 7.689 32.385 ( 5.265 -0.822 4.274) 6.831 32.394 ( 10.284 -3.033 4.918) 11.796 32.445 ( 5.124 -3.130 4.056) 7.246 32.571 ( 2.351 0.093 0.253) 2.366 32.628 ( 0.644 -4.060 -0.220) 4.117 32.845 ( 12.343 7.239 -3.268) 14.678 33.023 ( 6.649 -7.492 -1.282) 10.099 33.102 ( 0.912 5.288 -11.862) 13.019 33.228 ( -2.312 -5.612 -7.513) 9.658 33.646 ( -7.581 2.162 5.519) 9.623 33.723 ( -9.161 -4.350 5.032) 11.321 33.818 ( -13.162 2.918 -1.972) 13.625 33.881 ( -14.262 -2.593 -2.704) 14.746 98.527 ( 2.074 0.821 1.434) 2.652 98.542 ( 2.104 -0.166 2.248) 3.083 98.588 ( 0.644 0.745 -0.272) 1.022 98.598 ( -0.426 -0.119 0.234) 0.500 98.771 ( 1.072 2.340 0.808) 2.697 98.797 ( -0.032 2.131 -0.589) 2.211 98.848 ( 2.063 -3.528 -3.795) 5.577 98.910 ( -0.607 -5.510 -3.746) 6.690 100.450 ( 4.327 2.167 4.394) 6.536 100.506 ( 5.013 -2.643 3.129) 6.474 100.583 ( 1.089 2.222 -0.322) 2.495 100.618 ( 2.111 -0.162 -2.169) 3.031 100.675 ( 0.979 1.476 0.939) 2.005 100.733 ( -3.074 -3.280 2.370) 5.082 100.796 ( -4.229 3.417 -3.210) 6.313 100.862 ( -4.805 -2.381 -3.560) 6.437 102.602 ( 3.288 5.258 2.780) 6.796 102.709 ( 3.782 1.403 0.393) 4.052 102.726 ( 4.009 0.093 -0.158) 4.013 102.742 ( -2.385 4.522 3.247) 6.056 102.981 ( 5.453 -3.489 -0.480) 6.492 103.009 ( -4.557 -4.294 7.940) 10.112 103.135 ( -10.080 10.360 -5.597) 15.500 103.368 ( -12.768 -9.406 -8.454) 17.971 ======================= Grid point 137 (54/72) ======================= q-point: (-0.50 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 90 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.135 ( -11.091 3.627 -9.891) 15.297 4.135 ( 11.092 3.627 -9.891) 15.298 4.159 ( -14.079 2.569 -10.030) 17.476 4.159 ( 14.079 2.569 -10.030) 17.476 4.678 ( -28.568 13.294 8.062) 32.525 4.678 ( 28.568 13.294 8.062) 32.525 4.977 ( -15.757 -7.740 1.298) 17.604 4.977 ( 15.757 -7.740 1.298) 17.603 5.456 ( -15.261 1.515 -11.309) 19.054 5.456 ( 15.261 1.515 -11.309) 19.055 5.673 ( -21.337 -13.845 -15.257) 29.660 5.673 ( 21.337 -13.845 -15.257) 29.660 7.207 ( -17.577 1.028 30.239) 34.991 7.207 ( 17.577 1.028 30.239) 34.991 7.241 ( -19.051 -1.674 30.857) 36.303 7.241 ( 19.051 -1.674 30.857) 36.303 7.529 ( -4.234 1.664 16.561) 17.174 7.529 ( 4.234 1.664 16.561) 17.174 7.554 ( -3.012 -0.224 16.891) 17.159 7.554 ( 3.012 -0.224 16.891) 17.159 7.947 ( -13.317 3.131 -2.708) 13.946 7.947 ( 13.317 3.131 -2.708) 13.946 7.993 ( -12.240 -0.938 -1.257) 12.340 7.993 ( 12.240 -0.938 -1.257) 12.340 8.479 ( -7.474 2.697 -7.870) 11.183 8.479 ( 7.474 2.697 -7.870) 11.183 8.550 ( -11.177 -2.567 -7.490) 13.697 8.550 ( 11.177 -2.567 -7.490) 13.698 8.747 ( -12.080 2.510 -10.442) 16.164 8.747 ( 12.080 2.510 -10.442) 16.164 8.823 ( -8.065 -3.344 -9.013) 12.549 8.823 ( 8.065 -3.344 -9.013) 12.549 9.297 ( -19.555 3.096 8.828) 21.677 9.297 ( 19.555 3.096 8.828) 21.677 9.345 ( -20.507 -0.919 9.600) 22.662 9.345 ( 20.507 -0.919 9.600) 22.662 9.996 ( -6.274 1.481 -26.029) 26.815 9.996 ( 6.274 1.481 -26.029) 26.815 10.036 ( -7.051 -1.634 -26.972) 27.926 10.036 ( 7.051 -1.634 -26.972) 27.926 10.728 ( -3.092 3.376 -0.509) 4.607 10.728 ( 3.092 3.376 -0.509) 4.607 10.808 ( -3.176 -3.443 -4.456) 6.465 10.808 ( 3.176 -3.443 -4.456) 6.465 11.716 ( -0.692 2.527 1.428) 2.984 11.716 ( 0.692 2.527 1.428) 2.984 11.767 ( -0.771 -1.873 -1.100) 2.305 11.767 ( 0.771 -1.873 -1.100) 2.305 12.346 ( -5.302 3.180 16.504) 17.624 12.346 ( 5.302 3.180 16.504) 17.624 12.454 ( -2.930 -6.091 16.799) 18.108 12.454 ( 2.930 -6.091 16.799) 18.108 12.920 ( -3.162 2.611 -10.580) 11.347 12.920 ( 3.162 2.611 -10.580) 11.347 13.003 ( -4.050 -3.845 -9.840) 11.314 13.003 ( 4.050 -3.845 -9.840) 11.314 13.561 ( -1.839 3.787 0.476) 4.237 13.561 ( 1.839 3.787 0.476) 4.237 13.669 ( -9.437 -5.464 1.070) 10.957 13.669 ( 9.437 -5.464 1.070) 10.957 13.950 ( -5.689 5.611 -1.307) 8.097 13.950 ( 5.689 5.611 -1.307) 8.097 14.108 ( -12.907 -7.310 -3.895) 15.336 14.108 ( 12.907 -7.310 -3.895) 15.336 15.066 ( -2.953 1.773 7.255) 8.031 15.066 ( 2.953 1.773 7.255) 8.031 15.076 ( -2.522 0.971 7.213) 7.703 15.076 ( 2.522 0.971 7.213) 7.703 15.440 ( -2.249 5.210 -2.369) 6.149 15.440 ( 2.249 5.210 -2.369) 6.149 15.543 ( -3.207 -1.739 -5.248) 6.392 15.543 ( 3.207 -1.739 -5.248) 6.392 15.639 ( -5.471 4.820 9.963) 12.346 15.639 ( 5.471 4.820 9.963) 12.346 15.804 ( -0.949 -7.867 1.574) 8.079 15.804 ( 0.949 -7.867 1.574) 8.079 16.214 ( -3.958 6.563 1.936) 7.905 16.214 ( 3.958 6.563 1.936) 7.905 16.309 ( -2.387 -1.230 -3.641) 4.524 16.309 ( 2.387 -1.230 -3.641) 4.524 16.621 ( -3.916 -0.472 1.609) 4.260 16.621 ( 3.916 -0.472 1.609) 4.260 16.684 ( -1.973 -5.308 0.426) 5.679 16.684 ( 1.973 -5.308 0.426) 5.679 16.879 ( -1.693 3.649 -1.705) 4.369 16.879 ( 1.693 3.649 -1.705) 4.369 16.935 ( -7.511 -1.499 -3.329) 8.352 16.935 ( 7.511 -1.499 -3.329) 8.352 17.728 ( -5.760 1.897 -2.715) 6.645 17.728 ( 5.760 1.897 -2.715) 6.645 17.749 ( -6.485 0.619 -2.305) 6.910 17.749 ( 6.485 0.619 -2.305) 6.910 18.171 ( -5.938 1.929 -1.590) 6.443 18.171 ( 5.938 1.929 -1.590) 6.443 18.256 ( -5.937 -4.690 -4.557) 8.832 18.256 ( 5.937 -4.690 -4.557) 8.832 19.669 ( -0.822 1.309 2.409) 2.863 19.669 ( 0.822 1.309 2.409) 2.863 19.696 ( -0.515 -1.085 0.679) 1.380 19.696 ( 0.515 -1.085 0.679) 1.380 20.806 ( -5.440 8.881 8.102) 13.195 20.806 ( 5.440 8.881 8.102) 13.195 20.998 ( -4.101 -8.027 -0.903) 9.059 20.998 ( 4.101 -8.027 -0.903) 9.059 24.630 ( -5.358 7.805 2.362) 9.758 24.630 ( 5.358 7.805 2.362) 9.758 24.766 ( -3.690 -3.820 -3.921) 6.601 24.766 ( 3.690 -3.820 -3.921) 6.601 25.681 ( -4.951 2.248 1.174) 5.563 25.681 ( 4.952 2.248 1.174) 5.563 25.765 ( -7.511 -4.829 -2.597) 9.300 25.765 ( 7.511 -4.829 -2.597) 9.300 27.351 ( -8.510 6.415 2.865) 11.035 27.351 ( 8.510 6.415 2.865) 11.035 27.477 ( -8.362 3.664 -2.949) 9.594 27.477 ( 8.362 3.664 -2.949) 9.594 27.514 ( -6.210 -6.023 1.851) 8.846 27.514 ( 6.210 -6.023 1.851) 8.846 27.608 ( -9.081 -5.896 -2.485) 11.108 27.608 ( 9.081 -5.896 -2.485) 11.108 30.056 ( -5.266 6.342 9.684) 12.718 30.056 ( 5.266 6.342 9.684) 12.718 30.198 ( -4.133 -6.171 7.159) 10.315 30.198 ( 4.133 -6.171 7.159) 10.315 30.630 ( -5.910 7.250 -8.696) 12.771 30.630 ( 5.910 7.250 -8.696) 12.771 30.784 ( -8.206 -6.199 -12.277) 16.016 30.784 ( 8.206 -6.199 -12.277) 16.016 32.320 ( -3.510 5.822 8.260) 10.698 32.320 ( 3.510 5.822 8.260) 10.698 32.403 ( -2.427 -0.533 5.100) 5.673 32.403 ( 2.427 -0.533 5.100) 5.673 32.535 ( -5.391 -0.075 1.844) 5.698 32.535 ( 5.391 -0.075 1.844) 5.698 32.602 ( -5.005 -5.150 1.910) 7.431 32.602 ( 5.005 -5.150 1.910) 7.431 33.033 ( -5.442 7.163 -3.637) 9.704 33.033 ( 5.442 7.163 -3.637) 9.704 33.176 ( -4.406 -5.044 -8.246) 10.623 33.176 ( 4.406 -5.044 -8.246) 10.623 33.625 ( -3.523 -0.273 1.362) 3.787 33.625 ( 3.523 -0.273 1.362) 3.787 33.651 ( -5.810 -2.180 -0.046) 6.206 33.651 ( 5.810 -2.180 -0.046) 6.206 98.560 ( -0.864 1.409 1.613) 2.310 98.560 ( 0.864 1.409 1.613) 2.310 98.590 ( -0.499 -0.945 1.190) 1.600 98.590 ( 0.499 -0.945 1.190) 1.600 98.789 ( -0.694 3.244 -0.390) 3.340 98.789 ( 0.694 3.244 -0.390) 3.340 98.887 ( -1.639 -5.275 -4.249) 6.969 98.887 ( 1.639 -5.275 -4.249) 6.969 100.535 ( -3.917 2.937 3.809) 6.203 100.535 ( 3.917 2.937 3.809) 6.203 100.603 ( -3.938 -2.873 2.019) 5.276 100.603 ( 3.938 -2.873 2.019) 5.276 100.716 ( -3.029 2.167 -2.002) 4.229 100.716 ( 3.029 2.167 -2.002) 4.229 100.764 ( -4.642 -1.798 -2.836) 5.729 100.764 ( 4.642 -1.798 -2.836) 5.729 102.674 ( -3.748 5.966 3.579) 7.903 102.674 ( 3.748 5.966 3.579) 7.903 102.769 ( -0.976 -0.215 0.801) 1.281 102.769 ( 0.976 -0.215 0.801) 1.281 102.986 ( -3.649 3.813 0.593) 5.311 102.986 ( 3.649 3.813 0.593) 5.311 103.141 ( -9.890 -7.690 -5.015) 13.494 103.141 ( 9.890 -7.690 -5.015) 13.494 ======================= Grid point 165 (55/72) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 36 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.725 ( 0.000 0.000 -37.792) 37.792 1.725 ( 0.000 0.000 37.792) 37.792 2.527 ( 0.000 0.000 -37.056) 37.056 2.527 ( 0.000 0.000 37.056) 37.056 3.212 ( 0.000 0.000 -23.304) 23.304 3.212 ( 0.000 0.000 23.304) 23.304 4.790 ( 0.000 0.000 -72.397) 72.397 4.790 ( 0.000 0.000 72.397) 72.397 4.820 ( 0.000 0.000 -9.357) 9.357 4.820 ( 0.000 0.000 9.357) 9.357 5.086 ( 0.000 0.000 -50.661) 50.661 5.086 ( 0.000 0.000 50.661) 50.661 6.817 ( 0.000 0.000 -9.909) 9.909 6.817 ( 0.000 0.000 9.909) 9.909 7.024 ( 0.000 0.000 -23.782) 23.782 7.024 ( 0.000 0.000 23.782) 23.782 7.351 ( 0.000 0.000 -4.340) 4.340 7.351 ( 0.000 0.000 4.340) 4.340 7.548 ( 0.000 0.000 -6.991) 6.991 7.548 ( 0.000 0.000 6.991) 6.991 7.713 ( 0.000 0.000 -10.759) 10.759 7.713 ( 0.000 0.000 10.759) 10.759 8.051 ( 0.000 0.000 -0.452) 0.452 8.051 ( 0.000 0.000 0.452) 0.452 8.060 ( 0.000 0.000 -2.041) 2.041 8.060 ( 0.000 0.000 2.041) 2.041 8.171 ( 0.000 0.000 -5.680) 5.680 8.171 ( 0.000 0.000 5.680) 5.680 8.854 ( 0.000 0.000 -7.839) 7.839 8.854 ( 0.000 0.000 7.839) 7.839 9.562 ( 0.000 0.000 -9.870) 9.870 9.562 ( 0.000 0.000 9.870) 9.870 10.445 ( 0.000 0.000 -31.108) 31.108 10.445 ( 0.000 0.000 31.108) 31.108 10.546 ( 0.000 0.000 -7.457) 7.457 10.546 ( 0.000 0.000 7.457) 7.457 10.666 ( 0.000 0.000 -16.114) 16.114 10.666 ( 0.000 0.000 16.114) 16.114 10.842 ( 0.000 0.000 -22.500) 22.500 10.842 ( 0.000 0.000 22.500) 22.500 11.066 ( 0.000 0.000 -16.270) 16.270 11.066 ( 0.000 0.000 16.270) 16.270 11.173 ( 0.000 0.000 -10.233) 10.233 11.173 ( 0.000 0.000 10.233) 10.233 11.346 ( 0.000 0.000 -15.357) 15.357 11.346 ( 0.000 0.000 15.357) 15.357 11.685 ( 0.000 0.000 -11.061) 11.061 11.685 ( 0.000 0.000 11.061) 11.061 11.941 ( 0.000 0.000 -2.485) 2.485 11.941 ( 0.000 0.000 2.485) 2.485 12.032 ( 0.000 0.000 -0.693) 0.693 12.032 ( 0.000 0.000 0.693) 0.693 12.377 ( 0.000 0.000 -7.697) 7.697 12.377 ( 0.000 0.000 7.697) 7.697 12.497 ( 0.000 0.000 -16.087) 16.087 12.497 ( 0.000 0.000 16.087) 16.087 13.357 ( 0.000 0.000 -5.701) 5.701 13.357 ( 0.000 0.000 5.701) 5.701 13.360 ( 0.000 0.000 -4.477) 4.477 13.360 ( 0.000 0.000 4.477) 4.477 14.090 ( 0.000 0.000 -0.389) 0.389 14.090 ( 0.000 0.000 0.389) 0.389 14.171 ( 0.000 0.000 -10.284) 10.284 14.171 ( 0.000 0.000 10.284) 10.284 14.693 ( 0.000 0.000 -6.116) 6.116 14.693 ( 0.000 0.000 6.116) 6.116 14.753 ( 0.000 0.000 -5.422) 5.422 14.753 ( 0.000 0.000 5.422) 5.422 15.359 ( 0.000 0.000 -3.458) 3.458 15.359 ( 0.000 0.000 3.458) 3.458 15.532 ( 0.000 0.000 -6.914) 6.914 15.532 ( 0.000 0.000 6.914) 6.914 15.830 ( 0.000 0.000 -0.509) 0.509 15.830 ( 0.000 0.000 0.509) 0.509 15.902 ( 0.000 0.000 -7.485) 7.485 15.902 ( 0.000 0.000 7.485) 7.485 16.126 ( 0.000 0.000 -8.710) 8.710 16.126 ( 0.000 0.000 8.710) 8.710 16.466 ( 0.000 0.000 -1.114) 1.114 16.466 ( 0.000 0.000 1.114) 1.114 16.603 ( 0.000 0.000 -0.800) 0.800 16.603 ( 0.000 0.000 0.800) 0.800 16.780 ( 0.000 0.000 -5.836) 5.836 16.780 ( 0.000 0.000 5.836) 5.836 16.888 ( 0.000 0.000 -9.484) 9.484 16.888 ( 0.000 0.000 9.484) 9.484 17.144 ( 0.000 0.000 -1.231) 1.231 17.144 ( 0.000 0.000 1.231) 1.231 17.441 ( 0.000 0.000 -5.772) 5.772 17.441 ( 0.000 0.000 5.772) 5.772 18.037 ( 0.000 0.000 -3.213) 3.213 18.037 ( 0.000 0.000 3.213) 3.213 18.715 ( 0.000 0.000 -6.078) 6.078 18.715 ( 0.000 0.000 6.078) 6.078 19.066 ( 0.000 0.000 -0.471) 0.471 19.066 ( 0.000 0.000 0.471) 0.471 19.515 ( 0.000 0.000 -1.602) 1.602 19.515 ( 0.000 0.000 1.602) 1.602 20.401 ( 0.000 0.000 -20.916) 20.916 20.401 ( 0.000 0.000 20.916) 20.916 20.500 ( 0.000 0.000 -19.297) 19.297 20.500 ( 0.000 0.000 19.297) 19.297 20.964 ( 0.000 0.000 -14.808) 14.808 20.964 ( 0.000 0.000 14.808) 14.808 24.110 ( 0.000 0.000 -2.162) 2.162 24.110 ( 0.000 0.000 2.162) 2.162 25.741 ( 0.000 0.000 -0.307) 0.307 25.741 ( 0.000 0.000 0.307) 0.307 26.089 ( 0.000 0.000 -7.786) 7.786 26.089 ( 0.000 0.000 7.786) 7.786 26.409 ( 0.000 0.000 -0.116) 0.116 26.409 ( 0.000 0.000 0.116) 0.116 27.017 ( 0.000 0.000 -13.828) 13.828 27.017 ( 0.000 0.000 13.828) 13.828 27.218 ( 0.000 0.000 -7.262) 7.262 27.218 ( 0.000 0.000 7.262) 7.262 28.147 ( 0.000 0.000 -4.648) 4.648 28.147 ( 0.000 0.000 4.648) 4.648 28.239 ( 0.000 0.000 -6.612) 6.612 28.239 ( 0.000 0.000 6.612) 6.612 29.509 ( 0.000 0.000 -1.748) 1.748 29.509 ( 0.000 0.000 1.748) 1.748 29.812 ( 0.000 0.000 -8.935) 8.935 29.812 ( 0.000 0.000 8.935) 8.935 30.666 ( 0.000 0.000 -2.411) 2.411 30.666 ( 0.000 0.000 2.411) 2.411 30.917 ( 0.000 0.000 -1.635) 1.635 30.917 ( 0.000 0.000 1.635) 1.635 31.220 ( 0.000 0.000 -1.847) 1.847 31.220 ( 0.000 0.000 1.847) 1.847 31.482 ( 0.000 0.000 -3.755) 3.755 31.482 ( 0.000 0.000 3.755) 3.755 32.119 ( 0.000 0.000 -9.789) 9.789 32.119 ( 0.000 0.000 9.789) 9.789 32.461 ( 0.000 0.000 -20.228) 20.228 32.461 ( 0.000 0.000 20.228) 20.228 32.607 ( 0.000 0.000 -2.839) 2.839 32.607 ( 0.000 0.000 2.839) 2.839 33.418 ( 0.000 0.000 -6.295) 6.295 33.418 ( 0.000 0.000 6.295) 6.295 34.192 ( 0.000 0.000 -5.875) 5.875 34.192 ( 0.000 0.000 5.875) 5.875 34.610 ( 0.000 0.000 -7.878) 7.878 34.610 ( 0.000 0.000 7.878) 7.878 98.359 ( 0.000 0.000 -1.571) 1.571 98.359 ( 0.000 0.000 1.571) 1.571 98.371 ( 0.000 0.000 -0.782) 0.782 98.371 ( 0.000 0.000 0.782) 0.782 98.703 ( 0.000 0.000 -2.393) 2.393 98.703 ( 0.000 0.000 2.393) 2.393 98.941 ( 0.000 0.000 -4.298) 4.298 98.941 ( 0.000 0.000 4.298) 4.298 100.342 ( 0.000 0.000 -2.650) 2.650 100.342 ( 0.000 0.000 2.650) 2.650 100.374 ( 0.000 0.000 -1.448) 1.448 100.374 ( 0.000 0.000 1.448) 1.448 100.750 ( 0.000 0.000 -3.364) 3.364 100.750 ( 0.000 0.000 3.364) 3.364 100.969 ( 0.000 0.000 -1.202) 1.202 100.969 ( 0.000 0.000 1.202) 1.202 102.522 ( 0.000 0.000 -1.165) 1.165 102.522 ( 0.000 0.000 1.165) 1.165 102.631 ( 0.000 0.000 -0.523) 0.523 102.631 ( 0.000 0.000 0.523) 0.523 102.991 ( 0.000 0.000 -2.320) 2.320 102.991 ( 0.000 0.000 2.320) 2.320 103.964 ( 0.000 0.000 -21.748) 21.748 103.964 ( 0.000 0.000 21.748) 21.748 ======================= Grid point 167 (56/72) ======================= q-point: ( 0.10 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.847 ( 12.275 0.000 -35.962) 37.999 1.847 ( 12.275 0.000 35.962) 37.999 2.912 ( 33.543 0.000 -34.993) 48.473 2.912 ( 33.543 0.000 34.993) 48.473 3.530 ( 28.243 0.000 -24.845) 37.616 3.530 ( 28.243 0.000 24.845) 37.616 4.782 ( 2.914 0.000 -25.186) 25.354 4.782 ( 2.914 0.000 25.186) 25.354 4.878 ( 3.911 0.000 -23.979) 24.296 4.878 ( 3.911 0.000 23.979) 24.296 5.167 ( 8.508 0.000 -35.713) 36.712 5.167 ( 8.508 0.000 35.713) 36.712 6.821 ( 0.569 0.000 -9.327) 9.345 6.821 ( 0.569 0.000 9.327) 9.345 6.958 ( -7.977 0.000 -17.359) 19.104 6.958 ( -7.977 0.000 17.359) 19.104 7.317 ( -3.411 0.000 -4.218) 5.425 7.317 ( -3.411 0.000 4.218) 5.425 7.395 ( -10.662 0.000 -3.971) 11.377 7.395 ( -10.662 0.000 3.971) 11.377 7.743 ( 1.235 0.000 -5.552) 5.688 7.743 ( 1.235 0.000 5.552) 5.688 8.039 ( -1.149 0.000 -4.924) 5.056 8.039 ( -1.149 0.000 4.924) 5.056 8.080 ( 1.791 0.000 -5.198) 5.498 8.080 ( 1.791 0.000 5.198) 5.498 8.231 ( 5.811 0.000 -2.254) 6.232 8.231 ( 5.811 0.000 2.254) 6.232 8.868 ( 1.064 0.000 -6.160) 6.252 8.868 ( 1.064 0.000 6.160) 6.252 9.530 ( -3.514 0.000 -8.124) 8.851 9.530 ( -3.514 0.000 8.124) 8.851 10.201 ( -17.383 0.000 -33.319) 37.580 10.201 ( -17.383 0.000 33.319) 37.580 10.331 ( -16.871 0.000 -24.969) 30.134 10.331 ( -16.871 0.000 24.969) 30.134 10.674 ( 1.643 0.000 -3.321) 3.705 10.674 ( 1.643 0.000 3.321) 3.705 10.925 ( -2.570 0.000 -18.393) 18.572 10.925 ( -2.570 0.000 18.393) 18.572 11.172 ( 6.172 0.000 -7.654) 9.833 11.172 ( 6.172 0.000 7.654) 9.833 11.273 ( 10.960 0.000 -5.489) 12.258 11.273 ( 10.960 0.000 5.489) 12.258 11.439 ( 9.323 0.000 -11.092) 14.490 11.439 ( 9.323 0.000 11.092) 14.490 11.698 ( -0.799 0.000 -3.656) 3.742 11.698 ( -0.799 0.000 3.656) 3.742 11.888 ( 4.432 0.000 -5.299) 6.908 11.888 ( 4.432 0.000 5.299) 6.908 12.181 ( 5.241 0.000 -1.346) 5.411 12.181 ( 5.241 0.000 1.346) 5.411 12.435 ( 6.471 0.000 -0.369) 6.481 12.435 ( 6.471 0.000 0.369) 6.481 12.585 ( 7.570 0.000 -9.357) 12.036 12.585 ( 7.570 0.000 9.357) 12.036 13.010 ( -17.882 0.000 -2.194) 18.016 13.010 ( -17.882 0.000 2.194) 18.016 13.479 ( -4.641 0.000 -1.623) 4.916 13.479 ( -4.641 0.000 1.623) 4.916 13.838 ( -9.619 0.000 -4.478) 10.611 13.838 ( -9.619 0.000 4.478) 10.611 14.313 ( 1.415 0.000 -8.225) 8.346 14.313 ( 1.415 0.000 8.225) 8.346 14.642 ( 3.175 0.000 -2.197) 3.861 14.642 ( 3.175 0.000 2.197) 3.861 14.916 ( 9.130 0.000 -3.436) 9.755 14.916 ( 9.130 0.000 3.436) 9.755 15.332 ( -2.057 0.000 -1.919) 2.813 15.332 ( -2.057 0.000 1.919) 2.813 15.546 ( 0.995 0.000 -7.333) 7.400 15.546 ( 0.995 0.000 7.333) 7.400 15.821 ( -0.241 0.000 -1.037) 1.065 15.821 ( -0.241 0.000 1.037) 1.065 15.928 ( 2.370 0.000 -5.808) 6.273 15.928 ( 2.370 0.000 5.808) 6.273 16.104 ( -2.311 0.000 -7.434) 7.785 16.104 ( -2.311 0.000 7.434) 7.785 16.384 ( -5.737 0.000 -1.141) 5.849 16.384 ( -5.737 0.000 1.141) 5.849 16.557 ( -4.598 0.000 -5.284) 7.004 16.557 ( -4.598 0.000 5.284) 7.004 16.863 ( 4.862 0.000 -0.535) 4.891 16.863 ( 4.862 0.000 0.535) 4.891 16.971 ( 7.819 0.000 -8.754) 11.738 16.971 ( 7.819 0.000 8.754) 11.738 17.157 ( 1.882 0.000 -0.171) 1.889 17.157 ( 1.882 0.000 0.171) 1.889 17.470 ( 2.709 0.000 -6.273) 6.833 17.470 ( 2.709 0.000 6.273) 6.833 18.019 ( -2.059 0.000 -3.571) 4.122 18.019 ( -2.059 0.000 3.571) 4.122 18.654 ( -6.631 0.000 -8.984) 11.166 18.654 ( -6.631 0.000 8.984) 11.166 18.992 ( -7.082 0.000 -1.008) 7.153 18.992 ( -7.082 0.000 1.008) 7.153 19.520 ( 0.780 0.000 -1.925) 2.077 19.520 ( 0.780 0.000 1.925) 2.077 20.203 ( -11.290 0.000 -12.646) 16.952 20.203 ( -11.290 0.000 12.646) 16.952 20.672 ( 7.893 0.000 -18.190) 19.829 20.672 ( 7.893 0.000 18.190) 19.829 20.965 ( 1.033 0.000 -13.056) 13.097 20.965 ( 1.033 0.000 13.056) 13.097 24.170 ( 5.823 0.000 -2.971) 6.537 24.170 ( 5.823 0.000 2.971) 6.537 25.528 ( -18.969 0.000 -6.033) 19.906 25.528 ( -18.969 0.000 6.033) 19.906 25.944 ( -12.797 0.000 -11.910) 17.482 25.944 ( -12.797 0.000 11.910) 17.482 26.419 ( 0.774 0.000 -1.398) 1.597 26.419 ( 0.774 0.000 1.398) 1.597 27.026 ( 0.220 0.000 -8.392) 8.395 27.026 ( 0.220 0.000 8.392) 8.395 27.272 ( 4.970 0.000 -7.536) 9.027 27.272 ( 4.970 0.000 7.536) 9.027 28.078 ( -6.254 0.000 -2.910) 6.898 28.078 ( -6.254 0.000 2.910) 6.898 28.229 ( -1.336 0.000 -5.200) 5.369 28.229 ( -1.336 0.000 5.200) 5.369 29.590 ( 6.972 0.000 -2.054) 7.269 29.590 ( 6.972 0.000 2.054) 7.269 29.874 ( 5.528 0.000 -7.582) 9.383 29.874 ( 5.528 0.000 7.582) 9.383 30.609 ( -4.528 0.000 -3.610) 5.791 30.609 ( -4.528 0.000 3.610) 5.791 30.975 ( 1.257 0.000 -7.622) 7.725 30.975 ( 1.257 0.000 7.622) 7.725 31.135 ( -0.152 0.000 -7.437) 7.439 31.135 ( -0.152 0.000 7.437) 7.439 31.650 ( 12.956 0.000 -2.941) 13.285 31.650 ( 12.956 0.000 2.941) 13.285 32.154 ( 2.751 0.000 -5.942) 6.548 32.154 ( 2.751 0.000 5.942) 6.548 32.455 ( 0.525 0.000 -18.853) 18.860 32.455 ( 0.525 0.000 18.853) 18.860 32.660 ( 3.960 0.000 -2.556) 4.713 32.660 ( 3.960 0.000 2.556) 4.713 33.401 ( -1.440 0.000 -6.311) 6.473 33.401 ( -1.440 0.000 6.311) 6.473 34.150 ( -4.041 0.000 -5.614) 6.917 34.150 ( -4.041 0.000 5.614) 6.917 34.551 ( -5.856 0.000 -7.762) 9.723 34.551 ( -5.856 0.000 7.762) 9.723 98.386 ( 1.658 0.000 -0.903) 1.888 98.386 ( 1.658 0.000 0.903) 1.888 98.415 ( 4.761 0.000 -1.163) 4.901 98.415 ( 4.761 0.000 1.163) 4.901 98.698 ( -0.304 0.000 -2.438) 2.457 98.698 ( -0.304 0.000 2.438) 2.457 98.950 ( 0.794 0.000 -4.642) 4.709 98.950 ( 0.794 0.000 4.642) 4.709 100.357 ( 1.658 0.000 -2.356) 2.881 100.357 ( 1.658 0.000 2.356) 2.881 100.392 ( 1.536 0.000 -2.011) 2.530 100.392 ( 1.536 0.000 2.011) 2.530 100.739 ( -1.064 0.000 -3.267) 3.436 100.739 ( -1.064 0.000 3.267) 3.436 100.976 ( 0.475 0.000 -0.385) 0.611 100.976 ( 0.475 0.000 0.385) 0.611 102.507 ( -1.151 0.000 -1.296) 1.734 102.507 ( -1.151 0.000 1.296) 1.734 102.659 ( 2.438 0.000 -0.401) 2.470 102.659 ( 2.438 0.000 0.401) 2.470 102.944 ( -4.062 0.000 -3.193) 5.167 102.944 ( -4.062 0.000 3.193) 5.167 103.919 ( -4.524 0.000 -20.441) 20.936 103.919 ( -4.524 0.000 20.441) 20.936 ======================= Grid point 169 (57/72) ======================= q-point: ( 0.20 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.213 ( 24.118 0.000 -31.410) 39.601 2.213 ( 24.118 0.000 31.410) 39.601 3.590 ( 27.508 0.000 -37.568) 46.562 3.590 ( 27.508 0.000 37.568) 46.562 4.089 ( 20.538 0.000 -33.223) 39.058 4.089 ( 20.538 0.000 33.223) 39.058 4.945 ( 8.102 0.000 -4.644) 9.338 4.945 ( 8.102 0.000 4.644) 9.338 5.097 ( 28.085 0.000 -23.388) 36.548 5.097 ( 28.085 0.000 23.388) 36.548 5.485 ( 25.704 0.000 -11.476) 28.150 5.485 ( 25.704 0.000 11.476) 28.150 6.644 ( -23.153 0.000 -1.269) 23.188 6.644 ( -23.153 0.000 1.269) 23.188 6.832 ( -1.203 0.000 -8.896) 8.977 6.832 ( -1.203 0.000 8.896) 8.977 7.143 ( -8.095 0.000 -15.756) 17.714 7.143 ( -8.095 0.000 15.756) 17.714 7.358 ( 4.262 0.000 -3.961) 5.819 7.358 ( 4.262 0.000 3.961) 5.819 7.774 ( 2.703 0.000 -4.902) 5.598 7.774 ( 2.703 0.000 4.902) 5.598 8.012 ( -1.474 0.000 -6.423) 6.590 8.012 ( -1.474 0.000 6.423) 6.590 8.117 ( 1.462 0.000 -4.113) 4.365 8.117 ( 1.462 0.000 4.113) 4.365 8.381 ( 8.674 0.000 -2.460) 9.016 8.381 ( 8.674 0.000 2.460) 9.016 8.881 ( 0.110 0.000 -2.815) 2.817 8.881 ( 0.110 0.000 2.815) 2.817 9.410 ( -8.717 0.000 -4.931) 10.015 9.410 ( -8.717 0.000 4.931) 10.015 9.834 ( -18.475 0.000 -19.106) 26.577 9.834 ( -18.475 0.000 19.106) 26.577 10.003 ( -16.126 0.000 -18.642) 24.650 10.003 ( -16.126 0.000 18.642) 24.650 10.623 ( -5.749 0.000 -4.916) 7.564 10.623 ( -5.749 0.000 4.916) 7.564 10.863 ( -4.020 0.000 -18.783) 19.208 10.863 ( -4.020 0.000 18.783) 19.208 11.152 ( -5.162 0.000 -0.121) 5.163 11.152 ( -5.162 0.000 0.121) 5.163 11.468 ( -4.811 0.000 -2.076) 5.240 11.468 ( -4.811 0.000 2.076) 5.240 11.597 ( 6.539 0.000 -6.302) 9.081 11.597 ( 6.539 0.000 6.302) 9.081 11.759 ( 13.817 0.000 -11.102) 17.725 11.759 ( 13.817 0.000 11.102) 17.725 11.989 ( -9.144 0.000 -4.987) 10.415 11.989 ( -9.144 0.000 4.987) 10.415 12.212 ( 9.503 0.000 -2.694) 9.877 12.212 ( 9.503 0.000 2.694) 9.877 12.562 ( 4.964 0.000 -8.472) 9.819 12.562 ( 4.964 0.000 8.472) 9.819 12.758 ( 7.926 0.000 -9.671) 12.504 12.758 ( 7.926 0.000 9.671) 12.504 12.835 ( 1.872 0.000 -13.667) 13.795 12.835 ( 1.872 0.000 13.667) 13.795 13.330 ( 0.279 0.000 -3.539) 3.550 13.330 ( 0.279 0.000 3.539) 3.550 13.757 ( -2.234 0.000 -4.708) 5.211 13.757 ( -2.234 0.000 4.708) 5.211 14.267 ( -3.557 0.000 -3.268) 4.831 14.267 ( -3.557 0.000 3.268) 4.831 14.765 ( 6.150 0.000 -1.343) 6.295 14.765 ( 6.150 0.000 1.343) 6.295 15.086 ( 8.009 0.000 -2.027) 8.261 15.086 ( 8.009 0.000 2.027) 8.261 15.298 ( -1.140 0.000 -0.782) 1.382 15.298 ( -1.140 0.000 0.782) 1.382 15.568 ( 1.283 0.000 -7.479) 7.588 15.568 ( 1.283 0.000 7.479) 7.588 15.834 ( 1.797 0.000 -4.389) 4.743 15.834 ( 1.797 0.000 4.389) 4.743 15.975 ( -0.103 0.000 -3.172) 3.174 15.975 ( -0.103 0.000 3.172) 3.174 16.038 ( -2.425 0.000 -2.862) 3.751 16.038 ( -2.425 0.000 2.862) 3.751 16.288 ( -3.293 0.000 -0.684) 3.363 16.288 ( -3.293 0.000 0.684) 3.363 16.433 ( -7.277 0.000 -6.325) 9.641 16.433 ( -7.277 0.000 6.325) 9.641 16.907 ( -0.080 0.000 -5.964) 5.965 16.907 ( -0.080 0.000 5.964) 5.965 17.164 ( 9.797 0.000 -8.129) 12.730 17.164 ( 9.797 0.000 8.129) 12.730 17.201 ( 1.346 0.000 -2.954) 3.247 17.201 ( 1.346 0.000 2.954) 3.247 17.547 ( 5.173 0.000 -4.725) 7.006 17.547 ( 5.173 0.000 4.725) 7.006 17.940 ( -6.143 0.000 -4.595) 7.671 17.940 ( -6.143 0.000 4.595) 7.671 18.424 ( -16.375 0.000 -13.236) 21.055 18.424 ( -16.375 0.000 13.236) 21.055 18.817 ( -9.446 0.000 -2.469) 9.763 18.817 ( -9.446 0.000 2.469) 9.763 19.553 ( 2.504 0.000 -2.203) 3.335 19.553 ( 2.504 0.000 2.203) 3.335 19.997 ( -9.169 0.000 -4.876) 10.385 19.997 ( -9.169 0.000 4.876) 10.385 20.745 ( 0.511 0.000 -2.824) 2.870 20.745 ( 0.511 0.000 2.824) 2.870 21.034 ( 4.771 0.000 -1.865) 5.122 21.034 ( 4.771 0.000 1.865) 5.122 24.327 ( 9.151 0.000 -3.862) 9.932 24.327 ( 9.151 0.000 3.862) 9.932 25.107 ( -20.224 0.000 -14.156) 24.686 25.107 ( -20.224 0.000 14.156) 24.686 25.656 ( -14.335 0.000 -13.431) 19.644 25.656 ( -14.335 0.000 13.431) 19.644 26.429 ( -0.270 0.000 -2.915) 2.928 26.429 ( -0.270 0.000 2.915) 2.928 27.014 ( -1.211 0.000 -2.105) 2.428 27.014 ( -1.211 0.000 2.105) 2.428 27.385 ( 5.694 0.000 -5.797) 8.126 27.385 ( 5.694 0.000 5.797) 8.126 27.922 ( -8.969 0.000 -0.263) 8.973 27.922 ( -8.969 0.000 0.263) 8.973 28.175 ( -4.356 0.000 -2.051) 4.815 28.175 ( -4.356 0.000 2.051) 4.815 29.744 ( 7.514 0.000 -5.014) 9.033 29.744 ( 7.514 0.000 5.014) 9.033 29.999 ( 6.811 0.000 -5.577) 8.803 29.999 ( 6.811 0.000 5.577) 8.803 30.511 ( -5.055 0.000 -8.452) 9.849 30.511 ( -5.055 0.000 8.452) 9.849 30.927 ( -2.330 0.000 -4.939) 5.461 30.927 ( -2.330 0.000 4.939) 5.461 31.327 ( 15.787 0.000 -1.628) 15.871 31.327 ( 15.787 0.000 1.628) 15.871 31.941 ( 15.446 0.000 -1.525) 15.521 31.941 ( 15.446 0.000 1.525) 15.521 32.214 ( 3.582 0.000 -0.130) 3.584 32.214 ( 3.582 0.000 0.130) 3.584 32.494 ( 2.880 0.000 -16.888) 17.131 32.494 ( 2.880 0.000 16.888) 17.131 32.731 ( 2.800 0.000 -0.147) 2.804 32.731 ( 2.800 0.000 0.147) 2.804 33.374 ( -0.960 0.000 -5.339) 5.424 33.374 ( -0.960 0.000 5.339) 5.424 34.038 ( -7.059 0.000 -5.499) 8.949 34.038 ( -7.059 0.000 5.499) 8.949 34.382 ( -10.802 0.000 -7.229) 12.998 34.382 ( -10.802 0.000 7.229) 12.998 98.429 ( 2.464 0.000 -0.378) 2.492 98.429 ( 2.464 0.000 0.378) 2.492 98.514 ( 4.176 0.000 -3.896) 5.711 98.514 ( 4.176 0.000 3.896) 5.711 98.703 ( 1.134 0.000 -3.449) 3.630 98.703 ( 1.134 0.000 3.449) 3.630 98.965 ( 0.508 0.000 -5.408) 5.432 98.965 ( 0.508 0.000 5.408) 5.432 100.410 ( 3.425 0.000 -2.335) 4.145 100.410 ( 3.425 0.000 2.335) 4.145 100.428 ( 2.097 0.000 -2.542) 3.295 100.428 ( 2.097 0.000 2.542) 3.295 100.710 ( -1.806 0.000 -3.073) 3.565 100.710 ( -1.806 0.000 3.073) 3.565 100.976 ( -0.702 0.000 -0.863) 1.113 100.976 ( -0.702 0.000 0.863) 1.113 102.485 ( -0.897 0.000 -1.004) 1.346 102.485 ( -0.897 0.000 1.004) 1.346 102.708 ( 1.447 0.000 -2.768) 3.124 102.708 ( 1.447 0.000 2.768) 3.124 102.867 ( -2.245 0.000 -3.163) 3.879 102.867 ( -2.245 0.000 3.163) 3.879 103.787 ( -8.442 0.000 -17.533) 19.459 103.787 ( -8.442 0.000 17.533) 19.459 ======================= Grid point 171 (58/72) ======================= q-point: ( 0.30 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.786 ( 32.338 0.000 -26.070) 41.538 2.786 ( 32.338 0.000 26.070) 41.538 3.915 ( 7.339 0.000 -33.192) 33.994 3.915 ( 7.339 0.000 33.192) 33.994 4.290 ( 2.668 0.000 -27.421) 27.551 4.290 ( 2.668 0.000 27.421) 27.551 5.112 ( 8.625 0.000 -4.246) 9.614 5.112 ( 8.625 0.000 4.246) 9.614 5.933 ( 42.351 0.000 -9.116) 43.321 5.933 ( 42.351 0.000 9.116) 43.321 6.069 ( -9.952 0.000 -3.801) 10.653 6.069 ( -9.952 0.000 3.801) 10.653 6.225 ( 25.757 0.000 -4.347) 26.121 6.225 ( 25.757 0.000 4.347) 26.121 6.694 ( -7.301 0.000 -2.585) 7.745 6.694 ( -7.301 0.000 2.585) 7.745 7.156 ( 8.504 0.000 -3.759) 9.298 7.156 ( 8.504 0.000 3.759) 9.298 7.504 ( 9.442 0.000 -9.331) 13.274 7.504 ( 9.442 0.000 9.331) 13.274 7.859 ( 4.822 0.000 -8.022) 9.359 7.859 ( 4.822 0.000 8.022) 9.359 7.979 ( -1.490 0.000 -7.071) 7.226 7.979 ( -1.490 0.000 7.071) 7.226 8.131 ( 0.338 0.000 -0.710) 0.786 8.131 ( 0.338 0.000 0.710) 0.786 8.561 ( 8.917 0.000 -4.847) 10.149 8.561 ( 8.917 0.000 4.847) 10.149 8.869 ( -1.741 0.000 -0.138) 1.746 8.869 ( -1.741 0.000 0.138) 1.746 9.182 ( -13.907 0.000 -3.834) 14.426 9.182 ( -13.907 0.000 3.834) 14.426 9.478 ( -16.406 0.000 -5.713) 17.373 9.478 ( -16.406 0.000 5.713) 17.373 9.692 ( -14.548 0.000 -8.225) 16.712 9.692 ( -14.548 0.000 8.225) 16.712 10.427 ( -16.000 0.000 -0.037) 16.000 10.427 ( -16.000 0.000 0.037) 16.000 10.781 ( -3.541 0.000 -15.299) 15.703 10.781 ( -3.541 0.000 15.299) 15.703 10.899 ( -21.911 0.000 -7.926) 23.300 10.899 ( -21.911 0.000 7.926) 23.300 11.106 ( -23.885 0.000 -8.035) 25.200 11.106 ( -23.885 0.000 8.035) 25.200 11.706 ( 3.973 0.000 -3.381) 5.217 11.706 ( 3.973 0.000 3.381) 5.217 11.771 ( -6.132 0.000 -0.820) 6.186 11.771 ( -6.132 0.000 0.820) 6.186 12.132 ( 19.514 0.000 -14.401) 24.253 12.132 ( 19.514 0.000 14.401) 24.253 12.406 ( 6.814 0.000 -8.945) 11.244 12.406 ( 6.814 0.000 8.945) 11.244 12.684 ( 8.185 0.000 -2.265) 8.493 12.684 ( 8.185 0.000 2.265) 8.493 12.911 ( 5.644 0.000 -7.712) 9.556 12.911 ( 5.644 0.000 7.712) 9.556 12.988 ( 13.884 0.000 -3.644) 14.354 12.988 ( 13.884 0.000 3.644) 14.354 13.574 ( 16.647 0.000 -2.437) 16.824 13.574 ( 16.647 0.000 2.437) 16.824 13.713 ( 0.458 0.000 -4.015) 4.041 13.713 ( 0.458 0.000 4.015) 4.041 14.206 ( -2.233 0.000 -2.495) 3.349 14.206 ( -2.233 0.000 2.495) 3.349 14.848 ( 2.521 0.000 -2.400) 3.481 14.848 ( 2.521 0.000 2.400) 3.481 15.228 ( 5.502 0.000 -1.927) 5.830 15.228 ( 5.502 0.000 1.927) 5.830 15.280 ( -0.994 0.000 -1.874) 2.122 15.280 ( -0.994 0.000 1.874) 2.122 15.594 ( 0.924 0.000 -6.426) 6.492 15.594 ( 0.924 0.000 6.426) 6.492 15.867 ( -6.541 0.000 -3.922) 7.627 15.867 ( -6.541 0.000 3.922) 7.627 15.902 ( 4.515 0.000 -8.733) 9.831 15.902 ( 4.515 0.000 8.733) 9.831 16.031 ( -2.975 0.000 -8.897) 9.382 16.031 ( -2.975 0.000 8.897) 9.382 16.271 ( 1.028 0.000 -0.020) 1.028 16.271 ( 1.028 0.000 0.020) 1.028 16.320 ( -0.600 0.000 -2.460) 2.532 16.320 ( -0.600 0.000 2.460) 2.532 16.869 ( -3.687 0.000 -4.842) 6.086 16.869 ( -3.687 0.000 4.842) 6.086 17.122 ( -8.186 0.000 -4.015) 9.118 17.122 ( -8.186 0.000 4.015) 9.118 17.372 ( 9.176 0.000 -6.995) 11.538 17.372 ( 9.176 0.000 6.995) 11.538 17.631 ( -3.692 0.000 -2.287) 4.343 17.631 ( -3.692 0.000 2.287) 4.343 17.802 ( -1.971 0.000 -4.919) 5.299 17.802 ( -1.971 0.000 4.919) 5.299 18.067 ( -16.130 0.000 -8.783) 18.366 18.067 ( -16.130 0.000 8.783) 18.366 18.629 ( -9.436 0.000 -4.105) 10.290 18.629 ( -9.436 0.000 4.105) 10.290 19.609 ( 2.710 0.000 -2.856) 3.937 19.609 ( 2.710 0.000 2.856) 3.937 19.840 ( -6.474 0.000 -1.159) 6.577 19.840 ( -6.474 0.000 1.159) 6.577 20.756 ( 1.469 0.000 -14.521) 14.596 20.756 ( 1.469 0.000 14.521) 14.596 21.095 ( 0.558 0.000 -4.060) 4.098 21.095 ( 0.558 0.000 4.060) 4.098 24.482 ( 4.413 0.000 -1.921) 4.813 24.482 ( 4.413 0.000 1.921) 4.813 24.805 ( -8.959 0.000 -11.348) 14.458 24.805 ( -8.959 0.000 11.348) 14.458 25.438 ( -5.602 0.000 -9.054) 10.646 25.438 ( -5.602 0.000 9.054) 10.646 26.370 ( -6.837 0.000 -4.582) 8.230 26.370 ( -6.837 0.000 4.582) 8.230 27.006 ( 1.491 0.000 -1.669) 2.238 27.006 ( 1.491 0.000 1.669) 2.238 27.492 ( 5.140 0.000 -3.056) 5.980 27.492 ( 5.140 0.000 3.056) 5.980 27.727 ( -10.338 0.000 -2.760) 10.700 27.727 ( -10.338 0.000 2.760) 10.700 28.056 ( -7.292 0.000 -0.717) 7.328 28.056 ( -7.292 0.000 0.717) 7.328 29.863 ( 4.723 0.000 -8.846) 10.028 29.863 ( 4.723 0.000 8.846) 10.028 30.176 ( 11.042 0.000 -6.783) 12.959 30.176 ( 11.042 0.000 6.783) 12.959 30.408 ( -5.368 0.000 -10.778) 12.041 30.408 ( -5.368 0.000 10.778) 12.041 30.890 ( -2.239 0.000 -11.569) 11.784 30.890 ( -2.239 0.000 11.569) 11.784 31.707 ( 21.058 0.000 -6.013) 21.899 31.707 ( 21.058 0.000 6.013) 21.899 32.223 ( 10.433 0.000 -3.691) 11.067 32.223 ( 10.433 0.000 3.691) 11.067 32.332 ( 10.030 0.000 -1.277) 10.110 32.332 ( 10.030 0.000 1.277) 10.110 32.551 ( 2.814 0.000 -15.339) 15.595 32.551 ( 2.814 0.000 15.339) 15.595 32.763 ( 0.214 0.000 -2.663) 2.672 32.763 ( 0.214 0.000 2.663) 2.672 33.367 ( 0.147 0.000 -2.534) 2.538 33.367 ( 0.147 0.000 2.534) 2.538 33.866 ( -10.084 0.000 -6.015) 11.741 33.866 ( -10.084 0.000 6.015) 11.741 34.136 ( -13.103 0.000 -5.398) 14.171 34.136 ( -13.103 0.000 5.398) 14.171 98.479 ( 2.373 0.000 -0.230) 2.385 98.479 ( 2.373 0.000 0.230) 2.385 98.563 ( 0.857 0.000 -3.054) 3.172 98.563 ( 0.857 0.000 3.054) 3.172 98.752 ( 3.557 0.000 -6.298) 7.233 98.752 ( 3.557 0.000 6.298) 7.233 98.965 ( -0.540 0.000 -6.284) 6.307 98.965 ( -0.540 0.000 6.284) 6.307 100.462 ( 1.992 0.000 -3.978) 4.449 100.462 ( 1.992 0.000 3.978) 4.449 100.500 ( 4.633 0.000 -1.201) 4.786 100.500 ( 4.633 0.000 1.201) 4.786 100.671 ( -1.813 0.000 -2.875) 3.399 100.671 ( -1.813 0.000 2.875) 3.399 100.941 ( -2.894 0.000 -1.158) 3.118 100.941 ( -2.894 0.000 1.158) 3.118 102.477 ( 0.260 0.000 -0.322) 0.414 102.477 ( 0.260 0.000 0.322) 0.414 102.682 ( -3.281 0.000 -3.881) 5.082 102.682 ( -3.281 0.000 3.881) 5.082 102.900 ( 4.797 0.000 -3.024) 5.671 102.900 ( 4.797 0.000 3.024) 5.671 103.595 ( -10.409 0.000 -14.114) 17.537 103.595 ( -10.409 0.000 14.114) 17.537 ======================= Grid point 173 (59/72) ======================= q-point: ( 0.40 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.454 ( 32.252 0.000 -20.044) 37.973 3.454 ( 32.252 0.000 20.044) 37.973 3.982 ( 0.512 0.000 -19.129) 19.135 3.982 ( 0.512 0.000 19.129) 19.135 4.316 ( 2.988 0.000 -14.867) 15.164 4.316 ( 2.988 0.000 14.867) 15.164 5.122 ( -17.874 0.000 -6.878) 19.152 5.122 ( -17.874 0.000 6.878) 19.152 5.644 ( -2.249 0.000 -1.733) 2.839 5.644 ( -2.249 0.000 1.733) 2.839 6.216 ( -16.658 0.000 -8.842) 18.859 6.216 ( -16.658 0.000 8.842) 18.859 6.971 ( 42.080 0.000 -7.777) 42.792 6.971 ( 42.080 0.000 7.777) 42.792 7.195 ( 38.771 0.000 -4.159) 38.994 7.195 ( 38.771 0.000 4.159) 38.994 7.425 ( 18.819 0.000 -0.280) 18.821 7.425 ( 18.819 0.000 0.280) 18.821 7.681 ( 5.074 0.000 -7.231) 8.834 7.681 ( 5.074 0.000 7.231) 8.834 7.874 ( 1.213 0.000 -5.062) 5.205 7.874 ( 1.213 0.000 5.062) 5.205 7.991 ( 0.615 0.000 -12.261) 12.277 7.991 ( 0.615 0.000 12.261) 12.277 8.198 ( 7.054 0.000 -3.595) 7.917 8.198 ( 7.054 0.000 3.595) 7.917 8.701 ( 1.882 0.000 -1.987) 2.737 8.701 ( 1.882 0.000 1.987) 2.737 8.736 ( -12.864 0.000 -0.525) 12.875 8.736 ( -12.864 0.000 0.525) 12.875 8.856 ( -18.749 0.000 -4.641) 19.315 8.856 ( -18.749 0.000 4.641) 19.315 9.285 ( 1.242 0.000 -0.630) 1.393 9.285 ( 1.242 0.000 0.630) 1.393 9.457 ( -7.201 0.000 -1.731) 7.406 9.457 ( -7.201 0.000 1.731) 7.406 9.957 ( -27.434 0.000 -6.966) 28.304 9.957 ( -27.434 0.000 6.966) 28.304 10.256 ( -36.613 0.000 -5.764) 37.064 10.256 ( -36.613 0.000 5.764) 37.064 10.736 ( -0.943 0.000 -10.426) 10.468 10.736 ( -0.943 0.000 10.426) 10.468 10.821 ( -6.728 0.000 -3.744) 7.700 10.821 ( -6.728 0.000 3.744) 7.700 11.720 ( -0.127 0.000 -4.022) 4.024 11.720 ( -0.127 0.000 4.022) 4.024 11.748 ( 0.377 0.000 -3.279) 3.301 11.748 ( 0.377 0.000 3.279) 3.301 12.469 ( 12.224 0.000 -17.464) 21.317 12.469 ( 12.224 0.000 17.464) 21.317 12.570 ( 9.916 0.000 -8.118) 12.815 12.570 ( 9.916 0.000 8.118) 12.815 12.789 ( 2.611 0.000 -5.332) 5.937 12.789 ( 2.611 0.000 5.332) 5.937 13.002 ( 1.073 0.000 -8.050) 8.121 13.002 ( 1.073 0.000 8.050) 8.121 13.273 ( 13.731 0.000 -1.028) 13.769 13.273 ( 13.731 0.000 1.028) 13.769 13.622 ( -2.649 0.000 -8.418) 8.825 13.622 ( -2.649 0.000 8.418) 8.825 14.006 ( 16.319 0.000 -2.895) 16.574 14.006 ( 16.319 0.000 2.895) 16.574 14.189 ( 0.713 0.000 -8.368) 8.398 14.189 ( 0.713 0.000 8.368) 8.398 14.901 ( 4.108 0.000 -1.664) 4.432 14.901 ( 4.108 0.000 1.664) 4.432 15.230 ( -5.164 0.000 -2.631) 5.796 15.230 ( -5.164 0.000 2.631) 5.796 15.298 ( 2.490 0.000 -0.362) 2.517 15.298 ( 2.490 0.000 0.362) 2.517 15.549 ( -7.059 0.000 -0.886) 7.114 15.549 ( -7.059 0.000 0.886) 7.114 15.783 ( -0.260 0.000 -0.949) 0.984 15.783 ( -0.260 0.000 0.949) 0.984 15.922 ( -5.560 0.000 -2.791) 6.221 15.922 ( -5.560 0.000 2.791) 6.221 16.027 ( 7.814 0.000 -0.894) 7.865 16.027 ( 7.814 0.000 0.894) 7.865 16.265 ( -0.456 0.000 -3.191) 3.223 16.265 ( -0.456 0.000 3.191) 3.223 16.491 ( 14.383 0.000 -3.412) 14.782 16.491 ( 14.383 0.000 3.412) 14.782 16.774 ( -4.945 0.000 -2.542) 5.560 16.774 ( -4.945 0.000 2.542) 5.560 16.899 ( -12.340 0.000 -2.503) 12.591 16.899 ( -12.340 0.000 2.503) 12.591 17.290 ( -22.282 0.000 -9.720) 24.310 17.290 ( -22.282 0.000 9.720) 24.310 17.541 ( 7.336 0.000 -6.676) 9.919 17.541 ( 7.336 0.000 6.676) 9.919 17.824 ( -7.222 0.000 -0.187) 7.224 17.824 ( -7.222 0.000 0.187) 7.224 17.972 ( 10.819 0.000 -4.135) 11.582 17.972 ( 10.819 0.000 4.135) 11.582 18.432 ( -10.443 0.000 -4.025) 11.192 18.432 ( -10.443 0.000 4.025) 11.192 19.653 ( 1.669 0.000 -3.200) 3.609 19.653 ( 1.669 0.000 3.200) 3.609 19.738 ( -3.752 0.000 -1.014) 3.887 19.738 ( -3.752 0.000 1.014) 3.887 20.819 ( 4.856 0.000 -17.956) 18.601 20.819 ( 4.856 0.000 17.956) 18.601 21.052 ( -4.481 0.000 -11.439) 12.285 21.052 ( -4.481 0.000 11.439) 12.285 24.509 ( 0.920 0.000 -10.668) 10.707 24.509 ( 0.920 0.000 10.668) 10.707 24.687 ( -5.611 0.000 -8.080) 9.837 24.687 ( -5.611 0.000 8.080) 9.837 25.494 ( 10.875 0.000 -1.302) 10.952 25.494 ( 10.875 0.000 1.302) 10.952 26.141 ( -15.437 0.000 -6.237) 16.649 26.141 ( -15.437 0.000 6.237) 16.649 27.098 ( 7.459 0.000 -3.633) 8.297 27.098 ( 7.459 0.000 3.633) 8.297 27.503 ( -10.583 0.000 -4.036) 11.327 27.503 ( -10.583 0.000 4.036) 11.327 27.609 ( 5.378 0.000 -0.425) 5.395 27.609 ( 5.378 0.000 0.425) 5.395 27.898 ( -8.159 0.000 -1.748) 8.344 27.898 ( -8.159 0.000 1.748) 8.344 29.968 ( 6.234 0.000 -10.878) 12.538 29.968 ( 6.234 0.000 10.878) 12.538 30.263 ( -6.591 0.000 -12.296) 13.951 30.263 ( -6.591 0.000 12.296) 13.951 30.438 ( 11.659 0.000 -9.520) 15.052 30.438 ( 11.659 0.000 9.520) 15.052 30.813 ( -5.729 0.000 -12.748) 13.976 30.813 ( -5.729 0.000 12.748) 13.976 32.108 ( 17.384 0.000 -5.241) 18.157 32.108 ( 17.384 0.000 5.241) 18.157 32.360 ( 4.372 0.000 -5.901) 7.344 32.360 ( 4.372 0.000 5.901) 7.344 32.509 ( 3.777 0.000 -6.464) 7.487 32.509 ( 3.777 0.000 6.464) 7.487 32.675 ( 6.892 0.000 -4.070) 8.004 32.675 ( 6.892 0.000 4.070) 8.004 32.757 ( 4.436 0.000 -2.199) 4.951 32.757 ( 4.436 0.000 2.199) 4.951 33.336 ( -6.302 0.000 -5.035) 8.066 33.336 ( -6.302 0.000 5.035) 8.066 33.673 ( -6.037 0.000 -3.223) 6.843 33.673 ( -6.037 0.000 3.223) 6.843 33.888 ( -11.232 0.000 -2.030) 11.414 33.888 ( -11.232 0.000 2.030) 11.414 98.520 ( 1.749 0.000 -0.849) 1.944 98.520 ( 1.749 0.000 0.849) 1.944 98.564 ( -0.461 0.000 -2.026) 2.078 98.564 ( -0.461 0.000 2.026) 2.078 98.828 ( 3.716 0.000 -7.739) 8.585 98.828 ( 3.716 0.000 7.739) 8.585 98.942 ( -1.783 0.000 -7.127) 7.347 98.942 ( -1.783 0.000 7.127) 7.347 100.502 ( 2.067 0.000 -3.966) 4.472 100.502 ( 2.067 0.000 3.966) 4.472 100.569 ( 0.707 0.000 -2.410) 2.511 100.569 ( 0.707 0.000 2.410) 2.511 100.666 ( 2.714 0.000 -1.454) 3.079 100.666 ( 2.714 0.000 1.454) 3.079 100.863 ( -4.713 0.000 -0.645) 4.757 100.863 ( -4.713 0.000 0.645) 4.757 102.498 ( 1.760 0.000 -0.385) 1.802 102.498 ( 1.760 0.000 0.385) 1.802 102.611 ( -3.532 0.000 -2.495) 4.325 102.611 ( -3.532 0.000 2.495) 4.325 103.024 ( 7.356 0.000 -5.081) 8.940 103.024 ( 7.356 0.000 5.081) 8.940 103.385 ( -10.344 0.000 -10.708) 14.889 103.385 ( -10.344 0.000 10.708) 14.889 ======================= Grid point 175 (60/72) ======================= q-point: (-0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 36 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.911 ( -10.464 0.000 -2.059) 10.664 3.911 ( -10.464 0.000 2.059) 10.664 3.911 ( 10.464 0.000 -2.058) 10.665 3.911 ( 10.464 0.000 2.059) 10.664 4.580 ( -25.723 0.000 -11.795) 28.298 4.580 ( 25.723 0.000 -11.795) 28.298 4.580 ( -25.723 0.000 11.795) 28.298 4.580 ( 25.723 0.000 11.795) 28.298 5.863 ( -16.879 0.000 -9.052) 19.153 5.863 ( 16.880 0.000 -9.052) 19.153 5.863 ( -16.879 0.000 9.052) 19.153 5.863 ( 16.879 0.000 9.052) 19.153 7.486 ( -12.981 0.000 -1.605) 13.080 7.486 ( -12.981 0.000 1.605) 13.080 7.486 ( 12.981 0.000 -1.605) 13.080 7.486 ( 12.981 0.000 1.605) 13.080 7.736 ( -2.740 0.000 -1.246) 3.010 7.736 ( 2.740 0.000 -1.246) 3.010 7.736 ( -2.740 0.000 1.246) 3.010 7.736 ( 2.740 0.000 1.246) 3.010 8.105 ( -17.268 0.000 -21.386) 27.487 8.105 ( 17.268 0.000 -21.386) 27.487 8.105 ( -17.268 0.000 21.386) 27.487 8.105 ( 17.268 0.000 21.386) 27.487 8.279 ( -27.767 0.000 -18.563) 33.400 8.279 ( 27.767 0.000 -18.563) 33.400 8.279 ( -27.767 0.000 18.563) 33.400 8.279 ( 27.767 0.000 18.563) 33.400 8.660 ( -4.964 0.000 -0.724) 5.017 8.660 ( -4.964 0.000 0.724) 5.017 8.660 ( 4.964 0.000 -0.724) 5.017 8.660 ( 4.964 0.000 0.724) 5.017 9.455 ( -6.593 0.000 -8.613) 10.846 9.455 ( 6.593 0.000 -8.613) 10.846 9.455 ( -6.593 0.000 8.613) 10.846 9.455 ( 6.593 0.000 8.613) 10.846 9.641 ( -16.281 0.000 -5.662) 17.238 9.641 ( 16.281 0.000 -5.662) 17.238 9.641 ( -16.281 0.000 5.662) 17.238 9.641 ( 16.281 0.000 5.662) 17.238 10.744 ( -1.809 0.000 -6.272) 6.528 10.744 ( 1.809 0.000 -6.272) 6.528 10.744 ( -1.809 0.000 6.272) 6.528 10.744 ( 1.809 0.000 6.272) 6.528 11.736 ( -1.206 0.000 -4.158) 4.329 11.736 ( 1.206 0.000 -4.158) 4.329 11.736 ( -1.206 0.000 4.158) 4.329 11.736 ( 1.206 0.000 4.158) 4.329 12.632 ( -4.518 0.000 -12.804) 13.577 12.632 ( 4.518 0.000 -12.804) 13.577 12.632 ( -4.518 0.000 12.804) 13.577 12.632 ( 4.518 0.000 12.804) 13.577 12.912 ( -8.582 0.000 -5.642) 10.271 12.912 ( 8.582 0.000 -5.642) 10.271 12.912 ( -8.582 0.000 5.642) 10.270 12.912 ( 8.582 0.000 5.642) 10.271 13.511 ( -9.159 0.000 -7.237) 11.673 13.511 ( 9.159 0.000 -7.237) 11.673 13.511 ( -9.159 0.000 7.237) 11.673 13.511 ( 9.159 0.000 7.237) 11.673 14.193 ( -2.787 0.000 -5.393) 6.071 14.193 ( 2.787 0.000 -5.393) 6.071 14.193 ( -2.787 0.000 5.393) 6.071 14.193 ( 2.787 0.000 5.393) 6.071 15.057 ( -10.652 0.000 -0.576) 10.667 15.057 ( -10.652 0.000 0.576) 10.667 15.057 ( 10.652 0.000 -0.576) 10.667 15.057 ( 10.652 0.000 0.576) 10.667 15.384 ( -6.851 0.000 -2.879) 7.431 15.384 ( 6.851 0.000 -2.879) 7.431 15.384 ( -6.851 0.000 2.879) 7.431 15.384 ( 6.851 0.000 2.879) 7.431 15.829 ( -3.813 0.000 -3.369) 5.088 15.829 ( 3.813 0.000 -3.369) 5.088 15.829 ( -3.813 0.000 3.369) 5.088 15.829 ( 3.813 0.000 3.369) 5.088 16.198 ( -7.331 0.000 -2.138) 7.636 16.198 ( -7.331 0.000 2.138) 7.636 16.198 ( 7.331 0.000 -2.138) 7.636 16.198 ( 7.331 0.000 2.138) 7.636 16.730 ( -2.651 0.000 -0.239) 2.661 16.730 ( -2.651 0.000 0.239) 2.661 16.730 ( 2.651 0.000 -0.239) 2.661 16.730 ( 2.651 0.000 0.239) 2.661 16.849 ( -20.580 0.000 -5.962) 21.426 16.849 ( -20.580 0.000 5.962) 21.426 16.849 ( 20.580 0.000 -5.962) 21.426 16.849 ( 20.580 0.000 5.962) 21.426 17.684 ( -6.962 0.000 -3.013) 7.586 17.684 ( 6.962 0.000 -3.013) 7.586 17.684 ( -6.962 0.000 3.013) 7.586 17.684 ( 6.962 0.000 3.013) 7.586 18.208 ( -11.862 0.000 -3.627) 12.404 18.208 ( -11.862 0.000 3.627) 12.404 18.208 ( 11.862 0.000 -3.627) 12.404 18.208 ( 11.862 0.000 3.627) 12.404 19.685 ( -1.860 0.000 -2.315) 2.970 19.685 ( 1.860 0.000 -2.315) 2.970 19.685 ( -1.860 0.000 2.315) 2.970 19.685 ( 1.860 0.000 2.315) 2.970 20.937 ( -6.408 0.000 -16.612) 17.805 20.937 ( 6.408 0.000 -16.612) 17.805 20.937 ( -6.408 0.000 16.612) 17.805 20.937 ( 6.408 0.000 16.612) 17.805 24.570 ( -5.125 0.000 -10.328) 11.529 24.570 ( 5.125 0.000 -10.328) 11.529 24.570 ( -5.125 0.000 10.328) 11.529 24.570 ( 5.125 0.000 10.328) 11.529 25.798 ( -17.633 0.000 -6.178) 18.684 25.798 ( 17.633 0.000 -6.178) 18.684 25.798 ( -17.633 0.000 6.178) 18.684 25.798 ( 17.633 0.000 6.178) 18.684 27.284 ( -10.602 0.000 -4.448) 11.497 27.284 ( 10.602 0.000 -4.448) 11.497 27.284 ( -10.602 0.000 4.448) 11.497 27.284 ( 10.602 0.000 4.448) 11.497 27.741 ( -7.361 0.000 -1.155) 7.451 27.741 ( -7.361 0.000 1.155) 7.451 27.741 ( 7.361 0.000 -1.155) 7.451 27.741 ( 7.361 0.000 1.155) 7.451 30.111 ( -7.815 0.000 -12.063) 14.374 30.111 ( 7.815 0.000 -12.063) 14.374 30.111 ( -7.815 0.000 12.063) 14.374 30.111 ( 7.815 0.000 12.063) 14.374 30.659 ( -9.677 0.000 -11.802) 15.262 30.659 ( 9.677 0.000 -11.802) 15.262 30.659 ( -9.677 0.000 11.802) 15.262 30.659 ( 9.677 0.000 11.802) 15.262 32.348 ( -6.270 0.000 -5.891) 8.603 32.348 ( 6.270 0.000 -5.891) 8.603 32.348 ( -6.270 0.000 5.891) 8.603 32.348 ( 6.270 0.000 5.891) 8.603 32.607 ( -6.444 0.000 -1.062) 6.531 32.607 ( -6.444 0.000 1.062) 6.531 32.607 ( 6.444 0.000 -1.062) 6.531 32.607 ( 6.444 0.000 1.062) 6.531 33.065 ( -17.839 0.000 -10.331) 20.614 33.065 ( 17.839 0.000 -10.331) 20.614 33.065 ( -17.839 0.000 10.331) 20.614 33.065 ( 17.839 0.000 10.331) 20.614 33.701 ( -6.841 0.000 -0.046) 6.841 33.701 ( -6.841 0.000 0.046) 6.841 33.701 ( 6.841 0.000 -0.046) 6.841 33.701 ( 6.841 0.000 0.046) 6.841 98.548 ( -1.079 0.000 -1.424) 1.787 98.548 ( 1.079 0.000 -1.424) 1.787 98.548 ( -1.079 0.000 1.424) 1.787 98.548 ( 1.079 0.000 1.424) 1.787 98.895 ( -2.909 0.000 -7.745) 8.273 98.895 ( 2.909 0.000 -7.745) 8.273 98.895 ( -2.909 0.000 7.745) 8.273 98.895 ( 2.909 0.000 7.745) 8.273 100.544 ( -2.036 0.000 -3.582) 4.121 100.544 ( 2.036 0.000 -3.582) 4.121 100.544 ( -2.036 0.000 3.582) 4.121 100.544 ( 2.036 0.000 3.582) 4.121 100.760 ( -5.435 0.000 -0.097) 5.436 100.760 ( -5.435 0.000 0.097) 5.436 100.760 ( 5.435 0.000 -0.097) 5.436 100.760 ( 5.435 0.000 0.097) 5.436 102.545 ( -2.915 0.000 -1.247) 3.171 102.545 ( 2.915 0.000 -1.247) 3.171 102.545 ( -2.915 0.000 1.247) 3.171 102.545 ( 2.915 0.000 1.247) 3.171 103.189 ( -9.083 0.000 -7.659) 11.881 103.189 ( 9.083 0.000 -7.659) 11.881 103.189 ( -9.083 0.000 7.659) 11.881 103.189 ( 9.083 0.000 7.659) 11.881 ======================= Grid point 187 (61/72) ======================= q-point: ( 0.00 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.193 ( 0.000 36.655 -28.023) 46.140 2.193 ( 0.000 36.655 28.023) 46.140 2.595 ( 0.000 5.915 -35.731) 36.217 2.595 ( 0.000 5.915 35.731) 36.217 3.164 ( 0.000 -3.949 -24.217) 24.537 3.164 ( 0.000 -3.949 24.217) 24.537 4.627 ( 0.000 -17.421 -7.614) 19.012 4.627 ( 0.000 -17.421 7.614) 19.012 4.802 ( 0.000 1.168 -71.825) 71.834 4.802 ( 0.000 1.168 71.825) 71.834 5.044 ( 0.000 -3.935 -57.812) 57.946 5.044 ( 0.000 -3.935 57.812) 57.946 6.827 ( 0.000 1.445 -11.768) 11.856 6.827 ( 0.000 1.445 11.768) 11.856 7.036 ( 0.000 -0.061 -22.258) 22.258 7.036 ( 0.000 -0.061 22.258) 22.258 7.383 ( 0.000 2.571 -2.685) 3.717 7.383 ( 0.000 2.571 2.685) 3.717 7.580 ( 0.000 2.941 -5.838) 6.537 7.580 ( 0.000 2.941 5.838) 6.537 7.668 ( 0.000 -3.910 -7.536) 8.490 7.668 ( 0.000 -3.910 7.536) 8.490 7.934 ( 0.000 -6.638 -3.294) 7.410 7.934 ( 0.000 -6.638 3.294) 7.410 8.109 ( 0.000 4.162 -1.280) 4.354 8.109 ( 0.000 4.162 1.280) 4.354 8.268 ( 0.000 4.132 -5.073) 6.543 8.268 ( 0.000 4.132 5.073) 6.543 8.915 ( 0.000 5.775 -7.918) 9.800 8.915 ( 0.000 5.775 7.918) 9.800 9.507 ( 0.000 -5.167 -8.904) 10.294 9.507 ( 0.000 -5.167 8.904) 10.294 10.457 ( 0.000 0.846 -25.792) 25.806 10.457 ( 0.000 0.846 25.792) 25.806 10.513 ( 0.000 -2.185 -8.010) 8.303 10.513 ( 0.000 -2.185 8.010) 8.303 10.667 ( 0.000 0.015 -14.907) 14.907 10.667 ( 0.000 0.015 14.907) 14.907 10.802 ( 0.000 -3.764 -25.389) 25.666 10.802 ( 0.000 -3.764 25.389) 25.666 11.142 ( 0.000 6.303 -16.866) 18.005 11.142 ( 0.000 6.303 16.866) 18.005 11.217 ( 0.000 4.362 -10.133) 11.032 11.217 ( 0.000 4.362 10.133) 11.032 11.481 ( 0.000 10.139 -13.416) 16.816 11.481 ( 0.000 10.139 13.416) 16.816 11.628 ( 0.000 -4.680 -8.540) 9.738 11.628 ( 0.000 -4.680 8.540) 9.738 11.840 ( 0.000 -7.527 -9.458) 12.087 11.840 ( 0.000 -7.527 9.458) 12.087 12.048 ( 0.000 0.595 -0.660) 0.889 12.048 ( 0.000 0.595 0.660) 0.889 12.383 ( 0.000 0.498 -7.397) 7.414 12.383 ( 0.000 0.498 7.397) 7.414 12.463 ( 0.000 -2.623 -14.625) 14.858 12.463 ( 0.000 -2.623 14.625) 14.858 13.423 ( 0.000 5.181 -3.662) 6.345 13.423 ( 0.000 5.181 3.662) 6.345 13.444 ( 0.000 6.161 -4.788) 7.803 13.444 ( 0.000 6.161 4.788) 7.803 14.070 ( 0.000 -1.750 -0.491) 1.818 14.070 ( 0.000 -1.750 0.491) 1.818 14.140 ( 0.000 -2.625 -9.912) 10.254 14.140 ( 0.000 -2.625 9.912) 10.254 14.733 ( 0.000 3.663 -6.637) 7.581 14.733 ( 0.000 3.663 6.637) 7.581 14.801 ( 0.000 4.633 -8.357) 9.555 14.801 ( 0.000 4.633 8.357) 9.555 15.385 ( 0.000 1.710 -4.081) 4.425 15.385 ( 0.000 1.710 4.081) 4.425 15.534 ( 0.000 0.081 -6.350) 6.351 15.534 ( 0.000 0.081 6.350) 6.351 15.801 ( 0.000 -2.491 -1.651) 2.989 15.801 ( 0.000 -2.491 1.651) 2.989 15.852 ( 0.000 -2.778 -7.563) 8.057 15.852 ( 0.000 -2.778 7.563) 8.057 16.080 ( 0.000 -7.498 -12.471) 14.551 16.080 ( 0.000 -7.498 12.471) 14.551 16.344 ( 0.000 -9.991 -8.100) 12.862 16.344 ( 0.000 -9.991 8.100) 12.862 16.431 ( 0.000 -2.813 -1.898) 3.393 16.431 ( 0.000 -2.813 1.898) 3.393 16.805 ( 0.000 -6.704 -11.186) 13.041 16.805 ( 0.000 -6.704 11.186) 13.041 16.992 ( 0.000 10.199 -7.160) 12.461 16.992 ( 0.000 10.199 7.160) 12.461 17.176 ( 0.000 2.105 -8.074) 8.343 17.176 ( 0.000 2.105 8.074) 8.343 17.586 ( 0.000 11.351 -11.663) 16.275 17.586 ( 0.000 11.351 11.663) 16.275 18.073 ( 0.000 2.256 -5.672) 6.104 18.073 ( 0.000 2.256 5.672) 6.104 18.704 ( 0.000 -0.706 -5.719) 5.763 18.704 ( 0.000 -0.706 5.719) 5.763 18.980 ( 0.000 -6.220 -3.459) 7.118 18.980 ( 0.000 -6.220 3.459) 7.118 19.662 ( 0.000 10.548 -3.432) 11.093 19.662 ( 0.000 10.548 3.432) 11.093 20.374 ( 0.000 -9.835 -16.099) 18.865 20.374 ( 0.000 -9.835 16.099) 18.865 20.511 ( 0.000 9.642 -24.269) 26.114 20.511 ( 0.000 9.642 24.269) 26.114 20.993 ( 0.000 1.105 -20.574) 20.604 20.993 ( 0.000 1.105 20.574) 20.604 24.240 ( 0.000 11.530 -4.525) 12.386 24.240 ( 0.000 11.530 4.525) 12.386 25.531 ( 0.000 -17.319 -1.487) 17.383 25.531 ( 0.000 -17.319 1.487) 17.383 26.143 ( 0.000 4.637 -9.926) 10.956 26.143 ( 0.000 4.637 9.926) 10.956 26.418 ( 0.000 -0.062 -8.674) 8.674 26.418 ( 0.000 -0.062 8.674) 8.674 27.019 ( 0.000 0.274 -13.537) 13.540 27.019 ( 0.000 0.274 13.537) 13.540 27.177 ( 0.000 -3.381 -8.406) 9.060 27.177 ( 0.000 -3.381 8.406) 9.060 28.157 ( 0.000 0.894 -4.713) 4.797 28.157 ( 0.000 0.894 4.713) 4.797 28.238 ( 0.000 -0.288 -6.493) 6.500 28.238 ( 0.000 -0.288 6.493) 6.500 29.536 ( 0.000 2.413 -3.408) 4.176 29.536 ( 0.000 2.413 3.408) 4.176 29.783 ( 0.000 -2.582 -8.509) 8.892 29.783 ( 0.000 -2.582 8.509) 8.892 30.710 ( 0.000 3.724 -2.678) 4.587 30.710 ( 0.000 3.724 2.678) 4.587 30.930 ( 0.000 0.606 -3.649) 3.699 30.930 ( 0.000 0.606 3.649) 3.699 31.215 ( 0.000 0.039 -10.813) 10.813 31.215 ( 0.000 0.039 10.813) 10.813 31.443 ( 0.000 -3.392 -3.651) 4.984 31.443 ( 0.000 -3.392 3.651) 4.984 32.131 ( 0.000 1.575 -10.088) 10.210 32.131 ( 0.000 1.575 10.088) 10.210 32.523 ( 0.000 5.223 -21.506) 22.131 32.523 ( 0.000 5.223 21.506) 22.131 32.553 ( 0.000 -5.099 -3.695) 6.297 32.553 ( 0.000 -5.099 3.695) 6.297 33.191 ( 0.000 -15.935 -15.695) 22.366 33.191 ( 0.000 -15.935 15.695) 22.366 34.291 ( 0.000 6.517 -4.217) 7.762 34.291 ( 0.000 6.517 4.217) 7.762 34.587 ( 0.000 -2.068 -7.790) 8.060 34.587 ( 0.000 -2.068 7.790) 8.060 98.361 ( 0.000 0.201 -1.563) 1.576 98.361 ( 0.000 0.201 1.563) 1.576 98.371 ( 0.000 -0.041 -0.904) 0.905 98.371 ( 0.000 -0.041 0.904) 0.905 98.718 ( 0.000 1.367 -2.373) 2.739 98.718 ( 0.000 1.367 2.373) 2.739 98.905 ( 0.000 -2.887 -3.428) 4.481 98.905 ( 0.000 -2.887 3.428) 4.481 100.336 ( 0.000 -0.522 -2.960) 3.006 100.336 ( 0.000 -0.522 2.960) 3.006 100.337 ( 0.000 -2.061 -3.461) 4.028 100.337 ( 0.000 -2.061 3.461) 4.028 100.813 ( 0.000 4.181 -6.252) 7.521 100.813 ( 0.000 4.181 6.252) 7.521 100.961 ( 0.000 -0.701 -2.810) 2.896 100.961 ( 0.000 -0.701 2.810) 2.896 102.502 ( 0.000 -0.455 -0.419) 0.619 102.502 ( 0.000 -0.455 0.419) 0.619 102.614 ( 0.000 -1.548 -1.016) 1.852 102.614 ( 0.000 -1.548 1.016) 1.852 103.206 ( 0.000 16.043 -15.296) 22.166 103.206 ( 0.000 16.043 15.296) 22.166 103.928 ( 0.000 -3.414 -22.449) 22.707 103.928 ( 0.000 -3.414 22.449) 22.707 ======================= Grid point 189 (62/72) ======================= q-point: ( 0.10 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.285 ( 9.388 34.910 -27.827) 45.620 2.285 ( 9.388 34.910 27.827) 45.620 2.972 ( 32.891 5.244 -34.043) 47.626 2.972 ( 32.891 5.244 34.043) 47.626 3.483 ( 28.266 -4.073 -25.812) 38.494 3.483 ( 28.266 -4.073 25.812) 38.494 4.647 ( 2.621 -16.635 -7.467) 18.421 4.647 ( 2.621 -16.635 7.467) 18.421 4.837 ( 4.706 0.911 -50.083) 50.312 4.837 ( 4.706 0.911 50.083) 50.312 5.124 ( 8.391 -4.099 -38.080) 39.208 5.124 ( 8.391 -4.099 38.080) 39.208 6.831 ( 0.462 1.368 -11.289) 11.381 6.831 ( 0.462 1.368 11.289) 11.381 6.983 ( -6.798 1.149 -18.516) 19.758 6.983 ( -6.798 1.149 18.516) 19.758 7.336 ( -4.188 1.606 -5.221) 6.883 7.336 ( -4.188 1.606 5.221) 6.883 7.408 ( -11.386 1.022 -3.747) 12.030 7.408 ( -11.386 1.022 3.747) 12.030 7.720 ( 1.978 -1.553 -3.002) 3.917 7.720 ( 1.978 -1.553 3.002) 3.917 7.937 ( 0.209 -6.615 -7.374) 9.908 7.937 ( 0.209 -6.615 7.374) 9.908 8.136 ( 2.402 4.508 -4.144) 6.577 8.136 ( 2.402 4.508 4.144) 6.577 8.301 ( 3.686 3.484 -3.630) 6.237 8.301 ( 3.686 3.484 3.630) 6.237 8.925 ( 0.716 5.418 -6.570) 8.546 8.925 ( 0.716 5.418 6.570) 8.546 9.478 ( -3.186 -4.830 -7.275) 9.295 9.478 ( -3.186 -4.830 7.275) 9.295 10.211 ( -17.081 0.790 -32.691) 36.893 10.211 ( -17.081 0.790 32.691) 36.893 10.317 ( -16.261 -1.327 -26.402) 31.036 10.317 ( -16.261 -1.327 26.402) 31.036 10.659 ( 0.700 -0.218 -7.456) 7.492 10.659 ( 0.700 -0.218 7.456) 7.492 10.968 ( 0.170 -2.825 -8.600) 9.054 10.968 ( 0.170 -2.825 8.600) 9.054 11.131 ( 6.052 4.410 -13.537) 15.470 11.131 ( 6.052 4.410 13.537) 15.470 11.330 ( 7.776 3.506 -6.483) 10.714 11.330 ( 7.776 3.506 6.483) 10.714 11.542 ( 4.960 7.507 -6.623) 11.172 11.542 ( 4.960 7.507 6.623) 11.172 11.659 ( 2.451 -3.075 -3.368) 5.178 11.659 ( 2.451 -3.075 3.368) 5.178 11.882 ( 6.400 -1.534 -12.154) 13.822 11.882 ( 6.400 -1.534 12.154) 13.822 12.111 ( 3.971 -4.822 -2.601) 6.766 12.111 ( 3.971 -4.822 2.601) 6.766 12.434 ( 6.104 0.042 -4.762) 7.742 12.434 ( 6.104 0.042 4.762) 7.742 12.559 ( 7.542 -2.019 -9.471) 12.274 12.559 ( 7.542 -2.019 9.471) 12.274 13.091 ( -18.874 6.227 -2.008) 19.976 13.091 ( -18.874 6.227 2.008) 19.976 13.463 ( -11.009 -2.211 -3.017) 11.627 13.463 ( -11.009 -2.211 3.017) 11.627 13.891 ( -4.138 5.076 -5.949) 8.847 13.891 ( -4.138 5.076 5.949) 8.847 14.307 ( 4.676 -1.628 -8.913) 10.196 14.307 ( 4.676 -1.628 8.913) 10.196 14.691 ( 1.367 5.399 -3.114) 6.381 14.691 ( 1.367 5.399 3.114) 6.381 14.943 ( 8.975 2.373 -3.011) 9.759 14.943 ( 8.975 2.373 3.011) 9.759 15.357 ( -1.938 1.625 -2.905) 3.851 15.357 ( -1.938 1.625 2.905) 3.851 15.542 ( 0.336 -0.470 -6.823) 6.848 15.542 ( 0.336 -0.470 6.823) 6.848 15.799 ( -0.204 -2.169 -1.284) 2.529 15.799 ( -0.204 -2.169 1.284) 2.529 15.874 ( 1.800 -3.961 -6.833) 8.101 15.874 ( 1.800 -3.961 6.833) 8.101 16.048 ( -2.628 -6.157 -7.410) 9.986 16.048 ( -2.628 -6.157 7.410) 9.986 16.293 ( -3.172 -4.869 -5.436) 7.958 16.293 ( -3.172 -4.869 5.436) 7.958 16.504 ( 4.499 -3.075 -0.257) 5.455 16.504 ( 4.499 -3.075 0.257) 5.455 16.844 ( 4.082 -6.661 -7.213) 10.633 16.844 ( 4.082 -6.661 7.213) 10.633 16.986 ( -1.370 6.312 -3.236) 7.224 16.986 ( -1.370 6.312 3.236) 7.224 17.198 ( 2.334 1.499 -2.088) 3.472 17.198 ( 2.334 1.499 2.088) 3.472 17.594 ( 0.898 10.280 -11.826) 15.695 17.594 ( 0.898 10.280 11.826) 15.695 18.062 ( -1.562 2.726 -5.912) 6.695 18.062 ( -1.562 2.726 5.912) 6.695 18.644 ( -6.424 -0.608 -7.680) 10.031 18.644 ( -6.424 -0.608 7.680) 10.031 18.923 ( -5.492 -5.455 -3.421) 8.463 18.923 ( -5.492 -5.455 3.421) 8.463 19.646 ( -1.209 9.416 -2.933) 9.936 19.646 ( -1.209 9.416 2.933) 9.936 20.192 ( -11.252 -2.596 -10.669) 15.722 20.192 ( -11.252 -2.596 10.669) 15.722 20.663 ( 7.892 1.975 -17.271) 19.091 20.663 ( 7.892 1.975 17.271) 19.091 20.990 ( 0.311 0.925 -18.019) 18.045 20.990 ( 0.311 0.925 18.019) 18.045 24.289 ( 4.759 10.480 -4.915) 12.516 24.289 ( 4.759 10.480 4.915) 12.516 25.367 ( -14.741 -13.242 -4.651) 20.354 25.367 ( -14.741 -13.242 4.651) 20.354 26.024 ( -11.787 6.067 -11.566) 17.593 26.024 ( -11.787 6.067 11.566) 17.593 26.393 ( -1.173 -2.460 -6.452) 7.004 26.393 ( -1.173 -2.460 6.452) 7.004 27.020 ( -0.309 -0.148 -7.656) 7.664 27.020 ( -0.309 -0.148 7.656) 7.664 27.229 ( 4.675 -3.683 -7.325) 9.438 27.229 ( 4.675 -3.683 7.325) 9.438 28.088 ( -6.128 1.026 -3.097) 6.942 28.088 ( -6.128 1.026 3.097) 6.942 28.216 ( -2.328 -1.273 -4.917) 5.587 28.216 ( -2.328 -1.273 4.917) 5.587 29.617 ( 7.031 2.419 -3.590) 8.257 29.617 ( 7.031 2.419 3.590) 8.257 29.848 ( 5.761 -2.311 -7.562) 9.783 29.848 ( 5.761 -2.311 7.562) 9.783 30.639 ( -5.073 2.772 -3.277) 6.645 30.639 ( -5.073 2.772 3.277) 6.645 30.954 ( -2.317 -2.788 -4.472) 5.757 30.954 ( -2.317 -2.788 4.472) 5.757 31.185 ( 4.990 5.213 -7.994) 10.769 31.185 ( 4.990 5.213 7.994) 10.769 31.621 ( 13.326 -2.870 -3.365) 14.040 31.621 ( 13.326 -2.870 3.365) 14.040 32.159 ( 2.348 1.090 -6.962) 7.428 32.159 ( 2.348 1.090 6.962) 7.428 32.498 ( 0.088 1.873 -14.548) 14.668 32.498 ( 0.088 1.873 14.548) 14.668 32.624 ( 4.250 -1.820 -3.146) 5.592 32.624 ( 4.250 -1.820 3.146) 5.592 33.199 ( 0.773 -14.453 -14.237) 20.302 33.199 ( 0.773 -14.453 14.237) 20.302 34.241 ( -4.801 6.165 -4.520) 9.027 34.241 ( -4.801 6.165 4.520) 9.027 34.530 ( -5.699 -1.943 -7.688) 9.765 34.530 ( -5.699 -1.943 7.688) 9.765 98.387 ( 1.768 0.075 -0.856) 1.966 98.387 ( 1.768 0.075 0.856) 1.966 98.410 ( 4.126 -0.446 -0.797) 4.226 98.410 ( 4.126 -0.446 0.797) 4.226 98.714 ( -0.231 1.480 -2.355) 2.791 98.714 ( -0.231 1.480 2.355) 2.791 98.914 ( 0.715 -2.987 -3.757) 4.853 98.914 ( 0.715 -2.987 3.757) 4.853 100.347 ( 1.573 -0.991 -3.225) 3.722 100.347 ( 1.573 -0.991 3.225) 3.722 100.363 ( 1.972 -1.404 -3.129) 3.956 100.363 ( 1.972 -1.404 3.129) 3.956 100.799 ( -1.365 4.067 -5.608) 7.061 100.799 ( -1.365 4.067 5.608) 7.061 100.965 ( 0.202 -0.958 -2.627) 2.804 100.965 ( 0.202 -0.958 2.627) 2.804 102.496 ( -0.418 0.076 -0.259) 0.498 102.496 ( -0.418 0.076 0.259) 0.498 102.637 ( 2.188 -1.845 -0.913) 3.005 102.637 ( 2.188 -1.845 0.913) 3.005 103.146 ( -5.438 15.245 -13.409) 21.019 103.146 ( -5.438 15.245 13.409) 21.019 103.879 ( -4.905 -3.793 -21.012) 21.907 103.879 ( -4.905 -3.793 21.012) 21.907 ======================= Grid point 191 (63/72) ======================= q-point: ( 0.20 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.574 ( 19.568 29.724 -26.263) 44.228 2.574 ( 19.568 29.724 26.263) 44.228 3.638 ( 27.006 4.133 -37.124) 46.093 3.638 ( 27.006 4.133 37.124) 46.093 4.042 ( 20.705 -4.115 -33.524) 39.617 4.042 ( 20.705 -4.115 33.524) 39.617 4.752 ( 7.652 -17.312 -5.957) 19.843 4.752 ( 7.652 -17.312 5.957) 19.843 5.124 ( 28.839 2.537 -21.378) 35.988 5.124 ( 28.839 2.537 21.378) 35.988 5.444 ( 26.134 -3.786 -12.416) 29.180 5.444 ( 26.134 -3.786 12.416) 29.180 6.688 ( -22.570 3.504 -5.533) 23.501 6.688 ( -22.570 3.504 5.533) 23.501 6.822 ( -3.651 -0.539 -8.261) 9.048 6.822 ( -3.651 -0.539 8.261) 9.048 7.175 ( -6.293 2.591 -13.432) 15.058 7.175 ( -6.293 2.591 13.432) 15.058 7.349 ( 3.627 -1.087 -4.754) 6.078 7.349 ( 3.627 -1.087 4.754) 6.078 7.757 ( 2.493 -1.037 -1.754) 3.219 7.757 ( 2.493 -1.037 1.754) 3.219 7.943 ( 0.374 -5.387 -8.619) 10.171 7.943 ( 0.374 -5.387 8.619) 10.171 8.185 ( 1.996 5.591 -4.165) 7.252 8.185 ( 1.996 5.591 4.165) 7.252 8.414 ( 7.084 1.782 -3.267) 8.002 8.414 ( 7.084 1.782 3.267) 8.002 8.928 ( -0.576 4.318 -3.725) 5.732 8.928 ( -0.576 4.318 3.725) 5.732 9.368 ( -7.980 -3.892 -4.013) 9.743 9.368 ( -7.980 -3.892 4.013) 9.743 9.849 ( -18.398 1.267 -21.402) 28.251 9.849 ( -18.398 1.267 21.402) 28.251 9.987 ( -16.537 -1.470 -20.535) 26.407 9.987 ( -16.537 -1.470 20.535) 26.407 10.619 ( -4.502 0.348 -6.369) 7.807 10.619 ( -4.502 0.348 6.369) 7.807 10.888 ( -5.455 -0.592 -14.522) 15.524 10.888 ( -5.455 -0.592 14.522) 15.524 11.168 ( -4.494 3.467 -2.597) 6.242 11.168 ( -4.494 3.467 2.597) 6.242 11.447 ( -5.696 -1.444 -2.588) 6.420 11.447 ( -5.696 -1.444 2.588) 6.420 11.632 ( 6.103 2.451 -5.846) 8.799 11.632 ( 6.103 2.451 5.846) 8.799 11.755 ( 9.115 -0.042 -12.191) 15.222 11.755 ( 9.115 -0.042 12.191) 15.222 12.007 ( -2.982 1.539 -5.892) 6.781 12.007 ( -2.982 1.539 5.892) 6.781 12.190 ( 10.345 -2.072 -7.296) 12.827 12.190 ( 10.345 -2.072 7.296) 12.827 12.565 ( 4.439 0.146 -6.413) 7.800 12.565 ( 4.439 0.146 6.413) 7.800 12.724 ( 8.535 -3.389 -9.487) 13.203 12.724 ( 8.535 -3.389 9.487) 13.203 12.845 ( -2.624 1.967 -7.762) 8.427 12.845 ( -2.624 1.967 7.762) 8.427 13.249 ( -1.380 -6.585 -3.066) 7.394 13.249 ( -1.380 -6.585 3.066) 7.394 13.858 ( -1.378 8.400 -5.086) 9.916 13.858 ( -1.378 8.400 5.086) 9.916 14.309 ( -2.798 2.051 -4.528) 5.704 14.309 ( -2.798 2.051 4.528) 5.704 14.790 ( 6.644 3.369 -1.414) 7.583 14.790 ( 6.644 3.369 1.414) 7.583 15.111 ( 7.290 1.845 -3.797) 8.424 15.111 ( 7.290 1.845 3.797) 8.424 15.329 ( -0.606 2.323 -2.141) 3.217 15.329 ( -0.606 2.323 2.141) 3.217 15.551 ( 0.771 -1.431 -7.178) 7.360 15.551 ( 0.771 -1.431 7.178) 7.360 15.797 ( 0.269 -4.172 -1.182) 4.345 15.797 ( 0.269 -4.172 1.182) 4.345 15.867 ( -3.670 -8.926 -5.127) 10.928 15.867 ( -3.670 -8.926 5.127) 10.928 16.030 ( 1.747 1.435 -7.903) 8.220 16.030 ( 1.747 1.435 7.903) 8.220 16.244 ( -1.177 -1.434 -1.785) 2.575 16.244 ( -1.177 -1.434 1.785) 2.575 16.543 ( -1.607 5.060 -3.057) 6.126 16.543 ( -1.607 5.060 3.057) 6.126 16.901 ( -1.207 -1.449 -5.688) 5.992 16.901 ( -1.207 -1.449 5.688) 5.992 17.017 ( 7.280 -5.666 -4.291) 10.175 17.017 ( 7.280 -5.666 4.291) 10.175 17.236 ( 0.625 -1.601 -6.012) 6.253 17.236 ( 0.625 -1.601 6.012) 6.253 17.622 ( 1.728 6.963 -11.133) 13.244 17.622 ( 1.728 6.963 11.133) 13.244 17.986 ( -6.705 2.786 -7.213) 10.234 17.986 ( -6.705 2.786 7.213) 10.234 18.436 ( -13.776 1.303 -9.722) 16.912 18.436 ( -13.776 1.303 9.722) 16.912 18.780 ( -8.286 -3.756 -2.003) 9.315 18.780 ( -8.286 -3.756 2.003) 9.315 19.631 ( 0.033 6.362 -2.032) 6.679 19.631 ( 0.033 6.362 2.032) 6.679 19.984 ( -9.215 -1.526 -4.081) 10.193 19.984 ( -9.215 -1.526 4.081) 10.193 20.758 ( 1.937 1.882 -5.352) 5.995 20.758 ( 1.937 1.882 5.352) 5.995 21.026 ( 2.938 -1.056 -9.113) 9.633 21.026 ( 2.938 -1.056 9.113) 9.633 24.417 ( 7.412 7.705 -5.126) 11.857 24.417 ( 7.412 7.705 5.126) 11.857 25.034 ( -16.255 -6.139 -11.380) 20.770 25.034 ( -16.255 -6.139 11.380) 20.770 25.740 ( -14.547 7.058 -11.925) 20.091 25.740 ( -14.547 7.058 11.925) 20.091 26.371 ( -1.784 -5.617 -4.474) 7.400 26.371 ( -1.784 -5.617 4.474) 7.400 27.010 ( -0.318 0.437 -2.638) 2.693 27.010 ( -0.318 0.437 2.638) 2.693 27.332 ( 5.201 -4.586 -5.657) 8.949 27.332 ( 5.201 -4.586 5.657) 8.949 27.937 ( -8.625 1.510 -0.607) 8.778 27.937 ( -8.625 1.510 0.607) 8.778 28.143 ( -5.041 -2.681 -1.674) 5.950 28.143 ( -5.041 -2.681 1.674) 5.950 29.773 ( 7.689 2.477 -5.653) 9.859 29.773 ( 7.689 2.477 5.653) 9.859 29.978 ( 6.968 -1.939 -6.279) 9.578 29.978 ( 6.968 -1.939 6.279) 9.578 30.542 ( -4.412 3.011 -8.209) 9.794 30.542 ( -4.412 3.011 8.209) 9.794 30.885 ( -2.504 -3.718 -6.280) 7.716 30.885 ( -2.504 -3.718 6.280) 7.716 31.416 ( 15.957 7.559 -2.992) 17.908 31.416 ( 15.957 7.559 2.992) 17.908 31.915 ( 15.605 -2.687 -1.867) 15.944 31.915 ( 15.605 -2.687 1.867) 15.944 32.217 ( 3.685 1.012 -3.141) 4.947 32.217 ( 3.685 1.012 3.141) 4.947 32.530 ( 2.603 1.471 -13.728) 14.050 32.530 ( 2.603 1.471 13.728) 14.050 32.698 ( 2.932 -1.639 -5.153) 6.151 32.698 ( 2.932 -1.639 5.153) 6.151 33.221 ( 1.383 -11.477 -10.798) 15.819 33.221 ( 1.383 -11.477 10.798) 15.819 34.109 ( -8.194 5.072 -5.017) 10.865 34.109 ( -8.194 5.072 5.017) 10.865 34.364 ( -10.624 -1.651 -7.271) 12.979 34.364 ( -10.624 -1.651 7.271) 12.979 98.432 ( 2.626 0.342 -0.465) 2.689 98.432 ( 2.626 0.342 0.465) 2.689 98.501 ( 4.309 -1.114 -3.361) 5.577 98.501 ( 4.309 -1.114 3.361) 5.577 98.716 ( 0.639 1.360 -2.758) 3.141 98.716 ( 0.639 1.360 2.758) 3.141 98.927 ( 0.489 -3.123 -4.516) 5.512 98.927 ( 0.489 -3.123 4.516) 5.512 100.395 ( 2.908 -1.077 -3.676) 4.809 100.395 ( 2.908 -1.077 3.676) 4.809 100.413 ( 3.207 -0.767 -2.224) 3.978 100.413 ( 3.207 -0.767 2.224) 3.978 100.762 ( -2.212 3.798 -4.612) 6.371 100.762 ( -2.212 3.798 4.612) 6.371 100.960 ( -0.989 -1.484 -2.647) 3.191 100.960 ( -0.989 -1.484 2.647) 3.191 102.492 ( 0.090 1.258 -0.507) 1.359 102.492 ( 0.090 1.258 0.507) 1.359 102.693 ( 3.139 -1.921 -1.248) 3.886 102.693 ( 3.139 -1.921 1.248) 3.886 103.021 ( -6.284 12.568 -9.492) 16.957 103.021 ( -6.284 12.568 9.492) 16.957 103.739 ( -8.791 -4.472 -17.816) 20.364 103.739 ( -8.791 -4.472 17.816) 20.364 ======================= Grid point 193 (64/72) ======================= q-point: ( 0.30 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.054 ( 27.726 22.675 -23.286) 42.721 3.054 ( 27.726 22.675 23.286) 42.721 3.956 ( 7.036 3.520 -33.310) 34.227 3.956 ( 7.036 3.520 33.310) 34.227 4.252 ( 3.499 -3.353 -27.913) 28.331 4.252 ( 3.499 -3.353 27.913) 28.331 4.941 ( 10.897 -15.445 -5.688) 19.740 4.941 ( 10.897 -15.445 5.688) 19.740 5.929 ( 34.284 0.348 -11.473) 36.155 5.929 ( 34.284 0.348 11.473) 36.155 6.101 ( 14.663 0.701 -8.975) 17.206 6.101 ( 14.663 0.701 8.975) 17.206 6.228 ( 7.212 1.989 -7.230) 10.404 6.228 ( 7.212 1.989 7.230) 10.404 6.639 ( -7.986 -4.532 -1.615) 9.324 6.639 ( -7.986 -4.532 1.615) 9.324 7.214 ( 8.861 4.661 -2.578) 10.338 7.214 ( 8.861 4.661 2.578) 10.338 7.490 ( 9.489 -1.498 -8.823) 13.044 7.490 ( 9.489 -1.498 8.823) 13.044 7.829 ( 4.041 -1.668 -6.686) 7.989 7.829 ( 4.041 -1.668 6.686) 7.989 7.953 ( 0.786 -2.952 -10.053) 10.507 7.953 ( 0.786 -2.952 10.053) 10.507 8.204 ( 0.057 6.483 -4.553) 7.922 8.204 ( 0.057 6.483 4.553) 7.922 8.562 ( 7.122 -0.440 -5.657) 9.106 8.562 ( 7.122 -0.440 5.657) 9.106 8.903 ( -2.242 2.926 -1.349) 3.925 8.903 ( -2.242 2.926 1.349) 3.925 9.161 ( -12.620 -2.080 -2.800) 13.093 9.161 ( -12.620 -2.080 2.800) 13.093 9.494 ( -16.269 1.467 -7.096) 17.810 9.494 ( -16.269 1.467 7.096) 17.810 9.669 ( -14.749 -2.033 -8.587) 17.187 9.669 ( -14.749 -2.033 8.587) 17.187 10.450 ( -14.697 2.189 -1.936) 14.985 10.450 ( -14.697 2.189 1.936) 14.985 10.778 ( -6.658 -2.187 -10.863) 12.928 10.778 ( -6.658 -2.187 10.863) 12.928 10.909 ( -21.012 2.364 -4.879) 21.701 10.909 ( -21.012 2.364 4.879) 21.701 11.100 ( -22.367 -0.532 -7.525) 23.605 11.100 ( -22.367 -0.532 7.526) 23.605 11.710 ( 2.273 0.459 -2.570) 3.462 11.710 ( 2.273 0.459 2.570) 3.462 11.783 ( -4.278 0.414 -2.715) 5.084 11.783 ( -4.278 0.414 2.715) 5.084 12.156 ( 17.837 2.824 -13.462) 22.525 12.156 ( 17.837 2.824 13.462) 22.525 12.401 ( 7.694 -0.109 -9.704) 12.385 12.401 ( 7.694 -0.109 9.704) 12.385 12.643 ( 5.995 -3.345 -3.014) 7.497 12.643 ( 5.995 -3.345 3.014) 7.497 12.844 ( 5.565 -5.811 -15.325) 17.309 12.844 ( 5.565 -5.811 15.325) 17.309 13.016 ( 14.641 2.642 -9.985) 17.918 13.016 ( 14.641 2.642 9.985) 17.918 13.455 ( 16.542 -8.884 -2.619) 18.959 13.455 ( 16.542 -8.884 2.619) 18.959 13.822 ( -1.579 8.759 -1.435) 9.015 13.822 ( -1.579 8.759 1.435) 9.015 14.244 ( -2.989 1.920 -3.631) 5.080 14.244 ( -2.989 1.920 3.631) 5.080 14.907 ( 4.582 4.894 -1.947) 6.981 14.907 ( 4.582 4.894 1.947) 6.981 15.214 ( 2.708 -0.225 -4.737) 5.461 15.214 ( 2.708 -0.225 4.737) 5.461 15.335 ( 1.001 3.459 -0.345) 3.617 15.335 ( 1.001 3.459 0.345) 3.617 15.573 ( 1.221 -1.509 -7.037) 7.299 15.573 ( 1.221 -1.509 7.037) 7.299 15.736 ( -6.592 -9.919 -2.385) 12.146 15.736 ( -6.592 -9.919 2.385) 12.146 15.850 ( 3.616 -4.489 -5.558) 8.007 15.850 ( 3.616 -4.489 5.558) 8.007 16.062 ( 0.390 4.132 -10.139) 10.956 16.062 ( 0.390 4.132 10.139) 10.956 16.277 ( 4.441 0.660 -1.014) 4.603 16.277 ( 4.441 0.660 1.014) 4.603 16.457 ( -4.989 8.524 -6.339) 11.736 16.457 ( -4.989 8.524 6.339) 11.736 16.854 ( -3.507 -1.632 -5.036) 6.350 16.854 ( -3.507 -1.632 5.036) 6.350 17.099 ( -4.124 -1.508 -5.090) 6.723 17.099 ( -4.124 -1.508 5.090) 6.723 17.277 ( 6.097 -7.548 -8.357) 12.806 17.277 ( 6.097 -7.548 8.357) 12.806 17.637 ( -3.244 1.966 -10.552) 11.213 17.637 ( -3.244 1.966 10.552) 11.213 17.787 ( -9.716 -0.810 -7.630) 12.380 17.787 ( -9.716 -0.810 7.630) 12.380 18.176 ( -9.885 7.170 -5.390) 13.348 18.176 ( -9.885 7.170 5.390) 13.348 18.604 ( -9.249 -2.786 -1.079) 9.720 18.604 ( -9.249 -2.786 1.079) 9.720 19.645 ( 1.029 3.095 -1.857) 3.753 19.645 ( 1.029 3.095 1.857) 3.753 19.830 ( -6.181 -0.934 -1.368) 6.399 19.830 ( -6.181 -0.934 1.368) 6.399 20.785 ( 1.647 2.689 -12.714) 13.099 20.785 ( 1.647 2.689 12.714) 13.099 21.067 ( 0.348 -2.528 -4.497) 5.171 21.067 ( 0.348 -2.528 4.497) 5.171 24.539 ( 3.179 4.702 -1.809) 5.957 24.539 ( 3.179 4.702 1.809) 5.957 24.793 ( -6.738 -1.186 -9.566) 11.760 24.793 ( -6.738 -1.186 9.566) 11.760 25.511 ( -6.675 6.806 -8.467) 12.750 25.511 ( -6.675 6.806 8.467) 12.750 26.286 ( -7.467 -7.810 -4.361) 11.652 26.286 ( -7.467 -7.810 4.361) 11.652 27.028 ( 2.792 2.472 -1.275) 3.941 27.028 ( 2.792 2.472 1.275) 3.941 27.433 ( 5.066 -5.082 -3.129) 7.828 27.433 ( 5.066 -5.082 3.129) 7.828 27.750 ( -10.074 2.071 -2.607) 10.610 27.750 ( -10.074 2.071 2.607) 10.610 28.014 ( -7.665 -3.502 -1.108) 8.499 28.014 ( -7.665 -3.502 1.108) 8.499 29.901 ( 5.339 3.180 -8.759) 10.739 29.901 ( 5.339 3.180 8.759) 10.739 30.147 ( 9.823 -2.497 -7.099) 12.374 30.147 ( 9.823 -2.497 7.099) 12.374 30.459 ( -3.981 4.400 -10.298) 11.885 30.459 ( -3.981 4.400 10.298) 11.885 30.847 ( -2.112 -3.802 -11.546) 12.338 30.847 ( -2.112 -3.802 11.546) 12.338 31.784 ( 19.844 6.555 -5.867) 21.707 31.784 ( 19.844 6.555 5.867) 21.707 32.218 ( 13.145 -1.399 -2.590) 13.470 32.218 ( 13.145 -1.399 2.590) 13.470 32.321 ( 7.737 0.167 -3.321) 8.421 32.321 ( 7.737 0.167 3.321) 8.421 32.583 ( 2.515 1.284 -12.046) 12.373 32.583 ( 2.515 1.284 12.046) 12.373 32.738 ( 1.045 -0.777 -6.303) 6.436 32.738 ( 1.045 -0.777 6.303) 6.436 33.252 ( 1.665 -9.069 -6.807) 11.461 33.252 ( 1.665 -9.069 6.807) 11.461 33.916 ( -11.017 3.679 -5.591) 12.891 33.916 ( -11.017 3.679 5.591) 12.891 34.121 ( -13.135 -1.448 -5.800) 14.432 34.121 ( -13.135 -1.448 5.800) 14.432 98.486 ( 2.557 0.660 -0.748) 2.745 98.486 ( 2.557 0.660 0.748) 2.745 98.563 ( 1.705 -0.235 -3.128) 3.570 98.563 ( 1.705 -0.235 3.128) 3.570 98.748 ( 2.506 0.012 -4.527) 5.175 98.748 ( 2.506 0.012 4.527) 5.175 98.928 ( -0.448 -3.089 -5.381) 6.220 98.928 ( -0.448 -3.089 5.381) 6.220 100.452 ( 2.762 -0.439 -4.172) 5.023 100.452 ( 2.762 -0.439 4.172) 5.023 100.495 ( 4.694 -0.562 -2.116) 5.180 100.495 ( 4.694 -0.562 2.116) 5.180 100.714 ( -2.521 3.254 -3.855) 5.640 100.714 ( -2.521 3.254 3.855) 5.640 100.920 ( -2.964 -1.795 -2.532) 4.292 100.920 ( -2.964 -1.795 2.532) 4.292 102.504 ( 1.254 2.675 -1.072) 3.143 102.504 ( 1.254 2.675 1.072) 3.143 102.737 ( 0.093 1.763 -1.927) 2.613 102.737 ( 0.093 1.763 1.927) 2.613 102.936 ( -0.860 5.456 -3.175) 6.371 102.936 ( -0.860 5.456 3.175) 6.371 103.542 ( -10.472 -4.799 -14.115) 18.219 103.542 ( -10.472 -4.799 14.115) 18.219 ======================= Grid point 195 (65/72) ======================= q-point: ( 0.40 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.627 ( 26.764 14.434 -18.123) 35.399 3.627 ( 26.764 14.434 18.123) 35.399 4.017 ( 0.310 2.864 -19.456) 19.668 4.017 ( 0.310 2.864 19.456) 19.668 4.313 ( 6.131 0.141 -16.235) 17.355 4.313 ( 6.131 0.141 16.235) 17.355 5.100 ( -3.841 -4.634 -1.240) 6.146 5.100 ( -3.841 -4.634 1.240) 6.146 5.577 ( -13.687 -3.131 -4.130) 14.635 5.577 ( -13.687 -3.131 4.130) 14.635 6.121 ( -18.977 -8.186 -9.240) 22.638 6.121 ( -18.977 -8.186 9.240) 22.638 6.990 ( 42.350 1.720 -7.698) 43.078 6.990 ( 42.350 1.720 7.698) 43.078 7.166 ( 39.259 -2.211 -6.133) 39.797 7.166 ( 39.259 -2.211 6.133) 39.797 7.479 ( 17.541 4.160 -0.460) 18.033 7.479 ( 17.541 4.160 0.460) 18.033 7.671 ( 5.832 -0.889 -7.542) 9.575 7.671 ( 5.832 -0.889 7.542) 9.575 7.878 ( 3.063 0.090 -10.085) 10.541 7.878 ( 3.063 0.090 10.085) 10.541 7.981 ( 1.589 -1.090 -12.565) 12.712 7.981 ( 1.589 -1.090 12.565) 12.712 8.230 ( 3.284 3.441 -4.244) 6.375 8.230 ( 3.284 3.441 4.244) 6.375 8.639 ( -3.683 -4.157 -3.013) 6.318 8.639 ( -3.683 -4.157 3.013) 6.318 8.784 ( -9.716 2.556 -4.628) 11.061 8.784 ( -9.716 2.556 4.628) 11.061 8.865 ( -16.830 0.647 -5.430) 17.696 8.865 ( -16.830 0.647 5.430) 17.696 9.306 ( 1.221 1.795 -8.586) 8.856 9.306 ( 1.221 1.795 8.586) 8.856 9.445 ( -5.383 -1.153 -7.860) 9.596 9.445 ( -5.383 -1.153 7.860) 9.596 9.989 ( -28.003 2.905 -6.509) 28.896 9.989 ( -28.003 2.905 6.509) 28.896 10.243 ( -35.698 -1.394 -5.284) 36.113 10.243 ( -35.698 -1.394 5.284) 36.113 10.745 ( -1.526 0.882 -8.292) 8.478 10.745 ( -1.526 0.882 8.292) 8.478 10.820 ( -6.746 -0.155 -3.787) 7.737 10.820 ( -6.746 -0.155 3.787) 7.737 11.725 ( 0.217 0.386 -3.251) 3.281 11.725 ( 0.217 0.386 3.251) 3.281 11.752 ( -0.108 0.177 -2.355) 2.364 11.752 ( -0.108 0.177 2.355) 2.364 12.481 ( 11.483 1.486 -17.394) 20.895 12.481 ( 11.483 1.486 17.394) 20.895 12.548 ( 8.157 -0.891 -7.518) 11.128 12.548 ( 8.157 -0.891 7.518) 11.128 12.747 ( 4.171 -3.613 -6.508) 8.533 12.747 ( 4.171 -3.613 6.508) 8.533 12.945 ( 2.245 -5.174 -12.801) 13.988 12.945 ( 2.245 -5.174 12.801) 13.988 13.306 ( 13.716 3.004 -5.929) 15.242 13.306 ( 13.716 3.004 5.929) 15.242 13.668 ( -0.210 1.295 -10.499) 10.580 13.668 ( -0.210 1.295 10.499) 10.580 13.899 ( 11.778 -4.454 -1.279) 12.656 13.899 ( 11.778 -4.454 1.279) 12.656 14.202 ( -1.667 -0.734 -11.245) 11.391 14.202 ( -1.667 -0.734 11.245) 11.391 14.983 ( 4.093 6.162 -1.924) 7.643 14.983 ( 4.093 6.162 1.924) 7.643 15.226 ( -1.998 0.022 -4.293) 4.736 15.226 ( -1.998 0.022 4.293) 4.736 15.346 ( 0.376 3.457 -2.576) 4.327 15.346 ( 0.376 3.457 2.576) 4.327 15.522 ( -6.962 -2.209 -6.021) 9.466 15.522 ( -6.962 -2.209 6.021) 9.466 15.697 ( 4.112 -4.913 -6.150) 8.881 15.697 ( 4.112 -4.913 6.150) 8.881 15.916 ( -0.200 -3.806 -4.560) 5.943 15.916 ( -0.200 -3.806 4.560) 5.943 16.077 ( 3.723 5.954 -6.143) 9.330 16.077 ( 3.723 5.954 6.143) 9.330 16.292 ( -2.880 2.204 -2.705) 4.524 16.292 ( -2.880 2.204 2.705) 4.524 16.518 ( 11.169 1.792 -3.022) 11.708 16.518 ( 11.169 1.792 3.022) 11.708 16.763 ( -4.733 -2.161 -4.090) 6.618 16.763 ( -4.733 -2.161 4.090) 6.618 16.912 ( -11.551 2.096 -3.290) 12.192 16.912 ( -11.551 2.096 3.290) 12.192 17.231 ( -16.949 -5.190 -7.666) 19.313 17.231 ( -16.949 -5.190 7.666) 19.313 17.537 ( 5.201 1.132 -2.073) 5.712 17.537 ( 5.201 1.132 2.073) 5.712 17.764 ( 0.082 -2.752 -1.361) 3.072 17.764 ( 0.082 -2.752 1.361) 3.072 18.081 ( 1.187 6.077 -2.738) 6.771 18.081 ( 1.187 6.077 2.738) 6.771 18.411 ( -10.053 -2.275 -2.493) 10.604 18.411 ( -10.053 -2.275 2.493) 10.604 19.664 ( 0.925 1.122 -2.211) 2.646 19.664 ( 0.925 1.122 2.211) 2.646 19.735 ( -3.399 -0.219 -0.973) 3.542 19.735 ( -3.399 -0.219 0.973) 3.542 20.842 ( 4.085 1.969 -15.019) 15.688 20.842 ( 4.085 1.969 15.019) 15.688 21.032 ( -3.606 -1.804 -8.635) 9.530 21.032 ( -3.606 -1.804 8.635) 9.530 24.556 ( 0.871 3.950 -8.947) 9.818 24.556 ( 0.871 3.950 8.947) 9.818 24.711 ( -4.185 1.620 -5.737) 7.284 24.711 ( -4.185 1.620 5.737) 7.284 25.524 ( 7.863 3.122 -1.742) 8.637 25.524 ( 7.863 3.122 1.742) 8.637 26.068 ( -13.836 -6.541 -5.360) 16.216 26.068 ( -13.836 -6.541 5.360) 16.216 27.133 ( 7.569 3.326 -3.115) 8.835 27.133 ( 7.569 3.326 3.115) 8.835 27.517 ( -4.628 -0.291 -2.532) 5.283 27.517 ( -4.628 -0.291 2.532) 5.283 27.565 ( -0.165 -2.169 -1.250) 2.509 27.565 ( -0.165 -2.169 1.250) 2.509 27.850 ( -8.458 -4.083 -2.173) 9.640 27.850 ( -8.458 -4.083 2.173) 9.640 30.014 ( 6.368 3.936 -10.552) 12.938 30.014 ( 6.368 3.936 10.552) 12.938 30.267 ( -2.097 -0.305 -7.396) 7.694 30.267 ( -2.097 -0.305 7.396) 7.694 30.453 ( 7.006 2.020 -5.173) 8.939 30.453 ( 7.006 2.020 5.173) 8.939 30.776 ( -5.310 -3.354 -12.568) 14.050 30.776 ( -5.310 -3.354 12.568) 14.050 32.157 ( 16.016 4.226 -4.528) 17.172 32.157 ( 16.016 4.226 4.528) 17.172 32.380 ( 4.538 1.628 -5.365) 7.213 32.380 ( 4.538 1.628 5.365) 7.213 32.512 ( 6.192 -0.493 -3.908) 7.339 32.512 ( 6.192 -0.493 3.908) 7.339 32.647 ( 2.694 -2.528 -1.647) 4.045 32.647 ( 2.694 -2.528 1.647) 4.045 32.775 ( 6.948 2.536 -6.762) 10.021 32.775 ( 6.948 2.536 6.762) 10.021 33.260 ( -2.952 -6.397 -5.362) 8.854 33.260 ( -2.952 -6.397 5.362) 8.854 33.697 ( -8.571 1.939 -4.262) 9.766 33.697 ( -8.571 1.939 4.262) 9.766 33.867 ( -11.608 -1.797 -2.845) 12.086 33.867 ( -11.608 -1.797 2.845) 12.086 98.531 ( 1.930 0.970 -1.201) 2.472 98.531 ( 1.930 0.970 1.201) 2.472 98.576 ( -0.169 0.873 -1.993) 2.182 98.576 ( -0.169 0.873 1.993) 2.182 98.807 ( 3.148 -1.517 -6.219) 7.134 98.807 ( 3.148 -1.517 6.219) 7.134 98.908 ( -1.591 -2.840 -6.145) 6.954 98.908 ( -1.591 -2.840 6.145) 6.954 100.508 ( 2.834 0.659 -3.963) 4.917 100.508 ( 2.834 0.659 3.963) 4.917 100.579 ( 2.453 0.328 -1.765) 3.040 100.579 ( 2.453 0.328 1.765) 3.040 100.677 ( 0.128 1.307 -2.272) 2.624 100.677 ( 0.128 1.307 2.272) 2.624 100.844 ( -4.582 -1.735 -2.209) 5.374 100.844 ( -4.582 -1.735 2.209) 5.374 102.543 ( 2.641 4.060 -1.769) 5.156 102.543 ( 2.641 4.060 1.769) 5.156 102.688 ( -3.938 5.946 -3.631) 8.003 102.688 ( -3.938 5.946 3.631) 8.003 102.998 ( 5.964 -1.895 -4.054) 7.456 102.998 ( 5.964 -1.895 4.054) 7.456 103.334 ( -10.113 -4.576 -10.511) 15.287 103.334 ( -10.113 -4.576 10.511) 15.287 ======================= Grid point 197 (66/72) ======================= q-point: (-0.50 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.966 ( -6.900 4.134 -1.058) 8.113 3.966 ( -6.898 4.134 1.057) 8.111 3.966 ( 6.898 4.134 -1.057) 8.111 3.966 ( 6.900 4.134 1.058) 8.113 4.655 ( -27.331 7.070 -13.038) 31.095 4.655 ( 27.319 7.070 -13.035) 31.085 4.655 ( -27.319 7.070 13.035) 31.085 4.655 ( 27.331 7.070 13.038) 31.095 5.732 ( -18.066 -11.286 -9.220) 23.211 5.732 ( 18.011 -11.286 -9.208) 23.164 5.732 ( -18.011 -11.286 9.209) 23.164 5.732 ( 18.066 -11.286 9.220) 23.211 7.515 ( -10.751 2.432 -3.276) 11.499 7.515 ( -6.196 2.432 -1.469) 6.817 7.515 ( 6.196 2.432 1.469) 6.817 7.515 ( 10.751 2.432 3.276) 11.499 7.728 ( -4.707 -0.877 -3.086) 5.697 7.728 ( 4.417 -0.877 -3.038) 5.432 7.728 ( -4.417 -0.877 3.038) 5.432 7.728 ( 4.707 -0.877 3.086) 5.697 8.106 ( -17.362 -0.026 -19.629) 26.206 8.106 ( 13.758 -0.026 -19.309) 23.710 8.106 ( -13.758 -0.026 19.309) 23.710 8.106 ( 17.362 -0.026 19.629) 26.206 8.273 ( -27.855 -0.182 -18.621) 33.507 8.273 ( 27.816 -0.182 -18.615) 33.471 8.273 ( -27.816 -0.182 18.615) 33.471 8.273 ( 27.855 -0.182 18.621) 33.507 8.662 ( -4.582 0.086 -5.246) 6.966 8.662 ( 3.994 0.086 -5.193) 6.552 8.662 ( -3.994 0.086 5.193) 6.552 8.662 ( 4.582 0.086 5.246) 6.966 9.491 ( -11.529 2.923 -11.425) 16.492 9.491 ( 11.506 2.923 -11.422) 16.474 9.491 ( -11.506 2.923 11.422) 16.474 9.491 ( 11.529 2.923 11.425) 16.492 9.631 ( -18.453 -0.849 -9.292) 20.678 9.631 ( 18.392 -0.849 -9.279) 20.618 9.631 ( -18.392 -0.849 9.279) 20.618 9.631 ( 18.453 -0.849 9.292) 20.678 10.746 ( -1.508 0.156 -5.249) 5.463 10.746 ( 1.484 0.156 -5.248) 5.456 10.746 ( -1.484 0.156 5.248) 5.456 10.746 ( 1.508 0.156 5.249) 5.463 11.740 ( -0.987 0.271 -3.410) 3.561 11.740 ( 0.986 0.271 -3.410) 3.561 11.740 ( -0.986 0.271 3.410) 3.561 11.740 ( 0.987 0.271 3.410) 3.561 12.611 ( -2.762 -1.080 -12.268) 12.621 12.611 ( 2.732 -1.080 -12.267) 12.614 12.611 ( -2.732 -1.080 12.267) 12.614 12.611 ( 2.762 -1.080 12.268) 12.621 12.883 ( -7.323 -2.725 -8.004) 11.186 12.883 ( 6.541 -2.725 -7.928) 10.633 12.883 ( -6.541 -2.725 7.928) 10.633 12.883 ( 7.323 -2.725 8.004) 11.186 13.550 ( -9.952 3.023 -7.621) 12.894 13.550 ( 9.812 3.023 -7.601) 12.774 13.550 ( -9.812 3.023 7.601) 12.774 13.550 ( 9.952 3.023 7.621) 12.894 14.119 ( -7.870 -5.563 -7.893) 12.457 14.119 ( 7.798 -5.563 -7.885) 12.407 14.119 ( -7.798 -5.563 7.885) 12.407 14.119 ( 7.870 -5.563 7.893) 12.457 15.109 ( -7.389 3.737 -1.268) 8.377 15.109 ( -6.421 3.737 -0.348) 7.437 15.109 ( 6.421 3.737 0.348) 7.437 15.109 ( 7.389 3.737 1.268) 8.377 15.396 ( -4.663 0.886 -5.310) 7.122 15.396 ( 4.505 0.886 -5.295) 7.008 15.396 ( -4.505 0.886 5.295) 7.008 15.396 ( 4.663 0.886 5.310) 7.122 15.819 ( -6.991 -0.856 -7.095) 9.997 15.819 ( 6.966 -0.856 -7.092) 9.978 15.819 ( -6.966 -0.856 7.092) 9.978 15.819 ( 6.991 -0.856 7.095) 9.997 16.211 ( -5.004 1.258 -4.359) 6.755 16.211 ( 0.567 1.258 -4.032) 4.262 16.211 ( -0.567 1.258 4.032) 4.262 16.211 ( 5.004 1.258 4.359) 6.755 16.700 ( -2.793 -2.002 -1.951) 3.952 16.700 ( 0.757 -2.002 -1.732) 2.754 16.700 ( -0.757 -2.002 1.732) 2.754 16.700 ( 2.793 -2.002 1.951) 3.952 16.871 ( -14.753 1.143 -4.372) 15.430 16.871 ( -14.493 1.143 4.274) 15.153 16.871 ( 14.493 1.143 -4.274) 15.153 16.871 ( 14.753 1.143 4.372) 15.430 17.683 ( -6.193 0.563 -1.351) 6.363 17.683 ( -5.106 0.563 -0.680) 5.182 17.683 ( 5.106 0.563 0.680) 5.182 17.683 ( 6.193 0.563 1.351) 6.363 18.209 ( -8.356 -0.530 -4.177) 9.357 18.209 ( -0.946 -0.530 -3.129) 3.312 18.209 ( 0.946 -0.530 3.129) 3.312 18.209 ( 8.356 -0.530 4.177) 9.357 19.687 ( -1.512 0.335 -1.807) 2.380 19.687 ( 1.401 0.335 -1.797) 2.303 19.687 ( -1.401 0.335 1.797) 2.303 19.687 ( 1.512 0.335 1.807) 2.380 20.939 ( -5.173 0.118 -13.507) 14.464 20.939 ( 5.132 0.118 -13.505) 14.448 20.939 ( -5.132 0.118 13.505) 14.448 20.939 ( 5.173 0.118 13.507) 14.464 24.614 ( -4.364 3.496 -8.802) 10.428 24.614 ( 4.141 3.496 -8.790) 10.326 24.614 ( -4.141 3.496 8.790) 10.326 24.614 ( 4.364 3.496 8.802) 10.428 25.769 ( -14.834 -2.373 -5.287) 15.926 25.769 ( 2.136 -2.373 -2.001) 3.768 25.769 ( -2.136 -2.373 2.001) 3.768 25.769 ( 14.834 -2.373 5.287) 15.926 27.316 ( -10.320 3.000 -4.155) 11.523 27.316 ( 9.500 3.000 -3.932) 10.710 27.316 ( -9.500 3.000 3.932) 10.710 27.316 ( 10.320 3.000 4.155) 11.523 27.687 ( -7.582 -4.586 -1.678) 9.018 27.687 ( -7.475 -4.586 1.624) 8.919 27.687 ( 7.475 -4.586 -1.624) 8.919 27.687 ( 7.582 -4.586 1.678) 9.018 30.153 ( -7.070 3.442 -11.308) 13.773 30.153 ( 6.984 3.442 -11.302) 13.725 30.153 ( -6.984 3.442 11.302) 13.725 30.153 ( 7.070 3.442 11.308) 13.773 30.634 ( -8.631 -2.148 -11.417) 14.473 30.634 ( 8.410 -2.148 -11.399) 14.328 30.634 ( -8.410 -2.148 11.399) 14.328 30.634 ( 8.631 -2.148 11.417) 14.473 32.378 ( -5.143 2.568 -5.202) 7.753 32.378 ( 3.827 2.568 -5.074) 6.854 32.378 ( -3.827 2.568 5.074) 6.854 32.378 ( 5.143 2.568 5.202) 7.753 32.602 ( -4.661 -0.592 -3.496) 5.856 32.602 ( 4.639 -0.592 -3.493) 5.837 32.602 ( -4.639 -0.592 3.493) 5.837 32.602 ( 4.661 -0.592 3.496) 5.856 33.055 ( -15.815 -0.720 -9.687) 18.560 33.055 ( 15.780 -0.720 -9.680) 18.526 33.055 ( -15.780 -0.720 9.680) 18.526 33.055 ( 15.815 -0.720 9.687) 18.560 33.680 ( -5.831 -1.718 -0.710) 6.120 33.680 ( -5.435 -1.718 0.095) 5.701 33.680 ( 5.435 -1.718 -0.095) 5.701 33.680 ( 5.831 -1.718 0.710) 6.120 98.562 ( -1.109 1.146 -1.616) 2.270 98.562 ( 1.054 1.146 -1.612) 2.241 98.562 ( -1.054 1.146 1.612) 2.241 98.562 ( 1.109 1.146 1.616) 2.270 98.866 ( -2.590 -2.365 -6.592) 7.467 98.866 ( 2.585 -2.365 -6.592) 7.465 98.866 ( -2.585 -2.365 6.592) 7.465 98.866 ( 2.590 -2.365 6.592) 7.467 100.563 ( -2.414 1.589 -3.719) 4.710 100.563 ( 2.230 1.589 -3.706) 4.608 100.563 ( -2.230 1.589 3.706) 4.608 100.563 ( 2.414 1.589 3.719) 4.710 100.745 ( -4.893 -1.285 -1.941) 5.419 100.745 ( 0.920 -1.285 -1.096) 1.923 100.745 ( -0.920 -1.285 1.096) 1.923 100.745 ( 4.893 -1.285 1.941) 5.419 102.608 ( -3.739 5.321 -2.702) 7.042 102.608 ( 3.697 5.321 -2.696) 7.018 102.608 ( -3.697 5.321 2.696) 7.018 102.608 ( 3.739 5.321 2.702) 7.042 103.146 ( -8.552 -3.815 -7.278) 11.860 103.146 ( 8.552 -3.815 -7.278) 11.860 103.146 ( -8.552 -3.815 7.278) 11.860 103.146 ( 8.552 -3.815 7.278) 11.860 ======================= Grid point 209 (67/72) ======================= q-point: ( 0.00 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.763 ( 0.000 8.631 -32.116) 33.255 2.763 ( 0.000 8.631 32.116) 33.255 2.895 ( 0.000 4.798 -16.591) 17.271 2.895 ( 0.000 4.798 16.591) 17.271 3.248 ( 0.000 30.647 -5.703) 31.174 3.248 ( 0.000 30.647 5.703) 31.174 4.059 ( 0.000 -33.787 -10.246) 35.306 4.059 ( 0.000 -33.787 10.246) 35.306 4.847 ( 0.000 3.065 -69.679) 69.746 4.847 ( 0.000 3.065 69.679) 69.746 4.937 ( 0.000 -5.000 -65.632) 65.822 4.937 ( 0.000 -5.000 65.632) 65.822 6.893 ( 0.000 4.341 -15.547) 16.142 6.893 ( 0.000 4.341 15.547) 16.142 6.991 ( 0.000 -3.861 -19.019) 19.407 6.991 ( 0.000 -3.861 19.019) 19.407 7.457 ( 0.000 4.190 -3.713) 5.598 7.457 ( 0.000 4.190 3.713) 5.598 7.562 ( 0.000 -5.172 -3.981) 6.526 7.562 ( 0.000 -5.172 3.981) 6.526 7.671 ( 0.000 5.065 -4.217) 6.591 7.671 ( 0.000 5.065 4.217) 6.591 7.794 ( 0.000 -6.060 -2.072) 6.404 7.794 ( 0.000 -6.060 2.072) 6.404 8.216 ( 0.000 4.921 -1.707) 5.209 8.216 ( 0.000 4.921 1.707) 5.209 8.295 ( 0.000 -1.619 -3.356) 3.726 8.295 ( 0.000 -1.619 3.356) 3.726 9.101 ( 0.000 10.549 -7.610) 13.007 9.101 ( 0.000 10.549 7.610) 13.007 9.337 ( 0.000 -9.964 -7.907) 12.720 9.337 ( 0.000 -9.964 7.907) 12.720 10.475 ( 0.000 0.592 -19.885) 19.893 10.475 ( 0.000 0.592 19.885) 19.893 10.482 ( 0.000 -0.503 -11.746) 11.757 10.482 ( 0.000 -0.503 11.746) 11.757 10.669 ( 0.000 0.409 -16.765) 16.770 10.669 ( 0.000 0.409 16.765) 16.770 10.709 ( 0.000 -3.580 -25.964) 26.210 10.709 ( 0.000 -3.580 25.964) 26.210 11.317 ( 0.000 9.033 -18.274) 20.384 11.317 ( 0.000 9.033 18.274) 20.384 11.343 ( 0.000 6.348 -6.660) 9.201 11.343 ( 0.000 6.348 6.660) 9.201 11.503 ( 0.000 -6.153 -5.193) 8.052 11.503 ( 0.000 -6.153 5.193) 8.052 11.540 ( 0.000 -7.985 -13.160) 15.393 11.540 ( 0.000 -7.985 13.160) 15.393 11.832 ( 0.000 9.367 -9.357) 13.240 11.832 ( 0.000 9.367 9.357) 13.240 12.010 ( 0.000 -4.975 -4.692) 6.838 12.010 ( 0.000 -4.975 4.692) 6.838 12.394 ( 0.000 0.418 -7.553) 7.565 12.394 ( 0.000 0.418 7.553) 7.565 12.411 ( 0.000 -1.566 -10.704) 10.818 12.411 ( 0.000 -1.566 10.704) 10.818 13.536 ( 0.000 3.978 -1.129) 4.136 13.536 ( 0.000 3.978 1.129) 4.136 13.556 ( 0.000 2.642 -3.771) 4.605 13.556 ( 0.000 2.642 3.771) 4.605 14.037 ( 0.000 -0.367 -3.111) 3.132 14.037 ( 0.000 -0.367 3.111) 3.132 14.071 ( 0.000 -3.062 -7.619) 8.211 14.071 ( 0.000 -3.062 7.619) 8.211 14.845 ( 0.000 5.738 -8.230) 10.033 14.845 ( 0.000 5.738 8.230) 10.033 14.905 ( 0.000 2.076 -9.977) 10.190 14.905 ( 0.000 2.076 9.977) 10.190 15.431 ( 0.000 3.408 -3.937) 5.207 15.431 ( 0.000 3.408 3.937) 5.207 15.517 ( 0.000 -2.450 -3.449) 4.231 15.517 ( 0.000 -2.450 3.449) 4.231 15.740 ( 0.000 -1.866 -6.491) 6.754 15.740 ( 0.000 -1.866 6.491) 6.754 15.777 ( 0.000 -4.669 -12.784) 13.610 15.777 ( 0.000 -4.669 12.784) 13.610 15.956 ( 0.000 1.114 -6.693) 6.785 15.956 ( 0.000 1.114 6.693) 6.785 16.099 ( 0.000 -10.472 -8.041) 13.203 16.099 ( 0.000 -10.472 8.041) 13.203 16.487 ( 0.000 5.447 -6.923) 8.809 16.487 ( 0.000 5.447 6.923) 8.809 16.636 ( 0.000 -7.835 -10.538) 13.132 16.636 ( 0.000 -7.835 10.538) 13.132 17.160 ( 0.000 4.776 -9.974) 11.058 17.160 ( 0.000 4.776 9.974) 11.058 17.206 ( 0.000 0.113 -10.031) 10.032 17.206 ( 0.000 0.113 10.031) 10.032 17.860 ( 0.000 12.246 -15.047) 19.400 17.860 ( 0.000 12.246 15.047) 19.400 18.062 ( 0.000 -4.834 -11.004) 12.019 18.062 ( 0.000 -4.834 11.004) 12.019 18.719 ( 0.000 2.989 -4.252) 5.198 18.719 ( 0.000 2.989 4.252) 5.198 18.833 ( 0.000 -6.632 -4.273) 7.889 18.833 ( 0.000 -6.632 4.273) 7.889 19.897 ( 0.000 10.538 -8.018) 13.241 19.897 ( 0.000 10.538 8.018) 13.241 20.133 ( 0.000 -11.164 -12.198) 16.536 20.133 ( 0.000 -11.164 12.198) 16.536 20.766 ( 0.000 11.631 -28.626) 30.899 20.766 ( 0.000 11.631 28.626) 30.899 20.957 ( 0.000 -5.069 -27.169) 27.638 20.957 ( 0.000 -5.069 27.169) 27.638 24.592 ( 0.000 19.772 -6.404) 20.783 24.592 ( 0.000 19.772 6.404) 20.783 25.071 ( 0.000 -22.804 -5.054) 23.357 25.071 ( 0.000 -22.804 5.054) 23.357 26.269 ( 0.000 6.094 -12.779) 14.157 26.269 ( 0.000 6.094 12.779) 14.157 26.380 ( 0.000 -3.546 -12.498) 12.992 26.380 ( 0.000 -3.546 12.498) 12.992 27.037 ( 0.000 1.566 -12.812) 12.908 27.037 ( 0.000 1.566 12.812) 12.908 27.094 ( 0.000 -3.570 -11.009) 11.573 27.094 ( 0.000 -3.570 11.009) 11.573 28.185 ( 0.000 1.584 -5.077) 5.318 28.185 ( 0.000 1.584 5.077) 5.318 28.220 ( 0.000 -1.366 -5.844) 6.002 28.220 ( 0.000 -1.366 5.844) 6.002 29.611 ( 0.000 4.158 -5.610) 6.983 29.611 ( 0.000 4.158 5.610) 6.983 29.706 ( 0.000 -4.210 -7.343) 8.464 29.706 ( 0.000 -4.210 7.343) 8.464 30.813 ( 0.000 5.135 -1.634) 5.389 30.813 ( 0.000 5.135 1.634) 5.389 30.909 ( 0.000 -2.972 -3.265) 4.415 30.909 ( 0.000 -2.972 3.265) 4.415 31.250 ( 0.000 3.380 -13.743) 14.152 31.250 ( 0.000 3.380 13.743) 14.152 31.347 ( 0.000 -4.887 -8.097) 9.457 31.347 ( 0.000 -4.887 8.097) 9.457 32.212 ( 0.000 6.074 -9.874) 11.593 32.212 ( 0.000 6.074 9.874) 11.593 32.388 ( 0.000 -9.056 -7.638) 11.847 32.388 ( 0.000 -9.056 7.638) 11.847 32.670 ( 0.000 7.862 -23.620) 24.894 32.670 ( 0.000 7.862 23.620) 24.894 32.876 ( 0.000 -11.549 -23.791) 26.446 32.876 ( 0.000 -11.549 23.791) 26.446 34.422 ( 0.000 5.266 -5.883) 7.895 34.422 ( 0.000 5.266 5.883) 7.895 34.522 ( 0.000 -3.795 -7.279) 8.209 34.522 ( 0.000 -3.795 7.279) 8.209 98.366 ( 0.000 0.203 -1.456) 1.470 98.366 ( 0.000 0.203 1.456) 1.470 98.369 ( 0.000 -0.105 -1.193) 1.197 98.369 ( 0.000 -0.105 1.193) 1.197 98.763 ( 0.000 2.677 -2.306) 3.533 98.763 ( 0.000 2.677 2.306) 3.533 98.832 ( 0.000 -3.471 -2.466) 4.258 98.832 ( 0.000 -3.471 2.466) 4.258 100.313 ( 0.000 -0.155 -4.190) 4.193 100.313 ( 0.000 -0.155 4.190) 4.193 100.322 ( 0.000 -0.685 -3.654) 3.718 100.322 ( 0.000 -0.685 3.654) 3.718 100.892 ( 0.000 2.780 -6.718) 7.271 100.892 ( 0.000 2.780 6.718) 7.271 100.938 ( 0.000 -1.512 -5.039) 5.261 100.938 ( 0.000 -1.512 5.039) 5.261 102.519 ( 0.000 1.817 -1.444) 2.321 102.519 ( 0.000 1.817 1.444) 2.321 102.569 ( 0.000 -2.380 -1.520) 2.824 102.569 ( 0.000 -2.380 1.520) 2.824 103.559 ( 0.000 14.280 -23.018) 27.088 103.559 ( 0.000 14.280 23.018) 27.088 103.804 ( 0.000 -8.149 -23.805) 25.161 103.804 ( 0.000 -8.149 23.805) 25.161 ======================= Grid point 211 (68/72) ======================= q-point: ( 0.10 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.080 ( 18.715 20.459 -16.269) 32.148 3.080 ( 18.715 20.459 16.269) 32.148 3.137 ( 25.715 12.867 -17.850) 33.845 3.137 ( 25.715 12.867 17.850) 33.845 3.425 ( 21.073 8.633 -14.593) 27.048 3.425 ( 21.073 8.633 14.593) 27.048 4.091 ( 3.549 -32.758 -9.911) 34.408 4.091 ( 3.549 -32.758 9.911) 34.408 4.895 ( 6.165 4.060 -45.308) 45.906 4.895 ( 6.165 4.060 45.308) 45.906 5.007 ( 7.734 -5.782 -41.642) 42.747 5.007 ( 7.734 -5.782 41.642) 42.747 6.890 ( -0.550 3.754 -15.158) 15.626 6.890 ( -0.550 3.754 15.158) 15.626 6.969 ( -3.208 -2.592 -18.306) 18.765 6.969 ( -3.208 -2.592 18.306) 18.765 7.382 ( -6.817 2.390 -2.663) 7.699 7.382 ( -6.817 2.390 2.663) 7.699 7.420 ( -10.883 -0.524 -2.874) 11.268 7.420 ( -10.883 -0.524 2.874) 11.268 7.710 ( 2.125 1.485 -2.349) 3.499 7.710 ( 2.125 1.485 2.349) 3.499 7.795 ( 0.427 -5.775 -5.168) 7.762 7.795 ( 0.427 -5.775 5.168) 7.762 8.249 ( 3.047 4.967 -1.897) 6.128 8.249 ( 3.047 4.967 1.897) 6.128 8.325 ( 3.151 -1.487 -2.166) 4.103 8.325 ( 3.151 -1.487 2.166) 4.103 9.100 ( -0.545 9.837 -6.545) 11.828 9.100 ( -0.545 9.837 6.545) 11.828 9.319 ( -2.086 -9.297 -6.610) 11.596 9.319 ( -2.086 -9.297 6.610) 11.596 10.236 ( -16.536 1.540 -30.959) 35.132 10.236 ( -16.536 1.540 30.959) 35.132 10.277 ( -15.891 -2.057 -28.759) 32.921 10.277 ( -15.891 -2.057 28.759) 32.921 10.693 ( 0.799 3.598 -8.636) 9.390 10.693 ( 0.799 3.598 8.636) 9.390 10.818 ( 2.109 -7.417 -10.384) 12.934 10.818 ( 2.109 -7.417 10.384) 12.934 11.331 ( 4.438 9.477 -18.257) 21.043 11.331 ( 4.438 9.477 18.257) 21.043 11.410 ( 3.191 2.701 -10.239) 11.060 11.410 ( 3.191 2.701 10.239) 11.060 11.582 ( 5.648 -2.157 -2.764) 6.648 11.582 ( 5.648 -2.157 2.764) 6.648 11.634 ( 5.737 -3.314 -11.492) 13.265 11.634 ( 5.737 -3.314 11.492) 13.265 11.872 ( 6.589 4.552 -15.417) 17.373 11.872 ( 6.589 4.552 15.417) 17.373 12.006 ( 1.304 -5.435 -8.820) 10.441 12.006 ( 1.304 -5.435 8.820) 10.441 12.453 ( 6.317 1.845 -7.274) 9.809 12.453 ( 6.317 1.845 7.274) 9.809 12.506 ( 7.181 -2.657 -8.961) 11.787 12.506 ( 7.181 -2.657 8.961) 11.787 13.238 ( -20.146 6.683 -2.157) 21.335 13.238 ( -20.146 6.683 2.157) 21.335 13.374 ( -18.307 -5.481 -3.004) 19.345 13.374 ( -18.307 -5.481 3.004) 19.345 14.046 ( 2.972 8.215 -7.110) 11.263 14.046 ( 2.972 8.215 7.110) 11.263 14.215 ( 6.195 -6.460 -8.324) 12.223 14.215 ( 6.195 -6.460 8.324) 12.223 14.868 ( 2.778 8.855 -4.908) 10.498 14.868 ( 2.778 8.855 4.908) 10.498 14.984 ( 6.592 -0.535 -6.503) 9.275 14.984 ( 6.592 -0.535 6.503) 9.275 15.397 ( -2.050 3.101 -2.324) 4.384 15.397 ( -2.050 3.101 2.324) 4.384 15.502 ( -1.421 -4.266 -3.372) 5.620 15.502 ( -1.421 -4.266 3.372) 5.620 15.731 ( -1.742 -2.240 -3.647) 4.621 15.731 ( -1.742 -2.240 3.647) 4.621 15.763 ( -1.135 -4.363 -6.956) 8.289 15.763 ( -1.135 -4.363 6.956) 8.289 15.998 ( 4.055 2.846 -6.731) 8.357 15.998 ( 4.055 2.846 6.731) 8.357 16.132 ( 2.840 -8.434 -7.316) 11.521 16.132 ( 2.840 -8.434 7.316) 11.521 16.530 ( 4.240 4.697 -5.818) 8.596 16.530 ( 4.240 4.697 5.818) 8.596 16.672 ( 3.563 -7.799 -9.007) 12.435 16.672 ( 3.563 -7.799 9.007) 12.435 17.124 ( -3.414 5.076 -1.275) 6.249 17.124 ( -3.414 5.076 1.275) 6.249 17.197 ( -1.091 -1.629 -2.166) 2.922 17.197 ( -1.091 -1.629 2.166) 2.922 17.857 ( -0.530 12.164 -14.206) 18.709 17.857 ( -0.530 12.164 14.206) 18.709 18.058 ( -0.990 -4.714 -10.638) 11.678 18.058 ( -0.990 -4.714 10.638) 11.678 18.664 ( -5.603 3.292 -4.232) 7.756 18.664 ( -5.603 3.292 4.232) 7.756 18.783 ( -4.886 -6.687 -4.201) 9.286 18.783 ( -4.886 -6.687 4.201) 9.286 19.860 ( -3.330 9.505 -6.138) 11.795 19.860 ( -3.330 9.505 6.138) 11.795 20.059 ( -6.500 -8.441 -8.449) 13.597 20.059 ( -6.500 -8.441 8.449) 13.597 20.800 ( 2.734 8.678 -22.553) 24.319 20.800 ( 2.734 8.678 22.553) 24.319 20.957 ( 0.141 -4.496 -23.018) 23.454 20.957 ( 0.141 -4.496 23.018) 23.454 24.602 ( 1.000 17.193 -6.651) 18.462 24.602 ( 1.000 17.193 6.651) 18.462 25.005 ( -6.134 -18.547 -5.969) 20.426 25.005 ( -6.134 -18.547 5.969) 20.426 26.173 ( -9.446 6.940 -12.478) 17.120 26.173 ( -9.446 6.940 12.478) 17.120 26.309 ( -5.687 -5.141 -11.202) 13.574 26.309 ( -5.687 -5.141 11.202) 13.574 27.043 ( 0.593 2.584 -6.610) 7.122 27.043 ( 0.593 2.584 6.610) 7.122 27.129 ( 3.116 -4.808 -6.761) 8.862 27.129 ( 3.116 -4.808 6.761) 8.862 28.123 ( -5.486 2.116 -3.500) 6.843 28.123 ( -5.486 2.116 3.500) 6.843 28.175 ( -4.131 -2.325 -4.180) 6.320 28.175 ( -4.131 -2.325 4.180) 6.320 29.689 ( 6.833 3.930 -5.597) 9.668 29.689 ( 6.833 3.930 5.597) 9.668 29.778 ( 6.280 -3.874 -6.976) 10.154 29.778 ( 6.280 -3.874 6.976) 10.154 30.730 ( -5.450 5.289 -3.070) 8.191 30.730 ( -5.450 5.289 3.070) 8.191 30.855 ( -4.826 -5.644 -1.679) 7.613 30.855 ( -4.826 -5.644 1.679) 7.613 31.346 ( 10.430 8.412 -5.454) 14.467 31.346 ( 10.430 8.412 5.454) 14.467 31.517 ( 13.037 -6.578 -4.376) 15.244 31.517 ( 13.037 -6.578 4.376) 15.244 32.231 ( 1.882 5.807 -7.859) 9.952 32.231 ( 1.882 5.807 7.859) 9.952 32.400 ( 1.400 -8.488 -6.459) 10.757 32.400 ( 1.400 -8.488 6.459) 10.757 32.703 ( 2.900 7.392 -20.892) 22.350 32.703 ( 2.900 7.392 20.892) 22.350 32.904 ( 2.575 -11.205 -21.548) 24.424 32.904 ( 2.575 -11.205 21.548) 24.424 34.368 ( -5.269 5.201 -5.968) 9.510 34.368 ( -5.269 5.201 5.968) 9.510 34.467 ( -5.457 -3.726 -7.226) 9.792 34.467 ( -5.457 -3.726 7.226) 9.792 98.391 ( 2.147 0.277 -0.674) 2.267 98.391 ( 2.147 0.277 0.674) 2.267 98.399 ( 2.961 -0.463 -0.468) 3.033 98.399 ( 2.961 -0.463 0.468) 3.033 98.763 ( 0.041 2.884 -2.295) 3.686 98.763 ( 0.041 2.884 2.295) 3.686 98.837 ( 0.427 -3.674 -2.647) 4.548 98.837 ( 0.427 -3.674 2.647) 4.548 100.332 ( 1.848 -0.043 -4.123) 4.519 100.332 ( 1.848 -0.043 4.123) 4.519 100.342 ( 1.947 -0.753 -3.581) 4.145 100.342 ( 1.947 -0.753 3.581) 4.145 100.880 ( -1.182 3.075 -6.042) 6.882 100.880 ( -1.182 3.075 6.042) 6.882 100.934 ( -0.476 -1.922 -4.679) 5.080 100.934 ( -0.476 -1.922 4.679) 5.080 102.525 ( 0.608 2.304 -1.503) 2.818 102.525 ( 0.608 2.304 1.503) 2.818 102.584 ( 1.529 -2.795 -1.632) 3.579 102.584 ( 1.529 -2.795 1.632) 3.579 103.490 ( -6.409 14.360 -20.688) 25.986 103.490 ( -6.409 14.360 20.688) 25.986 103.744 ( -5.816 -8.678 -21.963) 24.321 103.744 ( -5.816 -8.678 21.963) 24.321 ======================= Grid point 213 (69/72) ======================= q-point: ( 0.20 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.343 ( 13.535 36.093 -16.999) 42.129 3.343 ( 13.535 36.093 16.999) 42.129 3.747 ( 25.296 3.753 -31.639) 40.682 3.747 ( 25.296 3.753 31.639) 40.682 3.928 ( 20.097 -4.759 -31.511) 37.676 3.928 ( 20.097 -4.759 31.511) 37.676 4.222 ( 10.115 -28.710 -5.495) 30.932 4.222 ( 10.115 -28.710 5.495) 30.932 5.207 ( 28.554 4.948 -17.891) 34.057 5.207 ( 28.554 4.948 17.891) 34.057 5.331 ( 27.491 -5.919 -14.604) 31.687 5.331 ( 27.491 -5.919 14.604) 31.687 6.768 ( -18.385 3.159 -7.333) 20.044 6.768 ( -18.385 3.159 7.333) 20.044 6.811 ( -10.416 -0.841 -6.017) 12.059 6.811 ( -10.416 -0.841 6.017) 12.059 7.241 ( -2.628 3.126 -8.347) 9.292 7.241 ( -2.628 3.126 8.347) 9.292 7.306 ( 1.330 -2.665 -5.162) 5.959 7.306 ( 1.330 -2.665 5.162) 5.959 7.753 ( 2.584 1.195 -4.263) 5.127 7.753 ( 2.584 1.195 4.263) 5.127 7.821 ( 2.088 -4.847 -7.721) 9.352 7.821 ( 2.088 -4.847 7.721) 9.352 8.322 ( 3.713 5.951 -3.117) 7.676 8.322 ( 3.713 5.951 3.117) 7.676 8.415 ( 5.373 -2.120 -2.592) 6.330 8.415 ( 5.373 -2.120 2.592) 6.330 9.065 ( -2.966 7.750 -4.028) 9.224 9.065 ( -2.966 7.750 4.028) 9.224 9.240 ( -5.928 -7.452 -3.611) 10.184 9.240 ( -5.928 -7.452 3.611) 10.184 9.886 ( -17.860 2.154 -24.515) 30.407 9.886 ( -17.860 2.154 24.515) 30.407 9.941 ( -17.182 -2.558 -23.943) 29.581 9.941 ( -17.182 -2.558 23.943) 29.581 10.665 ( -3.380 4.093 -7.774) 9.414 10.665 ( -3.380 4.093 7.774) 9.414 10.790 ( -3.704 -6.557 -9.657) 12.246 10.790 ( -3.704 -6.557 9.657) 12.246 11.312 ( -8.240 7.112 -2.185) 11.102 11.312 ( -8.240 7.112 2.185) 11.102 11.412 ( -8.273 -2.247 -3.664) 9.323 11.412 ( -8.273 -2.247 3.664) 9.323 11.684 ( 6.125 2.814 -6.871) 9.625 11.684 ( 6.125 2.814 6.871) 9.625 11.749 ( 4.361 -1.702 -10.346) 11.356 11.749 ( 4.361 -1.702 10.346) 11.356 12.052 ( 7.537 2.687 -6.504) 10.311 12.052 ( 7.537 2.687 6.504) 10.311 12.125 ( 11.701 -3.562 -9.246) 15.333 12.125 ( 11.701 -3.562 9.246) 15.333 12.577 ( 2.871 1.368 -6.773) 7.483 12.577 ( 2.871 1.368 6.773) 7.483 12.635 ( 3.560 -3.830 -8.651) 10.108 12.635 ( 3.560 -3.830 8.651) 10.108 12.932 ( -4.060 5.726 -4.239) 8.200 12.932 ( -4.060 5.726 4.239) 8.200 13.083 ( -3.634 -7.735 -3.165) 9.113 13.083 ( -3.634 -7.735 3.165) 9.113 14.078 ( -0.135 10.458 -6.100) 12.108 14.078 ( -0.135 10.458 6.100) 12.108 14.270 ( -0.441 -6.016 -6.643) 8.973 14.270 ( -0.441 -6.016 6.643) 8.973 14.950 ( 5.080 10.196 -4.655) 12.306 14.950 ( 5.080 10.196 4.655) 12.306 15.120 ( 5.918 -2.929 -5.111) 8.350 15.120 ( 5.918 -2.929 5.111) 8.350 15.378 ( 0.140 2.358 -2.315) 3.308 15.378 ( 0.140 2.358 2.315) 3.308 15.477 ( -0.787 -6.203 -3.563) 7.197 15.477 ( -0.787 -6.203 3.563) 7.197 15.676 ( -3.035 -1.013 -3.183) 4.513 15.676 ( -3.035 -1.013 3.183) 4.513 15.737 ( -1.305 -4.500 -5.127) 6.945 15.737 ( -1.305 -4.500 5.127) 6.945 16.096 ( 4.985 4.104 -6.233) 8.975 16.096 ( 4.985 4.104 6.233) 8.975 16.190 ( 2.881 -3.852 -4.417) 6.531 16.190 ( 2.881 -3.852 4.417) 6.531 16.632 ( 4.411 4.355 -3.311) 7.028 16.632 ( 4.411 4.355 3.311) 7.028 16.763 ( 4.360 -7.566 -5.622) 10.385 16.763 ( 4.360 -7.566 5.622) 10.385 17.051 ( -2.272 5.047 -5.135) 7.550 17.051 ( -2.272 5.047 5.135) 7.550 17.161 ( -2.180 -4.561 -6.066) 7.897 17.161 ( -2.180 -4.561 6.066) 7.897 17.818 ( -4.031 9.641 -11.727) 15.707 17.818 ( -4.031 9.641 11.727) 15.707 17.984 ( -7.424 -4.147 -9.928) 13.072 17.984 ( -7.424 -4.147 9.928) 13.072 18.506 ( -9.288 5.424 -2.150) 10.969 18.506 ( -9.288 5.424 2.150) 10.969 18.654 ( -7.540 -7.130 -3.206) 10.861 18.654 ( -7.540 -7.130 3.206) 10.861 19.786 ( -3.599 6.874 -3.106) 8.358 19.786 ( -3.599 6.874 3.106) 8.358 19.916 ( -7.056 -4.718 -3.467) 9.169 19.916 ( -7.056 -4.718 3.467) 9.169 20.847 ( 1.639 5.779 -10.628) 12.208 20.847 ( 1.639 5.779 10.628) 12.208 20.969 ( 1.009 -4.388 -12.835) 13.602 20.969 ( 1.009 -4.388 12.835) 13.602 24.630 ( 1.658 10.770 -6.647) 12.764 24.630 ( 1.658 10.770 6.647) 12.764 24.858 ( -7.503 -9.550 -8.133) 14.617 24.858 ( -7.503 -9.550 8.133) 14.617 25.940 ( -12.213 10.701 -9.911) 19.024 25.940 ( -12.213 10.701 9.911) 19.024 26.184 ( -6.706 -10.730 -7.379) 14.647 26.184 ( -6.706 -10.730 7.379) 14.647 27.066 ( 1.926 4.807 -3.729) 6.382 27.066 ( 1.926 4.807 3.729) 6.382 27.201 ( 3.921 -6.766 -4.919) 9.238 27.201 ( 3.921 -6.766 4.919) 9.238 27.989 ( -7.689 3.162 -0.712) 8.345 27.989 ( -7.689 3.162 0.712) 8.345 28.069 ( -6.403 -3.802 -0.997) 7.513 28.069 ( -6.403 -3.802 0.997) 7.513 29.842 ( 7.743 3.531 -6.543) 10.735 29.842 ( 7.743 3.531 6.543) 10.735 29.919 ( 7.366 -3.297 -6.839) 10.578 29.919 ( 7.366 -3.297 6.839) 10.578 30.641 ( -3.329 5.724 -8.069) 10.438 30.641 ( -3.329 5.724 8.069) 10.438 30.775 ( -2.723 -5.971 -7.782) 10.179 30.775 ( -2.723 -5.971 7.782) 10.179 31.619 ( 16.036 9.872 -4.137) 19.280 31.619 ( 16.036 9.872 4.137) 19.280 31.810 ( 15.777 -6.964 -3.409) 17.579 31.810 ( 15.777 -6.964 3.409) 17.579 32.287 ( 3.791 5.588 -4.950) 8.373 32.287 ( 3.791 5.588 4.950) 8.373 32.447 ( 3.095 -7.745 -5.444) 9.960 32.447 ( 3.095 -7.745 5.444) 9.960 32.767 ( 3.155 7.217 -17.267) 18.979 32.767 ( 3.155 7.217 17.267) 18.979 32.966 ( 3.268 -10.657 -16.869) 20.219 32.966 ( 3.268 -10.657 16.869) 20.219 34.220 ( -9.407 4.681 -6.037) 12.118 34.220 ( -9.407 4.681 6.037) 12.118 34.309 ( -10.148 -3.359 -7.007) 12.781 34.309 ( -10.148 -3.359 7.007) 12.781 98.446 ( 3.147 0.900 -0.980) 3.417 98.446 ( 3.147 0.900 0.980) 3.417 98.472 ( 3.912 -1.392 -2.071) 4.640 98.472 ( 3.912 -1.392 2.071) 4.640 98.765 ( 0.234 3.079 -2.342) 3.876 98.765 ( 0.234 3.079 2.342) 3.876 98.845 ( 0.332 -3.973 -3.108) 5.056 98.845 ( 0.332 -3.973 3.108) 5.056 100.384 ( 3.213 0.146 -4.110) 5.219 100.384 ( 3.213 0.146 4.110) 5.219 100.396 ( 3.423 -0.783 -3.323) 4.835 100.396 ( 3.423 -0.783 3.323) 4.835 100.846 ( -2.205 3.538 -5.120) 6.602 100.846 ( -2.205 3.538 5.120) 6.602 100.914 ( -1.631 -2.642 -4.257) 5.269 100.914 ( -1.631 -2.642 4.257) 5.269 102.546 ( 1.601 3.457 -1.819) 4.222 102.546 ( 1.601 3.457 1.819) 4.222 102.628 ( 2.864 -3.663 -2.041) 5.078 102.628 ( 2.864 -3.663 2.041) 5.078 103.328 ( -9.141 13.803 -15.860) 22.926 103.328 ( -9.141 13.803 15.860) 22.926 103.587 ( -9.441 -9.419 -17.946) 22.359 103.587 ( -9.441 -9.419 17.946) 22.359 ======================= Grid point 215 (70/72) ======================= q-point: ( 0.30 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.663 ( 17.808 29.171 -17.352) 38.329 3.663 ( 17.808 29.171 17.352) 38.329 4.039 ( 5.471 0.340 -27.156) 27.704 4.039 ( 5.471 0.340 27.156) 27.704 4.167 ( 8.148 -1.153 -22.185) 23.662 4.167 ( 8.148 -1.152 22.185) 23.662 4.474 ( 14.740 -24.468 -5.660) 29.120 4.474 ( 14.740 -24.468 5.660) 29.120 5.966 ( 31.816 3.071 -10.813) 33.743 5.966 ( 31.816 3.071 10.813) 33.743 6.050 ( 32.226 -4.032 -8.666) 33.613 6.050 ( 32.226 -4.032 8.666) 33.613 6.347 ( -9.690 7.429 -7.455) 14.306 6.347 ( -9.690 7.429 7.455) 14.306 6.511 ( -9.723 -6.926 -3.973) 12.582 6.511 ( -9.723 -6.926 3.973) 12.582 7.329 ( 9.635 5.298 -2.529) 11.283 7.329 ( 9.635 5.298 2.529) 11.283 7.432 ( 9.775 -3.788 -6.608) 12.392 7.432 ( 9.775 -3.788 6.608) 12.392 7.818 ( 3.648 1.003 -7.809) 8.677 7.818 ( 3.648 1.003 7.809) 8.677 7.872 ( 2.886 -3.627 -9.596) 10.657 7.872 ( 2.886 -3.627 9.596) 10.657 8.373 ( 0.937 7.908 -5.704) 9.796 8.373 ( 0.937 7.908 5.704) 9.796 8.514 ( 3.717 -4.360 -5.764) 8.127 8.514 ( 3.717 -4.360 5.764) 8.127 8.988 ( -4.734 4.563 -1.888) 6.841 8.988 ( -4.734 4.563 1.888) 6.841 9.089 ( -8.965 -4.272 -1.631) 10.064 9.089 ( -8.965 -4.272 1.631) 10.064 9.542 ( -15.710 2.786 -9.061) 18.348 9.542 ( -15.710 2.786 9.061) 18.348 9.610 ( -15.170 -3.146 -9.327) 18.084 9.610 ( -15.170 -3.146 9.327) 18.084 10.531 ( -12.484 5.239 -3.823) 14.068 10.531 ( -12.484 5.239 3.823) 14.068 10.668 ( -11.050 -6.631 -5.267) 13.922 10.668 ( -11.050 -6.631 5.267) 13.922 11.002 ( -19.923 4.694 -4.260) 20.907 11.002 ( -19.923 4.694 4.260) 20.907 11.077 ( -20.819 -1.962 -6.559) 21.916 11.077 ( -20.819 -1.962 6.559) 21.916 11.729 ( 0.250 1.418 -2.701) 3.060 11.729 ( 0.250 1.418 2.701) 3.060 11.768 ( -1.777 -1.673 -3.455) 4.230 11.768 ( -1.777 -1.673 3.455) 4.230 12.270 ( 15.081 7.029 -11.462) 20.204 12.270 ( 15.081 7.029 11.462) 20.204 12.395 ( 13.172 -2.238 -7.746) 15.444 12.395 ( 13.172 -2.238 7.746) 15.444 12.580 ( 1.080 -0.134 -4.543) 4.671 12.580 ( 1.080 -0.134 4.543) 4.671 12.683 ( 3.701 -7.729 -15.347) 17.578 12.683 ( 3.701 -7.729 15.347) 17.578 13.105 ( 15.162 5.482 -8.246) 18.109 13.105 ( 15.162 5.482 8.246) 18.109 13.256 ( 15.634 -8.289 -4.717) 18.313 13.256 ( 15.634 -8.289 4.717) 18.313 14.043 ( -3.177 10.188 -4.208) 11.471 14.043 ( -3.177 10.188 4.208) 11.471 14.220 ( -3.947 -4.894 -4.995) 8.030 14.220 ( -3.947 -4.894 4.995) 8.030 15.054 ( 4.645 8.119 -2.804) 9.765 15.054 ( 4.645 8.119 2.804) 9.765 15.198 ( 1.931 -3.025 -2.666) 4.471 15.198 ( 1.931 -3.025 2.666) 4.471 15.396 ( 1.343 1.984 -2.174) 3.235 15.396 ( 1.343 1.984 2.174) 3.235 15.479 ( 0.696 -6.855 -3.687) 7.815 15.479 ( 0.696 -6.855 3.687) 7.815 15.624 ( -1.690 2.244 -6.178) 6.787 15.624 ( -1.690 2.244 6.178) 6.787 15.729 ( 1.037 -5.950 -6.437) 8.827 15.729 ( 1.037 -5.950 6.437) 8.827 16.178 ( 3.324 5.488 -6.841) 9.379 16.178 ( 3.324 5.488 6.841) 9.379 16.268 ( 5.092 -2.144 -2.860) 6.221 16.268 ( 5.092 -2.144 2.860) 6.221 16.626 ( -5.195 6.851 -6.289) 10.653 16.626 ( -5.195 6.851 6.289) 10.653 16.771 ( -3.947 -6.016 -8.822) 11.384 16.771 ( -3.947 -6.016 8.822) 11.384 17.086 ( 2.365 1.173 -6.735) 7.234 17.086 ( 2.365 1.173 6.735) 7.234 17.145 ( 1.805 -3.939 -5.787) 7.229 17.145 ( 1.805 -3.939 5.787) 7.229 17.700 ( -6.667 3.300 -8.346) 11.180 17.700 ( -6.667 3.300 8.346) 11.180 17.762 ( -12.109 -1.895 -7.553) 14.397 17.762 ( -12.109 -1.895 7.553) 14.397 18.334 ( -7.525 7.352 -3.159) 10.984 18.334 ( -7.525 7.352 3.159) 10.984 18.495 ( -8.240 -6.784 -3.350) 11.187 18.495 ( -8.240 -6.784 3.350) 11.187 19.727 ( -2.167 3.865 -1.161) 4.581 19.727 ( -2.167 3.865 1.161) 4.581 19.796 ( -4.716 -2.267 -1.409) 5.419 19.796 ( -4.716 -2.267 1.409) 5.419 20.872 ( 1.161 5.036 -9.004) 10.382 20.872 ( 1.161 5.036 9.004) 10.382 20.985 ( 0.315 -4.761 -6.261) 7.872 20.985 ( 0.315 -4.761 6.261) 7.872 24.655 ( 0.329 5.123 -2.634) 5.770 24.655 ( 0.329 5.123 2.634) 5.770 24.747 ( -2.871 -3.130 -5.807) 7.195 24.747 ( -2.871 -3.130 5.807) 7.195 25.733 ( -7.768 12.901 -6.835) 16.538 25.733 ( -7.768 12.901 6.835) 16.538 26.039 ( -7.899 -13.799 -4.951) 16.653 26.039 ( -7.899 -13.799 4.951) 16.653 27.127 ( 4.342 6.388 -2.140) 8.015 27.127 ( 4.342 6.388 2.140) 8.015 27.288 ( 4.909 -7.603 -2.905) 9.505 27.288 ( 4.909 -7.603 2.905) 9.505 27.818 ( -9.431 4.041 -2.317) 10.519 27.818 ( -9.431 4.041 2.317) 10.519 27.918 ( -8.535 -4.829 -1.826) 9.974 27.918 ( -8.535 -4.829 1.826) 9.974 29.986 ( 6.789 4.240 -8.457) 11.645 29.986 ( 6.789 4.240 8.457) 11.645 30.076 ( 8.315 -3.786 -7.877) 12.063 30.076 ( 8.315 -3.786 7.877) 12.063 30.585 ( -2.605 6.686 -10.389) 12.626 30.585 ( -2.605 6.686 10.389) 12.626 30.733 ( -2.099 -6.347 -11.116) 12.972 30.733 ( -2.099 -6.347 11.116) 12.972 31.961 ( 17.461 8.704 -4.922) 20.121 31.961 ( 17.461 8.704 4.922) 20.121 32.131 ( 15.737 -6.245 -2.632) 17.134 32.131 ( 15.737 -6.245 2.632) 17.134 32.380 ( 5.409 4.962 -4.389) 8.552 32.380 ( 5.409 4.962 4.389) 8.552 32.515 ( 3.424 -6.303 -4.287) 8.357 32.515 ( 3.424 -6.303 4.287) 8.357 32.823 ( 2.548 7.757 -13.865) 16.090 32.823 ( 2.548 7.757 13.865) 16.090 33.028 ( 3.000 -10.396 -11.836) 16.036 33.028 ( 3.000 -10.396 11.836) 16.036 34.000 ( -12.290 3.710 -5.961) 14.155 34.000 ( -12.290 3.710 5.961) 14.155 34.073 ( -12.981 -2.823 -6.226) 14.671 34.073 ( -12.981 -2.823 6.226) 14.671 98.509 ( 2.992 1.425 -1.746) 3.746 98.509 ( 2.992 1.425 1.746) 3.746 98.543 ( 3.021 -1.480 -2.810) 4.384 98.543 ( 3.021 -1.480 2.810) 4.384 98.773 ( 0.559 2.453 -2.156) 3.313 98.773 ( 0.559 2.453 2.156) 3.313 98.847 ( -0.223 -3.919 -3.548) 5.291 98.847 ( -0.223 -3.919 3.548) 5.291 100.455 ( 3.801 0.697 -4.202) 5.709 100.455 ( 3.801 0.697 4.202) 5.709 100.476 ( 4.458 -1.041 -3.447) 5.731 100.476 ( 4.458 -1.041 3.447) 5.731 100.792 ( -3.097 3.628 -4.423) 6.505 100.792 ( -3.097 3.628 4.423) 6.505 100.866 ( -3.113 -3.026 -3.879) 5.822 100.866 ( -3.113 -3.026 3.879) 5.822 102.591 ( 2.866 4.833 -2.395) 6.108 102.591 ( 2.866 4.833 2.395) 6.108 102.696 ( 3.790 -4.215 -2.519) 6.203 102.696 ( 3.790 -4.215 2.519) 6.203 103.148 ( -8.351 11.668 -10.804) 17.961 103.148 ( -8.351 11.668 10.804) 17.961 103.386 ( -10.235 -9.299 -13.535) 19.351 103.386 ( -10.235 -9.299 13.535) 19.351 ======================= Grid point 217 (71/72) ======================= q-point: ( 0.40 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.958 ( 8.733 11.332 -12.387) 18.924 3.958 ( 8.733 11.332 12.388) 18.924 4.070 ( -0.598 0.054 -14.855) 14.867 4.070 ( -0.598 0.054 14.855) 14.867 4.408 ( 19.302 12.348 -16.505) 28.239 4.408 ( 19.302 12.348 16.505) 28.239 4.815 ( 18.238 -19.662 -10.814) 28.916 4.815 ( 18.238 -19.662 10.814) 28.916 5.644 ( -27.930 8.829 -11.927) 31.628 5.644 ( -27.930 8.829 11.927) 31.628 5.889 ( -24.381 -12.019 -10.850) 29.268 5.889 ( -24.381 -12.019 10.850) 29.268 7.042 ( 42.195 2.881 -7.928) 43.030 7.042 ( 42.195 2.881 7.928) 43.030 7.108 ( 40.871 -2.947 -7.524) 41.662 7.108 ( 40.871 -2.947 7.524) 41.662 7.574 ( 13.714 3.932 -4.953) 15.102 7.574 ( 13.714 3.932 4.953) 15.102 7.640 ( 8.789 -2.084 -7.544) 11.768 7.640 ( 8.789 -2.084 7.544) 11.769 7.887 ( 4.148 1.261 -14.412) 15.050 7.887 ( 4.148 1.261 14.412) 15.050 7.936 ( 4.207 -2.707 -13.752) 14.633 7.936 ( 4.207 -2.707 13.752) 14.633 8.356 ( -2.621 7.397 -3.841) 8.737 8.356 ( -2.621 7.397 3.841) 8.737 8.519 ( -4.639 -6.774 -3.277) 8.840 8.519 ( -4.639 -6.774 3.277) 8.840 8.836 ( -11.813 2.149 -4.324) 12.762 8.836 ( -11.813 2.149 4.324) 12.762 8.869 ( -13.727 -0.631 -4.888) 14.584 8.869 ( -13.727 -0.631 4.888) 14.584 9.354 ( 0.214 2.429 -12.376) 12.614 9.354 ( 0.214 2.429 12.376) 12.614 9.407 ( -2.180 -2.206 -11.846) 12.245 9.407 ( -2.180 -2.206 11.846) 12.245 10.080 ( -29.439 4.981 -5.522) 30.363 10.080 ( -29.438 4.981 5.522) 30.363 10.184 ( -32.572 -4.014 -4.755) 33.161 10.184 ( -32.572 -4.014 4.755) 33.161 10.774 ( -3.813 1.659 -4.249) 5.945 10.774 ( -3.813 1.659 4.249) 5.945 10.807 ( -6.140 -1.097 -3.654) 7.229 10.807 ( -6.140 -1.097 3.654) 7.229 11.733 ( 0.314 0.454 -1.632) 1.723 11.733 ( 0.314 0.454 1.632) 1.723 11.747 ( -0.280 -0.643 -0.920) 1.157 11.747 ( -0.280 -0.643 0.920) 1.157 12.540 ( 8.358 3.739 -4.674) 10.280 12.540 ( 8.358 3.739 4.674) 10.280 12.597 ( 5.752 5.892 -10.996) 13.738 12.597 ( 5.752 5.892 10.996) 13.738 12.646 ( 6.976 -4.923 -6.637) 10.815 12.646 ( 6.976 -4.923 6.637) 10.815 12.782 ( 4.960 -9.063 -16.070) 19.104 12.782 ( 4.960 -9.063 16.070) 19.104 13.405 ( 13.550 5.990 -5.036) 15.647 13.405 ( 13.550 5.990 5.036) 15.647 13.562 ( 12.019 -7.868 -5.525) 15.391 13.562 ( 12.019 -7.868 5.525) 15.391 13.969 ( -2.951 7.661 -5.993) 10.165 13.969 ( -2.951 7.661 5.993) 10.165 14.128 ( -5.150 -5.825 -10.935) 13.417 14.128 ( -5.150 -5.825 10.935) 13.417 15.122 ( 2.560 5.887 -1.225) 6.535 15.122 ( 2.560 5.887 1.225) 6.535 15.214 ( -0.202 -1.989 -2.184) 2.961 15.214 ( -0.202 -1.989 2.184) 2.961 15.409 ( -0.271 1.894 -2.028) 2.788 15.409 ( -0.271 1.894 2.028) 2.788 15.457 ( -2.945 -3.106 -4.638) 6.311 15.457 ( -2.945 -3.106 4.638) 6.311 15.665 ( 6.180 2.948 -6.912) 9.729 15.665 ( 6.180 2.948 6.912) 9.729 15.787 ( 4.004 -6.812 -4.091) 8.898 15.787 ( 4.004 -6.812 4.091) 8.898 16.232 ( 1.178 6.796 -5.458) 8.795 16.232 ( 1.178 6.796 5.458) 8.795 16.323 ( -2.609 -0.756 -3.279) 4.258 16.323 ( -2.609 -0.756 3.279) 4.258 16.559 ( 3.373 2.809 -4.511) 6.294 16.559 ( 3.373 2.809 4.511) 6.294 16.664 ( -4.067 -5.930 -6.690) 9.822 16.664 ( -4.067 -5.930 6.690) 9.822 16.997 ( -9.604 4.985 -1.522) 10.927 16.997 ( -9.604 4.985 1.522) 10.927 17.109 ( -10.097 -5.261 -3.819) 12.009 17.109 ( -10.097 -5.261 3.819) 12.009 17.606 ( 2.794 4.518 -1.677) 5.571 17.606 ( 2.794 4.518 1.677) 5.571 17.701 ( 3.015 -3.579 -2.330) 5.228 17.701 ( 3.015 -3.579 2.330) 5.228 18.201 ( -5.385 5.375 -3.785) 8.498 18.201 ( -5.385 5.375 3.785) 8.498 18.324 ( -8.702 -5.361 -4.028) 10.986 18.324 ( -8.702 -5.361 4.028) 10.986 19.699 ( -0.709 1.737 -0.804) 2.041 19.699 ( -0.709 1.737 0.804) 2.041 19.727 ( -2.314 -0.708 -0.553) 2.483 19.727 ( -2.314 -0.708 0.553) 2.483 20.901 ( 1.767 3.279 -7.837) 8.677 20.901 ( 1.767 3.279 7.837) 8.677 20.975 ( -1.269 -3.216 -2.636) 4.348 20.975 ( -1.269 -3.216 2.636) 4.348 24.656 ( 0.738 4.438 -4.939) 6.681 24.656 ( 0.738 4.438 4.939) 6.681 24.723 ( -0.938 -1.184 -1.534) 2.153 24.723 ( -0.938 -1.184 1.534) 2.153 25.650 ( -0.253 8.485 -2.643) 8.891 25.650 ( -0.253 8.485 2.643) 8.891 25.871 ( -8.610 -10.569 -3.629) 14.107 25.871 ( -8.610 -10.569 3.629) 14.107 27.244 ( 7.296 6.541 -2.326) 10.071 27.244 ( 7.296 6.541 2.326) 10.071 27.402 ( 6.557 -7.313 -1.678) 9.965 27.402 ( 6.557 -7.313 1.678) 9.965 27.619 ( -10.173 4.672 -3.520) 11.735 27.619 ( -10.173 4.672 3.520) 11.735 27.737 ( -9.299 -5.698 -2.963) 11.301 27.737 ( -9.299 -5.698 2.963) 11.301 30.120 ( 6.579 5.227 -9.276) 12.516 30.120 ( 6.579 5.227 9.276) 12.516 30.223 ( 5.079 -3.691 -5.835) 8.571 30.223 ( 5.079 -3.691 5.835) 8.571 30.541 ( -0.995 5.617 -7.058) 9.075 30.541 ( -0.995 5.617 7.058) 9.075 30.673 ( -4.055 -5.777 -11.151) 13.197 30.673 ( -4.055 -5.777 11.151) 13.197 32.277 ( 13.013 6.166 -2.767) 14.664 32.277 ( 13.013 6.166 2.767) 14.664 32.391 ( 8.428 -2.703 -2.979) 9.339 32.391 ( 8.428 -2.703 2.979) 9.339 32.498 ( 6.016 1.407 -3.682) 7.193 32.498 ( 6.016 1.407 3.682) 7.193 32.571 ( 1.924 -4.010 -3.013) 5.372 32.571 ( 1.924 -4.010 3.013) 5.372 32.891 ( 5.420 7.703 -8.250) 12.521 32.891 ( 5.420 7.703 8.250) 12.521 33.083 ( 1.917 -9.056 -6.461) 11.289 33.083 ( 1.917 -9.056 6.461) 11.289 33.750 ( -11.399 2.805 -4.851) 12.702 33.750 ( -11.399 2.805 4.851) 12.702 33.814 ( -12.106 -2.848 -4.206) 13.128 33.814 ( -12.106 -2.848 4.206) 13.128 98.561 ( 2.115 1.577 -1.815) 3.202 98.561 ( 2.115 1.577 1.815) 3.202 98.586 ( 1.177 -0.343 -1.692) 2.089 98.586 ( 1.177 -0.343 1.692) 2.089 98.789 ( 1.042 0.537 -1.934) 2.262 98.789 ( 1.042 0.537 1.934) 2.262 98.836 ( -0.896 -3.252 -3.595) 4.930 98.836 ( -0.896 -3.252 3.595) 4.930 100.533 ( 3.952 1.556 -3.934) 5.790 100.533 ( 3.952 1.556 3.934) 5.790 100.567 ( 4.341 -1.295 -3.071) 5.473 100.567 ( 4.341 -1.295 3.071) 5.473 100.726 ( -3.172 2.894 -3.589) 5.596 100.726 ( -3.172 2.894 3.589) 5.596 100.792 ( -4.199 -2.842 -3.461) 6.139 100.792 ( -4.199 -2.842 3.461) 6.139 102.660 ( 4.018 5.995 -3.121) 7.863 102.660 ( 4.018 5.995 3.121) 7.863 102.764 ( 2.091 -1.679 -1.243) 2.956 102.764 ( 2.091 -1.679 1.243) 2.956 103.018 ( -3.638 5.845 -4.404) 8.173 103.018 ( -3.638 5.845 4.404) 8.173 103.191 ( -8.948 -8.031 -9.386) 15.253 103.191 ( -8.948 -8.031 9.386) 15.253 ======================= Grid point 219 (72/72) ======================= q-point: (-0.50 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 60 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.044 ( -1.873 2.121 -0.838) 2.951 4.044 ( 0.413 2.121 -0.575) 2.236 4.044 ( -0.413 2.121 0.575) 2.236 4.044 ( 1.873 2.121 0.838) 2.951 4.878 ( -21.615 11.200 -10.645) 26.570 4.878 ( 21.456 11.200 -10.609) 26.426 4.878 ( -21.456 11.200 10.609) 26.426 4.878 ( 21.615 11.200 10.645) 26.570 5.430 ( -16.752 -13.349 -8.195) 22.934 5.430 ( 16.472 -13.349 -8.132) 22.708 5.430 ( -16.472 -13.349 8.132) 22.707 5.430 ( 16.752 -13.349 8.195) 22.934 7.579 ( -6.978 2.722 -3.764) 8.383 7.579 ( 1.027 2.722 -2.979) 4.164 7.579 ( -1.027 2.722 2.979) 4.164 7.579 ( 6.978 2.722 3.764) 8.383 7.693 ( -5.482 -1.953 -3.693) 6.892 7.693 ( 5.339 -1.953 -3.670) 6.766 7.693 ( -5.339 -1.953 3.670) 6.766 7.693 ( 5.482 -1.953 3.693) 6.892 8.102 ( -8.972 -0.243 -8.045) 12.053 8.102 ( 5.560 -0.243 -7.696) 9.497 8.102 ( -5.560 -0.243 7.696) 9.497 8.102 ( 8.972 -0.243 8.046) 12.053 8.280 ( -13.547 0.567 -8.744) 16.134 8.280 ( 13.184 0.567 -8.682) 15.797 8.280 ( -13.184 0.567 8.682) 15.797 8.280 ( 13.547 0.567 8.744) 16.133 8.660 ( -2.652 -0.199 -3.487) 4.386 8.660 ( 2.560 -0.199 -3.479) 4.324 8.660 ( -2.560 -0.199 3.479) 4.324 8.660 ( 2.652 -0.199 3.487) 4.386 9.558 ( -19.145 2.673 -15.682) 24.892 9.558 ( 18.734 2.673 -15.627) 24.542 9.558 ( -18.734 2.673 15.627) 24.542 9.558 ( 19.145 2.673 15.682) 24.892 9.606 ( -21.608 -1.440 -14.929) 26.303 9.606 ( 21.083 -1.440 -14.846) 25.826 9.606 ( -21.083 -1.440 14.846) 25.826 9.606 ( 21.608 -1.440 14.929) 26.303 10.749 ( -0.629 0.076 -2.133) 2.225 10.749 ( 0.607 0.076 -2.132) 2.218 10.749 ( -0.607 0.076 2.132) 2.218 10.749 ( 0.629 0.076 2.133) 2.225 11.742 ( -0.407 -0.078 -1.331) 1.394 11.742 ( 0.406 -0.078 -1.331) 1.393 11.742 ( -0.406 -0.078 1.331) 1.393 11.742 ( 0.407 -0.078 1.331) 1.394 12.620 ( -0.878 1.815 -8.577) 8.811 12.620 ( 0.774 1.815 -8.576) 8.800 12.620 ( -0.773 1.815 8.576) 8.800 12.620 ( 0.878 1.815 8.577) 8.811 12.800 ( -3.849 -3.847 -7.649) 9.387 12.800 ( 3.492 -3.847 -7.630) 9.231 12.800 ( -3.492 -3.847 7.630) 9.231 12.800 ( 3.849 -3.847 7.649) 9.387 13.615 ( -6.115 2.185 -4.543) 7.925 13.615 ( 4.909 2.185 -4.377) 6.931 13.615 ( -4.909 2.185 4.377) 6.930 13.615 ( 6.115 2.185 4.543) 7.925 14.009 ( -5.983 -3.293 -5.550) 8.800 14.009 ( 5.069 -3.293 -5.448) 8.138 14.009 ( -5.069 -3.293 5.448) 8.138 14.009 ( 5.983 -3.293 5.550) 8.800 15.179 ( -2.182 1.935 -1.103) 3.118 15.179 ( -1.455 1.935 -0.961) 2.605 15.179 ( 1.455 1.935 0.961) 2.605 15.179 ( 2.182 1.935 1.103) 3.118 15.410 ( -1.038 0.234 -4.090) 4.226 15.410 ( 1.001 0.234 -4.089) 4.216 15.410 ( -1.001 0.234 4.089) 4.216 15.410 ( 1.038 0.234 4.090) 4.226 15.800 ( -4.556 -0.595 -4.467) 6.409 15.800 ( 4.506 -0.595 -4.462) 6.369 15.800 ( -4.506 -0.595 4.462) 6.369 15.800 ( 4.556 -0.595 4.467) 6.409 16.242 ( -2.534 1.005 -2.305) 3.570 16.242 ( 1.687 1.005 -2.217) 2.961 16.242 ( -1.687 1.005 2.217) 2.961 16.242 ( 2.534 1.005 2.305) 3.570 16.665 ( -1.689 -0.881 -2.512) 3.153 16.665 ( 1.683 -0.881 -2.512) 3.149 16.665 ( -1.683 -0.881 2.512) 3.149 16.665 ( 1.689 -0.881 2.512) 3.153 16.883 ( -5.382 0.106 -1.810) 5.679 16.883 ( -1.873 0.106 -0.669) 1.992 16.883 ( 1.874 0.106 0.669) 1.992 16.883 ( 5.382 0.106 1.810) 5.679 17.716 ( -3.922 1.667 -1.035) 4.385 17.716 ( -2.938 1.667 0.567) 3.425 17.716 ( 2.938 1.667 -0.567) 3.425 17.716 ( 3.922 1.667 1.035) 4.385 18.178 ( -3.355 -1.596 -2.500) 4.478 18.178 ( 0.057 -1.595 -2.236) 2.748 18.178 ( -0.057 -1.595 2.236) 2.748 18.178 ( 3.355 -1.595 2.500) 4.478 19.698 ( -0.658 0.458 -0.621) 1.014 19.698 ( 0.611 0.458 -0.616) 0.981 19.698 ( -0.611 0.458 0.616) 0.981 19.698 ( 0.658 0.458 0.621) 1.014 20.940 ( -1.977 0.025 -5.211) 5.574 20.940 ( 1.936 0.025 -5.209) 5.558 20.940 ( -1.936 0.025 5.209) 5.558 20.940 ( 1.977 0.025 5.211) 5.574 24.689 ( -1.868 2.416 -3.712) 4.807 24.689 ( 1.574 2.416 -3.697) 4.689 24.689 ( -1.574 2.416 3.697) 4.689 24.689 ( 1.868 2.416 3.712) 4.807 25.716 ( -6.092 -1.755 -2.265) 6.733 25.716 ( 0.195 -1.755 -1.005) 2.032 25.716 ( -0.195 -1.755 1.005) 2.032 25.716 ( 6.092 -1.755 2.265) 6.733 27.413 ( -9.211 5.548 -3.397) 11.277 27.413 ( 4.462 5.548 -2.080) 7.417 27.413 ( -4.462 5.548 2.080) 7.417 27.413 ( 9.211 5.548 3.397) 11.277 27.559 ( -8.098 -6.484 -2.532) 10.679 27.559 ( -3.467 -6.484 0.679) 7.384 27.559 ( 3.467 -6.484 -0.679) 7.384 27.559 ( 8.098 -6.484 2.532) 10.679 30.233 ( -3.671 2.785 -6.177) 7.706 30.233 ( 3.554 2.785 -6.169) 7.645 30.233 ( -3.554 2.785 6.169) 7.645 30.233 ( 3.671 2.785 6.177) 7.706 30.580 ( -4.309 -2.003 -6.388) 7.962 30.580 ( 4.096 -2.003 -6.373) 7.836 30.580 ( -4.096 -2.003 6.373) 7.836 30.580 ( 4.309 -2.003 6.388) 7.962 32.444 ( -2.105 2.664 -2.876) 4.450 32.444 ( 0.522 2.664 -2.795) 3.896 32.444 ( -0.522 2.664 2.795) 3.896 32.444 ( 2.105 2.664 2.876) 4.450 32.576 ( -1.690 -1.504 -3.381) 4.068 32.576 ( 1.667 -1.504 -3.380) 4.058 32.576 ( -1.667 -1.504 3.380) 4.058 32.576 ( 1.690 -1.504 3.381) 4.068 33.043 ( -7.025 -0.308 -4.630) 8.419 33.043 ( 7.002 -0.308 -4.626) 8.398 33.043 ( -7.002 -0.308 4.626) 8.398 33.043 ( 7.025 -0.308 4.630) 8.419 33.644 ( -2.586 -1.132 -0.593) 2.885 33.644 ( -1.882 -1.132 -0.045) 2.197 33.644 ( 1.882 -1.132 0.045) 2.197 33.644 ( 2.586 -1.132 0.593) 2.885 98.590 ( -0.693 1.031 -1.117) 1.671 98.590 ( 0.652 1.031 -1.114) 1.652 98.590 ( -0.652 1.031 1.114) 1.652 98.590 ( 0.693 1.031 1.117) 1.671 98.813 ( -1.257 -1.755 -2.944) 3.651 98.813 ( 1.248 -1.755 -2.944) 3.647 98.813 ( -1.248 -1.755 2.944) 3.647 98.813 ( 1.257 -1.755 2.944) 3.651 100.603 ( -1.993 1.534 -2.557) 3.586 100.603 ( 1.742 1.534 -2.536) 3.438 100.603 ( -1.742 1.534 2.536) 3.438 100.603 ( 1.993 1.534 2.557) 3.586 100.711 ( -2.828 -1.365 -2.018) 3.733 100.711 ( 2.119 -1.365 -1.919) 3.168 100.711 ( -2.119 -1.365 1.919) 3.168 100.711 ( 2.828 -1.365 2.018) 3.733 102.743 ( -3.666 5.414 -3.106) 7.238 102.743 ( 3.660 5.414 -3.106) 7.235 102.743 ( -3.660 5.414 3.106) 7.235 102.743 ( 3.666 5.414 3.106) 7.238 103.042 ( -5.416 -4.497 -4.683) 8.455 103.042 ( 5.415 -4.497 -4.683) 8.455 103.042 ( -5.415 -4.497 4.683) 8.455 103.042 ( 5.416 -4.497 4.683) 8.455 =================== 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 3/50400 10.0 529.335 721.867 740.949 0.000 0.000 -0.000 3/50400 20.0 304.896 159.548 358.068 0.000 0.000 0.000 3/50400 30.0 224.017 85.279 224.168 0.000 0.000 0.000 3/50400 40.0 165.753 55.002 151.614 0.000 0.000 0.000 3/50400 50.0 126.481 39.221 109.160 0.000 0.000 -0.000 3/50400 60.0 99.610 29.667 82.919 0.000 0.000 -0.000 3/50400 70.0 80.648 23.376 65.714 0.000 0.000 -0.000 3/50400 80.0 66.812 19.000 53.786 0.000 0.000 -0.000 3/50400 90.0 56.406 15.830 45.118 0.000 0.000 -0.000 3/50400 100.0 48.382 13.457 38.581 0.000 0.000 -0.000 3/50400 110.0 42.064 11.631 33.506 0.000 0.000 -0.000 3/50400 120.0 37.002 10.193 29.475 0.000 0.000 -0.000 3/50400 130.0 32.886 9.040 26.213 0.000 0.000 -0.000 3/50400 140.0 29.493 8.100 23.532 0.000 0.000 -0.000 3/50400 150.0 26.663 7.321 21.298 0.000 0.000 -0.000 3/50400 160.0 24.277 6.667 19.415 0.000 0.000 -0.000 3/50400 170.0 22.245 6.113 17.811 0.000 0.000 -0.000 3/50400 180.0 20.498 5.638 16.431 0.000 0.000 -0.000 3/50400 190.0 18.984 5.227 15.235 0.000 0.000 -0.000 3/50400 200.0 17.663 4.869 14.189 0.000 0.000 -0.000 3/50400 210.0 16.501 4.554 13.268 0.000 0.000 -0.000 3/50400 220.0 15.473 4.275 12.453 0.000 0.000 -0.000 3/50400 230.0 14.558 4.027 11.727 0.000 0.000 -0.000 3/50400 240.0 13.740 3.805 11.077 0.000 0.000 -0.000 3/50400 250.0 13.005 3.606 10.491 0.000 0.000 -0.000 3/50400 260.0 12.340 3.425 9.962 0.000 0.000 -0.000 3/50400 270.0 11.738 3.262 9.482 0.000 0.000 -0.000 3/50400 280.0 11.189 3.112 9.044 0.000 0.000 -0.000 3/50400 290.0 10.688 2.976 8.644 0.000 0.000 -0.000 3/50400 300.0 10.229 2.851 8.277 0.000 0.000 -0.000 3/50400 310.0 9.807 2.735 7.939 0.000 0.000 -0.000 3/50400 320.0 9.417 2.629 7.627 0.000 0.000 -0.000 3/50400 330.0 9.057 2.530 7.338 0.000 0.000 -0.000 3/50400 340.0 8.723 2.439 7.070 0.000 0.000 -0.000 3/50400 350.0 8.412 2.353 6.821 0.000 0.000 -0.000 3/50400 360.0 8.123 2.274 6.588 0.000 0.000 -0.000 3/50400 370.0 7.852 2.200 6.371 0.000 0.000 -0.000 3/50400 380.0 7.600 2.130 6.168 0.000 0.000 -0.000 3/50400 390.0 7.363 2.065 5.977 0.000 0.000 -0.000 3/50400 400.0 7.140 2.004 5.797 0.000 0.000 -0.000 3/50400 410.0 6.930 1.946 5.629 0.000 0.000 -0.000 3/50400 420.0 6.733 1.891 5.470 0.000 0.000 -0.000 3/50400 430.0 6.546 1.840 5.319 0.000 0.000 -0.000 3/50400 440.0 6.370 1.791 5.177 0.000 0.000 -0.000 3/50400 450.0 6.203 1.745 5.042 0.000 0.000 -0.000 3/50400 460.0 6.045 1.701 4.914 0.000 0.000 -0.000 3/50400 470.0 5.895 1.659 4.793 0.000 0.000 -0.000 3/50400 480.0 5.752 1.620 4.678 0.000 0.000 -0.000 3/50400 490.0 5.616 1.582 4.568 0.000 0.000 -0.000 3/50400 500.0 5.486 1.546 4.463 0.000 0.000 -0.000 3/50400 510.0 5.362 1.511 4.363 0.000 0.000 -0.000 3/50400 520.0 5.244 1.479 4.267 0.000 0.000 -0.000 3/50400 530.0 5.131 1.447 4.176 0.000 0.000 -0.000 3/50400 540.0 5.023 1.417 4.088 0.000 0.000 -0.000 3/50400 550.0 4.920 1.388 4.004 0.000 0.000 -0.000 3/50400 560.0 4.821 1.361 3.924 0.000 0.000 -0.000 3/50400 570.0 4.725 1.334 3.847 0.000 0.000 -0.000 3/50400 580.0 4.634 1.308 3.773 0.000 0.000 -0.000 3/50400 590.0 4.546 1.284 3.701 0.000 0.000 -0.000 3/50400 600.0 4.461 1.260 3.633 0.000 0.000 -0.000 3/50400 610.0 4.380 1.238 3.567 0.000 0.000 -0.000 3/50400 620.0 4.302 1.216 3.503 0.000 0.000 -0.000 3/50400 630.0 4.226 1.194 3.442 0.000 0.000 -0.000 3/50400 640.0 4.153 1.174 3.383 0.000 0.000 -0.000 3/50400 650.0 4.083 1.154 3.326 0.000 0.000 -0.000 3/50400 660.0 4.014 1.135 3.270 0.000 0.000 -0.000 3/50400 670.0 3.949 1.117 3.217 0.000 0.000 -0.000 3/50400 680.0 3.885 1.099 3.165 0.000 0.000 -0.000 3/50400 690.0 3.824 1.082 3.115 0.000 0.000 -0.000 3/50400 700.0 3.764 1.065 3.067 0.000 0.000 -0.000 3/50400 710.0 3.706 1.049 3.020 0.000 0.000 -0.000 3/50400 720.0 3.650 1.033 2.975 0.000 0.000 -0.000 3/50400 730.0 3.596 1.018 2.931 0.000 0.000 -0.000 3/50400 740.0 3.544 1.003 2.888 0.000 0.000 -0.000 3/50400 750.0 3.493 0.989 2.846 0.000 0.000 -0.000 3/50400 760.0 3.443 0.975 2.806 0.000 0.000 -0.000 3/50400 770.0 3.395 0.961 2.767 0.000 0.000 -0.000 3/50400 780.0 3.348 0.948 2.729 0.000 0.000 -0.000 3/50400 790.0 3.303 0.936 2.692 0.000 0.000 -0.000 3/50400 800.0 3.258 0.923 2.656 0.000 0.000 -0.000 3/50400 810.0 3.215 0.911 2.621 0.000 0.000 -0.000 3/50400 820.0 3.173 0.899 2.587 0.000 0.000 -0.000 3/50400 830.0 3.132 0.888 2.554 0.000 0.000 -0.000 3/50400 840.0 3.093 0.877 2.521 0.000 0.000 -0.000 3/50400 850.0 3.054 0.866 2.490 0.000 0.000 -0.000 3/50400 860.0 3.016 0.855 2.459 0.000 0.000 -0.000 3/50400 870.0 2.979 0.845 2.429 0.000 0.000 -0.000 3/50400 880.0 2.943 0.834 2.400 0.000 0.000 -0.000 3/50400 890.0 2.908 0.825 2.371 0.000 0.000 -0.000 3/50400 900.0 2.874 0.815 2.343 0.000 0.000 -0.000 3/50400 910.0 2.841 0.806 2.316 0.000 0.000 -0.000 3/50400 920.0 2.808 0.796 2.290 0.000 0.000 -0.000 3/50400 930.0 2.776 0.787 2.264 0.000 0.000 -0.000 3/50400 940.0 2.745 0.779 2.238 0.000 0.000 -0.000 3/50400 950.0 2.714 0.770 2.214 0.000 0.000 -0.000 3/50400 960.0 2.685 0.762 2.189 0.000 0.000 -0.000 3/50400 970.0 2.656 0.753 2.166 0.000 0.000 -0.000 3/50400 980.0 2.627 0.745 2.142 0.000 0.000 -0.000 3/50400 990.0 2.599 0.737 2.120 0.000 0.000 -0.000 3/50400 1000.0 2.572 0.730 2.098 0.000 0.000 -0.000 3/50400 Thermal conductivity related properties were written into "kappa-m1056.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 21:21:41]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|