----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 04:16:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.750831999112024 -4.605309789999999 0.000000000000000 b 6.750831999112024 4.605309789999999 0.000000000000000 c -1.566179945646615 0.000000000000000 5.490763388800965 Atomic positions (fractional): *1 O 0.03676723559782 0.96323276440218 0.75000000000000 15.999 2 O 0.96323276440218 0.03676723559782 0.25000000000000 15.999 *3 O 0.63721813009073 0.12325871044698 0.85688064197593 15.999 4 O 0.87674128955302 0.36278186990927 0.64311935802407 15.999 5 O 0.36278186990927 0.87674128955302 0.14311935802407 15.999 6 O 0.12325871044698 0.63721813009073 0.35688064197593 15.999 *7 O 0.56909366914490 0.66171843936184 0.55382846409864 15.999 8 O 0.33828156063816 0.43090633085510 0.94617153590136 15.999 *9 O 0.12501255431752 0.25202303480187 0.09258808738744 15.999 10 O 0.74797696519813 0.87498744568248 0.40741191261256 15.999 11 O 0.87498744568248 0.74797696519813 0.90741191261256 15.999 12 O 0.25202303480187 0.12501255431752 0.59258808738744 15.999 13 O 0.66171843936184 0.56909366914490 0.05382846409864 15.999 14 O 0.43090633085510 0.33828156063816 0.44617153590136 15.999 *15 Ga 0.42001034350572 0.24346107447283 0.70182338973454 69.723 16 Ga 0.75653892552717 0.57998965649428 0.79817661026546 69.723 17 Ga 0.57998965649428 0.75653892552717 0.29817661026546 69.723 18 Ga 0.24346107447283 0.42001034350572 0.20182338973454 69.723 *19 Ga 0.82056357729137 0.94169150128015 0.74397904603886 69.723 20 Ga 0.05830849871985 0.17943642270863 0.75602095396114 69.723 21 Ga 0.94169150128015 0.82056357729137 0.24397904603886 69.723 22 Ga 0.17943642270863 0.05830849871985 0.25602095396114 69.723 *23 Sr 0.31457015596654 0.68542984403346 0.75000000000000 87.620 24 Sr 0.68542984403346 0.31457015596654 0.25000000000000 87.620 -------------------------------- unit cell --------------------------------- Lattice vectors: a 13.501663998224048 0.000000000000000 0.000000000000000 b 0.000000000000000 9.210619579999998 0.000000000000000 c -1.566179945646615 0.000000000000000 5.490763388800965 Atomic positions (fractional): *1 O 0.50000000000000 0.46323276440218 0.75000000000000 15.999 > 1 2 O 0.50000000000000 0.53676723559782 0.25000000000000 15.999 > 2 *3 O 0.38023842026885 0.74302029017813 0.85688064197593 15.999 > 3 4 O 0.61976157973115 0.74302029017813 0.64311935802407 15.999 > 4 5 O 0.61976157973115 0.25697970982187 0.14311935802407 15.999 > 5 6 O 0.38023842026885 0.25697970982187 0.35688064197593 15.999 > 6 *7 O 0.61540605425337 0.04631238510847 0.55382846409864 15.999 > 7 8 O 0.38459394574663 0.04631238510847 0.94617153590136 15.999 > 8 *9 O 0.18851779455969 0.06350524024217 0.09258808738744 15.999 > 9 10 O 0.81148220544031 0.06350524024217 0.40741191261256 15.999 > 10 11 O 0.81148220544031 0.93649475975783 0.90741191261256 15.999 > 11 12 O 0.18851779455969 0.93649475975783 0.59258808738744 15.999 > 12 13 O 0.61540605425337 0.95368761489153 0.05382846409864 15.999 > 13 14 O 0.38459394574663 0.95368761489153 0.44617153590136 15.999 > 14 15 O 0.00000000000000 0.96323276440218 0.75000000000000 15.999 > 1 16 O 0.00000000000000 0.03676723559782 0.25000000000000 15.999 > 2 17 O 0.88023842026885 0.24302029017813 0.85688064197593 15.999 > 3 18 O 0.11976157973115 0.24302029017813 0.64311935802407 15.999 > 4 19 O 0.11976157973115 0.75697970982187 0.14311935802407 15.999 > 5 20 O 0.88023842026885 0.75697970982187 0.35688064197593 15.999 > 6 21 O 0.11540605425337 0.54631238510847 0.55382846409864 15.999 > 7 22 O 0.88459394574663 0.54631238510847 0.94617153590136 15.999 > 8 23 O 0.68851779455969 0.56350524024217 0.09258808738744 15.999 > 9 24 O 0.31148220544031 0.56350524024217 0.40741191261256 15.999 > 10 25 O 0.31148220544031 0.43649475975783 0.90741191261256 15.999 > 11 26 O 0.68851779455969 0.43649475975783 0.59258808738744 15.999 > 12 27 O 0.11540605425337 0.45368761489153 0.05382846409864 15.999 > 13 28 O 0.88459394574663 0.45368761489153 0.44617153590136 15.999 > 14 *29 Ga 0.33173570898928 0.91172536548355 0.70182338973454 69.723 > 15 30 Ga 0.66826429101073 0.91172536548355 0.79817661026546 69.723 > 16 31 Ga 0.66826429101073 0.08827463451645 0.29817661026546 69.723 > 17 32 Ga 0.33173570898928 0.08827463451645 0.20182338973454 69.723 > 18 *33 Ga 0.88112753928576 0.06056396199439 0.74397904603886 69.723 > 19 34 Ga 0.11887246071424 0.06056396199439 0.75602095396114 69.723 > 20 35 Ga 0.88112753928576 0.93943603800561 0.24397904603886 69.723 > 21 36 Ga 0.11887246071424 0.93943603800561 0.25602095396114 69.723 > 22 37 Ga 0.83173570898927 0.41172536548355 0.70182338973454 69.723 > 15 38 Ga 0.16826429101072 0.41172536548355 0.79817661026546 69.723 > 16 39 Ga 0.16826429101072 0.58827463451645 0.29817661026546 69.723 > 17 40 Ga 0.83173570898927 0.58827463451645 0.20182338973454 69.723 > 18 41 Ga 0.38112753928576 0.56056396199439 0.74397904603886 69.723 > 19 42 Ga 0.61887246071424 0.56056396199439 0.75602095396114 69.723 > 20 43 Ga 0.38112753928576 0.43943603800561 0.24397904603886 69.723 > 21 44 Ga 0.61887246071424 0.43943603800561 0.25602095396114 69.723 > 22 *45 Sr 0.50000000000000 0.18542984403346 0.75000000000000 87.620 > 23 46 Sr 0.50000000000000 0.81457015596654 0.25000000000000 87.620 > 24 47 Sr 0.00000000000000 0.68542984403346 0.75000000000000 87.620 > 23 48 Sr 0.00000000000000 0.31457015596653 0.25000000000000 87.620 > 24 -------------------------------- super cell -------------------------------- Lattice vectors: a 13.501663998224048 0.000000000000000 0.000000000000000 b 0.000000000000000 9.210619579999998 0.000000000000000 c -3.132359891293230 0.000000000000000 10.981526777601930 Atomic positions (fractional): *1 O 0.50000000000000 0.46323276440218 0.37500000000000 15.999 > 1 2 O 0.50000000000000 0.46323276440218 0.87500000000000 15.999 > 1 3 O 0.50000000000000 0.53676723559782 0.12500000000000 15.999 > 2 4 O 0.50000000000000 0.53676723559782 0.62500000000000 15.999 > 2 *5 O 0.38023842026885 0.74302029017813 0.42844032098796 15.999 > 3 6 O 0.38023842026885 0.74302029017813 0.92844032098796 15.999 > 3 7 O 0.61976157973115 0.74302029017813 0.32155967901204 15.999 > 4 8 O 0.61976157973115 0.74302029017813 0.82155967901204 15.999 > 4 9 O 0.61976157973115 0.25697970982187 0.07155967901204 15.999 > 5 10 O 0.61976157973115 0.25697970982187 0.57155967901204 15.999 > 5 11 O 0.38023842026885 0.25697970982187 0.17844032098796 15.999 > 6 12 O 0.38023842026885 0.25697970982187 0.67844032098796 15.999 > 6 *13 O 0.61540605425337 0.04631238510847 0.27691423204932 15.999 > 7 14 O 0.61540605425337 0.04631238510847 0.77691423204932 15.999 > 7 15 O 0.38459394574663 0.04631238510847 0.47308576795068 15.999 > 8 16 O 0.38459394574663 0.04631238510847 0.97308576795068 15.999 > 8 *17 O 0.18851779455969 0.06350524024217 0.04629404369372 15.999 > 9 18 O 0.18851779455969 0.06350524024217 0.54629404369372 15.999 > 9 19 O 0.81148220544031 0.06350524024217 0.20370595630628 15.999 > 10 20 O 0.81148220544031 0.06350524024217 0.70370595630628 15.999 > 10 21 O 0.81148220544031 0.93649475975783 0.45370595630628 15.999 > 11 22 O 0.81148220544031 0.93649475975783 0.95370595630628 15.999 > 11 23 O 0.18851779455969 0.93649475975783 0.29629404369372 15.999 > 12 24 O 0.18851779455969 0.93649475975783 0.79629404369372 15.999 > 12 25 O 0.61540605425337 0.95368761489153 0.02691423204932 15.999 > 13 26 O 0.61540605425337 0.95368761489153 0.52691423204932 15.999 > 13 27 O 0.38459394574663 0.95368761489153 0.22308576795068 15.999 > 14 28 O 0.38459394574663 0.95368761489153 0.72308576795068 15.999 > 14 29 O 0.00000000000000 0.96323276440218 0.37500000000000 15.999 > 1 30 O 0.00000000000000 0.96323276440218 0.87500000000000 15.999 > 1 31 O 0.00000000000000 0.03676723559782 0.12500000000000 15.999 > 2 32 O 0.00000000000000 0.03676723559782 0.62500000000000 15.999 > 2 33 O 0.88023842026885 0.24302029017813 0.42844032098796 15.999 > 3 34 O 0.88023842026885 0.24302029017813 0.92844032098796 15.999 > 3 35 O 0.11976157973115 0.24302029017813 0.32155967901204 15.999 > 4 36 O 0.11976157973115 0.24302029017813 0.82155967901204 15.999 > 4 37 O 0.11976157973115 0.75697970982187 0.07155967901204 15.999 > 5 38 O 0.11976157973115 0.75697970982187 0.57155967901204 15.999 > 5 39 O 0.88023842026885 0.75697970982187 0.17844032098796 15.999 > 6 40 O 0.88023842026885 0.75697970982187 0.67844032098796 15.999 > 6 41 O 0.11540605425337 0.54631238510847 0.27691423204932 15.999 > 7 42 O 0.11540605425337 0.54631238510847 0.77691423204932 15.999 > 7 43 O 0.88459394574663 0.54631238510847 0.47308576795068 15.999 > 8 44 O 0.88459394574663 0.54631238510847 0.97308576795068 15.999 > 8 45 O 0.68851779455969 0.56350524024217 0.04629404369372 15.999 > 9 46 O 0.68851779455969 0.56350524024217 0.54629404369372 15.999 > 9 47 O 0.31148220544031 0.56350524024217 0.20370595630628 15.999 > 10 48 O 0.31148220544031 0.56350524024217 0.70370595630628 15.999 > 10 49 O 0.31148220544031 0.43649475975783 0.45370595630628 15.999 > 11 50 O 0.31148220544031 0.43649475975783 0.95370595630628 15.999 > 11 51 O 0.68851779455969 0.43649475975783 0.29629404369372 15.999 > 12 52 O 0.68851779455969 0.43649475975783 0.79629404369372 15.999 > 12 53 O 0.11540605425337 0.45368761489153 0.02691423204932 15.999 > 13 54 O 0.11540605425337 0.45368761489153 0.52691423204932 15.999 > 13 55 O 0.88459394574663 0.45368761489153 0.22308576795068 15.999 > 14 56 O 0.88459394574663 0.45368761489153 0.72308576795068 15.999 > 14 *57 Ga 0.33173570898928 0.91172536548355 0.35091169486727 69.723 > 15 58 Ga 0.33173570898928 0.91172536548355 0.85091169486727 69.723 > 15 59 Ga 0.66826429101073 0.91172536548355 0.39908830513273 69.723 > 16 60 Ga 0.66826429101073 0.91172536548355 0.89908830513273 69.723 > 16 61 Ga 0.66826429101073 0.08827463451645 0.14908830513273 69.723 > 17 62 Ga 0.66826429101073 0.08827463451645 0.64908830513273 69.723 > 17 63 Ga 0.33173570898928 0.08827463451645 0.10091169486727 69.723 > 18 64 Ga 0.33173570898928 0.08827463451645 0.60091169486727 69.723 > 18 *65 Ga 0.88112753928576 0.06056396199439 0.37198952301943 69.723 > 19 66 Ga 0.88112753928576 0.06056396199439 0.87198952301943 69.723 > 19 67 Ga 0.11887246071424 0.06056396199439 0.37801047698057 69.723 > 20 68 Ga 0.11887246071424 0.06056396199439 0.87801047698057 69.723 > 20 69 Ga 0.88112753928576 0.93943603800561 0.12198952301943 69.723 > 21 70 Ga 0.88112753928576 0.93943603800561 0.62198952301943 69.723 > 21 71 Ga 0.11887246071424 0.93943603800561 0.12801047698057 69.723 > 22 72 Ga 0.11887246071424 0.93943603800561 0.62801047698057 69.723 > 22 73 Ga 0.83173570898927 0.41172536548355 0.35091169486727 69.723 > 15 74 Ga 0.83173570898927 0.41172536548355 0.85091169486727 69.723 > 15 75 Ga 0.16826429101072 0.41172536548355 0.39908830513273 69.723 > 16 76 Ga 0.16826429101072 0.41172536548355 0.89908830513273 69.723 > 16 77 Ga 0.16826429101072 0.58827463451645 0.14908830513273 69.723 > 17 78 Ga 0.16826429101072 0.58827463451645 0.64908830513273 69.723 > 17 79 Ga 0.83173570898927 0.58827463451645 0.10091169486727 69.723 > 18 80 Ga 0.83173570898927 0.58827463451645 0.60091169486727 69.723 > 18 81 Ga 0.38112753928576 0.56056396199439 0.37198952301943 69.723 > 19 82 Ga 0.38112753928576 0.56056396199439 0.87198952301943 69.723 > 19 83 Ga 0.61887246071424 0.56056396199439 0.37801047698057 69.723 > 20 84 Ga 0.61887246071424 0.56056396199439 0.87801047698057 69.723 > 20 85 Ga 0.38112753928576 0.43943603800561 0.12198952301943 69.723 > 21 86 Ga 0.38112753928576 0.43943603800561 0.62198952301943 69.723 > 21 87 Ga 0.61887246071424 0.43943603800561 0.12801047698057 69.723 > 22 88 Ga 0.61887246071424 0.43943603800561 0.62801047698057 69.723 > 22 *89 Sr 0.50000000000000 0.18542984403346 0.37500000000000 87.620 > 23 90 Sr 0.50000000000000 0.18542984403346 0.87500000000000 87.620 > 23 91 Sr 0.50000000000000 0.81457015596654 0.12500000000000 87.620 > 24 92 Sr 0.50000000000000 0.81457015596654 0.62500000000000 87.620 > 24 93 Sr 0.00000000000000 0.68542984403346 0.37500000000000 87.620 > 23 94 Sr 0.00000000000000 0.68542984403346 0.87500000000000 87.620 > 23 95 Sr 0.00000000000000 0.31457015596653 0.12500000000000 87.620 > 24 96 Sr 0.00000000000000 0.31457015596653 0.62500000000000 87.620 > 24 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.2916307 0.0000000 0.0499062 0.0000000 3.3106680 0.0000000 0.0498914 0.0000000 3.4400547 -------------------------- Born effective charges -------------------------- 1 O -2.4056422 0.0000000 -0.1237084 0.0000000 -1.7406238 0.0000000 -0.1217079 0.0000000 -1.6610227 2 O -2.4056422 0.0000000 -0.1237084 0.0000000 -1.7406238 0.0000000 -0.1217079 0.0000000 -1.6610227 3 O -1.2598936 0.2215115 -0.2239221 0.2251668 -2.6100174 0.0371192 -0.2335815 -0.0114036 -1.7532546 4 O -1.2598936 -0.2215115 -0.2239221 -0.2251668 -2.6100174 -0.0371192 -0.2335815 0.0114036 -1.7532546 5 O -1.2598936 0.2215115 -0.2239221 0.2251668 -2.6100174 0.0371192 -0.2335815 -0.0114036 -1.7532546 6 O -1.2598936 -0.2215115 -0.2239221 -0.2251668 -2.6100174 -0.0371192 -0.2335815 0.0114036 -1.7532546 7 O -1.7753768 0.0407048 0.3496810 0.0573205 -1.7043529 0.3428676 0.3287194 0.3730777 -2.2762914 8 O -1.7753768 -0.0407048 0.3496810 -0.0573205 -1.7043529 -0.3428676 0.3287194 -0.3730777 -2.2762914 9 O -2.2876290 -0.4398415 -0.1804170 -0.3731006 -1.4036971 0.2705422 -0.1625019 0.1998471 -2.1683647 10 O -2.2876290 0.4398415 -0.1804170 0.3731006 -1.4036971 -0.2705422 -0.1625019 -0.1998471 -2.1683647 11 O -2.2876290 -0.4398415 -0.1804170 -0.3731006 -1.4036971 0.2705422 -0.1625019 0.1998471 -2.1683647 12 O -2.2876290 0.4398415 -0.1804170 0.3731006 -1.4036971 -0.2705422 -0.1625019 -0.1998471 -2.1683647 13 O -1.7753768 -0.0407048 0.3496810 -0.0573205 -1.7043529 -0.3428676 0.3287194 -0.3730777 -2.2762914 14 O -1.7753768 0.0407048 0.3496810 0.0573205 -1.7043529 0.3428676 0.3287194 0.3730777 -2.2762914 15 Ga 2.6337628 -0.2641390 0.0884079 -0.1089003 2.6656295 -0.3476038 0.0889468 0.0578339 2.8087268 16 Ga 2.6337628 0.2641390 0.0884079 0.1089003 2.6656295 0.3476038 0.0889468 -0.0578339 2.8087268 17 Ga 2.6337628 -0.2641390 0.0884079 -0.1089003 2.6656295 -0.3476038 0.0889468 0.0578339 2.8087268 18 Ga 2.6337628 0.2641390 0.0884079 0.1089003 2.6656295 0.3476038 0.0889468 -0.0578339 2.8087268 19 Ga 2.7438062 -0.1248076 -0.0237768 0.0249119 2.6791988 0.1661500 -0.0359605 -0.1991236 2.8975760 20 Ga 2.7438062 0.1248076 -0.0237768 -0.0249119 2.6791988 -0.1661500 -0.0359605 0.1991236 2.8975760 21 Ga 2.7438062 0.1248076 -0.0237768 -0.0249119 2.6791988 -0.1661500 -0.0359605 0.1991236 2.8975760 22 Ga 2.7438062 -0.1248076 -0.0237768 0.0249119 2.6791988 0.1661500 -0.0359605 -0.1991236 2.8975760 23 Sr 2.2963030 0.0000000 0.1037626 0.0000000 2.4871020 0.0000000 0.1504633 0.0000000 2.6442384 24 Sr 2.2963030 0.0000000 0.1037626 0.0000000 2.4871020 0.0000000 0.1504633 0.0000000 2.6442384 ---------------------------------------------------------------------------- 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: 288/288 Permutation basis: 12816/12816 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2704 Number of blocks in projector: 2704 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: 584 Use submatrix version of eigh solver. (1) Block: 584 / 584 (2) Block: 250 / 584 (2) 237 eigenvectors found. (2) Block: 500 / 584 (2) 239 eigenvectors found. (2) Block: 584 / 584 (2) 79 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 571 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 568 Use submatrix version of eigh solver. (1) Block: 568 / 568 (2) Block: 250 / 568 (2) 240 eigenvectors found. (2) Block: 500 / 568 (2) 242 eigenvectors found. (2) Block: 568 / 568 (2) 62 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 568 Use submatrix version of eigh solver. (1) Block: 568 / 568 (2) Block: 250 / 568 (2) 240 eigenvectors found. (2) Block: 500 / 568 (2) 242 eigenvectors found. (2) Block: 568 / 568 (2) 62 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 328 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 328 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 328 Use standard eigh solver. Tree of FC basis block matrices: - (2704, 2650), data: False |-- (328, 321), data: True |-- (328, 321), data: True |-- (328, 321), data: True |-- (568, 558), data: False |-- (568, 558), data: False |-- (568, 14), data: (568, 24) @ (24, 14) |-- (68, 62), data: True |-- (250, 242), data: True |-- (250, 240), data: True |-- (568, 558), data: False |-- (568, 558), data: False |-- (568, 14), data: (568, 24) @ (24, 14) |-- (68, 62), data: True |-- (250, 242), data: True |-- (250, 240), data: True |-- (584, 571), data: False |-- (584, 571), data: False |-- (584, 16), data: (584, 29) @ (29, 16) |-- (84, 79), data: True |-- (250, 239), data: True |-- (250, 237), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 720 - Time: 0.727 Solver_block: 200 / 720 - Time: 0.628 Solver_block: 300 / 720 - Time: 0.602 Solver_block: 400 / 720 - Time: 0.610 Solver_block: 500 / 720 - Time: 0.609 Solver_block: 600 / 720 - Time: 0.623 Solver_block: 700 / 720 - Time: 0.615 Solver_block: 720 / 720 - Time: 0.301 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 5.144 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yx) -0.00000000 (yx) Permutation basis: 288/288 Permutation basis: 12816/12816 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2704 Number of blocks in projector: 2704 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: 584 Use submatrix version of eigh solver. (1) Block: 584 / 584 (2) Block: 250 / 584 (2) 237 eigenvectors found. (2) Block: 500 / 584 (2) 239 eigenvectors found. (2) Block: 584 / 584 (2) 79 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 16 eigenvectors found. (1) 571 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 568 Use submatrix version of eigh solver. (1) Block: 568 / 568 (2) Block: 250 / 568 (2) 240 eigenvectors found. (2) Block: 500 / 568 (2) 242 eigenvectors found. (2) Block: 568 / 568 (2) 62 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 568 Use submatrix version of eigh solver. (1) Block: 568 / 568 (2) Block: 250 / 568 (2) 240 eigenvectors found. (2) Block: 500 / 568 (2) 242 eigenvectors found. (2) Block: 568 / 568 (2) 62 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 328 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 328 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 328 Use standard eigh solver. Tree of FC basis block matrices: - (2704, 2650), data: False |-- (328, 321), data: True |-- (328, 321), data: True |-- (328, 321), data: True |-- (568, 558), data: False |-- (568, 558), data: False |-- (568, 14), data: (568, 24) @ (24, 14) |-- (68, 62), data: True |-- (250, 242), data: True |-- (250, 240), data: True |-- (568, 558), data: False |-- (568, 558), data: False |-- (568, 14), data: (568, 24) @ (24, 14) |-- (68, 62), data: True |-- (250, 242), data: True |-- (250, 240), data: True |-- (584, 571), data: False |-- (584, 571), data: False |-- (584, 16), data: (584, 29) @ (29, 16) |-- (84, 79), data: True |-- (250, 239), data: True |-- (250, 237), 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 04:16:55]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 04:16:55]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.750831999112024 -4.605309789999999 0.000000000000000 b 6.750831999112024 4.605309789999999 0.000000000000000 c -1.566179945646615 0.000000000000000 5.490763388800965 Atomic positions (fractional): 1 O 0.03676723559782 0.96323276440218 0.75000000000000 15.999 2 O 0.96323276440218 0.03676723559782 0.25000000000000 15.999 3 O 0.63721813009073 0.12325871044698 0.85688064197593 15.999 4 O 0.87674128955302 0.36278186990927 0.64311935802407 15.999 5 O 0.36278186990927 0.87674128955302 0.14311935802407 15.999 6 O 0.12325871044698 0.63721813009073 0.35688064197593 15.999 7 O 0.56909366914490 0.66171843936184 0.55382846409864 15.999 8 O 0.33828156063816 0.43090633085510 0.94617153590136 15.999 9 O 0.12501255431752 0.25202303480187 0.09258808738744 15.999 10 O 0.74797696519813 0.87498744568248 0.40741191261256 15.999 11 O 0.87498744568248 0.74797696519813 0.90741191261256 15.999 12 O 0.25202303480187 0.12501255431752 0.59258808738744 15.999 13 O 0.66171843936184 0.56909366914490 0.05382846409864 15.999 14 O 0.43090633085510 0.33828156063816 0.44617153590136 15.999 15 Ga 0.42001034350572 0.24346107447283 0.70182338973454 69.723 16 Ga 0.75653892552717 0.57998965649428 0.79817661026546 69.723 17 Ga 0.57998965649428 0.75653892552717 0.29817661026546 69.723 18 Ga 0.24346107447283 0.42001034350572 0.20182338973454 69.723 19 Ga 0.82056357729137 0.94169150128015 0.74397904603886 69.723 20 Ga 0.05830849871985 0.17943642270863 0.75602095396114 69.723 21 Ga 0.94169150128015 0.82056357729137 0.24397904603886 69.723 22 Ga 0.17943642270863 0.05830849871985 0.25602095396114 69.723 23 Sr 0.31457015596654 0.68542984403346 0.75000000000000 87.620 24 Sr 0.68542984403346 0.31457015596654 0.25000000000000 87.620 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.501663998224048 0.000000000000000 0.000000000000000 b 0.000000000000000 9.210619579999998 0.000000000000000 c -3.132359891293230 0.000000000000000 10.981526777601930 Atomic positions (fractional): 1 O 0.50000000000000 0.46323276440218 0.37500000000000 15.999 > 1 2 O 0.50000000000000 0.46323276440218 0.87500000000000 15.999 > 1 3 O 0.50000000000000 0.53676723559782 0.12500000000000 15.999 > 3 4 O 0.50000000000000 0.53676723559782 0.62500000000000 15.999 > 3 5 O 0.38023842026885 0.74302029017813 0.42844032098796 15.999 > 5 6 O 0.38023842026885 0.74302029017813 0.92844032098796 15.999 > 5 7 O 0.61976157973115 0.74302029017813 0.32155967901204 15.999 > 7 8 O 0.61976157973115 0.74302029017813 0.82155967901204 15.999 > 7 9 O 0.61976157973115 0.25697970982187 0.07155967901204 15.999 > 9 10 O 0.61976157973115 0.25697970982187 0.57155967901204 15.999 > 9 11 O 0.38023842026885 0.25697970982187 0.17844032098796 15.999 > 11 12 O 0.38023842026885 0.25697970982187 0.67844032098796 15.999 > 11 13 O 0.61540605425337 0.04631238510847 0.27691423204932 15.999 > 13 14 O 0.61540605425337 0.04631238510847 0.77691423204932 15.999 > 13 15 O 0.38459394574663 0.04631238510847 0.47308576795068 15.999 > 15 16 O 0.38459394574663 0.04631238510847 0.97308576795068 15.999 > 15 17 O 0.18851779455969 0.06350524024217 0.04629404369372 15.999 > 17 18 O 0.18851779455969 0.06350524024217 0.54629404369372 15.999 > 17 19 O 0.81148220544031 0.06350524024217 0.20370595630628 15.999 > 19 20 O 0.81148220544031 0.06350524024217 0.70370595630628 15.999 > 19 21 O 0.81148220544031 0.93649475975783 0.45370595630628 15.999 > 21 22 O 0.81148220544031 0.93649475975783 0.95370595630628 15.999 > 21 23 O 0.18851779455969 0.93649475975783 0.29629404369372 15.999 > 23 24 O 0.18851779455969 0.93649475975783 0.79629404369372 15.999 > 23 25 O 0.61540605425337 0.95368761489153 0.02691423204932 15.999 > 25 26 O 0.61540605425337 0.95368761489153 0.52691423204932 15.999 > 25 27 O 0.38459394574663 0.95368761489153 0.22308576795068 15.999 > 27 28 O 0.38459394574663 0.95368761489153 0.72308576795068 15.999 > 27 29 O 0.00000000000000 0.96323276440218 0.37500000000000 15.999 > 1 30 O 0.00000000000000 0.96323276440218 0.87500000000000 15.999 > 1 31 O 0.00000000000000 0.03676723559782 0.12500000000000 15.999 > 3 32 O 0.00000000000000 0.03676723559782 0.62500000000000 15.999 > 3 33 O 0.88023842026885 0.24302029017813 0.42844032098796 15.999 > 5 34 O 0.88023842026885 0.24302029017813 0.92844032098796 15.999 > 5 35 O 0.11976157973115 0.24302029017813 0.32155967901204 15.999 > 7 36 O 0.11976157973115 0.24302029017813 0.82155967901204 15.999 > 7 37 O 0.11976157973115 0.75697970982187 0.07155967901204 15.999 > 9 38 O 0.11976157973115 0.75697970982187 0.57155967901204 15.999 > 9 39 O 0.88023842026885 0.75697970982187 0.17844032098796 15.999 > 11 40 O 0.88023842026885 0.75697970982187 0.67844032098796 15.999 > 11 41 O 0.11540605425337 0.54631238510847 0.27691423204932 15.999 > 13 42 O 0.11540605425337 0.54631238510847 0.77691423204932 15.999 > 13 43 O 0.88459394574663 0.54631238510847 0.47308576795068 15.999 > 15 44 O 0.88459394574663 0.54631238510847 0.97308576795068 15.999 > 15 45 O 0.68851779455969 0.56350524024217 0.04629404369372 15.999 > 17 46 O 0.68851779455969 0.56350524024217 0.54629404369372 15.999 > 17 47 O 0.31148220544031 0.56350524024217 0.20370595630628 15.999 > 19 48 O 0.31148220544031 0.56350524024217 0.70370595630628 15.999 > 19 49 O 0.31148220544031 0.43649475975783 0.45370595630628 15.999 > 21 50 O 0.31148220544031 0.43649475975783 0.95370595630628 15.999 > 21 51 O 0.68851779455969 0.43649475975783 0.29629404369372 15.999 > 23 52 O 0.68851779455969 0.43649475975783 0.79629404369372 15.999 > 23 53 O 0.11540605425337 0.45368761489153 0.02691423204932 15.999 > 25 54 O 0.11540605425337 0.45368761489153 0.52691423204932 15.999 > 25 55 O 0.88459394574663 0.45368761489153 0.22308576795068 15.999 > 27 56 O 0.88459394574663 0.45368761489153 0.72308576795068 15.999 > 27 57 Ga 0.33173570898928 0.91172536548355 0.35091169486727 69.723 > 57 58 Ga 0.33173570898928 0.91172536548355 0.85091169486727 69.723 > 57 59 Ga 0.66826429101073 0.91172536548355 0.39908830513273 69.723 > 59 60 Ga 0.66826429101073 0.91172536548355 0.89908830513273 69.723 > 59 61 Ga 0.66826429101073 0.08827463451645 0.14908830513273 69.723 > 61 62 Ga 0.66826429101073 0.08827463451645 0.64908830513273 69.723 > 61 63 Ga 0.33173570898928 0.08827463451645 0.10091169486727 69.723 > 63 64 Ga 0.33173570898928 0.08827463451645 0.60091169486727 69.723 > 63 65 Ga 0.88112753928576 0.06056396199439 0.37198952301943 69.723 > 65 66 Ga 0.88112753928576 0.06056396199439 0.87198952301943 69.723 > 65 67 Ga 0.11887246071424 0.06056396199439 0.37801047698057 69.723 > 67 68 Ga 0.11887246071424 0.06056396199439 0.87801047698057 69.723 > 67 69 Ga 0.88112753928576 0.93943603800561 0.12198952301943 69.723 > 69 70 Ga 0.88112753928576 0.93943603800561 0.62198952301943 69.723 > 69 71 Ga 0.11887246071424 0.93943603800561 0.12801047698057 69.723 > 71 72 Ga 0.11887246071424 0.93943603800561 0.62801047698057 69.723 > 71 73 Ga 0.83173570898927 0.41172536548355 0.35091169486727 69.723 > 57 74 Ga 0.83173570898927 0.41172536548355 0.85091169486727 69.723 > 57 75 Ga 0.16826429101072 0.41172536548355 0.39908830513273 69.723 > 59 76 Ga 0.16826429101072 0.41172536548355 0.89908830513273 69.723 > 59 77 Ga 0.16826429101072 0.58827463451645 0.14908830513273 69.723 > 61 78 Ga 0.16826429101072 0.58827463451645 0.64908830513273 69.723 > 61 79 Ga 0.83173570898927 0.58827463451645 0.10091169486727 69.723 > 63 80 Ga 0.83173570898927 0.58827463451645 0.60091169486727 69.723 > 63 81 Ga 0.38112753928576 0.56056396199439 0.37198952301943 69.723 > 65 82 Ga 0.38112753928576 0.56056396199439 0.87198952301943 69.723 > 65 83 Ga 0.61887246071424 0.56056396199439 0.37801047698057 69.723 > 67 84 Ga 0.61887246071424 0.56056396199439 0.87801047698057 69.723 > 67 85 Ga 0.38112753928576 0.43943603800561 0.12198952301943 69.723 > 69 86 Ga 0.38112753928576 0.43943603800561 0.62198952301943 69.723 > 69 87 Ga 0.61887246071424 0.43943603800561 0.12801047698057 69.723 > 71 88 Ga 0.61887246071424 0.43943603800561 0.62801047698057 69.723 > 71 89 Sr 0.50000000000000 0.18542984403346 0.37500000000000 87.620 > 89 90 Sr 0.50000000000000 0.18542984403346 0.87500000000000 87.620 > 89 91 Sr 0.50000000000000 0.81457015596654 0.12500000000000 87.620 > 91 92 Sr 0.50000000000000 0.81457015596654 0.62500000000000 87.620 > 91 93 Sr 0.00000000000000 0.68542984403346 0.37500000000000 87.620 > 89 94 Sr 0.00000000000000 0.68542984403346 0.87500000000000 87.620 > 89 95 Sr 0.00000000000000 0.31457015596653 0.12500000000000 87.620 > 91 96 Sr 0.00000000000000 0.31457015596653 0.62500000000000 87.620 > 91 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.2916307 0.0000000 0.0499062 0.0000000 3.3106680 0.0000000 0.0498914 0.0000000 3.4400547 -------------------------- Born effective charges -------------------------- 1 O -2.4056422 0.0000000 -0.1237084 0.0000000 -1.7406238 0.0000000 -0.1217079 0.0000000 -1.6610227 2 O -2.4056422 0.0000000 -0.1237084 0.0000000 -1.7406238 0.0000000 -0.1217079 0.0000000 -1.6610227 3 O -1.2598936 0.2215115 -0.2239221 0.2251668 -2.6100174 0.0371192 -0.2335815 -0.0114036 -1.7532546 4 O -1.2598936 -0.2215115 -0.2239221 -0.2251668 -2.6100174 -0.0371192 -0.2335815 0.0114036 -1.7532546 5 O -1.2598936 0.2215115 -0.2239221 0.2251668 -2.6100174 0.0371192 -0.2335815 -0.0114036 -1.7532546 6 O -1.2598936 -0.2215115 -0.2239221 -0.2251668 -2.6100174 -0.0371192 -0.2335815 0.0114036 -1.7532546 7 O -1.7753768 0.0407048 0.3496810 0.0573205 -1.7043529 0.3428676 0.3287194 0.3730777 -2.2762914 8 O -1.7753768 -0.0407048 0.3496810 -0.0573205 -1.7043529 -0.3428676 0.3287194 -0.3730777 -2.2762914 9 O -2.2876290 -0.4398415 -0.1804170 -0.3731006 -1.4036971 0.2705422 -0.1625019 0.1998471 -2.1683647 10 O -2.2876290 0.4398415 -0.1804170 0.3731006 -1.4036971 -0.2705422 -0.1625019 -0.1998471 -2.1683647 11 O -2.2876290 -0.4398415 -0.1804170 -0.3731006 -1.4036971 0.2705422 -0.1625019 0.1998471 -2.1683647 12 O -2.2876290 0.4398415 -0.1804170 0.3731006 -1.4036971 -0.2705422 -0.1625019 -0.1998471 -2.1683647 13 O -1.7753768 -0.0407048 0.3496810 -0.0573205 -1.7043529 -0.3428676 0.3287194 -0.3730777 -2.2762914 14 O -1.7753768 0.0407048 0.3496810 0.0573205 -1.7043529 0.3428676 0.3287194 0.3730777 -2.2762914 15 Ga 2.6337628 -0.2641390 0.0884079 -0.1089003 2.6656295 -0.3476038 0.0889468 0.0578339 2.8087268 16 Ga 2.6337628 0.2641390 0.0884079 0.1089003 2.6656295 0.3476038 0.0889468 -0.0578339 2.8087268 17 Ga 2.6337628 -0.2641390 0.0884079 -0.1089003 2.6656295 -0.3476038 0.0889468 0.0578339 2.8087268 18 Ga 2.6337628 0.2641390 0.0884079 0.1089003 2.6656295 0.3476038 0.0889468 -0.0578339 2.8087268 19 Ga 2.7438062 -0.1248076 -0.0237768 0.0249119 2.6791988 0.1661500 -0.0359605 -0.1991236 2.8975760 20 Ga 2.7438062 0.1248076 -0.0237768 -0.0249119 2.6791988 -0.1661500 -0.0359605 0.1991236 2.8975760 21 Ga 2.7438062 0.1248076 -0.0237768 -0.0249119 2.6791988 -0.1661500 -0.0359605 0.1991236 2.8975760 22 Ga 2.7438062 -0.1248076 -0.0237768 0.0249119 2.6791988 0.1661500 -0.0359605 -0.1991236 2.8975760 23 Sr 2.2963030 0.0000000 0.1037626 0.0000000 2.4871020 0.0000000 0.1504633 0.0000000 2.6442384 24 Sr 2.2963030 0.0000000 0.1037626 0.0000000 2.4871020 0.0000000 0.1504633 0.0000000 2.6442384 ---------------------------------------------------------------------------- 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] [-0.0027 0.0000 0.0096] [ 0.0027 0.0000 -0.0096] Computing fc3[ 5, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0027 0.0000 0.0096] [ 0.0027 0.0000 -0.0096] Computing fc3[ 13, 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] [-0.0027 0.0000 0.0096] [ 0.0027 0.0000 -0.0096] 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] [-0.0027 0.0000 0.0096] [ 0.0027 0.0000 -0.0096] Computing fc3[ 57, 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] [-0.0027 0.0000 0.0096] [ 0.0027 0.0000 -0.0096] 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] [-0.0027 0.0000 0.0096] [ 0.0027 0.0000 -0.0096] Computing fc3[ 89, 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] [-0.0027 0.0000 0.0096] [ 0.0027 0.0000 -0.0096] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000002 (xxx) 0.00000002 (xxx) 0.00000002 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000001 (yz) 0.00000001 (yz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 04:17:19]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 04:17:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.750831999112024 -4.605309789999999 0.000000000000000 b 6.750831999112024 4.605309789999999 0.000000000000000 c -1.566179945646615 0.000000000000000 5.490763388800965 Atomic positions (fractional): 1 O 0.03676723559782 0.96323276440218 0.75000000000000 15.999 2 O 0.96323276440218 0.03676723559782 0.25000000000000 15.999 3 O 0.63721813009073 0.12325871044698 0.85688064197593 15.999 4 O 0.87674128955302 0.36278186990927 0.64311935802407 15.999 5 O 0.36278186990927 0.87674128955302 0.14311935802407 15.999 6 O 0.12325871044698 0.63721813009073 0.35688064197593 15.999 7 O 0.56909366914490 0.66171843936184 0.55382846409864 15.999 8 O 0.33828156063816 0.43090633085510 0.94617153590136 15.999 9 O 0.12501255431752 0.25202303480187 0.09258808738744 15.999 10 O 0.74797696519813 0.87498744568248 0.40741191261256 15.999 11 O 0.87498744568248 0.74797696519813 0.90741191261256 15.999 12 O 0.25202303480187 0.12501255431752 0.59258808738744 15.999 13 O 0.66171843936184 0.56909366914490 0.05382846409864 15.999 14 O 0.43090633085510 0.33828156063816 0.44617153590136 15.999 15 Ga 0.42001034350572 0.24346107447283 0.70182338973454 69.723 16 Ga 0.75653892552717 0.57998965649428 0.79817661026546 69.723 17 Ga 0.57998965649428 0.75653892552717 0.29817661026546 69.723 18 Ga 0.24346107447283 0.42001034350572 0.20182338973454 69.723 19 Ga 0.82056357729137 0.94169150128015 0.74397904603886 69.723 20 Ga 0.05830849871985 0.17943642270863 0.75602095396114 69.723 21 Ga 0.94169150128015 0.82056357729137 0.24397904603886 69.723 22 Ga 0.17943642270863 0.05830849871985 0.25602095396114 69.723 23 Sr 0.31457015596654 0.68542984403346 0.75000000000000 87.620 24 Sr 0.68542984403346 0.31457015596654 0.25000000000000 87.620 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.501663998224048 0.000000000000000 0.000000000000000 b 0.000000000000000 9.210619579999998 0.000000000000000 c -3.132359891293230 0.000000000000000 10.981526777601930 Atomic positions (fractional): 1 O 0.50000000000000 0.46323276440218 0.37500000000000 15.999 > 1 2 O 0.50000000000000 0.46323276440218 0.87500000000000 15.999 > 1 3 O 0.50000000000000 0.53676723559782 0.12500000000000 15.999 > 3 4 O 0.50000000000000 0.53676723559782 0.62500000000000 15.999 > 3 5 O 0.38023842026885 0.74302029017813 0.42844032098796 15.999 > 5 6 O 0.38023842026885 0.74302029017813 0.92844032098796 15.999 > 5 7 O 0.61976157973115 0.74302029017813 0.32155967901204 15.999 > 7 8 O 0.61976157973115 0.74302029017813 0.82155967901204 15.999 > 7 9 O 0.61976157973115 0.25697970982187 0.07155967901204 15.999 > 9 10 O 0.61976157973115 0.25697970982187 0.57155967901204 15.999 > 9 11 O 0.38023842026885 0.25697970982187 0.17844032098796 15.999 > 11 12 O 0.38023842026885 0.25697970982187 0.67844032098796 15.999 > 11 13 O 0.61540605425337 0.04631238510847 0.27691423204932 15.999 > 13 14 O 0.61540605425337 0.04631238510847 0.77691423204932 15.999 > 13 15 O 0.38459394574663 0.04631238510847 0.47308576795068 15.999 > 15 16 O 0.38459394574663 0.04631238510847 0.97308576795068 15.999 > 15 17 O 0.18851779455969 0.06350524024217 0.04629404369372 15.999 > 17 18 O 0.18851779455969 0.06350524024217 0.54629404369372 15.999 > 17 19 O 0.81148220544031 0.06350524024217 0.20370595630628 15.999 > 19 20 O 0.81148220544031 0.06350524024217 0.70370595630628 15.999 > 19 21 O 0.81148220544031 0.93649475975783 0.45370595630628 15.999 > 21 22 O 0.81148220544031 0.93649475975783 0.95370595630628 15.999 > 21 23 O 0.18851779455969 0.93649475975783 0.29629404369372 15.999 > 23 24 O 0.18851779455969 0.93649475975783 0.79629404369372 15.999 > 23 25 O 0.61540605425337 0.95368761489153 0.02691423204932 15.999 > 25 26 O 0.61540605425337 0.95368761489153 0.52691423204932 15.999 > 25 27 O 0.38459394574663 0.95368761489153 0.22308576795068 15.999 > 27 28 O 0.38459394574663 0.95368761489153 0.72308576795068 15.999 > 27 29 O 0.00000000000000 0.96323276440218 0.37500000000000 15.999 > 1 30 O 0.00000000000000 0.96323276440218 0.87500000000000 15.999 > 1 31 O 0.00000000000000 0.03676723559782 0.12500000000000 15.999 > 3 32 O 0.00000000000000 0.03676723559782 0.62500000000000 15.999 > 3 33 O 0.88023842026885 0.24302029017813 0.42844032098796 15.999 > 5 34 O 0.88023842026885 0.24302029017813 0.92844032098796 15.999 > 5 35 O 0.11976157973115 0.24302029017813 0.32155967901204 15.999 > 7 36 O 0.11976157973115 0.24302029017813 0.82155967901204 15.999 > 7 37 O 0.11976157973115 0.75697970982187 0.07155967901204 15.999 > 9 38 O 0.11976157973115 0.75697970982187 0.57155967901204 15.999 > 9 39 O 0.88023842026885 0.75697970982187 0.17844032098796 15.999 > 11 40 O 0.88023842026885 0.75697970982187 0.67844032098796 15.999 > 11 41 O 0.11540605425337 0.54631238510847 0.27691423204932 15.999 > 13 42 O 0.11540605425337 0.54631238510847 0.77691423204932 15.999 > 13 43 O 0.88459394574663 0.54631238510847 0.47308576795068 15.999 > 15 44 O 0.88459394574663 0.54631238510847 0.97308576795068 15.999 > 15 45 O 0.68851779455969 0.56350524024217 0.04629404369372 15.999 > 17 46 O 0.68851779455969 0.56350524024217 0.54629404369372 15.999 > 17 47 O 0.31148220544031 0.56350524024217 0.20370595630628 15.999 > 19 48 O 0.31148220544031 0.56350524024217 0.70370595630628 15.999 > 19 49 O 0.31148220544031 0.43649475975783 0.45370595630628 15.999 > 21 50 O 0.31148220544031 0.43649475975783 0.95370595630628 15.999 > 21 51 O 0.68851779455969 0.43649475975783 0.29629404369372 15.999 > 23 52 O 0.68851779455969 0.43649475975783 0.79629404369372 15.999 > 23 53 O 0.11540605425337 0.45368761489153 0.02691423204932 15.999 > 25 54 O 0.11540605425337 0.45368761489153 0.52691423204932 15.999 > 25 55 O 0.88459394574663 0.45368761489153 0.22308576795068 15.999 > 27 56 O 0.88459394574663 0.45368761489153 0.72308576795068 15.999 > 27 57 Ga 0.33173570898928 0.91172536548355 0.35091169486727 69.723 > 57 58 Ga 0.33173570898928 0.91172536548355 0.85091169486727 69.723 > 57 59 Ga 0.66826429101073 0.91172536548355 0.39908830513273 69.723 > 59 60 Ga 0.66826429101073 0.91172536548355 0.89908830513273 69.723 > 59 61 Ga 0.66826429101073 0.08827463451645 0.14908830513273 69.723 > 61 62 Ga 0.66826429101073 0.08827463451645 0.64908830513273 69.723 > 61 63 Ga 0.33173570898928 0.08827463451645 0.10091169486727 69.723 > 63 64 Ga 0.33173570898928 0.08827463451645 0.60091169486727 69.723 > 63 65 Ga 0.88112753928576 0.06056396199439 0.37198952301943 69.723 > 65 66 Ga 0.88112753928576 0.06056396199439 0.87198952301943 69.723 > 65 67 Ga 0.11887246071424 0.06056396199439 0.37801047698057 69.723 > 67 68 Ga 0.11887246071424 0.06056396199439 0.87801047698057 69.723 > 67 69 Ga 0.88112753928576 0.93943603800561 0.12198952301943 69.723 > 69 70 Ga 0.88112753928576 0.93943603800561 0.62198952301943 69.723 > 69 71 Ga 0.11887246071424 0.93943603800561 0.12801047698057 69.723 > 71 72 Ga 0.11887246071424 0.93943603800561 0.62801047698057 69.723 > 71 73 Ga 0.83173570898927 0.41172536548355 0.35091169486727 69.723 > 57 74 Ga 0.83173570898927 0.41172536548355 0.85091169486727 69.723 > 57 75 Ga 0.16826429101072 0.41172536548355 0.39908830513273 69.723 > 59 76 Ga 0.16826429101072 0.41172536548355 0.89908830513273 69.723 > 59 77 Ga 0.16826429101072 0.58827463451645 0.14908830513273 69.723 > 61 78 Ga 0.16826429101072 0.58827463451645 0.64908830513273 69.723 > 61 79 Ga 0.83173570898927 0.58827463451645 0.10091169486727 69.723 > 63 80 Ga 0.83173570898927 0.58827463451645 0.60091169486727 69.723 > 63 81 Ga 0.38112753928576 0.56056396199439 0.37198952301943 69.723 > 65 82 Ga 0.38112753928576 0.56056396199439 0.87198952301943 69.723 > 65 83 Ga 0.61887246071424 0.56056396199439 0.37801047698057 69.723 > 67 84 Ga 0.61887246071424 0.56056396199439 0.87801047698057 69.723 > 67 85 Ga 0.38112753928576 0.43943603800561 0.12198952301943 69.723 > 69 86 Ga 0.38112753928576 0.43943603800561 0.62198952301943 69.723 > 69 87 Ga 0.61887246071424 0.43943603800561 0.12801047698057 69.723 > 71 88 Ga 0.61887246071424 0.43943603800561 0.62801047698057 69.723 > 71 89 Sr 0.50000000000000 0.18542984403346 0.37500000000000 87.620 > 89 90 Sr 0.50000000000000 0.18542984403346 0.87500000000000 87.620 > 89 91 Sr 0.50000000000000 0.81457015596654 0.12500000000000 87.620 > 91 92 Sr 0.50000000000000 0.81457015596654 0.62500000000000 87.620 > 91 93 Sr 0.00000000000000 0.68542984403346 0.37500000000000 87.620 > 89 94 Sr 0.00000000000000 0.68542984403346 0.87500000000000 87.620 > 89 95 Sr 0.00000000000000 0.31457015596653 0.12500000000000 87.620 > 91 96 Sr 0.00000000000000 0.31457015596653 0.62500000000000 87.620 > 91 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.2916307 0.0000000 0.0499062 0.0000000 3.3106680 0.0000000 0.0498914 0.0000000 3.4400547 -------------------------- Born effective charges -------------------------- 1 O -2.4056422 0.0000000 -0.1237084 0.0000000 -1.7406238 0.0000000 -0.1217079 0.0000000 -1.6610227 2 O -2.4056422 0.0000000 -0.1237084 0.0000000 -1.7406238 0.0000000 -0.1217079 0.0000000 -1.6610227 3 O -1.2598936 0.2215115 -0.2239221 0.2251668 -2.6100174 0.0371192 -0.2335815 -0.0114036 -1.7532546 4 O -1.2598936 -0.2215115 -0.2239221 -0.2251668 -2.6100174 -0.0371192 -0.2335815 0.0114036 -1.7532546 5 O -1.2598936 0.2215115 -0.2239221 0.2251668 -2.6100174 0.0371192 -0.2335815 -0.0114036 -1.7532546 6 O -1.2598936 -0.2215115 -0.2239221 -0.2251668 -2.6100174 -0.0371192 -0.2335815 0.0114036 -1.7532546 7 O -1.7753768 0.0407048 0.3496810 0.0573205 -1.7043529 0.3428676 0.3287194 0.3730777 -2.2762914 8 O -1.7753768 -0.0407048 0.3496810 -0.0573205 -1.7043529 -0.3428676 0.3287194 -0.3730777 -2.2762914 9 O -2.2876290 -0.4398415 -0.1804170 -0.3731006 -1.4036971 0.2705422 -0.1625019 0.1998471 -2.1683647 10 O -2.2876290 0.4398415 -0.1804170 0.3731006 -1.4036971 -0.2705422 -0.1625019 -0.1998471 -2.1683647 11 O -2.2876290 -0.4398415 -0.1804170 -0.3731006 -1.4036971 0.2705422 -0.1625019 0.1998471 -2.1683647 12 O -2.2876290 0.4398415 -0.1804170 0.3731006 -1.4036971 -0.2705422 -0.1625019 -0.1998471 -2.1683647 13 O -1.7753768 -0.0407048 0.3496810 -0.0573205 -1.7043529 -0.3428676 0.3287194 -0.3730777 -2.2762914 14 O -1.7753768 0.0407048 0.3496810 0.0573205 -1.7043529 0.3428676 0.3287194 0.3730777 -2.2762914 15 Ga 2.6337628 -0.2641390 0.0884079 -0.1089003 2.6656295 -0.3476038 0.0889468 0.0578339 2.8087268 16 Ga 2.6337628 0.2641390 0.0884079 0.1089003 2.6656295 0.3476038 0.0889468 -0.0578339 2.8087268 17 Ga 2.6337628 -0.2641390 0.0884079 -0.1089003 2.6656295 -0.3476038 0.0889468 0.0578339 2.8087268 18 Ga 2.6337628 0.2641390 0.0884079 0.1089003 2.6656295 0.3476038 0.0889468 -0.0578339 2.8087268 19 Ga 2.7438062 -0.1248076 -0.0237768 0.0249119 2.6791988 0.1661500 -0.0359605 -0.1991236 2.8975760 20 Ga 2.7438062 0.1248076 -0.0237768 -0.0249119 2.6791988 -0.1661500 -0.0359605 0.1991236 2.8975760 21 Ga 2.7438062 0.1248076 -0.0237768 -0.0249119 2.6791988 -0.1661500 -0.0359605 0.1991236 2.8975760 22 Ga 2.7438062 -0.1248076 -0.0237768 0.0249119 2.6791988 0.1661500 -0.0359605 -0.1991236 2.8975760 23 Sr 2.2963030 0.0000000 0.1037626 0.0000000 2.4871020 0.0000000 0.1504633 0.0000000 2.6442384 24 Sr 2.2963030 0.0000000 0.1037626 0.0000000 2.4871020 0.0000000 0.1504633 0.0000000 2.6442384 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000002 (xxx) 0.00000002 (xxx) 0.00000002 (xxx) 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 ... [ 7 7 9 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.59, Number of G-points: 313, Lambda: 0.11 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/128) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.134 ( 0.000 0.000 0.000) 0.000 2.338 ( 0.000 0.000 0.000) 0.000 2.473 ( 0.000 0.000 0.000) 0.000 2.480 ( 0.000 0.000 0.000) 0.000 2.822 ( 0.000 0.000 0.000) 0.000 2.859 ( 0.000 0.000 0.000) 0.000 3.391 ( 0.000 0.000 0.000) 0.000 3.411 ( 0.000 0.000 0.000) 0.000 3.511 ( 0.000 0.000 0.000) 0.000 3.832 ( 0.000 0.000 0.000) 0.000 3.905 ( 0.000 0.000 0.000) 0.000 3.924 ( 0.000 0.000 0.000) 0.000 4.002 ( 0.000 0.000 0.000) 0.000 4.103 ( 0.000 0.000 0.000) 0.000 4.354 ( 0.000 0.000 0.000) 0.000 4.598 ( 0.000 0.000 0.000) 0.000 4.653 ( 0.000 0.000 0.000) 0.000 5.211 ( 0.000 0.000 0.000) 0.000 5.292 ( 0.000 0.000 0.000) 0.000 5.307 ( 0.000 0.000 0.000) 0.000 5.556 ( 0.000 0.000 0.000) 0.000 5.728 ( 0.000 0.000 0.000) 0.000 5.766 ( 0.000 0.000 0.000) 0.000 5.799 ( 0.000 0.000 0.000) 0.000 6.379 ( 0.000 0.000 0.000) 0.000 6.848 ( 0.000 0.000 0.000) 0.000 7.035 ( 0.000 0.000 0.000) 0.000 7.043 ( 0.000 0.000 0.000) 0.000 7.088 ( 0.000 0.000 0.000) 0.000 7.760 ( 0.000 0.000 0.000) 0.000 7.793 ( 0.000 0.000 0.000) 0.000 8.026 ( 0.000 0.000 0.000) 0.000 8.254 ( 0.000 0.000 0.000) 0.000 8.283 ( 0.000 0.000 0.000) 0.000 8.328 ( 0.000 0.000 0.000) 0.000 8.661 ( 0.000 0.000 0.000) 0.000 8.975 ( 0.000 0.000 0.000) 0.000 8.982 ( 0.000 0.000 0.000) 0.000 9.625 ( 0.000 0.000 0.000) 0.000 10.537 ( 0.000 0.000 0.000) 0.000 10.952 ( 0.000 0.000 0.000) 0.000 12.986 ( 0.000 0.000 0.000) 0.000 13.506 ( 0.000 0.000 0.000) 0.000 14.007 ( 0.000 0.000 0.000) 0.000 14.069 ( 0.000 0.000 0.000) 0.000 14.082 ( 0.000 0.000 0.000) 0.000 14.188 ( 0.000 0.000 0.000) 0.000 14.458 ( 0.000 0.000 0.000) 0.000 14.554 ( 0.000 0.000 0.000) 0.000 14.913 ( 0.000 0.000 0.000) 0.000 16.240 ( 0.000 0.000 0.000) 0.000 16.560 ( 0.000 0.000 0.000) 0.000 16.624 ( 0.000 0.000 0.000) 0.000 17.981 ( 0.000 0.000 0.000) 0.000 18.394 ( 0.000 0.000 0.000) 0.000 18.634 ( 0.000 0.000 0.000) 0.000 18.874 ( 0.000 0.000 0.000) 0.000 18.888 ( 0.000 0.000 0.000) 0.000 19.364 ( 0.000 0.000 0.000) 0.000 19.622 ( 0.000 0.000 0.000) 0.000 19.840 ( 0.000 0.000 0.000) 0.000 21.020 ( 0.000 0.000 0.000) 0.000 21.588 ( 0.000 0.000 0.000) 0.000 21.667 ( 0.000 0.000 0.000) 0.000 22.213 ( 0.000 0.000 0.000) 0.000 23.359 ( 0.000 0.000 0.000) 0.000 23.442 ( 0.000 0.000 0.000) 0.000 23.812 ( 0.000 0.000 0.000) 0.000 23.858 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/128) ======================= q-point: ( 0.14 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.425 ( 23.562 -11.743 -3.234) 26.524 0.586 ( 20.732 -20.755 11.076) 31.357 1.062 ( 18.408 -51.599 8.697) 55.470 2.226 ( 0.833 -8.414 -2.993) 8.969 2.272 ( -6.414 2.223 0.307) 6.795 2.443 ( -4.321 -0.132 -0.716) 4.382 2.620 ( 9.705 6.429 18.374) 21.751 2.833 ( 2.309 4.492 13.797) 14.693 2.907 ( 1.199 -1.988 4.552) 5.109 3.203 ( -12.222 6.838 -4.495) 14.709 3.420 ( -1.303 0.172 -1.147) 1.745 3.519 ( -9.892 -4.223 2.050) 10.949 3.764 ( 1.035 5.362 -0.198) 5.465 3.875 ( -3.179 -2.883 -3.569) 5.582 3.962 ( 0.815 8.254 2.877) 8.779 4.107 ( 0.450 0.765 2.669) 2.812 4.258 ( -3.427 -14.263 -6.908) 16.214 4.401 ( -2.909 -0.770 10.164) 10.601 4.614 ( 1.699 -2.412 -3.770) 4.787 4.684 ( 1.761 0.682 5.554) 5.866 5.069 ( 0.846 13.642 -3.379) 14.080 5.380 ( -2.336 10.483 7.156) 12.905 5.473 ( 6.761 5.451 -3.458) 9.348 5.634 ( 25.856 10.869 -1.016) 28.066 5.729 ( 4.604 0.854 1.583) 4.943 5.788 ( 1.701 1.159 -0.831) 2.220 5.986 ( 5.640 -15.432 -2.363) 16.599 6.487 ( -2.337 0.918 -2.173) 3.321 6.770 ( -9.411 2.353 1.964) 9.897 6.918 ( -0.707 8.761 1.685) 8.949 7.080 ( -1.352 -0.801 -8.658) 8.799 7.261 ( 5.429 -6.619 7.451) 11.349 7.728 ( -2.450 7.405 1.604) 7.963 7.801 ( 2.515 -0.138 0.159) 2.524 7.964 ( -2.055 6.415 -1.999) 7.026 8.245 ( -2.971 3.714 -1.879) 5.114 8.367 ( -12.143 -10.430 -5.273) 16.853 8.487 ( -2.253 -6.221 -1.938) 6.895 8.766 ( 3.720 -7.143 6.128) 10.120 8.977 ( 0.144 1.516 2.166) 2.648 9.019 ( 2.816 0.338 -2.373) 3.698 9.634 ( -1.025 -1.839 -1.312) 2.481 10.649 ( -9.740 -4.982 -3.558) 11.504 10.950 ( 0.630 0.657 -0.387) 0.990 13.218 ( 20.552 15.851 18.409) 31.820 13.650 ( 2.917 5.885 4.488) 7.955 13.957 ( -0.510 4.629 -0.804) 4.726 14.119 ( 0.566 -3.576 3.845) 5.281 14.231 ( 1.323 -2.918 0.935) 3.337 14.457 ( 0.001 0.083 0.251) 0.265 14.538 ( -1.242 1.068 -0.405) 1.688 14.840 ( -10.883 -0.514 2.145) 11.105 15.016 ( -12.601 -11.390 1.740) 17.074 16.320 ( -6.848 -4.053 0.057) 7.958 16.568 ( 2.200 -0.103 -6.156) 6.539 16.627 ( -0.194 -0.592 -0.675) 0.919 17.988 ( 1.679 0.184 -0.344) 1.724 18.411 ( -10.218 -1.984 -0.793) 10.439 18.873 ( 0.394 0.504 0.292) 0.703 18.887 ( 0.302 -0.451 -0.344) 0.643 19.362 ( 5.138 4.800 4.366) 8.276 19.526 ( 55.506 30.224 -27.951) 69.107 19.646 ( 5.314 7.897 28.374) 29.928 19.872 ( 5.050 0.495 6.700) 8.405 21.027 ( 0.147 -0.827 -0.021) 0.840 21.625 ( -0.566 4.634 -0.217) 4.674 22.211 ( -7.169 -7.306 2.636) 10.570 22.436 ( 0.008 -0.651 -6.800) 6.831 23.343 ( -0.266 2.096 0.566) 2.188 23.713 ( -9.989 -0.452 -3.202) 10.499 23.955 ( 9.200 -0.130 2.571) 9.553 24.297 ( -40.082 -29.752 -14.687) 52.033 ======================= Grid point 2 (3/128) ======================= q-point: ( 0.29 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.841 ( 23.461 -10.774 -1.925) 25.888 1.136 ( 17.564 -19.224 10.710) 28.156 1.914 ( 1.385 -19.687 5.909) 20.601 2.126 ( -1.782 -9.742 -7.151) 12.215 2.274 ( -6.946 -1.244 -7.910) 10.600 2.534 ( 2.838 -11.487 8.096) 14.337 2.650 ( 1.957 3.346 11.086) 11.745 2.848 ( 1.600 2.925 9.695) 10.252 2.926 ( -3.573 -0.055 -0.346) 3.590 3.060 ( 0.312 -3.015 0.518) 3.075 3.340 ( -8.267 1.098 -4.790) 9.617 3.511 ( -4.631 -4.583 0.471) 6.532 3.756 ( 4.244 1.701 2.008) 4.994 3.781 ( -1.904 10.450 0.242) 10.625 3.892 ( -3.551 -3.891 -2.364) 5.773 4.088 ( 2.010 4.433 3.547) 6.022 4.392 ( 0.703 -6.196 -2.466) 6.706 4.449 ( 1.530 -2.503 0.754) 3.029 4.660 ( 0.956 0.228 1.801) 2.052 4.677 ( -3.685 0.320 1.153) 3.875 4.886 ( 3.667 9.095 -8.501) 12.978 5.184 ( -3.445 10.134 1.440) 10.800 5.331 ( 0.605 14.413 1.128) 14.470 5.667 ( -5.295 1.843 -1.408) 5.781 5.795 ( 13.139 0.614 -0.518) 13.164 5.916 ( 14.272 -3.470 3.727) 15.153 6.270 ( 3.343 -11.484 -6.895) 13.806 6.457 ( -2.259 -2.840 0.173) 3.633 6.656 ( -4.068 0.884 1.449) 4.408 6.771 ( -6.240 5.420 0.247) 8.270 7.050 ( -1.213 0.378 -1.942) 2.321 7.394 ( 1.020 2.243 5.364) 5.902 7.532 ( 2.716 10.853 3.099) 11.609 7.781 ( 1.137 4.799 -1.531) 5.164 7.918 ( -5.971 -3.005 -2.323) 7.076 8.209 ( 2.263 -1.775 -0.036) 2.876 8.352 ( -4.138 -2.780 -7.119) 8.691 8.546 ( -4.725 -4.229 2.912) 6.977 8.910 ( 2.220 -0.431 4.311) 4.868 8.965 ( 5.235 0.029 -0.371) 5.248 9.058 ( -2.318 -5.093 1.784) 5.873 9.642 ( -1.798 -1.552 -2.605) 3.525 10.606 ( -5.161 -0.971 -1.449) 5.448 10.943 ( 0.807 0.978 -0.386) 1.325 13.252 ( 8.821 5.061 7.806) 12.820 13.599 ( 1.035 4.209 1.377) 4.548 13.883 ( 0.230 3.610 -1.577) 3.946 14.208 ( 0.511 -4.681 5.609) 7.323 14.275 ( 1.624 -0.292 -1.017) 1.938 14.460 ( -0.057 0.072 -1.400) 1.403 14.501 ( -1.651 0.573 0.780) 1.913 14.739 ( -6.740 1.555 0.398) 6.929 15.052 ( -4.039 -4.383 -0.657) 5.996 16.308 ( -2.362 -1.034 -1.335) 2.903 16.579 ( 0.850 -0.610 -0.790) 1.311 16.630 ( -0.593 -0.468 -0.804) 1.103 18.008 ( 2.735 0.249 -0.533) 2.798 18.318 ( -7.270 1.048 -0.016) 7.345 18.870 ( 0.194 0.324 0.095) 0.390 18.901 ( 0.128 -0.959 -0.199) 0.987 19.350 ( 4.390 4.614 3.395) 7.217 19.552 ( 13.199 5.724 -12.022) 18.748 19.668 ( 4.426 3.065 6.559) 8.486 19.967 ( 7.585 -0.568 7.437) 10.638 21.047 ( 0.324 -1.413 -0.036) 1.451 21.528 ( -1.003 5.924 -0.338) 6.017 22.257 ( -4.988 -5.527 1.328) 7.562 22.431 ( 2.487 0.793 -2.920) 3.916 23.291 ( -1.369 3.347 0.708) 3.685 23.626 ( -6.720 -1.072 -2.577) 7.277 24.050 ( 7.497 0.350 2.460) 7.898 24.286 ( -17.032 -11.973 -6.681) 21.865 ======================= Grid point 3 (4/128) ======================= q-point: ( 0.43 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.241 ( 22.637 -9.465 -1.074) 24.560 1.565 ( 0.018 -10.339 8.235) 13.217 1.711 ( -8.469 6.377 1.852) 10.762 2.059 ( -6.005 7.751 -11.719) 15.280 2.534 ( 1.611 -10.387 -0.546) 10.526 2.629 ( -1.040 2.219 6.221) 6.686 2.765 ( -1.323 -10.756 1.716) 10.972 2.828 ( 3.990 2.391 2.850) 5.456 2.935 ( -0.505 -1.254 1.984) 2.400 3.228 ( -0.052 -5.927 -1.354) 6.080 3.257 ( -2.920 -5.711 3.956) 7.536 3.484 ( -0.909 4.534 -3.340) 5.704 3.697 ( 5.242 -1.337 0.640) 5.448 3.801 ( 1.229 -0.311 -0.028) 1.268 3.902 ( 0.021 -1.902 -0.747) 2.044 4.079 ( 1.405 -1.113 4.283) 4.643 4.285 ( -7.117 15.203 -3.788) 17.208 4.517 ( 2.517 -1.894 2.734) 4.171 4.632 ( 1.403 2.668 0.365) 3.036 4.670 ( -4.292 -7.077 -2.627) 8.683 4.862 ( 2.672 -1.865 -5.974) 6.805 5.042 ( -0.568 4.849 0.322) 4.892 5.121 ( -1.098 11.097 3.201) 11.601 5.572 ( -3.153 1.731 -1.153) 3.777 5.925 ( 6.319 -2.099 -0.077) 6.659 6.114 ( 9.404 -3.003 3.886) 10.609 6.246 ( -4.606 3.957 -5.427) 8.144 6.531 ( 2.214 -1.196 3.579) 4.375 6.626 ( -6.507 2.412 -0.135) 6.941 6.787 ( 1.543 -15.330 -5.311) 16.297 7.039 ( 0.679 0.557 1.216) 1.500 7.181 ( -3.219 15.376 3.798) 16.162 7.558 ( 2.538 -0.752 1.563) 3.074 7.707 ( -0.585 2.631 -1.843) 3.265 7.898 ( -2.198 -0.917 -0.375) 2.411 8.300 ( 0.125 -5.036 0.565) 5.069 8.339 ( 2.689 1.103 -3.934) 4.891 8.529 ( -4.540 -0.005 2.223) 5.055 8.902 ( 0.318 0.995 0.666) 1.239 9.018 ( 2.446 0.226 -0.708) 2.556 9.136 ( -0.456 -3.964 2.758) 4.851 9.629 ( -1.149 -0.171 -1.787) 2.131 10.572 ( -1.792 -0.069 -0.445) 1.847 10.937 ( 0.385 0.467 -0.127) 0.618 13.284 ( 2.742 1.067 2.391) 3.792 13.560 ( 0.252 1.778 0.546) 1.877 13.847 ( 0.493 1.172 -0.861) 1.535 14.265 ( -1.624 -0.707 0.921) 1.996 14.309 ( 3.372 -2.145 3.074) 5.043 14.407 ( -2.275 2.495 -3.464) 4.838 14.527 ( 0.811 -1.851 1.341) 2.425 14.661 ( -2.780 1.545 -0.354) 3.200 15.065 ( -1.129 -1.236 -0.446) 1.732 16.298 ( -0.632 -0.165 -0.657) 0.927 16.596 ( 0.553 -0.457 0.319) 0.785 16.625 ( -0.582 -0.035 -0.575) 0.819 18.030 ( 1.749 0.105 -0.314) 1.780 18.245 ( -3.292 0.604 0.122) 3.349 18.868 ( 0.051 0.093 0.016) 0.107 18.914 ( 0.059 -0.491 -0.063) 0.499 19.337 ( 1.553 1.800 1.156) 2.643 19.559 ( 2.719 1.086 -3.042) 4.223 19.680 ( 1.326 0.709 0.872) 1.738 20.060 ( 3.428 -0.751 2.814) 4.498 21.071 ( 0.261 -0.943 -0.012) 0.979 21.442 ( -0.639 2.975 -0.195) 3.049 22.278 ( -2.082 -1.793 0.340) 2.768 22.445 ( 1.535 0.010 -0.795) 1.729 23.234 ( -1.041 1.720 0.273) 2.029 23.587 ( -2.158 -0.558 -0.963) 2.428 24.111 ( 3.577 0.448 1.302) 3.833 24.271 ( -5.959 -3.804 -2.455) 7.484 ======================= Grid point 8 (5/128) ======================= q-point: ( 0.14 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.490 ( 19.666 -0.000 13.063) 23.609 0.537 ( 23.536 -0.000 6.771) 24.491 1.232 ( 52.364 -0.000 16.009) 54.757 2.158 ( 0.331 -0.000 2.517) 2.539 2.176 ( -18.125 0.000 4.819) 18.755 2.402 ( -1.264 0.000 -5.708) 5.846 2.787 ( 4.407 -0.000 -4.606) 6.374 2.892 ( 3.974 -0.000 -3.179) 5.089 2.963 ( -12.547 0.000 40.546) 42.443 3.088 ( -14.609 0.000 -1.028) 14.645 3.351 ( -11.144 0.000 3.554) 11.697 3.399 ( -6.089 0.000 -1.713) 6.325 3.799 ( -1.858 0.000 -5.427) 5.736 3.928 ( 7.706 -0.000 -4.668) 9.009 3.977 ( 0.101 -0.000 -2.043) 2.045 4.129 ( 6.115 -0.000 7.828) 9.933 4.159 ( 4.338 -0.000 0.677) 4.391 4.325 ( -8.027 0.000 2.239) 8.333 4.613 ( 2.208 -0.000 0.598) 2.287 4.794 ( 6.769 -0.000 6.463) 9.359 5.082 ( -5.314 0.000 -3.567) 6.400 5.492 ( 3.939 -0.000 0.174) 3.943 5.561 ( -4.635 0.000 -4.549) 6.495 5.659 ( -5.585 0.000 -13.520) 14.628 5.823 ( 1.332 -0.000 2.995) 3.278 5.830 ( 14.654 -0.000 1.020) 14.689 6.343 ( -3.268 0.000 -0.591) 3.321 6.400 ( 6.903 -0.000 0.324) 6.911 6.676 ( -11.407 0.000 3.586) 11.957 6.869 ( -9.873 0.000 2.556) 10.199 7.188 ( 9.055 -0.000 -4.534) 10.126 7.215 ( 5.060 -0.000 1.566) 5.297 7.754 ( -3.324 0.000 4.494) 5.590 7.805 ( 2.705 -0.000 -1.458) 3.073 8.052 ( -9.813 0.000 -4.163) 10.660 8.109 ( 5.931 -0.000 -3.083) 6.684 8.180 ( -4.256 0.000 -0.265) 4.264 8.474 ( 1.494 -0.000 4.698) 4.930 8.707 ( 2.866 -0.000 0.408) 2.895 8.975 ( -0.739 0.000 0.797) 1.087 9.063 ( 0.797 -0.000 -2.564) 2.685 9.577 ( -3.087 0.000 -4.512) 5.467 10.519 ( -2.096 0.000 2.204) 3.042 10.959 ( 0.843 -0.000 -0.832) 1.185 13.545 ( 3.297 -0.000 0.540) 3.341 13.994 ( -0.630 0.000 -1.512) 1.638 14.010 ( -5.913 0.000 -2.336) 6.357 14.087 ( -0.033 0.000 5.743) 5.743 14.136 ( -10.519 0.000 40.050) 41.408 14.424 ( -4.760 0.000 6.647) 8.176 14.480 ( 0.536 -0.000 0.377) 0.655 14.530 ( -1.339 0.000 -3.309) 3.570 14.938 ( 4.019 -0.000 -7.343) 8.370 16.268 ( 2.449 -0.000 0.017) 2.449 16.572 ( 2.148 -0.000 -6.519) 6.864 16.622 ( -0.021 0.000 -0.617) 0.617 17.977 ( -0.529 0.000 0.611) 0.808 18.391 ( -0.392 0.000 0.462) 0.606 18.872 ( -0.870 0.000 -0.540) 1.023 18.886 ( 0.769 -0.000 -0.306) 0.827 19.301 ( -7.037 0.000 4.510) 8.359 19.619 ( 2.065 -0.000 -6.656) 6.969 19.812 ( -0.722 0.000 -4.972) 5.024 21.021 ( 0.040 -0.000 0.201) 0.205 21.327 ( 1.380 -0.000 0.967) 1.685 21.551 ( -2.098 0.000 -1.278) 2.457 21.707 ( 2.453 -0.000 1.136) 2.703 22.376 ( 4.341 -0.000 -11.135) 11.952 23.354 ( -0.820 0.000 1.418) 1.638 23.449 ( 1.044 -0.000 -1.382) 1.732 23.596 ( -9.218 0.000 -3.386) 9.821 24.099 ( 10.829 -0.000 4.291) 11.649 ======================= Grid point 9 (6/128) ======================= q-point: ( 0.29 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.882 ( 21.191 -9.574 5.429) 23.878 0.989 ( 14.009 -24.531 8.395) 29.470 1.847 ( 6.479 -3.481 8.152) 10.980 1.991 ( 9.654 -6.415 11.000) 15.979 2.205 ( -1.232 -2.826 -5.620) 6.410 2.387 ( -2.411 -4.392 -0.316) 5.020 2.743 ( -4.041 2.442 -2.775) 5.476 2.860 ( -1.862 2.815 -5.415) 6.381 2.928 ( -6.592 1.385 21.774) 22.792 3.063 ( 5.990 -2.122 3.840) 7.425 3.264 ( -6.523 0.746 -1.899) 6.835 3.357 ( -6.221 -5.044 1.840) 8.217 3.795 ( 0.287 -2.825 -1.682) 3.300 3.874 ( 5.036 4.502 -1.390) 6.896 3.994 ( 0.277 13.186 -1.983) 13.337 4.159 ( 1.184 -6.107 2.521) 6.712 4.223 ( 1.010 -4.025 -1.182) 4.314 4.383 ( -0.342 -7.729 1.859) 7.957 4.661 ( 2.582 -1.938 2.150) 3.879 4.792 ( 4.431 9.224 3.010) 10.667 4.995 ( -1.526 5.752 -7.784) 9.798 5.314 ( -5.136 12.572 -3.920) 14.135 5.467 ( -2.660 5.240 -2.135) 6.253 5.605 ( -9.313 0.248 -6.284) 11.238 5.882 ( 3.370 -3.494 4.680) 6.743 6.082 ( 13.104 -8.283 -1.821) 15.609 6.195 ( 6.239 6.818 3.432) 9.859 6.408 ( -4.110 2.547 -4.115) 6.350 6.595 ( -3.747 0.035 1.833) 4.172 6.789 ( -5.717 1.825 2.862) 6.649 7.137 ( 5.464 7.365 -4.522) 10.225 7.380 ( 2.445 -6.375 2.877) 7.410 7.692 ( -2.811 6.003 4.109) 7.799 7.788 ( -10.044 -0.140 -3.447) 10.619 7.915 ( 5.490 6.564 -0.442) 8.569 8.151 ( -3.425 -4.643 0.194) 5.773 8.270 ( 4.742 -5.614 -0.425) 7.361 8.476 ( -1.032 -0.532 1.047) 1.564 8.844 ( 0.400 -10.932 2.488) 11.219 8.953 ( -2.904 0.659 0.889) 3.108 9.053 ( 2.342 1.645 -1.847) 3.406 9.553 ( -4.226 -3.355 -5.474) 7.686 10.523 ( -3.324 -2.287 1.476) 4.296 10.961 ( 0.856 0.624 -0.932) 1.411 13.510 ( 5.038 9.979 5.386) 12.408 13.730 ( -0.312 11.964 4.239) 12.696 13.939 ( -0.205 3.952 -1.298) 4.164 14.134 ( -2.214 -4.685 6.106) 8.008 14.282 ( 1.022 -3.954 3.610) 5.450 14.442 ( -4.059 -2.972 4.057) 6.463 14.486 ( -2.955 0.665 -1.499) 3.380 14.557 ( -8.512 -8.555 5.207) 13.143 14.972 ( 2.955 -1.987 -6.742) 7.625 16.298 ( 2.327 0.012 -0.210) 2.337 16.579 ( 1.411 -0.408 -2.806) 3.167 16.620 ( -0.123 -0.126 -0.748) 0.769 17.986 ( -1.241 -1.584 0.511) 2.076 18.351 ( 0.205 4.201 0.455) 4.230 18.860 ( -1.152 -0.314 -0.822) 1.450 18.898 ( 1.056 -0.307 -0.223) 1.122 19.259 ( -9.366 -3.407 5.014) 11.157 19.620 ( 1.973 0.256 -5.926) 6.251 19.778 ( -0.043 1.796 -6.284) 6.536 20.653 ( 24.871 45.475 8.921) 52.594 21.032 ( 0.318 -0.827 -0.128) 0.896 21.587 ( -2.896 3.708 -0.846) 4.780 22.039 ( -6.723 -17.077 0.630) 18.363 22.426 ( 2.224 -2.959 -5.191) 6.376 23.322 ( -2.745 3.145 0.858) 4.261 23.515 ( -5.693 -3.396 -1.897) 6.896 23.699 ( -9.873 -23.337 -6.152) 26.075 24.224 ( 9.739 -0.219 3.787) 10.452 ======================= Grid point 10 (7/128) ======================= q-point: ( 0.43 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.277 ( 18.129 -11.228 5.536) 22.031 1.406 ( -10.490 -6.051 3.928) 12.731 1.614 ( -11.148 -9.251 5.644) 15.547 2.101 ( -2.561 9.041 -11.153) 14.584 2.487 ( -10.723 -12.230 2.095) 16.400 2.513 ( 23.276 -6.513 6.998) 25.162 2.653 ( -5.029 -0.147 -3.110) 5.915 2.895 ( 8.665 -3.255 1.783) 9.426 2.901 ( -4.129 -0.005 9.798) 10.632 3.191 ( 6.105 -4.478 6.716) 10.120 3.234 ( 5.402 0.445 -5.839) 7.967 3.418 ( -4.440 -8.374 -0.941) 9.525 3.788 ( 0.428 7.270 1.922) 7.532 3.856 ( 2.153 0.744 -2.896) 3.685 3.914 ( 8.438 -1.632 3.965) 9.465 4.183 ( 3.941 7.475 2.963) 8.955 4.328 ( -2.438 -8.210 -5.388) 10.118 4.494 ( -0.193 -1.524 2.065) 2.574 4.613 ( -0.143 11.684 -0.844) 11.716 4.711 ( 0.550 1.680 6.407) 6.647 4.840 ( -0.009 3.657 -14.180) 14.644 5.118 ( -3.464 6.306 -0.877) 7.248 5.279 ( -7.104 11.867 1.573) 13.920 5.473 ( -9.908 -1.983 -4.512) 11.066 5.959 ( 0.864 -1.503 5.190) 5.472 6.167 ( -0.167 0.457 3.582) 3.615 6.220 ( -6.057 4.466 -3.032) 8.113 6.461 ( 5.616 -14.415 -2.632) 15.693 6.589 ( 0.568 0.454 -3.748) 3.818 6.734 ( 6.264 3.369 1.388) 7.246 7.091 ( 4.577 3.720 -2.847) 6.549 7.394 ( -2.950 9.044 4.822) 10.665 7.570 ( -1.433 3.320 -0.599) 3.665 7.665 ( -8.863 -0.198 -1.075) 8.931 7.918 ( 4.882 1.150 -0.279) 5.023 8.231 ( 0.456 -5.054 4.078) 6.510 8.378 ( 5.083 -0.990 0.956) 5.266 8.489 ( 0.227 -1.951 -0.417) 2.008 8.893 ( -3.621 0.654 -0.383) 3.700 8.992 ( -4.868 -5.789 0.642) 7.590 9.081 ( 4.608 -2.703 0.059) 5.343 9.552 ( -4.054 -4.346 -4.598) 7.514 10.531 ( -1.937 -2.197 1.128) 3.139 10.951 ( 0.331 1.138 -0.874) 1.473 13.414 ( 2.847 9.075 5.440) 10.956 13.616 ( -0.119 5.063 -0.439) 5.083 13.882 ( 0.254 3.039 -0.981) 3.203 14.194 ( -3.307 -4.198 5.203) 7.459 14.325 ( 1.230 -0.654 -1.535) 2.072 14.424 ( 0.354 1.929 -6.036) 6.347 14.497 ( -1.122 -4.122 5.086) 6.642 14.584 ( -7.223 -4.209 5.383) 9.943 15.013 ( 0.909 -2.765 -4.160) 5.077 16.315 ( 2.427 0.843 0.178) 2.575 16.595 ( 0.978 -0.551 -1.552) 1.915 16.620 ( 0.159 -0.228 -0.238) 0.366 17.989 ( -3.319 -1.404 0.557) 3.646 18.307 ( 3.997 3.483 0.128) 5.303 18.853 ( -1.313 -0.668 -0.876) 1.714 18.914 ( 1.039 -0.341 -0.321) 1.139 19.221 ( -11.511 -3.655 4.562) 12.910 19.616 ( 2.297 0.959 -5.906) 6.409 19.725 ( 0.595 2.814 -4.928) 5.706 20.409 ( 18.727 23.829 8.598) 31.504 21.054 ( 0.284 -1.509 -0.019) 1.536 21.481 ( -3.159 4.502 -0.856) 5.566 22.170 ( -3.152 -8.216 0.457) 8.812 22.465 ( 1.969 -0.473 -1.898) 2.775 23.238 ( -3.570 2.164 0.041) 4.175 23.535 ( -1.000 -3.659 0.077) 3.794 23.863 ( -10.774 -14.827 -5.921) 19.260 24.332 ( 8.803 0.277 3.413) 9.446 ======================= Grid point 11 (8/128) ======================= q-point: (-0.43 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.055 ( -31.973 4.777 2.047) 32.392 1.665 ( 14.637 -11.914 4.122) 19.318 1.748 ( -1.835 14.576 -6.382) 16.018 1.985 ( 2.821 -11.730 6.070) 13.505 2.498 ( -9.730 -5.919 -2.654) 11.694 2.630 ( -5.775 -3.457 -8.155) 10.574 2.731 ( 11.553 -0.443 5.791) 12.931 2.872 ( -3.967 -0.666 1.641) 4.344 3.017 ( 7.718 6.107 5.132) 11.099 3.254 ( 2.039 -2.053 -9.706) 10.128 3.388 ( 10.507 -1.397 2.115) 10.808 3.484 ( 2.419 -2.578 3.793) 5.185 3.804 ( 3.824 -0.207 1.900) 4.275 3.840 ( 0.682 15.645 -3.090) 15.962 3.930 ( -2.652 6.059 4.572) 8.041 4.134 ( -2.377 8.124 -4.648) 9.657 4.176 ( 7.546 -7.404 3.366) 11.095 4.490 ( 0.487 -1.967 -4.426) 4.868 4.645 ( -1.436 5.522 4.214) 7.093 4.731 ( 5.699 -6.926 2.849) 9.411 4.829 ( -0.621 -4.321 -6.659) 7.962 5.006 ( -10.426 4.755 0.704) 11.481 5.035 ( -1.913 2.813 -0.367) 3.422 5.460 ( -6.404 -7.744 -0.809) 10.081 5.945 ( -4.198 4.839 4.221) 7.672 6.057 ( -8.585 4.103 -2.794) 9.917 6.178 ( -2.901 -5.836 2.454) 6.964 6.536 ( 0.622 3.732 -2.095) 4.325 6.692 ( 7.199 -4.731 -2.107) 8.868 6.884 ( 9.742 -9.560 -2.424) 13.863 7.044 ( -0.154 9.733 -3.201) 10.247 7.193 ( 1.411 9.107 6.448) 11.247 7.510 ( -6.114 0.560 -4.858) 7.829 7.631 ( -4.243 -4.442 2.323) 6.567 7.968 ( 6.734 0.806 0.549) 6.804 8.282 ( -5.536 -1.552 4.348) 7.209 8.403 ( 5.007 3.274 3.822) 7.099 8.567 ( 7.524 -2.452 -2.453) 8.285 8.851 ( -4.466 -1.189 -1.506) 4.861 8.977 ( -5.281 -0.787 -0.751) 5.392 9.158 ( 1.643 -0.984 -1.766) 2.605 9.588 ( -1.604 -5.227 -0.738) 5.517 10.565 ( 0.530 -2.739 1.192) 3.034 10.932 ( -0.465 0.750 -0.741) 1.153 13.316 ( -0.626 6.953 1.676) 7.179 13.555 ( -0.349 1.856 -1.290) 2.287 13.843 ( -0.664 1.304 0.277) 1.489 14.230 ( -2.268 -2.530 3.696) 5.020 14.312 ( -1.211 0.893 -4.871) 5.098 14.423 ( 3.800 -0.634 -1.883) 4.288 14.536 ( -0.708 0.721 -0.152) 1.022 14.609 ( -2.937 -5.579 5.954) 8.672 15.054 ( 0.516 -2.770 -1.812) 3.350 16.330 ( 2.591 0.760 1.105) 2.918 16.596 ( -0.061 0.259 -1.429) 1.454 16.635 ( 1.362 -0.364 0.285) 1.438 17.965 ( -4.769 -1.185 0.630) 4.954 18.340 ( 8.911 1.178 0.176) 8.990 18.846 ( -1.905 -0.989 -1.055) 2.392 18.925 ( 0.886 0.189 -0.483) 1.027 19.150 ( -14.355 -3.084 3.122) 15.011 19.602 ( 2.593 1.999 -5.305) 6.234 19.681 ( -0.177 1.826 -1.975) 2.696 20.269 ( 9.422 17.558 4.906) 20.521 21.074 ( -0.004 -0.467 0.075) 0.473 21.410 ( -1.880 -0.048 -0.502) 1.947 22.253 ( -0.419 -5.209 0.180) 5.228 22.464 ( 0.614 2.184 -0.400) 2.304 23.205 ( -1.379 -1.494 -0.247) 2.048 23.599 ( 2.775 -3.010 1.840) 4.489 23.915 ( -9.917 -8.489 -5.019) 13.986 24.427 ( 8.657 0.522 3.388) 9.310 ======================= Grid point 12 (9/128) ======================= q-point: (-0.29 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.670 ( -26.234 5.345 0.896) 26.787 1.343 ( -5.321 24.702 -5.587) 25.879 1.982 ( 7.911 -9.702 2.990) 12.871 2.240 ( 4.474 -8.647 8.582) 12.978 2.480 ( -6.031 -2.330 -1.012) 6.544 2.558 ( -1.604 4.091 -8.194) 9.298 2.789 ( 7.294 29.813 -3.600) 30.903 2.806 ( -1.195 1.749 -0.660) 2.218 2.924 ( 0.298 1.261 2.699) 2.994 3.150 ( -4.947 11.217 -3.195) 12.669 3.362 ( 2.210 -3.756 -3.522) 5.603 3.555 ( 1.674 -1.021 2.606) 3.261 3.678 ( 4.907 -2.891 2.220) 6.113 3.817 ( 1.552 3.957 0.596) 4.292 3.990 ( -2.600 -3.155 -3.424) 5.332 4.040 ( 7.531 4.457 2.002) 8.977 4.367 ( -0.710 -6.003 0.333) 6.054 4.463 ( -0.683 3.112 -2.331) 3.948 4.615 ( -0.443 -2.595 2.891) 3.910 4.762 ( 1.477 2.731 -3.705) 4.834 4.797 ( -4.843 3.229 4.652) 7.451 5.040 ( 2.579 -11.971 -4.828) 13.163 5.108 ( -2.012 -10.851 3.431) 11.557 5.549 ( -5.144 -10.690 1.074) 11.912 5.797 ( -3.708 8.225 2.337) 9.320 5.886 ( -5.553 6.365 -2.474) 8.802 6.298 ( -0.817 -7.940 2.445) 8.348 6.495 ( 0.148 1.444 -1.594) 2.156 6.748 ( 3.539 9.607 -1.533) 10.352 6.812 ( -0.072 5.714 -0.325) 5.724 7.117 ( 8.424 -3.088 3.740) 9.720 7.242 ( 2.711 -10.332 -0.604) 10.699 7.393 ( -9.334 1.231 -6.023) 11.177 7.697 ( -1.176 -5.624 1.400) 5.913 8.033 ( 7.830 1.345 1.046) 8.013 8.195 ( -7.337 2.914 1.841) 8.106 8.447 ( 5.305 0.552 5.372) 7.570 8.654 ( 7.133 2.147 -2.987) 8.026 8.835 ( -4.222 -3.920 -1.353) 5.918 8.908 ( -5.870 1.320 -1.352) 6.166 9.140 ( 0.823 3.345 -1.981) 3.973 9.650 ( 0.103 -2.628 0.948) 2.796 10.632 ( 2.244 -3.240 1.157) 4.107 10.920 ( -0.766 -0.474 -0.357) 0.969 13.191 ( -3.349 6.150 -1.622) 7.187 13.547 ( -0.258 -1.390 -0.782) 1.615 13.840 ( -0.490 -1.649 0.791) 1.893 14.220 ( -2.353 1.477 -0.659) 2.855 14.289 ( 0.815 0.467 -1.299) 1.603 14.470 ( 1.791 -0.157 0.323) 1.827 14.502 ( -0.702 0.420 -0.683) 1.066 14.703 ( 0.206 -6.063 2.486) 6.556 15.098 ( 1.415 -1.995 -0.646) 2.530 16.355 ( 2.518 0.095 1.325) 2.847 16.584 ( -0.134 0.596 -0.697) 0.927 16.651 ( 1.210 0.408 0.269) 1.305 17.941 ( -3.824 -1.613 0.401) 4.169 18.456 ( 14.015 -0.266 1.097) 14.061 18.829 ( -5.549 -1.604 -1.768) 6.041 18.921 ( 0.718 1.247 -0.621) 1.567 19.029 ( -16.711 -2.025 1.485) 16.899 19.572 ( 1.835 3.570 -3.085) 5.062 19.649 ( -0.588 1.219 -0.498) 1.442 20.089 ( 2.442 14.024 1.382) 14.302 21.066 ( -0.220 1.171 0.038) 1.192 21.444 ( -0.224 -5.104 -0.042) 5.109 22.327 ( 2.248 -2.929 -0.495) 3.725 22.412 ( -1.724 3.283 0.763) 3.785 23.243 ( 0.132 -3.659 -0.323) 3.676 23.698 ( 6.710 -2.186 3.204) 7.750 23.895 ( -9.514 -4.248 -4.265) 11.258 24.524 ( 8.195 -0.321 3.160) 8.789 ======================= Grid point 13 (10/128) ======================= q-point: (-0.14 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.381 ( 0.000 10.197 0.000) 10.197 0.887 ( 0.000 27.844 0.000) 27.844 1.853 ( 0.000 48.560 0.000) 48.560 2.256 ( -0.000 -0.758 -0.000) 0.758 2.395 ( 0.000 9.245 0.000) 9.245 2.457 ( -0.000 -1.924 -0.000) 1.924 2.505 ( 0.000 1.601 0.000) 1.601 2.771 ( -0.000 -0.010 -0.000) 0.010 2.918 ( 0.000 1.179 0.000) 1.179 3.159 ( -0.000 -6.349 -0.000) 6.349 3.437 ( -0.000 -2.026 -0.000) 2.026 3.582 ( -0.000 -0.888 -0.000) 0.888 3.698 ( 0.000 0.098 0.000) 0.098 3.864 ( -0.000 -6.369 -0.000) 6.369 3.946 ( 0.000 3.560 0.000) 3.560 4.089 ( -0.000 -1.172 -0.000) 1.172 4.384 ( 0.000 0.695 0.000) 0.695 4.402 ( 0.000 2.913 0.000) 2.913 4.650 ( 0.000 1.527 0.000) 1.527 4.725 ( 0.000 3.352 0.000) 3.352 4.804 ( -0.000 -10.155 -0.000) 10.155 5.240 ( -0.000 -11.480 -0.000) 11.480 5.265 ( -0.000 -9.812 -0.000) 9.812 5.632 ( 0.000 10.229 0.000) 10.229 5.661 ( -0.000 -5.904 -0.000) 5.904 5.781 ( 0.000 2.010 0.000) 2.010 6.245 ( 0.000 15.666 0.000) 15.666 6.483 ( -0.000 -0.363 -0.000) 0.363 6.710 ( -0.000 -8.752 -0.000) 8.752 6.817 ( -0.000 -1.066 -0.000) 1.066 7.179 ( 0.000 2.838 0.000) 2.838 7.264 ( 0.000 3.366 0.000) 3.366 7.509 ( -0.000 -18.491 -0.000) 18.491 7.761 ( -0.000 -2.933 -0.000) 2.933 8.016 ( 0.000 6.961 0.000) 6.961 8.169 ( -0.000 -5.377 -0.000) 5.377 8.503 ( -0.000 -0.916 -0.000) 0.916 8.613 ( 0.000 6.312 0.000) 6.312 8.799 ( 0.000 4.725 0.000) 4.725 8.902 ( -0.000 -4.631 -0.000) 4.631 9.076 ( 0.000 4.800 0.000) 4.800 9.663 ( 0.000 0.965 0.000) 0.965 10.703 ( -0.000 -3.089 -0.000) 3.089 10.929 ( -0.000 -1.178 -0.000) 1.178 13.068 ( 0.000 5.251 0.000) 5.251 13.580 ( -0.000 -2.987 -0.000) 2.987 13.887 ( -0.000 -4.303 -0.000) 4.303 14.163 ( 0.000 3.496 0.000) 3.496 14.271 ( 0.000 2.389 0.000) 2.389 14.459 ( 0.000 0.680 0.000) 0.680 14.524 ( -0.000 -1.683 -0.000) 1.683 14.803 ( -0.000 -5.705 -0.000) 5.705 15.133 ( -0.000 -0.846 -0.000) 0.846 16.380 ( -0.000 -0.693 -0.000) 0.693 16.572 ( 0.000 0.642 0.000) 0.642 16.647 ( 0.000 1.027 0.000) 1.027 17.945 ( -0.000 -1.817 -0.000) 1.817 18.660 ( -0.000 -5.483 -0.000) 5.483 18.702 ( 0.000 3.380 0.000) 3.380 18.895 ( 0.000 1.598 0.000) 1.598 18.940 ( 0.000 0.160 0.000) 0.160 19.501 ( 0.000 6.116 0.000) 6.116 19.631 ( 0.000 0.661 0.000) 0.661 19.931 ( 0.000 7.455 0.000) 7.455 21.043 ( 0.000 1.344 0.000) 1.344 21.537 ( -0.000 -6.435 -0.000) 6.435 22.320 ( 0.000 5.327 0.000) 5.327 22.406 ( -0.000 -3.616 -0.000) 3.616 23.300 ( -0.000 -3.366 -0.000) 3.366 23.812 ( -0.000 -0.669 -0.000) 0.669 23.836 ( -0.000 -1.929 -0.000) 1.929 24.610 ( -0.000 -2.085 -0.000) 2.085 ======================= Grid point 16 (11/128) ======================= q-point: ( 0.29 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.987 ( 20.008 -0.000 11.472) 23.064 1.071 ( 22.069 -0.000 8.366) 23.602 1.594 ( -36.242 0.000 4.957) 36.579 2.112 ( -6.256 0.000 -0.230) 6.260 2.353 ( 7.899 -0.000 -7.340) 10.783 2.387 ( 33.699 -0.000 13.476) 36.293 2.661 ( -6.365 0.000 -1.543) 6.549 2.846 ( -3.318 0.000 -2.037) 3.894 2.973 ( 4.704 -0.000 -4.156) 6.276 3.103 ( -2.287 0.000 23.246) 23.359 3.230 ( -2.540 0.000 7.654) 8.065 3.272 ( 0.084 -0.000 -6.586) 6.587 3.757 ( 1.481 -0.000 -4.844) 5.066 3.972 ( 0.866 -0.000 -3.605) 3.708 4.034 ( 3.505 -0.000 -1.969) 4.020 4.152 ( -6.724 0.000 -5.173) 8.484 4.251 ( 1.905 -0.000 4.290) 4.694 4.285 ( 6.188 -0.000 4.566) 7.690 4.683 ( 2.011 -0.000 5.406) 5.768 4.941 ( 4.101 -0.000 2.273) 4.689 5.000 ( -1.137 0.000 -4.690) 4.826 5.334 ( -11.632 0.000 -6.587) 13.368 5.393 ( -12.018 0.000 -13.466) 18.049 5.599 ( 6.276 -0.000 0.576) 6.302 5.806 ( -3.265 0.000 -1.460) 3.576 6.132 ( 7.996 -0.000 4.729) 9.290 6.221 ( -7.535 0.000 -1.823) 7.753 6.368 ( -10.566 0.000 3.227) 11.048 6.707 ( 13.219 -0.000 -0.079) 13.220 6.749 ( -0.317 0.000 2.053) 2.077 7.283 ( 1.174 -0.000 -0.715) 1.375 7.310 ( 4.619 -0.000 -3.181) 5.608 7.646 ( -12.511 0.000 -3.432) 12.973 7.721 ( -2.902 0.000 4.381) 5.255 8.039 ( -4.663 0.000 -0.630) 4.705 8.076 ( 8.046 -0.000 2.200) 8.341 8.296 ( 8.766 -0.000 1.100) 8.834 8.479 ( -2.010 0.000 3.609) 4.131 8.746 ( 0.544 -0.000 -0.548) 0.772 8.926 ( -4.200 0.000 0.072) 4.201 9.084 ( 1.956 -0.000 -1.490) 2.459 9.456 ( -4.732 0.000 -6.408) 7.965 10.485 ( -2.328 0.000 2.565) 3.464 10.975 ( 1.066 -0.000 -0.822) 1.346 13.633 ( 4.246 -0.000 0.121) 4.247 13.831 ( -8.368 0.000 -2.831) 8.834 13.967 ( -1.077 0.000 -0.794) 1.339 14.137 ( 0.677 -0.000 8.802) 8.828 14.160 ( -4.659 0.000 20.755) 21.271 14.364 ( -2.898 0.000 1.221) 3.145 14.461 ( -2.308 0.000 -6.350) 6.757 14.498 ( 0.591 -0.000 1.164) 1.305 14.976 ( 3.402 -0.000 -6.671) 7.489 16.333 ( 3.243 -0.000 0.141) 3.246 16.580 ( 1.143 -0.000 -2.291) 2.560 16.616 ( -0.151 0.000 -0.686) 0.703 17.968 ( -0.708 0.000 0.823) 1.086 18.386 ( -0.367 0.000 0.626) 0.726 18.841 ( -1.312 0.000 -1.035) 1.671 18.907 ( 1.128 -0.000 -0.184) 1.143 19.148 ( -8.709 0.000 3.566) 9.410 19.623 ( 1.241 -0.000 -3.723) 3.924 19.772 ( -0.205 0.000 -4.253) 4.258 21.023 ( 0.007 -0.000 0.243) 0.243 21.364 ( 1.240 -0.000 1.178) 1.710 21.502 ( -1.683 0.000 -1.008) 1.962 21.765 ( 2.206 -0.000 0.850) 2.364 22.404 ( 2.560 -0.000 -4.231) 4.945 23.342 ( -1.001 0.000 1.273) 1.619 23.413 ( -6.188 0.000 -2.386) 6.632 23.467 ( 1.261 -0.000 -1.228) 1.760 24.330 ( 8.330 -0.000 3.103) 8.889 ======================= Grid point 17 (12/128) ======================= q-point: ( 0.43 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.171 ( -34.192 2.150 3.341) 34.422 1.361 ( 16.560 -6.787 7.382) 19.360 1.379 ( 13.575 -14.471 9.905) 22.176 2.095 ( -7.592 -6.967 -3.879) 11.010 2.295 ( -3.905 4.779 -2.382) 6.615 2.514 ( -7.603 -1.885 -11.298) 13.748 2.794 ( 12.646 1.513 9.686) 16.000 2.889 ( 3.677 1.275 0.608) 3.939 2.990 ( 13.079 -0.743 7.390) 15.041 3.197 ( -0.623 -7.745 8.516) 11.528 3.258 ( -0.525 -1.229 3.179) 3.449 3.313 ( 11.644 -0.471 -1.587) 11.761 3.828 ( 3.914 -4.136 -2.351) 6.160 3.930 ( -3.489 8.738 -3.103) 9.907 3.980 ( 5.901 -0.392 -1.139) 6.023 4.117 ( -2.534 -6.749 -3.038) 7.823 4.343 ( 5.585 0.271 5.342) 7.733 4.417 ( 2.391 -9.279 2.039) 9.797 4.715 ( -0.680 -0.256 5.338) 5.388 4.866 ( 0.837 13.135 -0.577) 13.175 4.932 ( 0.802 8.510 -7.322) 11.255 5.112 ( -10.700 3.361 -3.790) 11.838 5.268 ( -16.195 -1.040 -10.521) 19.341 5.420 ( -1.948 13.830 0.298) 13.970 5.938 ( 1.407 -6.121 2.974) 6.949 6.123 ( -7.703 0.714 -1.032) 7.804 6.237 ( -6.430 3.720 3.868) 8.375 6.276 ( 2.382 -10.265 -0.687) 10.560 6.713 ( 8.033 6.129 -1.140) 10.168 6.863 ( 11.133 1.005 0.448) 11.187 7.207 ( 3.405 5.685 -3.417) 7.456 7.395 ( -1.579 -2.662 -0.702) 3.174 7.521 ( -11.248 -2.324 -0.424) 11.494 7.653 ( -3.844 6.311 1.894) 7.628 7.985 ( 1.685 0.916 0.000) 1.917 8.186 ( 2.058 -2.699 3.159) 4.637 8.418 ( 6.916 -2.497 3.012) 7.946 8.490 ( 3.894 -1.610 1.685) 4.538 8.806 ( -4.390 -6.802 -0.792) 8.134 8.868 ( -4.668 0.266 -0.821) 4.747 9.101 ( 2.372 -0.472 -0.573) 2.486 9.418 ( -4.490 -3.758 -5.543) 8.063 10.484 ( -1.634 -1.783 1.786) 3.006 10.974 ( 0.699 1.187 -0.647) 1.522 13.600 ( 1.079 8.803 3.132) 9.406 13.688 ( -2.550 5.129 -1.891) 6.032 13.930 ( -0.477 2.943 -0.569) 3.036 14.138 ( -0.602 -1.485 9.202) 9.341 14.290 ( -1.689 -4.550 0.488) 4.878 14.371 ( -4.013 -6.124 8.454) 11.183 14.417 ( -0.879 -0.274 -6.984) 7.045 14.520 ( -0.051 -1.394 0.957) 1.691 14.993 ( 2.036 -0.531 -4.554) 5.017 16.358 ( 2.598 0.789 0.289) 2.730 16.591 ( 0.825 -0.525 -1.530) 1.816 16.615 ( 0.036 -0.452 -0.260) 0.522 17.960 ( -1.355 0.400 0.688) 1.571 18.376 ( 1.433 1.010 0.379) 1.793 18.826 ( -1.370 -0.214 -0.969) 1.692 18.919 ( 0.939 -0.236 -0.230) 0.995 19.086 ( -7.816 -1.521 2.575) 8.369 19.624 ( 0.941 0.085 -2.754) 2.912 19.747 ( -0.026 1.540 -3.117) 3.477 21.017 ( 5.289 14.601 3.645) 15.951 21.049 ( 4.846 13.315 -0.281) 14.172 21.500 ( -4.202 2.889 -1.077) 5.212 21.965 ( -1.309 -14.361 0.313) 14.424 22.447 ( 1.528 -2.929 -2.184) 3.961 23.247 ( -3.285 4.621 -0.254) 5.675 23.457 ( -0.869 -5.963 0.636) 6.059 23.559 ( -2.500 -10.646 -3.004) 11.340 24.418 ( 6.212 -0.444 2.299) 6.639 ======================= Grid point 18 (13/128) ======================= q-point: ( 0.57 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.780 ( -28.760 2.464 1.728) 28.917 1.657 ( 11.349 -8.428 5.839) 15.295 1.783 ( 9.806 -15.744 5.158) 19.252 2.017 ( -1.296 14.505 -2.991) 14.866 2.212 ( -11.783 -11.834 -3.213) 17.006 2.455 ( -6.601 -4.968 -7.720) 11.307 2.838 ( -2.002 1.843 -0.159) 2.726 2.931 ( 10.934 1.041 12.895) 16.939 3.149 ( 3.543 -2.248 -0.113) 4.198 3.216 ( -0.397 3.072 -8.012) 8.590 3.386 ( 2.305 -10.687 4.420) 11.793 3.469 ( 8.216 -1.826 0.114) 8.417 3.815 ( 2.304 1.440 3.509) 4.438 3.889 ( 1.113 -1.222 -1.267) 2.082 4.106 ( 0.506 -1.828 1.165) 2.226 4.222 ( 8.359 -5.083 -0.064) 9.783 4.367 ( 1.350 24.963 -2.697) 25.145 4.484 ( 4.323 -0.716 3.112) 5.375 4.657 ( 0.833 -7.046 -1.316) 7.217 4.725 ( -2.932 -0.577 6.045) 6.744 4.783 ( 1.208 9.005 -5.604) 10.675 4.974 ( -10.240 4.138 1.954) 11.216 5.010 ( -11.103 4.413 -8.101) 14.436 5.313 ( -3.016 -1.358 -1.217) 3.524 5.968 ( -1.054 1.641 2.891) 3.487 6.038 ( -5.030 1.783 0.009) 5.337 6.118 ( -3.205 2.814 0.919) 4.363 6.517 ( 1.235 -12.798 -1.596) 12.956 6.669 ( 3.681 4.991 -0.994) 6.281 6.965 ( 12.304 1.515 -1.756) 12.521 7.160 ( 0.742 4.387 -0.569) 4.485 7.337 ( -3.386 4.266 1.798) 5.736 7.480 ( -4.765 7.468 -2.029) 9.088 7.512 ( -3.934 -4.784 1.243) 6.317 8.046 ( 6.898 -1.414 -0.149) 7.043 8.199 ( -5.948 -1.343 2.347) 6.534 8.524 ( 7.234 0.895 5.086) 8.888 8.593 ( 5.873 -2.445 -0.231) 6.365 8.787 ( -3.946 -0.617 -2.199) 4.560 8.857 ( -7.136 -4.969 -1.733) 8.866 9.150 ( 1.800 -1.964 -0.000) 2.664 9.453 ( -2.362 -7.398 -2.317) 8.104 10.518 ( -0.360 -3.387 0.936) 3.533 10.950 ( 0.061 1.973 -0.476) 2.031 13.460 ( -0.188 9.969 2.498) 10.279 13.596 ( -0.478 4.358 -1.641) 4.681 13.873 ( -0.535 3.186 -0.090) 3.232 14.196 ( 0.635 -2.144 6.437) 6.815 14.279 ( -2.097 -0.617 -6.137) 6.515 14.424 ( 1.146 -2.349 -2.805) 3.834 14.487 ( -2.433 -7.750 5.964) 10.077 14.535 ( -0.229 -0.319 0.376) 0.544 15.014 ( 0.661 -1.846 -1.959) 2.772 16.368 ( 1.519 0.828 0.544) 1.813 16.594 ( 0.053 0.043 -0.955) 0.958 16.635 ( 0.775 -1.264 0.006) 1.482 17.931 ( -1.810 0.990 0.430) 2.108 18.410 ( 4.093 -1.679 0.208) 4.429 18.808 ( -2.084 0.040 -0.910) 2.275 18.931 ( 0.663 -0.280 -0.383) 0.816 19.031 ( -6.112 0.150 1.726) 6.353 19.623 ( 0.660 0.397 -1.798) 1.957 19.709 ( 0.021 2.327 -1.545) 2.793 20.723 ( 7.186 25.291 2.745) 26.435 21.058 ( 0.094 -1.568 -0.009) 1.571 21.404 ( -2.601 2.737 -0.670) 3.835 22.134 ( -0.683 -9.281 0.145) 9.308 22.487 ( 0.729 -0.588 -0.628) 1.128 23.175 ( -1.706 0.694 -0.169) 1.849 23.562 ( 2.301 -6.253 2.172) 7.008 23.670 ( -5.236 -9.565 -3.779) 11.540 24.490 ( 3.808 -1.207 1.425) 4.241 ======================= Grid point 19 (14/128) ======================= q-point: (-0.29 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.575 ( 0.000 2.883 0.000) 2.883 1.687 ( 0.000 22.892 0.000) 22.892 1.874 ( -0.000 -10.330 -0.000) 10.330 2.091 ( -0.000 -14.528 -0.000) 14.528 2.329 ( -0.000 -10.293 -0.000) 10.293 2.491 ( -0.000 -5.204 -0.000) 5.204 2.810 ( 0.000 0.436 0.000) 0.436 2.982 ( 0.000 5.165 0.000) 5.165 3.162 ( -0.000 -3.326 -0.000) 3.326 3.165 ( 0.000 5.074 0.000) 5.074 3.534 ( -0.000 -2.928 -0.000) 2.928 3.538 ( 0.000 5.376 0.000) 5.376 3.770 ( 0.000 25.249 0.000) 25.249 3.873 ( 0.000 2.981 0.000) 2.981 3.914 ( -0.000 -2.922 -0.000) 2.922 4.125 ( -0.000 -0.110 -0.000) 0.110 4.314 ( -0.000 -0.690 -0.000) 0.690 4.527 ( 0.000 5.608 0.000) 5.608 4.645 ( 0.000 5.048 0.000) 5.048 4.778 ( -0.000 -0.303 -0.000) 0.303 4.804 ( -0.000 -3.348 -0.000) 3.348 4.915 ( -0.000 -10.599 -0.000) 10.599 4.916 ( -0.000 -3.208 -0.000) 3.208 5.362 ( -0.000 -7.754 -0.000) 7.754 5.897 ( 0.000 6.429 0.000) 6.429 5.954 ( 0.000 5.478 0.000) 5.478 6.145 ( -0.000 -7.956 -0.000) 7.956 6.537 ( 0.000 3.861 0.000) 3.861 6.762 ( -0.000 -7.086 -0.000) 7.086 7.021 ( 0.000 14.114 0.000) 14.114 7.048 ( -0.000 -4.913 -0.000) 4.913 7.282 ( 0.000 2.687 0.000) 2.687 7.333 ( 0.000 3.807 0.000) 3.807 7.592 ( -0.000 -6.778 -0.000) 6.778 8.116 ( 0.000 1.352 0.000) 1.352 8.158 ( -0.000 -0.892 -0.000) 0.892 8.521 ( 0.000 3.989 0.000) 3.989 8.704 ( -0.000 -6.643 -0.000) 6.643 8.747 ( 0.000 2.625 0.000) 2.625 8.868 ( -0.000 -2.152 -0.000) 2.152 9.170 ( 0.000 0.503 0.000) 0.503 9.567 ( -0.000 -7.735 -0.000) 7.735 10.580 ( -0.000 -4.316 -0.000) 4.316 10.921 ( 0.000 1.254 0.000) 1.254 13.306 ( 0.000 9.739 0.000) 9.739 13.545 ( 0.000 1.481 0.000) 1.481 13.834 ( 0.000 1.191 0.000) 1.191 14.223 ( 0.000 0.439 0.000) 0.439 14.277 ( -0.000 -1.761 -0.000) 1.761 14.467 ( -0.000 -2.125 -0.000) 2.125 14.514 ( 0.000 1.771 0.000) 1.771 14.602 ( -0.000 -7.001 -0.000) 7.001 15.055 ( -0.000 -3.294 -0.000) 3.294 16.369 ( 0.000 0.188 0.000) 0.188 16.590 ( 0.000 0.348 0.000) 0.348 16.657 ( -0.000 -0.650 -0.000) 0.650 17.910 ( 0.000 0.055 0.000) 0.055 18.495 ( -0.000 -4.561 -0.000) 4.561 18.777 ( 0.000 1.315 0.000) 1.315 18.939 ( -0.000 -0.239 -0.000) 0.239 18.973 ( 0.000 2.549 0.000) 2.549 19.612 ( 0.000 1.276 0.000) 1.276 19.672 ( 0.000 2.049 0.000) 2.049 20.395 ( 0.000 21.797 0.000) 21.797 21.074 ( -0.000 -0.169 -0.000) 0.169 21.383 ( -0.000 -1.845 -0.000) 1.845 22.252 ( -0.000 -6.554 -0.000) 6.554 22.468 ( 0.000 3.152 0.000) 3.152 23.188 ( -0.000 -2.911 -0.000) 2.911 23.707 ( -0.000 -6.584 -0.000) 6.584 23.723 ( -0.000 -5.393 -0.000) 5.393 24.540 ( -0.000 -2.049 -0.000) 2.049 ======================= Grid point 24 (15/128) ======================= q-point: ( 0.43 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.824 ( -31.070 0.000 2.996) 31.214 1.449 ( 16.699 -0.000 7.939) 18.490 1.527 ( 13.376 -0.000 6.865) 15.035 1.895 ( -11.907 0.000 -3.880) 12.523 2.335 ( -0.729 0.000 -1.908) 2.043 2.382 ( -7.513 0.000 -7.338) 10.502 2.842 ( 5.046 -0.000 0.030) 5.046 2.981 ( -5.333 0.000 0.788) 5.391 3.009 ( 0.648 -0.000 -1.196) 1.360 3.249 ( 6.714 -0.000 14.188) 15.697 3.284 ( 1.780 -0.000 3.821) 4.215 3.495 ( 21.587 -0.000 1.566) 21.644 3.825 ( 7.038 -0.000 -4.447) 8.325 3.944 ( -3.107 0.000 -0.494) 3.146 3.996 ( -0.270 0.000 -6.600) 6.606 4.072 ( -1.905 0.000 0.337) 1.935 4.278 ( -0.382 0.000 1.690) 1.733 4.459 ( 6.124 -0.000 4.247) 7.452 4.714 ( -4.714 0.000 7.369) 8.748 4.950 ( -2.152 0.000 -2.170) 3.056 4.991 ( -5.324 0.000 8.500) 10.030 5.020 ( -5.119 0.000 -19.768) 20.420 5.067 ( -7.200 0.000 -4.821) 8.665 5.702 ( 1.498 -0.000 1.127) 1.874 5.737 ( -1.319 0.000 -1.254) 1.819 6.077 ( -2.851 0.000 -1.123) 3.064 6.215 ( -4.394 0.000 1.759) 4.733 6.222 ( 0.258 -0.000 2.665) 2.677 6.835 ( 3.938 -0.000 0.982) 4.058 7.010 ( 14.306 -0.000 -2.386) 14.503 7.274 ( -0.569 0.000 -1.529) 1.631 7.343 ( -7.449 0.000 6.898) 10.152 7.376 ( -3.928 0.000 -7.575) 8.533 7.678 ( -1.938 0.000 0.912) 2.142 7.974 ( -1.727 0.000 1.074) 2.033 8.215 ( 2.526 -0.000 0.975) 2.708 8.474 ( 5.652 -0.000 1.343) 5.809 8.500 ( 2.312 -0.000 2.848) 3.668 8.730 ( -1.197 0.000 -0.440) 1.275 8.820 ( -4.302 0.000 -1.102) 4.440 9.109 ( 0.835 -0.000 -0.563) 1.007 9.335 ( -2.766 0.000 -3.476) 4.442 10.459 ( -0.995 0.000 1.057) 1.451 10.990 ( 0.521 -0.000 -0.277) 0.590 13.676 ( -4.085 0.000 -0.867) 4.176 13.703 ( 1.978 -0.000 -0.244) 1.993 13.945 ( -0.654 0.000 -0.109) 0.663 14.183 ( -1.745 0.000 8.543) 8.720 14.217 ( 1.499 -0.000 8.203) 8.338 14.324 ( -0.485 0.000 -2.044) 2.101 14.366 ( -2.167 0.000 -7.075) 7.399 14.514 ( 0.252 -0.000 0.561) 0.615 14.998 ( 1.198 -0.000 -2.477) 2.752 16.388 ( 1.514 -0.000 0.109) 1.518 16.591 ( 0.616 -0.000 -0.683) 0.920 16.608 ( -0.285 0.000 -0.222) 0.361 17.960 ( -0.329 0.000 0.386) 0.507 18.384 ( -0.116 0.000 0.301) 0.322 18.813 ( -0.631 0.000 -0.508) 0.810 18.925 ( 0.517 -0.000 -0.098) 0.526 19.021 ( -3.749 0.000 1.103) 3.908 19.626 ( 0.435 -0.000 -1.265) 1.337 19.753 ( -0.008 0.000 -1.422) 1.422 21.024 ( -0.013 0.000 0.104) 0.105 21.387 ( 0.448 -0.000 0.463) 0.644 21.473 ( -0.639 0.000 -0.370) 0.738 21.803 ( 0.903 -0.000 0.308) 0.954 22.426 ( 0.909 -0.000 -1.204) 1.509 23.313 ( -2.193 0.000 -0.858) 2.355 23.331 ( -0.443 0.000 0.443) 0.626 23.482 ( 0.551 -0.000 -0.423) 0.695 24.469 ( 3.162 -0.000 1.152) 3.365 ======================= Grid point 25 (16/128) ======================= q-point: (-0.43 -0.57 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.632 ( 0.000 1.181 0.000) 1.181 1.644 ( -0.000 -4.016 -0.000) 4.016 1.664 ( -0.000 -9.620 -0.000) 9.620 1.895 ( -0.000 -11.921 -0.000) 11.921 2.247 ( 0.000 10.932 0.000) 10.932 2.336 ( -0.000 -2.789 -0.000) 2.789 2.872 ( 0.000 3.781 0.000) 3.781 2.964 ( -0.000 -7.626 -0.000) 7.626 3.064 ( -0.000 -3.507 -0.000) 3.507 3.284 ( 0.000 2.160 0.000) 2.160 3.300 ( -0.000 -1.701 -0.000) 1.701 3.570 ( 0.000 6.278 0.000) 6.278 3.853 ( 0.000 1.258 0.000) 1.258 3.897 ( 0.000 1.086 0.000) 1.086 4.065 ( -0.000 -1.972 -0.000) 1.972 4.136 ( -0.000 -13.382 -0.000) 13.382 4.370 ( -0.000 -10.037 -0.000) 10.037 4.507 ( -0.000 -0.655 -0.000) 0.655 4.691 ( -0.000 -0.769 -0.000) 0.769 4.819 ( 0.000 14.593 0.000) 14.593 4.910 ( 0.000 4.037 0.000) 4.037 4.969 ( 0.000 3.001 0.000) 3.001 5.008 ( 0.000 4.329 0.000) 4.329 5.393 ( 0.000 15.708 0.000) 15.708 5.969 ( -0.000 -8.499 -0.000) 8.499 6.023 ( 0.000 4.125 0.000) 4.125 6.162 ( 0.000 3.791 0.000) 3.791 6.311 ( -0.000 -11.413 -0.000) 11.413 6.798 ( 0.000 7.016 0.000) 7.016 7.091 ( 0.000 2.234 0.000) 2.234 7.186 ( 0.000 3.295 0.000) 3.295 7.352 ( 0.000 1.706 0.000) 1.706 7.378 ( -0.000 -7.130 -0.000) 7.130 7.607 ( 0.000 7.535 0.000) 7.535 8.013 ( -0.000 -5.362 -0.000) 5.362 8.195 ( 0.000 3.100 0.000) 3.100 8.537 ( -0.000 -3.203 -0.000) 3.203 8.623 ( -0.000 -11.043 -0.000) 11.043 8.680 ( 0.000 4.461 0.000) 4.461 8.795 ( 0.000 0.175 0.000) 0.175 9.129 ( -0.000 -1.870 -0.000) 1.870 9.343 ( -0.000 -3.840 -0.000) 3.840 10.472 ( -0.000 -2.104 -0.000) 2.104 10.980 ( 0.000 1.528 0.000) 1.528 13.597 ( 0.000 6.748 0.000) 6.748 13.668 ( 0.000 4.923 0.000) 4.923 13.920 ( 0.000 2.651 0.000) 2.651 14.206 ( -0.000 -1.637 -0.000) 1.637 14.229 ( 0.000 0.228 0.000) 0.228 14.366 ( -0.000 -4.296 -0.000) 4.296 14.380 ( -0.000 -5.251 -0.000) 5.251 14.524 ( -0.000 -0.872 -0.000) 0.872 15.001 ( -0.000 -0.208 -0.000) 0.208 16.390 ( 0.000 0.768 0.000) 0.768 16.593 ( -0.000 -0.019 -0.000) 0.019 16.617 ( -0.000 -1.301 -0.000) 1.301 17.946 ( 0.000 1.482 0.000) 1.482 18.397 ( -0.000 -1.657 -0.000) 1.657 18.804 ( 0.000 0.586 0.000) 0.586 18.929 ( -0.000 -0.254 -0.000) 0.254 19.006 ( -0.000 -0.171 -0.000) 0.171 19.626 ( 0.000 0.054 0.000) 0.054 19.738 ( 0.000 1.564 0.000) 1.564 21.034 ( -0.000 -1.276 -0.000) 1.276 21.155 ( 0.000 23.439 0.000) 23.439 21.438 ( 0.000 3.348 0.000) 3.348 21.956 ( -0.000 -12.786 -0.000) 12.786 22.457 ( -0.000 -2.907 -0.000) 2.907 23.209 ( 0.000 5.016 0.000) 5.016 23.451 ( -0.000 -9.043 -0.000) 9.043 23.527 ( -0.000 -5.115 -0.000) 5.115 24.494 ( -0.000 -0.842 -0.000) 0.842 ======================= Grid point 51 (17/128) ======================= q-point: ( 0.00 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.592 ( 7.345 -0.000 28.926) 29.844 0.594 ( 2.010 -0.000 29.082) 29.152 1.211 ( -7.276 0.000 56.979) 57.442 2.247 ( 0.042 -0.000 10.492) 10.492 2.430 ( 5.389 -0.000 11.311) 12.529 2.621 ( 4.851 -0.000 13.035) 13.908 2.745 ( -2.549 0.000 12.689) 12.943 2.851 ( -2.750 0.000 -0.748) 2.850 3.278 ( -9.075 0.000 -1.673) 9.228 3.415 ( 5.280 -0.000 2.074) 5.673 3.516 ( 0.989 -0.000 -1.403) 1.717 3.711 ( -2.545 0.000 -11.419) 11.700 3.792 ( -8.747 0.000 -3.256) 9.333 3.886 ( -0.465 0.000 9.653) 9.664 3.947 ( 1.347 -0.000 -2.643) 2.967 3.987 ( 5.450 -0.000 -2.042) 5.820 4.136 ( 2.351 -0.000 3.642) 4.335 4.411 ( 1.019 -0.000 -10.069) 10.121 4.842 ( 1.518 -0.000 10.532) 10.640 5.104 ( -6.182 0.000 -14.390) 15.662 5.181 ( 14.106 -0.000 5.174) 15.025 5.244 ( -8.993 0.000 3.850) 9.782 5.335 ( 14.982 -0.000 -0.475) 14.990 5.523 ( 0.711 -0.000 -11.267) 11.290 5.538 ( -8.480 0.000 0.124) 8.481 5.765 ( -3.235 0.000 1.286) 3.482 5.955 ( 3.299 -0.000 7.430) 8.130 6.399 ( -0.625 0.000 1.846) 1.949 6.982 ( -2.327 0.000 10.622) 10.874 7.079 ( -0.357 0.000 2.997) 3.018 7.090 ( 2.844 -0.000 -0.023) 2.844 7.507 ( -7.789 0.000 -4.439) 8.966 7.689 ( 6.630 -0.000 -9.384) 11.490 7.863 ( -9.423 0.000 8.070) 12.406 8.001 ( 0.145 -0.000 -2.453) 2.458 8.143 ( -5.700 0.000 -8.666) 10.373 8.218 ( -1.235 0.000 -3.608) 3.813 8.415 ( 8.705 -0.000 1.981) 8.928 8.650 ( 0.921 -0.000 -1.190) 1.504 8.964 ( 1.226 -0.000 1.012) 1.589 9.098 ( -2.873 0.000 8.962) 9.412 9.517 ( -1.064 0.000 -10.131) 10.187 10.516 ( 2.540 -0.000 -2.224) 3.376 10.879 ( 1.149 -0.000 -7.174) 7.266 13.293 ( 36.233 -0.000 0.560) 36.238 13.468 ( 1.940 -0.000 -3.184) 3.729 13.929 ( 1.504 -0.000 -4.344) 4.597 14.101 ( 2.693 -0.000 1.721) 3.196 14.185 ( 1.079 -0.000 7.542) 7.618 14.459 ( -0.708 0.000 -0.958) 1.191 14.546 ( -2.751 0.000 -0.668) 2.831 14.691 ( 6.637 -0.000 -12.113) 13.812 15.245 ( -3.369 0.000 11.197) 11.693 16.228 ( 0.272 -0.000 -1.306) 1.334 16.671 ( -1.977 0.000 4.664) 5.066 17.703 ( -38.482 0.000 3.834) 38.672 17.951 ( 1.364 -0.000 -2.950) 3.250 18.385 ( 0.887 -0.000 -0.986) 1.326 18.658 ( 22.809 -0.000 -1.230) 22.842 18.872 ( -0.013 0.000 -1.216) 1.216 18.887 ( -0.793 0.000 1.063) 1.326 19.359 ( -2.061 0.000 -0.805) 2.213 19.923 ( 4.485 -0.000 8.130) 9.285 21.055 ( -0.777 0.000 3.222) 3.314 21.575 ( -1.540 0.000 -1.069) 1.875 21.621 ( -5.182 0.000 -0.204) 5.186 21.672 ( 1.644 -0.000 0.414) 1.695 22.266 ( -13.167 0.000 -1.723) 13.279 23.364 ( 1.491 -0.000 0.361) 1.534 23.451 ( -1.862 0.000 1.025) 2.125 23.747 ( -9.253 0.000 -4.947) 10.493 23.894 ( 10.820 -0.000 0.530) 10.833 ======================= Grid point 52 (18/128) ======================= q-point: ( 0.14 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.833 ( 14.411 -3.937 25.932) 29.928 0.989 ( 2.512 -23.346 23.325) 33.096 1.587 ( 11.284 -23.256 37.825) 45.814 2.278 ( -1.698 4.065 10.539) 11.423 2.425 ( -5.167 2.650 12.917) 14.163 2.611 ( -5.257 -1.171 13.795) 14.809 2.785 ( 2.086 2.320 9.863) 10.345 2.851 ( -0.512 -2.453 3.892) 4.629 3.119 ( -10.927 3.138 -4.106) 12.087 3.353 ( -6.047 3.777 -4.511) 8.437 3.463 ( -6.740 5.297 4.749) 9.800 3.612 ( -2.359 4.371 3.985) 6.368 3.736 ( 2.931 -3.424 -2.542) 5.175 3.835 ( -2.637 -0.758 3.860) 4.736 3.971 ( -0.615 4.687 -0.409) 4.745 4.119 ( 1.756 -2.917 -2.172) 4.038 4.171 ( 0.551 -7.760 -1.151) 7.864 4.492 ( -0.593 -10.056 -3.866) 10.790 4.728 ( -6.261 15.169 9.822) 19.126 4.855 ( -6.146 8.711 10.763) 15.149 4.940 ( -3.091 8.168 -3.364) 9.359 5.327 ( 0.292 8.843 -4.343) 9.856 5.461 ( 7.430 -2.683 -2.855) 8.400 5.539 ( 9.908 -2.163 -4.220) 10.984 5.719 ( 12.036 -5.109 -5.732) 14.277 5.805 ( 1.961 -4.339 2.897) 5.573 5.979 ( 2.822 1.585 3.473) 4.747 6.394 ( -2.481 -0.658 -1.923) 3.207 6.890 ( -14.233 3.631 5.277) 15.607 6.983 ( -4.451 8.649 1.984) 9.927 7.070 ( 1.142 2.919 3.238) 4.507 7.378 ( 2.461 0.281 0.791) 2.600 7.743 ( 0.269 0.710 -2.791) 2.892 7.786 ( 5.101 11.381 0.441) 12.480 7.925 ( -6.328 -0.565 -0.123) 6.354 8.150 ( 1.409 -3.146 -7.346) 8.115 8.225 ( -2.718 -2.701 -1.985) 4.316 8.488 ( 1.598 -5.070 -0.852) 5.384 8.802 ( 3.271 -9.646 -2.208) 10.422 9.010 ( -0.494 -4.733 1.143) 4.894 9.082 ( -1.755 3.021 8.611) 9.292 9.501 ( -1.666 -3.490 -11.022) 11.680 10.542 ( -0.546 -1.435 -4.832) 5.070 10.871 ( 2.198 0.320 -7.150) 7.487 13.371 ( 13.469 11.053 0.884) 17.446 13.585 ( 8.125 1.396 -6.519) 10.509 13.896 ( 0.442 3.865 -4.117) 5.664 14.178 ( 6.633 -1.174 0.951) 6.803 14.243 ( 1.386 -2.318 4.758) 5.471 14.448 ( -0.950 -0.655 -1.867) 2.195 14.473 ( -2.481 2.912 -3.634) 5.276 14.718 ( -1.087 -1.648 -7.318) 7.579 15.247 ( -7.603 -3.120 10.988) 13.722 16.240 ( 1.322 -0.637 -2.490) 2.890 16.668 ( -1.863 -0.352 4.555) 4.934 17.087 ( -33.367 11.955 26.732) 44.394 17.954 ( 2.275 0.501 -3.061) 3.847 18.390 ( -4.917 -0.276 -1.203) 5.070 18.861 ( 0.162 0.202 -1.739) 1.758 18.891 ( 0.147 -0.541 0.881) 1.044 18.946 ( 22.653 -0.117 -14.856) 27.090 19.406 ( 5.006 -2.650 -1.556) 5.874 19.992 ( -0.277 -1.805 10.528) 10.685 20.567 ( 2.637 47.506 33.009) 57.908 21.066 ( -1.069 -0.925 3.552) 3.823 21.615 ( -0.864 4.611 -0.532) 4.721 22.188 ( -6.514 -16.081 -12.164) 21.189 22.237 ( 2.711 -3.732 -2.119) 5.076 23.365 ( 0.336 2.198 1.503) 2.683 23.636 ( -8.674 -0.652 -4.254) 9.683 23.778 ( -9.362 -29.987 -16.090) 35.295 24.024 ( 10.500 -1.870 -1.101) 10.722 ======================= Grid point 53 (19/128) ======================= q-point: ( 0.29 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.132 ( 15.306 -4.771 23.348) 28.322 1.435 ( 5.180 -20.357 17.123) 27.101 2.024 ( 1.319 0.461 4.608) 4.815 2.187 ( -9.310 7.567 19.223) 22.660 2.372 ( -2.348 -10.474 9.835) 14.558 2.638 ( -2.841 -1.376 -1.531) 3.508 2.824 ( 0.585 0.347 14.271) 14.287 2.906 ( -3.929 -5.976 8.944) 11.452 3.075 ( -2.393 -8.516 1.904) 9.049 3.200 ( -7.036 1.920 -8.588) 11.267 3.327 ( -3.724 5.056 11.376) 12.994 3.608 ( -0.502 -2.402 3.632) 4.383 3.803 ( -2.382 4.732 3.135) 6.156 3.820 ( 4.212 -0.677 1.780) 4.622 3.892 ( -4.809 -1.836 8.619) 10.039 4.147 ( 3.499 4.524 -0.215) 5.723 4.295 ( -2.430 -8.770 -4.914) 10.343 4.525 ( -1.853 0.462 5.300) 5.634 4.627 ( -3.665 10.114 -5.728) 12.188 4.675 ( 2.060 -4.441 -0.320) 4.906 4.841 ( -2.618 5.079 9.617) 11.187 5.168 ( -2.052 9.630 -0.871) 9.885 5.397 ( -2.419 7.737 3.201) 8.715 5.661 ( -6.184 -2.607 0.852) 6.765 5.810 ( 17.985 8.925 2.778) 20.269 5.945 ( 15.728 -4.106 -3.192) 16.566 6.121 ( 0.888 -12.152 -4.329) 12.931 6.389 ( -2.099 -6.023 -4.960) 8.079 6.697 ( -8.114 4.853 0.146) 9.455 6.795 ( -7.811 7.472 0.937) 10.850 7.059 ( -2.161 -0.609 0.932) 2.430 7.425 ( 3.072 -1.690 -6.227) 7.146 7.540 ( -0.825 16.895 0.932) 16.941 7.750 ( 2.477 3.313 0.434) 4.160 7.902 ( -5.100 -2.421 -0.343) 5.656 8.194 ( 8.214 0.282 -2.680) 8.645 8.280 ( 0.160 -4.963 2.666) 5.636 8.573 ( -3.625 -6.394 -1.026) 7.421 8.922 ( 2.341 -2.397 -3.001) 4.498 9.015 ( 0.461 4.959 5.690) 7.562 9.103 ( -3.872 -7.152 2.161) 8.415 9.514 ( -1.337 -4.317 -9.339) 10.375 10.523 ( -0.667 0.267 -5.814) 5.858 10.871 ( 2.318 0.253 -6.588) 6.988 13.346 ( 7.990 7.536 1.676) 11.110 13.577 ( 1.900 2.990 -3.002) 4.644 13.830 ( 1.320 3.313 -3.131) 4.745 14.223 ( 2.556 1.462 -3.901) 4.887 14.295 ( 0.818 -1.307 0.391) 1.591 14.398 ( -2.860 0.948 -4.244) 5.205 14.475 ( 1.810 -2.704 0.028) 3.254 14.684 ( -2.313 1.455 -0.879) 2.870 15.249 ( -7.488 -2.977 12.625) 14.978 16.253 ( 1.523 -0.244 -2.908) 3.292 16.669 ( -1.672 -0.421 4.820) 5.119 16.824 ( -13.501 2.699 19.176) 23.606 17.968 ( 3.442 0.372 -3.362) 4.826 18.316 ( -5.181 1.677 -0.258) 5.452 18.853 ( -0.455 -0.214 -1.744) 1.815 18.906 ( -0.136 -1.013 0.732) 1.257 19.067 ( 12.549 1.622 -14.644) 19.353 19.499 ( 3.601 -3.608 -1.567) 5.333 20.001 ( -11.006 -1.004 15.874) 19.342 20.252 ( 12.233 18.805 20.491) 30.384 21.090 ( -0.795 -1.852 3.801) 4.302 21.515 ( -1.253 5.954 -0.777) 6.134 22.220 ( -4.245 -4.316 -5.827) 8.403 22.340 ( 4.460 -3.028 -4.667) 7.130 23.313 ( -1.898 3.586 1.285) 4.256 23.574 ( -4.241 -1.748 -2.305) 5.134 23.969 ( -8.508 -14.516 -11.090) 20.151 24.147 ( 7.953 -1.637 -2.986) 8.651 ======================= Grid point 54 (20/128) ======================= q-point: ( 0.43 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.435 ( 15.523 -3.984 17.302) 23.584 1.729 ( -11.499 -6.412 6.642) 14.746 1.877 ( -3.592 14.289 10.201) 17.920 1.995 ( -3.494 -2.197 11.259) 11.991 2.497 ( 1.144 -0.007 -1.912) 2.228 2.629 ( -3.930 -0.273 -7.461) 8.437 2.831 ( -4.541 -4.709 9.264) 11.341 2.993 ( 1.876 2.435 10.381) 10.827 3.061 ( -6.433 2.847 7.373) 10.190 3.215 ( -0.183 -9.475 -0.729) 9.505 3.391 ( -2.744 -1.090 7.356) 7.926 3.653 ( -1.846 -2.799 10.203) 10.740 3.773 ( 1.395 -1.463 3.776) 4.283 3.854 ( 0.280 3.008 10.137) 10.578 3.914 ( 3.158 1.231 3.951) 5.206 4.091 ( 0.493 -1.442 -5.108) 5.331 4.189 ( -7.421 11.763 -5.263) 14.871 4.493 ( -4.058 -0.564 3.453) 5.358 4.670 ( 6.293 -10.041 2.284) 12.068 4.756 ( -3.008 5.509 8.497) 10.564 4.785 ( -0.216 -8.156 -0.161) 8.161 5.018 ( -0.517 5.517 -1.935) 5.869 5.242 ( -4.292 9.456 7.746) 12.955 5.583 ( -4.870 -0.548 3.137) 5.818 5.934 ( 11.892 1.435 0.854) 12.009 6.097 ( 4.906 1.267 -7.834) 9.329 6.205 ( 2.426 -3.176 3.511) 5.319 6.514 ( -3.978 -2.010 -5.258) 6.893 6.579 ( -6.158 -3.278 -6.481) 9.521 6.699 ( 3.803 -7.194 -0.826) 8.179 7.042 ( -3.923 -0.859 -0.764) 4.088 7.252 ( -1.356 17.583 1.587) 17.707 7.444 ( 1.342 -0.637 -10.558) 10.662 7.749 ( 1.034 0.234 5.671) 5.769 7.890 ( -0.810 -0.583 -1.287) 1.629 8.280 ( 8.482 0.366 -2.037) 8.731 8.365 ( 1.936 -2.416 4.739) 5.660 8.584 ( -6.631 -1.675 2.214) 7.189 8.897 ( -2.342 1.685 -1.491) 3.248 9.016 ( 3.425 0.346 1.280) 3.673 9.131 ( -3.772 -0.948 -1.676) 4.235 9.559 ( 0.384 -4.724 -5.362) 7.156 10.502 ( 1.815 0.576 -5.932) 6.230 10.872 ( 1.452 -0.335 -6.218) 6.394 13.306 ( 2.831 5.748 -0.186) 6.410 13.535 ( -0.306 1.712 -2.666) 3.183 13.818 ( 2.048 -0.120 -1.462) 2.519 14.190 ( 1.789 2.294 -7.947) 8.463 14.275 ( -2.601 0.692 -6.768) 7.284 14.387 ( 0.503 -1.460 0.376) 1.589 14.549 ( 2.254 -2.550 1.828) 3.863 14.631 ( -0.925 3.030 2.559) 4.072 15.257 ( -5.477 -1.842 13.418) 14.609 16.265 ( 1.819 -0.122 -2.663) 3.227 16.677 ( -1.052 -0.513 5.650) 5.770 16.758 ( -6.881 -0.334 14.379) 15.944 17.991 ( 3.313 0.141 -3.421) 4.765 18.249 ( -2.806 0.896 0.196) 2.952 18.848 ( -0.300 -0.426 -1.918) 1.988 18.920 ( -0.601 -0.854 0.563) 1.187 19.096 ( 7.450 2.351 -13.430) 15.537 19.582 ( 0.725 -4.735 -0.348) 4.803 19.931 ( -13.192 -1.542 16.732) 21.363 20.209 ( 7.837 10.261 12.556) 18.010 21.123 ( -0.937 -1.449 4.853) 5.151 21.426 ( -0.761 2.689 -1.358) 3.107 22.219 ( -0.121 -0.988 -5.994) 6.076 22.401 ( 2.345 -1.780 -3.431) 4.521 23.247 ( -1.844 1.827 1.025) 2.791 23.577 ( 0.473 -1.157 -0.104) 1.254 24.024 ( -8.141 -8.285 -8.375) 14.320 24.225 ( 9.166 1.946 -2.483) 9.694 ======================= Grid point 55 (21/128) ======================= q-point: (-0.43 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.401 ( -23.208 6.355 3.258) 24.282 1.592 ( -8.290 17.917 18.826) 27.279 1.795 ( 11.032 -6.255 8.995) 15.548 2.172 ( 6.983 -4.937 1.735) 8.727 2.481 ( 5.077 9.278 -1.639) 10.702 2.558 ( -2.158 -1.679 -0.316) 2.752 2.868 ( -11.206 4.666 13.708) 18.309 2.893 ( -2.794 1.622 3.658) 4.880 3.082 ( 1.098 -0.420 13.472) 13.523 3.167 ( -1.780 17.001 0.675) 17.107 3.392 ( 0.470 -8.747 6.526) 10.923 3.678 ( -4.604 7.580 8.782) 12.482 3.729 ( -5.963 -2.419 5.812) 8.672 3.776 ( 1.401 5.906 -2.528) 6.575 3.891 ( 3.604 4.559 -4.539) 7.374 4.014 ( -2.694 -1.654 0.281) 3.174 4.334 ( 4.365 -15.012 1.414) 15.698 4.490 ( -3.029 -0.813 5.172) 6.049 4.667 ( -1.955 4.695 5.522) 7.507 4.749 ( 0.812 3.338 4.249) 5.464 4.956 ( -2.473 -9.573 -1.888) 10.066 5.016 ( -1.018 -2.317 2.641) 3.658 5.154 ( 0.046 -6.041 6.234) 8.681 5.621 ( 1.421 -4.067 4.043) 5.908 5.928 ( -2.642 5.897 -0.822) 6.514 6.014 ( -7.149 2.387 -5.976) 9.619 6.345 ( 4.063 -4.863 4.018) 7.504 6.384 ( -0.334 2.706 -9.021) 9.424 6.641 ( 2.935 -3.745 1.439) 4.971 6.881 ( -4.437 9.234 4.110) 11.038 6.971 ( 3.566 -10.664 -5.575) 12.551 7.137 ( 4.581 -2.789 -0.775) 5.418 7.408 ( -1.925 0.546 -10.789) 10.973 7.774 ( -3.392 -2.471 2.883) 5.091 7.914 ( 5.263 -0.126 0.791) 5.324 8.308 ( 3.286 4.870 -0.022) 5.875 8.408 ( 2.881 1.935 1.708) 3.868 8.532 ( -3.935 -0.190 1.882) 4.366 8.860 ( -1.683 0.083 -3.019) 3.457 9.051 ( -1.984 -2.007 3.166) 4.241 9.064 ( 0.903 4.728 -1.894) 5.172 9.611 ( 1.203 -1.983 -4.399) 4.973 10.512 ( 4.898 0.520 -6.056) 7.806 10.876 ( 0.533 -1.258 -6.113) 6.264 13.220 ( -2.029 5.015 -3.349) 6.363 13.518 ( 0.055 -0.882 -3.052) 3.177 13.849 ( 0.082 -2.329 -0.514) 2.387 14.151 ( 3.256 3.478 -7.993) 9.305 14.224 ( -1.924 -0.818 -7.080) 7.382 14.424 ( 2.197 -1.267 -1.039) 2.741 14.553 ( -2.026 2.784 3.849) 5.164 14.637 ( 4.253 -0.165 1.265) 4.440 15.268 ( -3.764 -0.380 13.819) 14.328 16.276 ( 1.569 0.133 -2.842) 3.249 16.693 ( -0.868 -0.092 5.877) 5.941 16.770 ( -3.462 -3.023 16.292) 16.928 18.003 ( 0.635 0.095 -2.984) 3.052 18.245 ( 2.898 -0.443 0.016) 2.932 18.847 ( -0.392 -0.696 -2.055) 2.205 18.921 ( -1.009 -0.168 0.485) 1.132 19.078 ( 3.593 2.165 -13.594) 14.226 19.664 ( -1.373 -6.208 0.891) 6.420 19.868 ( -16.739 -4.080 12.184) 21.102 20.147 ( 2.114 8.571 14.057) 16.599 21.127 ( -1.756 1.211 5.308) 5.721 21.432 ( 0.657 -3.947 -1.255) 4.193 22.212 ( 3.339 1.902 -5.802) 6.959 22.424 ( -0.193 -1.161 -3.042) 3.261 23.239 ( 0.370 -1.355 0.817) 1.624 23.612 ( 4.260 0.128 1.332) 4.465 24.012 ( -8.398 -4.700 -7.065) 11.938 24.265 ( 11.822 6.169 -3.851) 13.879 ======================= Grid point 56 (22/128) ======================= q-point: (-0.29 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.022 ( -26.106 8.893 2.815) 27.723 1.267 ( -10.806 18.790 25.797) 33.695 1.954 ( 3.019 11.504 11.622) 16.629 2.146 ( -9.150 18.128 0.681) 20.317 2.321 ( 14.870 6.049 8.174) 18.015 2.475 ( -2.877 10.325 5.075) 11.859 2.707 ( -6.167 -4.235 6.540) 9.936 2.906 ( -3.901 -3.336 8.051) 9.548 3.073 ( 4.792 -2.329 4.572) 7.021 3.231 ( 2.611 -6.213 14.847) 16.305 3.467 ( -2.245 1.343 9.340) 9.700 3.546 ( 5.498 9.671 3.135) 11.558 3.702 ( -2.262 -2.547 -1.041) 3.562 3.798 ( 0.969 -4.240 -0.243) 4.356 3.876 ( 1.154 0.066 -3.452) 3.640 4.033 ( 1.565 -0.510 -2.178) 2.730 4.442 ( -1.634 4.351 -1.097) 4.775 4.494 ( -1.409 -2.003 8.620) 8.961 4.598 ( 0.580 5.344 3.739) 6.548 4.764 ( -1.925 -3.305 6.545) 7.581 4.993 ( -9.555 -7.779 1.702) 12.438 5.056 ( 0.224 -6.306 -6.607) 9.136 5.410 ( 3.240 -14.722 6.475) 16.406 5.688 ( -1.263 0.560 -0.564) 1.492 5.777 ( -7.155 4.611 -4.735) 9.741 5.855 ( -11.010 -0.439 -0.467) 11.029 6.267 ( -1.210 9.417 -4.546) 10.526 6.471 ( 1.847 1.501 1.456) 2.790 6.654 ( 2.985 -1.726 0.798) 3.539 6.859 ( 3.767 -4.946 8.944) 10.893 7.118 ( 4.910 -3.185 2.841) 6.505 7.272 ( -2.951 -2.679 -5.474) 6.771 7.411 ( 4.305 -11.721 -8.118) 14.893 7.779 ( -3.567 -3.583 -1.526) 5.281 7.986 ( 4.430 -0.017 2.535) 5.104 8.225 ( -2.461 3.674 1.251) 4.595 8.379 ( 4.537 5.940 -4.108) 8.528 8.523 ( 0.909 1.273 -2.113) 2.628 8.808 ( -1.199 3.986 -1.966) 4.604 8.996 ( -0.516 2.479 2.066) 3.268 9.091 ( -0.400 -1.553 5.453) 5.684 9.609 ( 0.896 1.331 -6.046) 6.256 10.544 ( 6.974 1.338 -7.073) 10.023 10.883 ( 0.140 -1.508 -6.220) 6.401 13.099 ( -4.464 4.107 -4.738) 7.697 13.531 ( 0.509 -1.093 -4.569) 4.725 13.883 ( -0.590 -2.872 -2.105) 3.610 14.104 ( 1.607 3.013 -3.743) 5.067 14.212 ( 1.366 0.510 -5.203) 5.404 14.463 ( 2.797 -0.857 -2.073) 3.585 14.502 ( -2.002 1.615 2.926) 3.897 14.682 ( 6.109 1.644 -1.766) 6.568 15.269 ( -2.685 1.313 14.019) 14.334 16.271 ( 0.564 0.856 -3.225) 3.384 16.692 ( -1.730 0.405 5.420) 5.704 16.905 ( 1.519 -8.915 24.532) 26.145 17.987 ( -1.171 0.146 -2.584) 2.840 18.316 ( 8.152 -0.658 -0.339) 8.186 18.847 ( -1.341 -1.222 -2.673) 3.230 18.909 ( -1.156 0.255 0.376) 1.242 19.018 ( -1.643 1.923 -14.802) 15.017 19.710 ( -21.374 -5.730 -3.994) 22.486 19.772 ( 0.862 0.295 9.521) 9.565 20.153 ( -6.433 -7.322 25.866) 27.642 21.096 ( -1.804 1.698 4.666) 5.283 21.526 ( 0.808 -6.487 -0.526) 6.558 22.186 ( 5.629 5.618 -5.515) 9.678 22.428 ( -1.594 -2.068 -3.215) 4.142 23.288 ( 1.341 -2.939 0.495) 3.268 23.672 ( 7.873 0.992 1.828) 8.143 23.954 ( -8.818 -2.319 -6.251) 11.055 24.242 ( 15.338 13.965 -10.121) 23.081 ======================= Grid point 57 (23/128) ======================= q-point: (-0.14 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.652 ( -18.027 8.709 16.090) 25.685 0.897 ( -6.961 28.279 20.350) 35.529 1.405 ( -17.373 28.632 42.475) 54.090 2.186 ( 7.415 -7.404 7.001) 12.602 2.319 ( 1.265 9.175 9.668) 13.388 2.464 ( 12.723 1.083 11.324) 17.067 2.742 ( -5.658 -3.987 7.869) 10.479 2.907 ( -5.718 0.669 6.416) 8.620 3.231 ( 4.320 -7.286 7.360) 11.221 3.364 ( -3.364 -3.382 -5.632) 7.380 3.482 ( 3.029 -1.828 13.081) 13.550 3.574 ( 12.875 -1.878 13.606) 18.826 3.763 ( -2.693 -6.880 -0.834) 7.435 3.823 ( 1.012 1.735 -7.069) 7.349 3.910 ( 4.233 -2.233 -2.510) 5.404 4.052 ( 4.431 0.984 -1.242) 4.706 4.259 ( -4.251 13.139 -2.509) 14.035 4.487 ( 1.311 5.140 -8.424) 9.955 4.652 ( 9.788 -5.578 26.266) 28.580 4.808 ( -4.747 -5.794 10.697) 13.058 5.078 ( -8.336 -14.187 -4.385) 17.029 5.149 ( 5.215 -4.988 -7.095) 10.120 5.537 ( -16.043 1.808 -3.763) 16.577 5.576 ( -6.615 0.226 -3.419) 7.450 5.661 ( -0.552 -3.464 -2.557) 4.341 5.844 ( -3.237 -0.677 4.754) 5.791 6.014 ( -6.605 12.893 0.323) 14.490 6.426 ( 0.788 2.967 -2.948) 4.256 6.840 ( 10.364 -6.929 6.195) 13.921 6.986 ( 3.790 -1.793 7.697) 8.765 7.145 ( -3.995 0.966 -1.290) 4.308 7.328 ( -1.972 -12.957 5.049) 14.045 7.634 ( 8.711 -5.374 -8.275) 13.162 7.828 ( -4.785 -8.536 1.063) 9.843 7.996 ( -0.769 -0.842 3.244) 3.439 8.212 ( -0.898 -2.378 -7.614) 8.027 8.307 ( 3.815 6.344 -3.455) 8.169 8.436 ( 0.957 9.780 -6.387) 11.720 8.734 ( 2.837 6.571 1.217) 7.260 8.971 ( 1.130 2.377 1.835) 3.208 9.112 ( -4.533 -1.447 6.838) 8.331 9.568 ( 0.609 1.926 -8.065) 8.314 10.549 ( 5.532 4.561 -8.269) 10.944 10.885 ( 0.395 -0.845 -6.612) 6.677 13.015 ( 4.214 2.067 3.481) 5.843 13.514 ( 1.786 2.985 -6.047) 6.976 13.913 ( 0.926 -1.927 -4.569) 5.045 14.085 ( 0.819 0.457 0.703) 1.172 14.191 ( 1.411 3.171 1.508) 3.784 14.469 ( -0.427 0.609 0.543) 0.921 14.516 ( 0.561 -3.298 -1.939) 3.866 14.696 ( 8.078 4.783 -6.952) 11.681 15.256 ( -1.911 2.410 13.566) 13.911 16.246 ( -0.317 1.135 -2.479) 2.745 16.681 ( -1.987 0.374 4.953) 5.350 17.297 ( 11.193 -24.553 31.664) 41.602 17.965 ( -0.818 0.268 -2.734) 2.867 18.413 ( 12.355 3.006 -0.955) 12.751 18.794 ( -16.822 -0.614 -13.815) 21.777 18.889 ( -1.282 1.418 -3.496) 3.985 18.901 ( -2.418 1.353 -0.626) 2.840 19.486 ( -17.419 1.828 -1.562) 17.585 19.850 ( 5.104 -0.372 6.115) 7.973 20.504 ( -15.145 -46.469 38.433) 62.175 21.072 ( -1.664 0.682 4.313) 4.673 21.623 ( 0.279 -4.794 -0.306) 4.812 22.113 ( 8.357 12.121 -7.029) 16.315 22.423 ( -4.728 -1.580 -5.899) 7.723 23.343 ( 0.988 -1.880 0.529) 2.189 23.757 ( 10.018 1.334 0.960) 10.152 23.860 ( -8.826 1.012 -6.642) 11.093 24.001 ( 12.149 33.665 -22.566) 42.310 ======================= Grid point 59 (24/128) ======================= q-point: ( 0.14 0.14 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.915 ( 11.044 -0.000 24.816) 27.162 1.037 ( 12.546 -0.000 28.831) 31.442 1.750 ( 26.374 -0.000 31.427) 41.027 2.281 ( -3.848 0.000 8.775) 9.581 2.408 ( -16.792 0.000 16.827) 23.772 2.591 ( -5.734 0.000 21.087) 21.853 2.830 ( 2.216 -0.000 -2.474) 3.321 2.852 ( -2.118 0.000 11.749) 11.939 2.967 ( -16.690 0.000 -4.471) 17.278 3.295 ( -8.187 0.000 -2.189) 8.475 3.391 ( -6.003 0.000 -2.186) 6.389 3.667 ( 0.256 -0.000 -6.853) 6.858 3.757 ( -11.661 0.000 22.063) 24.955 3.832 ( 9.044 -0.000 -4.956) 10.313 3.887 ( -2.123 0.000 -5.540) 5.932 4.125 ( 7.865 -0.000 -2.296) 8.193 4.265 ( 4.803 -0.000 4.268) 6.426 4.307 ( -6.709 0.000 -2.913) 7.314 4.817 ( -11.284 0.000 14.864) 18.662 4.928 ( -2.504 0.000 -10.493) 10.788 4.939 ( 2.014 -0.000 9.671) 9.878 5.355 ( -1.541 0.000 -13.884) 13.969 5.470 ( -4.708 0.000 -1.483) 4.936 5.486 ( 1.746 -0.000 -1.210) 2.125 5.789 ( 8.748 -0.000 -4.751) 9.955 5.872 ( 16.773 -0.000 0.188) 16.774 6.190 ( 16.190 -0.000 -4.906) 16.917 6.356 ( -4.696 0.000 2.522) 5.330 6.745 ( -17.153 0.000 -0.226) 17.155 6.918 ( -9.837 0.000 1.353) 9.930 7.204 ( 3.150 -0.000 -3.810) 4.944 7.375 ( -4.816 0.000 10.036) 11.131 7.742 ( 2.506 -0.000 -5.591) 6.127 7.821 ( -5.012 0.000 1.219) 5.158 8.001 ( 0.897 -0.000 0.723) 1.152 8.086 ( 5.800 -0.000 2.490) 6.312 8.137 ( -1.457 0.000 -4.665) 4.887 8.541 ( 2.431 -0.000 2.472) 3.468 8.680 ( 2.292 -0.000 -3.228) 3.959 8.973 ( -0.650 0.000 -0.193) 0.678 9.123 ( -1.661 0.000 8.073) 8.242 9.408 ( -2.732 0.000 -11.192) 11.520 10.515 ( -0.972 0.000 -3.046) 3.198 10.880 ( 2.898 -0.000 -6.792) 7.384 13.525 ( 4.501 -0.000 -1.918) 4.892 13.703 ( 7.862 -0.000 -13.393) 15.530 13.930 ( 0.879 -0.000 -3.698) 3.801 14.240 ( 4.335 -0.000 -1.945) 4.751 14.259 ( 1.117 -0.000 9.161) 9.229 14.428 ( 0.759 -0.000 -4.536) 4.599 14.459 ( -4.291 0.000 -3.286) 5.405 14.638 ( -4.131 0.000 -4.543) 6.140 15.153 ( -10.026 0.000 16.179) 19.034 16.255 ( 2.912 -0.000 -1.421) 3.240 16.660 ( -1.621 0.000 4.681) 4.954 16.900 ( -25.604 0.000 23.719) 34.902 17.956 ( 0.696 -0.000 -2.826) 2.910 18.393 ( 0.192 -0.000 -0.211) 0.285 18.847 ( -0.930 0.000 -1.733) 1.967 18.891 ( 0.173 -0.000 0.730) 0.750 19.055 ( 9.051 -0.000 -17.138) 19.381 19.462 ( 7.898 -0.000 -3.587) 8.675 19.982 ( -5.750 0.000 13.943) 15.083 21.058 ( -0.778 0.000 3.043) 3.141 21.426 ( -6.436 0.000 4.042) 7.600 21.529 ( -1.903 0.000 -0.696) 2.026 21.721 ( 2.405 -0.000 0.281) 2.421 22.237 ( 4.916 -0.000 -3.383) 5.967 23.393 ( -0.501 0.000 2.329) 2.382 23.425 ( 0.339 -0.000 -0.964) 1.022 23.522 ( -8.287 0.000 -3.845) 9.135 24.134 ( 11.063 -0.000 -0.648) 11.082 ======================= Grid point 60 (25/128) ======================= q-point: ( 0.29 0.14 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.245 ( 8.810 -12.704 20.915) 26.009 1.303 ( 14.410 -7.304 24.001) 28.932 2.060 ( -8.821 1.939 12.115) 15.111 2.227 ( -3.870 0.973 11.995) 12.641 2.292 ( -2.731 -4.041 10.634) 11.699 2.579 ( -7.176 0.352 12.709) 14.599 2.790 ( -4.019 0.765 0.250) 4.099 2.872 ( 0.268 -2.359 15.162) 15.347 2.938 ( 1.950 -5.992 1.015) 6.383 3.194 ( -2.795 3.819 -1.717) 5.034 3.334 ( -3.772 0.427 2.419) 4.501 3.653 ( -1.520 3.566 9.167) 9.953 3.726 ( -4.662 -7.222 4.093) 9.521 3.845 ( 2.483 -1.001 -0.936) 2.836 3.956 ( 3.416 2.937 -2.828) 5.320 4.122 ( -3.030 -2.292 1.029) 3.936 4.259 ( 7.638 0.827 0.241) 7.687 4.423 ( -3.016 -9.245 1.069) 9.783 4.703 ( -4.866 6.839 -0.044) 8.394 4.783 ( 3.303 10.659 -3.546) 11.709 4.948 ( 0.233 4.954 9.881) 11.056 5.240 ( -4.510 4.529 -3.007) 7.064 5.406 ( -6.854 -1.755 -3.652) 7.962 5.554 ( -5.196 0.046 1.523) 5.414 5.896 ( 3.634 -9.536 -2.276) 10.455 6.069 ( 15.035 -1.650 -1.478) 15.197 6.224 ( 13.266 10.311 0.333) 16.805 6.310 ( -2.280 0.967 -1.539) 2.916 6.571 ( -12.503 -0.006 -5.494) 13.657 6.832 ( -6.760 0.782 1.040) 6.884 7.117 ( 1.581 8.217 -0.524) 8.384 7.392 ( -0.209 -2.432 -2.771) 3.693 7.688 ( -4.549 4.022 -0.915) 6.141 7.776 ( -6.446 1.546 0.805) 6.678 7.915 ( 4.737 6.700 -0.722) 8.237 8.200 ( 1.399 -7.774 3.460) 8.624 8.264 ( 8.143 -4.426 -0.351) 9.275 8.495 ( 0.577 2.102 1.446) 2.616 8.833 ( 0.002 -11.017 -3.492) 11.557 8.967 ( -3.592 -1.951 0.196) 4.092 9.100 ( -0.859 2.993 7.077) 7.731 9.383 ( -2.819 -4.362 -10.174) 11.423 10.494 ( -1.330 -0.555 -4.578) 4.799 10.887 ( 2.970 0.710 -6.201) 6.912 13.534 ( 5.297 4.988 -0.914) 7.333 13.659 ( 1.736 5.830 -6.599) 8.975 13.894 ( 1.182 3.623 -2.784) 4.720 14.222 ( -2.552 0.412 -9.039) 9.402 14.291 ( -0.678 0.353 7.224) 7.264 14.371 ( -2.939 1.630 -4.515) 5.628 14.466 ( 3.262 -2.171 -1.307) 4.130 14.633 ( -3.985 -3.865 0.377) 5.564 15.142 ( -7.621 -3.567 15.676) 17.792 16.281 ( 3.532 0.626 -1.582) 3.921 16.662 ( -1.374 -0.335 5.085) 5.278 16.762 ( -11.670 0.408 16.581) 20.280 17.962 ( 0.290 -1.047 -2.998) 3.188 18.356 ( 0.213 4.149 0.073) 4.155 18.835 ( -0.767 -0.253 -1.651) 1.838 18.897 ( 0.175 -0.391 0.234) 0.488 19.085 ( 2.680 -2.223 -13.903) 14.332 19.521 ( 5.057 0.031 -2.811) 5.786 19.948 ( -8.368 0.640 15.816) 17.904 20.887 ( 10.618 35.279 11.677) 38.649 21.068 ( -0.775 -1.181 3.133) 3.437 21.569 ( -3.261 3.417 -0.732) 4.780 21.995 ( -4.232 -16.737 -4.705) 17.893 22.318 ( 5.023 -3.990 -4.662) 7.930 23.338 ( -4.427 3.708 0.487) 5.795 23.485 ( -2.122 -4.065 -0.767) 4.650 23.573 ( -4.277 -15.979 -5.231) 17.349 24.244 ( 9.950 -0.127 -1.648) 10.087 ======================= Grid point 61 (26/128) ======================= q-point: ( 0.43 0.14 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.531 ( -7.688 -6.053 9.475) 13.621 1.578 ( 6.704 -0.641 19.326) 20.466 1.859 ( -12.184 -9.741 15.478) 21.976 2.117 ( -0.670 11.657 12.289) 16.951 2.438 ( -1.500 -1.512 -4.164) 4.677 2.503 ( -13.225 -6.813 1.327) 14.936 2.797 ( 4.787 0.805 6.981) 8.503 2.985 ( -3.303 -6.010 4.284) 8.086 3.114 ( 9.225 -5.189 10.628) 14.999 3.126 ( -0.317 3.469 -2.109) 4.072 3.362 ( 2.744 -3.497 10.231) 11.154 3.644 ( -1.013 -0.716 9.041) 9.125 3.810 ( -1.393 -5.087 3.166) 6.152 3.877 ( 1.998 1.438 5.318) 5.860 3.982 ( 8.157 -2.624 3.446) 9.236 4.127 ( -2.169 1.060 -6.014) 6.481 4.265 ( 1.520 8.118 -2.260) 8.563 4.493 ( -3.661 8.122 0.062) 8.909 4.582 ( 3.958 -11.013 -0.904) 11.737 4.712 ( 0.934 3.844 4.148) 5.732 4.877 ( -1.174 6.207 7.138) 9.532 5.105 ( -3.628 6.850 1.994) 8.004 5.329 ( -7.359 7.564 2.644) 10.879 5.411 ( -14.572 -5.974 -0.613) 15.761 6.027 ( -0.199 -1.194 0.254) 1.236 6.161 ( 0.868 2.574 -1.319) 3.020 6.215 ( 0.893 2.778 0.578) 2.974 6.375 ( 5.754 -12.293 -4.025) 14.157 6.474 ( 1.985 2.362 -8.403) 8.951 6.765 ( 3.033 3.641 1.744) 5.049 7.051 ( 2.781 3.565 -0.864) 4.603 7.393 ( -1.062 -0.585 -11.457) 11.521 7.497 ( -3.373 13.459 1.785) 13.989 7.700 ( -6.935 -1.521 3.436) 7.887 7.919 ( 4.565 0.515 -0.677) 4.644 8.312 ( -2.153 -5.599 0.840) 6.057 8.395 ( 10.720 0.360 0.424) 10.734 8.527 ( 1.356 -2.105 4.994) 5.587 8.867 ( -4.912 0.421 -3.197) 5.876 8.981 ( -6.149 -4.998 -0.417) 7.935 9.107 ( 2.959 -0.340 3.960) 4.955 9.423 ( -1.696 -7.666 -7.746) 11.029 10.487 ( 0.076 -1.569 -5.502) 5.722 10.880 ( 2.252 1.342 -5.957) 6.509 13.464 ( 2.698 9.349 -0.119) 9.731 13.571 ( -0.130 3.911 -2.873) 4.855 13.851 ( 1.183 2.569 -1.881) 3.396 14.165 ( -1.587 -1.265 -12.131) 12.300 14.251 ( -2.573 1.556 -4.972) 5.810 14.364 ( -0.180 -1.528 3.506) 3.829 14.537 ( 2.186 -2.721 0.824) 3.587 14.645 ( -2.238 -1.103 2.771) 3.729 15.178 ( -5.985 -4.243 14.347) 16.114 16.300 ( 3.631 1.129 -1.963) 4.279 16.675 ( -0.748 -0.794 5.935) 6.034 16.719 ( -6.077 -0.687 12.349) 13.780 17.967 ( -1.434 -1.287 -2.799) 3.398 18.307 ( 3.364 3.576 -0.067) 4.910 18.826 ( -1.030 -0.432 -1.841) 2.153 18.906 ( 0.052 -0.519 -0.351) 0.629 19.090 ( -0.926 -1.793 -11.192) 11.373 19.555 ( 2.218 -0.386 -0.995) 2.462 19.887 ( -7.489 2.067 15.525) 17.360 20.612 ( 10.830 22.288 10.976) 27.102 21.098 ( -0.668 -2.209 3.847) 4.487 21.459 ( -3.345 4.652 -0.986) 5.814 22.122 ( -1.580 -7.609 -5.028) 9.256 22.401 ( 3.737 -1.886 -4.138) 5.885 23.244 ( -4.105 1.841 0.576) 4.535 23.546 ( 1.250 -4.050 0.896) 4.332 23.728 ( -6.920 -13.173 -6.652) 16.299 24.336 ( 8.748 0.114 -2.851) 9.202 ======================= Grid point 62 (27/128) ======================= q-point: (-0.43 0.14 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.225 ( -28.507 5.614 8.659) 30.317 1.809 ( 5.895 -4.301 12.689) 14.637 1.877 ( -4.415 14.593 17.011) 22.844 2.147 ( 5.659 -10.097 10.937) 15.925 2.408 ( -5.251 -6.625 -2.829) 8.914 2.494 ( -5.772 -4.270 -2.643) 7.651 2.864 ( 1.834 -0.486 5.402) 5.725 3.016 ( 3.194 5.659 2.200) 6.860 3.074 ( -2.763 -2.682 5.922) 7.064 3.325 ( 6.499 -6.819 10.534) 14.132 3.436 ( 4.345 6.388 5.856) 9.695 3.686 ( -1.490 -2.594 4.480) 5.387 3.772 ( -6.188 14.269 0.799) 15.573 3.901 ( 3.314 3.474 9.168) 10.349 3.986 ( -6.063 8.689 -4.385) 11.467 4.031 ( 5.102 3.886 -1.307) 6.545 4.220 ( 9.451 -7.612 2.847) 12.465 4.448 ( -0.426 -0.749 3.166) 3.281 4.691 ( -3.613 -0.223 6.294) 7.260 4.789 ( -0.617 -0.100 1.263) 1.409 4.807 ( 0.236 -4.749 -0.253) 4.762 5.012 ( -1.699 -1.656 0.524) 2.430 5.125 ( -8.744 5.583 10.589) 14.824 5.446 ( -7.726 -11.400 0.052) 13.771 5.953 ( -7.630 4.443 -4.650) 9.978 6.024 ( -3.848 7.719 -0.500) 8.639 6.240 ( -4.218 -6.720 4.088) 8.925 6.449 ( 5.531 3.365 -5.956) 8.797 6.624 ( 7.483 -8.542 -4.171) 12.098 6.867 ( 11.511 -6.208 1.687) 13.186 6.989 ( 0.059 8.926 -2.691) 9.323 7.280 ( 4.178 8.518 -2.211) 9.742 7.345 ( -6.010 1.099 -6.043) 8.594 7.681 ( -5.977 -3.500 1.899) 7.182 7.970 ( 5.563 -0.149 -1.188) 5.690 8.326 ( -7.057 -2.218 -0.665) 7.427 8.469 ( 5.881 2.917 -0.480) 6.582 8.572 ( 5.403 2.199 3.825) 6.975 8.813 ( -3.180 -1.839 -1.229) 3.874 8.973 ( -6.138 -2.672 1.503) 6.861 9.142 ( 3.144 1.381 1.580) 3.780 9.522 ( -0.027 -7.615 -6.293) 9.879 10.513 ( 1.896 -2.615 -6.051) 6.859 10.862 ( 1.523 0.932 -5.964) 6.225 13.318 ( -1.139 9.445 -1.379) 9.613 13.525 ( 0.972 1.817 -1.169) 2.369 13.824 ( -0.652 0.355 -2.214) 2.335 14.165 ( 0.615 -2.555 -9.350) 9.713 14.192 ( 1.081 1.501 -7.606) 7.828 14.401 ( -0.121 -2.102 1.884) 2.825 14.575 ( -1.074 0.454 3.314) 3.513 14.654 ( 0.384 -1.553 1.571) 2.242 15.227 ( -4.620 -3.706 13.612) 14.844 16.308 ( 2.898 1.430 -3.121) 4.493 16.696 ( -1.526 -0.296 5.684) 5.893 16.733 ( -2.601 -2.902 13.735) 14.277 17.951 ( -3.599 -1.182 -2.185) 4.373 18.334 ( 8.652 0.979 -0.774) 8.742 18.812 ( -2.353 -0.643 -2.647) 3.600 18.910 ( -0.218 -0.225 -0.855) 0.911 19.049 ( -3.819 -0.082 -8.201) 9.047 19.574 ( -0.673 -0.906 0.779) 1.371 19.831 ( -4.352 2.409 13.574) 14.457 20.422 ( 4.012 17.453 10.224) 20.621 21.131 ( -1.335 -0.800 5.274) 5.499 21.387 ( -1.498 -0.285 -1.800) 2.359 22.196 ( 1.199 -4.470 -5.676) 7.324 22.425 ( 1.789 1.055 -3.448) 4.025 23.213 ( -1.578 -1.400 1.079) 2.369 23.639 ( 4.460 -3.418 1.873) 5.923 23.796 ( -7.577 -8.276 -6.203) 12.821 24.406 ( 7.691 0.694 -5.155) 9.285 ======================= Grid point 63 (28/128) ======================= q-point: (-0.29 0.14 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.909 ( -19.459 6.036 14.691) 25.118 1.569 ( -5.964 21.058 24.229) 32.651 1.968 ( 0.945 -6.611 2.380) 7.090 2.314 ( -1.380 -2.267 6.744) 7.247 2.436 ( -2.521 -3.624 -1.478) 4.655 2.615 ( 5.294 -5.495 8.546) 11.457 2.835 ( -2.172 6.996 1.455) 7.469 2.896 ( 1.076 20.293 11.371) 23.286 3.108 ( -0.546 1.515 0.395) 1.658 3.199 ( -1.630 6.832 11.738) 13.679 3.482 ( -0.354 -1.747 7.754) 7.956 3.631 ( 0.973 -2.233 7.953) 8.317 3.703 ( -2.458 0.383 -0.620) 2.563 3.808 ( 2.248 4.930 -0.806) 5.478 3.954 ( 5.074 2.625 1.751) 5.975 4.055 ( 3.294 0.874 -0.724) 3.484 4.386 ( -0.542 -5.297 0.681) 5.368 4.482 ( -0.385 -1.775 6.636) 6.880 4.644 ( -5.034 0.823 4.609) 6.875 4.722 ( -2.438 1.385 -1.587) 3.222 4.921 ( 1.175 -8.930 -3.742) 9.754 4.939 ( -4.699 6.571 7.395) 10.952 5.221 ( -0.321 -13.602 7.049) 15.324 5.562 ( -6.712 -10.950 0.743) 12.865 5.764 ( -6.096 5.949 -4.813) 9.784 5.871 ( -0.716 8.258 -0.059) 8.289 6.315 ( -2.764 -2.809 -1.471) 4.206 6.472 ( 2.922 -3.028 0.439) 4.231 6.702 ( 1.451 9.756 -3.560) 10.486 6.849 ( 2.197 -1.896 3.333) 4.419 7.140 ( 8.516 -10.845 -2.251) 13.972 7.229 ( -3.037 2.691 0.108) 4.059 7.295 ( 4.326 -1.817 -2.976) 5.556 7.690 ( -3.235 -3.861 -1.811) 5.352 8.025 ( 4.701 -0.728 -3.193) 5.729 8.227 ( -9.217 3.393 1.528) 9.939 8.428 ( -0.934 2.656 -6.041) 6.665 8.611 ( 7.957 3.719 -1.069) 8.849 8.842 ( 1.745 -1.150 2.377) 3.165 8.951 ( -5.870 -2.197 4.593) 7.771 9.152 ( 3.001 2.542 3.463) 5.240 9.587 ( 0.452 -2.710 -7.343) 7.840 10.561 ( 2.490 -2.627 -7.331) 8.176 10.855 ( 1.476 -0.270 -6.046) 6.229 13.167 ( -0.491 7.427 -0.509) 7.461 13.522 ( 1.449 -0.022 -1.529) 2.106 13.819 ( -1.236 -2.145 -3.037) 3.919 14.145 ( 0.736 1.197 -3.726) 3.982 14.220 ( 5.014 -1.080 -8.179) 9.654 14.434 ( -0.335 -2.293 -0.891) 2.482 14.535 ( -2.040 3.078 4.393) 5.739 14.701 ( 0.749 -2.822 -1.138) 3.134 15.272 ( -3.272 -2.182 12.830) 13.420 16.295 ( 1.577 1.759 -4.661) 5.225 16.693 ( -2.130 0.140 5.377) 5.785 16.833 ( -2.293 -6.883 18.902) 20.246 17.925 ( -3.453 -1.464 -2.082) 4.290 18.448 ( 13.049 -1.048 -1.902) 13.229 18.765 ( -6.732 -0.025 -4.474) 8.083 18.903 ( -0.495 0.240 -1.094) 1.225 18.970 ( -4.229 1.732 -3.758) 5.916 19.557 ( -3.416 1.552 1.017) 3.887 19.818 ( 0.259 0.637 12.579) 12.598 20.229 ( -3.098 11.197 12.945) 17.394 21.119 ( -1.814 1.613 5.034) 5.589 21.430 ( 0.228 -5.707 -1.316) 5.861 22.253 ( 3.527 -1.725 -6.411) 7.518 22.394 ( -0.782 1.914 -2.810) 3.488 23.251 ( 0.277 -3.370 1.127) 3.564 23.753 ( 7.772 -2.060 2.112) 8.313 23.793 ( -7.780 -4.338 -5.477) 10.457 24.433 ( 5.501 2.662 -10.742) 12.359 ======================= Grid point 64 (29/128) ======================= q-point: (-0.14 0.14 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.752 ( 0.010 7.134 24.004) 25.042 1.268 ( -3.725 20.932 27.555) 34.804 1.998 ( -4.222 31.942 9.091) 33.478 2.120 ( 1.258 -2.852 13.811) 14.159 2.440 ( -3.120 -1.171 4.357) 5.485 2.622 ( 4.357 5.713 12.884) 14.752 2.723 ( 2.235 2.858 8.030) 8.811 2.861 ( -2.331 -2.356 8.467) 9.092 3.134 ( -2.397 -4.387 -1.458) 5.207 3.272 ( -0.147 -7.525 11.016) 13.341 3.437 ( -6.825 0.337 -1.163) 6.931 3.656 ( -4.042 -0.412 2.101) 4.573 3.694 ( 5.081 0.344 2.592) 5.715 3.890 ( 2.601 -4.567 6.620) 8.453 3.914 ( 0.328 6.076 -3.283) 6.914 4.078 ( 2.032 -1.398 -1.012) 2.666 4.362 ( -2.597 6.151 -2.884) 7.273 4.547 ( -1.432 -5.482 12.898) 14.088 4.626 ( -1.825 1.498 2.469) 3.417 4.702 ( -0.696 -5.902 -3.621) 6.959 4.873 ( -3.959 -2.421 6.500) 7.987 5.098 ( 8.751 -8.974 -3.272) 12.954 5.426 ( -4.079 -11.369 7.059) 13.989 5.538 ( -1.457 5.956 -4.008) 7.326 5.707 ( 3.546 1.029 -0.899) 3.800 5.785 ( -1.377 0.104 1.687) 2.180 6.176 ( -3.305 14.070 -4.502) 15.138 6.458 ( -1.332 4.224 -3.584) 5.697 6.729 ( 0.766 -13.542 2.158) 13.734 6.943 ( -2.020 -2.653 9.495) 10.063 7.114 ( -5.596 1.078 -1.833) 5.986 7.327 ( 8.424 1.202 0.112) 8.510 7.495 ( 4.469 -16.963 -1.396) 17.597 7.719 ( 0.000 -2.853 -3.360) 4.408 8.056 ( -2.809 6.590 3.563) 8.001 8.096 ( -1.646 -4.778 -6.804) 8.475 8.344 ( -3.376 2.911 -8.254) 9.381 8.588 ( 4.088 7.340 -1.909) 8.615 8.857 ( 3.659 3.516 0.353) 5.086 8.982 ( -1.452 -4.291 6.996) 8.335 9.129 ( -0.331 4.704 4.691) 6.652 9.576 ( 0.476 1.264 -8.753) 8.856 10.581 ( 0.527 -0.419 -8.755) 8.781 10.863 ( 1.898 -0.702 -6.540) 6.846 13.128 ( 7.991 0.719 4.177) 9.046 13.541 ( 2.505 -0.526 -3.219) 4.113 13.847 ( -0.606 -3.892 -4.001) 5.615 14.142 ( 4.047 1.567 -0.697) 4.396 14.249 ( 3.353 1.275 -2.654) 4.462 14.458 ( -0.944 -2.403 -2.949) 3.920 14.482 ( -1.575 2.122 2.099) 3.374 14.736 ( 0.203 -1.766 -4.342) 4.692 15.294 ( -3.023 0.223 11.022) 11.431 16.263 ( 0.592 1.752 -4.802) 5.146 16.681 ( -2.048 0.426 4.762) 5.202 17.005 ( -11.327 -14.670 25.729) 31.709 17.921 ( 0.039 -1.607 -2.468) 2.945 18.543 ( -9.578 -0.062 -7.285) 12.034 18.702 ( 15.841 1.729 -1.554) 16.010 18.889 ( -0.152 0.498 -1.472) 1.561 18.910 ( -0.704 1.731 -0.184) 1.878 19.465 ( -1.328 5.581 -0.954) 5.815 19.918 ( 6.528 -3.366 12.683) 14.656 20.136 ( -10.073 -4.196 23.977) 26.343 21.089 ( -1.372 1.675 4.139) 4.671 21.529 ( 0.020 -6.673 -0.672) 6.707 22.269 ( 5.261 3.641 -5.899) 8.702 22.346 ( -3.930 -0.097 -4.582) 6.037 23.313 ( 0.521 -3.285 1.215) 3.541 23.735 ( -7.999 -1.165 -4.758) 9.379 23.877 ( 9.855 -0.733 1.291) 9.966 24.313 ( -2.200 12.081 -21.484) 24.745 ======================= Grid point 67 (30/128) ======================= q-point: ( 0.29 0.29 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.314 ( 13.302 -0.000 19.150) 23.317 1.478 ( 11.479 -0.000 26.973) 29.314 1.845 ( -37.935 0.000 17.690) 41.857 2.154 ( -11.761 0.000 3.937) 12.403 2.327 ( 7.580 -0.000 -0.168) 7.582 2.568 ( -7.059 0.000 12.922) 14.725 2.780 ( -0.659 0.000 1.098) 1.281 2.921 ( 6.230 -0.000 -0.704) 6.270 2.998 ( 7.748 -0.000 20.885) 22.276 3.227 ( 4.753 -0.000 7.055) 8.507 3.313 ( -0.385 0.000 -0.771) 0.862 3.607 ( -0.141 0.000 -9.108) 9.109 3.681 ( -7.642 0.000 24.095) 25.278 3.852 ( 2.646 -0.000 -7.944) 8.373 3.989 ( 6.538 -0.000 -3.012) 7.198 4.146 ( -8.868 0.000 7.274) 11.470 4.266 ( 3.695 -0.000 -0.520) 3.731 4.366 ( 5.519 -0.000 0.857) 5.585 4.728 ( -1.913 0.000 -3.876) 4.322 4.886 ( 2.635 -0.000 -4.774) 5.453 5.025 ( -1.468 0.000 10.285) 10.389 5.214 ( -6.867 0.000 -3.854) 7.875 5.217 ( -12.578 0.000 -4.449) 13.342 5.639 ( 7.450 -0.000 3.385) 8.183 5.774 ( -5.447 0.000 -0.415) 5.463 6.151 ( 1.393 -0.000 -4.827) 5.024 6.288 ( 1.117 -0.000 8.857) 8.927 6.366 ( -9.289 0.000 -3.122) 9.800 6.570 ( 17.121 -0.000 -9.401) 19.532 6.761 ( -2.946 0.000 -0.747) 3.039 7.200 ( 0.892 -0.000 -7.747) 7.798 7.360 ( -1.534 0.000 4.744) 4.985 7.646 ( -9.778 0.000 2.990) 10.225 7.726 ( -1.612 0.000 -2.236) 2.757 8.023 ( -3.719 0.000 -3.883) 5.376 8.129 ( 5.567 -0.000 1.594) 5.790 8.317 ( 10.136 -0.000 2.047) 10.341 8.581 ( -0.281 0.000 7.210) 7.215 8.690 ( 0.931 -0.000 -5.095) 5.179 8.921 ( -4.026 0.000 -1.112) 4.177 9.132 ( -1.281 0.000 6.882) 7.001 9.292 ( -1.691 0.000 -8.746) 8.908 10.455 ( -1.782 0.000 -5.614) 5.890 10.910 ( 3.229 -0.000 -5.433) 6.320 13.618 ( 4.779 -0.000 -1.110) 4.906 13.693 ( -1.001 0.000 -6.690) 6.764 13.920 ( 0.184 -0.000 -3.618) 3.623 14.140 ( -5.197 0.000 -13.905) 14.844 14.325 ( -4.605 0.000 -0.292) 4.614 14.350 ( 0.950 -0.000 4.586) 4.683 14.460 ( 0.358 -0.000 0.869) 0.940 14.549 ( -2.863 0.000 3.063) 4.192 15.106 ( -3.730 0.000 15.427) 15.872 16.322 ( 3.711 -0.000 -1.369) 3.956 16.661 ( -1.210 0.000 5.505) 5.636 16.709 ( -7.007 0.000 12.589) 14.407 17.948 ( 0.238 -0.000 -2.859) 2.869 18.389 ( -0.484 0.000 -0.359) 0.603 18.824 ( -0.429 0.000 -0.604) 0.741 18.897 ( 0.439 -0.000 -0.611) 0.753 19.033 ( -0.904 0.000 -10.387) 10.426 19.560 ( 3.569 -0.000 -2.434) 4.320 19.924 ( -6.548 0.000 15.576) 16.896 21.058 ( -0.839 0.000 2.735) 2.860 21.383 ( -0.474 0.000 0.382) 0.609 21.493 ( -1.323 0.000 0.355) 1.370 21.769 ( 1.972 -0.000 -0.401) 2.013 22.322 ( 4.781 -0.000 -3.749) 6.076 23.363 ( -4.754 0.000 -2.365) 5.310 23.366 ( -1.911 0.000 0.930) 2.125 23.457 ( 1.775 -0.000 0.392) 1.817 24.331 ( 8.083 -0.000 -2.821) 8.561 ======================= Grid point 68 (31/128) ======================= q-point: ( 0.43 0.29 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.385 ( -29.215 4.494 13.697) 32.578 1.627 ( 1.478 -10.846 17.051) 20.262 1.708 ( 6.978 -3.372 21.374) 22.736 2.094 ( -13.174 -7.737 2.702) 15.515 2.356 ( -0.091 -0.474 0.646) 0.806 2.473 ( -6.683 8.249 13.213) 16.949 2.866 ( 5.314 -7.238 4.217) 9.920 2.923 ( 1.456 3.759 4.515) 6.052 3.064 ( -3.112 -1.378 -2.007) 3.952 3.276 ( 4.281 3.081 2.842) 5.991 3.428 ( 9.913 -2.194 10.811) 14.831 3.650 ( -3.629 -1.350 13.089) 13.649 3.685 ( 4.135 -2.621 -5.336) 7.242 3.945 ( 9.215 -5.423 0.493) 10.704 4.028 ( -6.710 0.623 12.990) 14.634 4.047 ( 3.284 -0.738 -2.828) 4.397 4.366 ( -0.969 -3.854 -2.874) 4.904 4.448 ( 6.338 -4.914 0.251) 8.024 4.625 ( 2.016 8.416 -8.863) 12.387 4.866 ( 2.526 6.390 1.887) 7.125 4.929 ( -9.472 3.427 3.331) 10.610 5.101 ( -13.316 -0.217 0.668) 13.335 5.191 ( -3.307 -3.002 5.108) 6.785 5.427 ( -4.928 16.552 0.964) 17.297 5.977 ( 3.357 -12.424 0.923) 12.902 6.087 ( -6.075 1.740 -2.370) 6.750 6.225 ( -7.737 3.610 -3.601) 9.266 6.342 ( 1.909 -1.680 5.409) 5.977 6.635 ( 12.273 7.250 -5.155) 15.158 6.830 ( 9.174 -2.642 -3.002) 10.008 7.160 ( 4.014 3.643 -2.902) 6.148 7.341 ( -3.549 0.681 -3.155) 4.797 7.545 ( -7.392 1.452 1.261) 7.638 7.672 ( -4.656 4.099 1.252) 6.328 7.966 ( 1.861 0.323 -3.037) 3.577 8.196 ( -1.629 -3.212 -2.986) 4.678 8.483 ( 9.888 -5.281 2.596) 11.507 8.573 ( 3.369 1.657 5.843) 6.945 8.751 ( -5.162 -6.382 -3.365) 8.871 8.863 ( -5.527 0.199 0.001) 5.531 9.142 ( 0.727 -0.264 5.301) 5.357 9.294 ( 0.123 -4.062 -6.191) 7.405 10.433 ( -0.993 -1.727 -6.737) 7.025 10.916 ( 2.746 1.448 -5.046) 5.925 13.603 ( -1.572 6.639 -3.348) 7.600 13.631 ( 2.594 3.600 -1.016) 4.552 13.893 ( 0.041 2.204 -3.379) 4.034 14.069 ( -2.159 -2.803 -15.381) 15.783 14.231 ( -3.874 2.113 -4.982) 6.655 14.370 ( 0.528 0.662 5.954) 6.014 14.510 ( 0.140 -3.635 1.757) 4.040 14.571 ( -2.921 -4.093 4.068) 6.468 15.131 ( -2.609 -1.350 14.393) 14.690 16.347 ( 3.015 0.818 -1.551) 3.488 16.672 ( -0.955 -0.750 5.967) 6.090 16.690 ( -4.035 -0.466 10.272) 11.046 17.939 ( -0.542 0.150 -2.744) 2.801 18.371 ( 1.028 1.176 -0.857) 1.781 18.814 ( -0.540 0.605 -0.302) 0.865 18.902 ( 0.538 -0.170 -1.350) 1.463 19.007 ( -2.383 -1.965 -7.397) 8.016 19.582 ( 2.442 0.490 -1.392) 2.853 19.899 ( -4.782 1.423 15.004) 15.812 21.065 ( -0.583 1.196 2.425) 2.766 21.111 ( 5.500 21.361 4.382) 22.489 21.484 ( -3.805 3.223 -0.159) 4.989 21.935 ( -0.176 -12.717 -3.120) 13.096 22.388 ( 3.820 -3.016 -3.530) 6.013 23.245 ( -3.227 4.028 0.052) 5.161 23.463 ( -1.574 -8.635 -0.699) 8.805 23.517 ( 0.716 -5.400 -0.345) 5.458 24.398 ( 5.780 -0.473 -4.115) 7.111 ======================= Grid point 69 (32/128) ======================= q-point: (-0.43 0.29 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.043 ( -25.816 3.403 17.817) 31.551 1.790 ( -2.446 -3.721 8.148) 9.285 1.915 ( -2.270 -11.179 8.537) 14.248 2.172 ( -2.443 -12.370 5.150) 13.620 2.233 ( -7.936 13.279 14.643) 21.301 2.442 ( 6.060 -2.735 6.577) 9.353 2.906 ( -0.327 1.211 8.289) 8.383 2.967 ( -8.120 0.891 -7.421) 11.037 3.107 ( 8.908 -6.431 5.577) 12.321 3.317 ( 1.111 -3.739 3.624) 5.324 3.520 ( -1.099 -2.242 4.428) 5.084 3.649 ( -0.286 1.740 12.480) 12.604 3.782 ( 3.835 -4.251 -6.396) 8.584 3.953 ( -6.109 0.679 9.501) 11.316 4.031 ( 0.157 0.932 -5.711) 5.789 4.221 ( 7.112 4.331 -2.977) 8.843 4.345 ( 9.969 6.107 6.178) 13.223 4.525 ( 3.064 2.913 -1.972) 4.665 4.606 ( -3.529 -7.821 -0.728) 8.612 4.743 ( -2.701 4.225 1.772) 5.318 4.856 ( -0.908 0.716 7.550) 7.638 4.893 ( -12.179 4.818 1.311) 13.163 5.175 ( -5.620 6.238 10.868) 13.734 5.276 ( 0.958 -3.068 0.407) 3.239 5.952 ( -4.700 5.651 -4.121) 8.426 6.048 ( -5.278 1.795 -2.800) 6.239 6.142 ( -3.025 -1.886 4.646) 5.856 6.474 ( 3.893 -7.728 -2.115) 8.907 6.622 ( 7.348 3.326 -3.338) 8.729 6.975 ( 13.578 -0.709 1.742) 13.708 7.147 ( 5.550 7.286 -1.737) 9.322 7.243 ( -8.221 0.888 -6.504) 10.520 7.432 ( -1.205 5.726 -3.438) 6.787 7.577 ( -5.887 -0.423 3.016) 6.628 8.019 ( 5.750 -1.199 -2.875) 6.540 8.188 ( -6.651 -3.149 -3.154) 8.006 8.572 ( 1.729 3.961 -2.847) 5.175 8.656 ( 4.016 -2.494 7.314) 8.708 8.754 ( 0.097 -1.727 -0.939) 1.968 8.840 ( -6.300 -5.646 1.154) 8.538 9.175 ( 0.589 -0.846 2.826) 3.008 9.386 ( 2.603 -7.419 -4.161) 8.895 10.450 ( 0.158 -3.579 -7.451) 8.268 10.896 ( 2.265 2.313 -4.858) 5.838 13.440 ( -2.696 9.003 -3.711) 10.104 13.588 ( 1.927 4.339 0.453) 4.770 13.838 ( -0.012 2.870 -3.653) 4.646 14.089 ( 0.687 -4.479 -11.192) 12.075 14.180 ( 0.606 -0.964 -7.936) 8.017 14.385 ( -0.292 -0.536 3.545) 3.597 14.559 ( -0.482 -2.289 1.503) 2.781 14.611 ( -3.176 -2.906 4.886) 6.512 15.175 ( -2.661 -2.464 13.762) 14.232 16.348 ( 1.604 1.522 -2.403) 3.265 16.685 ( -2.350 -0.542 6.361) 6.803 16.713 ( -1.093 -2.088 10.371) 10.635 17.912 ( -1.509 0.665 -2.329) 2.853 18.394 ( 3.676 -1.533 -1.802) 4.372 18.790 ( -0.797 1.298 -1.189) 1.933 18.903 ( 0.247 -0.117 -1.926) 1.945 18.987 ( -2.495 -0.895 -4.009) 4.806 19.591 ( 1.845 0.907 -0.462) 2.107 19.874 ( -2.706 2.093 14.430) 14.830 20.797 ( 1.257 22.740 4.626) 23.240 21.108 ( -0.828 -2.117 4.492) 5.034 21.390 ( -1.611 3.366 -0.537) 3.770 22.086 ( 0.566 -8.475 -4.631) 9.675 22.445 ( 2.561 -0.702 -3.484) 4.381 23.184 ( -1.646 0.348 1.093) 2.006 23.579 ( -2.244 -8.479 -2.394) 9.092 23.621 ( 2.443 -6.234 1.006) 6.771 24.441 ( 3.085 -0.770 -5.937) 6.735 ======================= Grid point 70 (33/128) ======================= q-point: (-0.29 0.29 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.898 ( -4.815 2.112 23.026) 23.618 1.833 ( -6.109 -5.464 1.271) 8.294 1.909 ( -1.350 14.498 17.765) 22.970 2.090 ( -12.073 -10.097 2.736) 15.974 2.398 ( 5.206 -8.666 6.062) 11.787 2.617 ( 7.744 -5.948 8.953) 13.248 2.826 ( -5.494 2.448 -4.620) 7.585 2.955 ( -2.888 -3.675 10.193) 11.213 3.154 ( -3.110 4.048 0.404) 5.120 3.435 ( -0.687 -3.863 -1.024) 4.055 3.571 ( -1.223 -0.291 12.937) 12.998 3.652 ( 0.939 2.629 2.566) 3.792 3.729 ( -2.332 16.810 6.508) 18.176 3.837 ( -1.518 0.553 -2.141) 2.683 4.017 ( 0.118 1.278 6.095) 6.228 4.120 ( 2.761 4.403 -0.608) 5.232 4.321 ( -7.369 -0.053 2.271) 7.711 4.516 ( 3.735 2.702 -3.383) 5.718 4.584 ( -5.158 0.973 5.913) 7.907 4.758 ( -0.513 3.022 -5.822) 6.580 4.840 ( 7.544 -5.583 3.711) 10.092 4.987 ( -2.391 -10.415 7.605) 13.116 5.055 ( -3.840 4.843 11.617) 13.159 5.373 ( 0.953 -6.950 2.248) 7.366 5.811 ( -0.300 5.376 -6.719) 8.610 5.968 ( -0.466 4.223 -0.621) 4.294 6.182 ( -2.654 -6.245 3.472) 7.622 6.514 ( 3.164 3.026 -1.858) 4.756 6.759 ( 3.878 -9.542 -1.252) 10.375 6.955 ( 0.902 16.787 -7.946) 18.595 7.119 ( -1.915 -0.706 -4.746) 5.167 7.152 ( 0.498 -2.349 8.687) 9.013 7.394 ( 6.069 2.221 -3.351) 7.280 7.574 ( -3.253 -4.888 -1.122) 5.977 8.056 ( 2.316 1.600 -5.502) 6.180 8.154 ( -4.745 -2.048 -0.611) 5.204 8.459 ( -3.926 5.110 -3.344) 7.260 8.742 ( 6.044 3.114 0.641) 6.829 8.782 ( -3.602 -6.321 5.672) 9.226 8.897 ( 0.891 -2.819 1.225) 3.200 9.199 ( 0.245 -0.684 2.218) 2.334 9.511 ( 2.902 -5.436 -4.942) 7.899 10.494 ( 0.569 -4.198 -7.970) 9.026 10.873 ( 2.354 1.685 -4.884) 5.677 13.277 ( -0.738 7.360 -2.402) 7.778 13.552 ( 1.097 2.314 0.046) 2.562 13.796 ( 0.627 1.328 -3.583) 3.872 14.124 ( 0.654 -2.894 -5.600) 6.337 14.226 ( 5.879 -2.572 -9.668) 11.603 14.398 ( -0.812 -1.248 0.060) 1.490 14.566 ( -1.684 1.397 4.258) 4.788 14.634 ( -2.978 -3.489 2.140) 5.062 15.232 ( -2.751 -3.077 13.147) 13.779 16.321 ( 0.186 1.905 -3.787) 4.243 16.685 ( -2.181 -0.202 5.665) 6.074 16.776 ( -2.584 -3.459 13.536) 14.208 17.888 ( -0.147 -0.059 -2.256) 2.262 18.459 ( -0.433 -3.545 -3.310) 4.869 18.765 ( 3.738 1.860 -1.583) 4.465 18.899 ( 0.487 0.115 -2.514) 2.563 18.958 ( -1.392 0.895 -1.048) 1.959 19.588 ( 1.600 1.965 -0.069) 2.535 19.874 ( -0.357 1.181 14.881) 14.932 20.453 ( -6.309 19.089 6.071) 21.001 21.130 ( -1.664 -0.173 5.400) 5.653 21.370 ( 1.155 -1.473 -1.298) 2.278 22.192 ( 1.492 -5.846 -5.683) 8.288 22.436 ( 1.221 2.879 -3.287) 4.537 23.203 ( -0.081 -2.898 1.502) 3.265 23.638 ( -4.397 -5.194 -3.590) 7.695 23.780 ( 7.446 -5.956 2.375) 9.826 24.440 ( -0.812 0.175 -9.103) 9.141 ======================= Grid point 71 (34/128) ======================= q-point: (-0.14 0.29 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.975 ( 11.733 3.601 23.805) 26.782 1.650 ( 1.301 19.427 18.903) 27.138 1.932 ( -4.930 -9.052 5.959) 11.906 2.166 ( -9.564 -9.639 3.024) 13.911 2.490 ( 0.498 2.723 0.282) 2.782 2.725 ( -1.432 0.804 1.141) 2.000 2.817 ( -0.749 3.623 10.111) 10.766 2.910 ( -0.293 3.147 6.363) 7.104 3.118 ( -2.230 -5.116 7.838) 9.622 3.319 ( 2.749 16.341 7.073) 18.017 3.371 ( -7.086 5.959 -1.494) 9.378 3.670 ( -3.881 3.500 9.675) 10.996 3.700 ( 2.402 -4.265 3.468) 5.999 3.831 ( -3.209 -1.684 5.640) 6.704 3.982 ( -8.862 2.356 1.492) 9.290 4.072 ( 3.618 0.851 1.445) 3.988 4.344 ( -3.872 -7.099 -1.848) 8.295 4.535 ( -3.896 -3.484 3.846) 6.489 4.550 ( 4.407 3.199 -0.015) 5.446 4.706 ( 1.945 2.078 -0.936) 2.996 4.884 ( -6.039 6.421 5.132) 10.200 5.018 ( 3.714 -7.948 -0.221) 8.776 5.226 ( -1.335 -12.879 10.071) 16.403 5.530 ( 5.592 -8.867 1.014) 10.532 5.744 ( 3.720 5.237 -2.409) 6.860 5.909 ( 6.491 5.963 -1.343) 8.916 6.247 ( -2.270 -1.329 -2.014) 3.313 6.513 ( 1.195 0.655 -0.207) 1.378 6.677 ( 0.741 12.130 -6.876) 13.963 6.856 ( -8.422 -3.734 0.129) 9.214 7.078 ( -1.396 -1.104 0.929) 2.008 7.292 ( -1.003 -11.718 4.901) 12.742 7.422 ( 5.952 1.303 -5.631) 8.297 7.651 ( 2.328 -5.508 -1.641) 6.201 7.997 ( -5.898 0.776 -3.177) 6.744 8.149 ( 4.479 2.101 -1.999) 5.336 8.350 ( -2.104 3.621 -1.300) 4.385 8.695 ( -2.155 4.309 0.022) 4.818 8.897 ( 0.450 -6.366 5.627) 8.508 8.929 ( 3.236 1.171 -0.587) 3.491 9.197 ( -1.219 2.049 2.167) 3.222 9.566 ( 1.760 -0.460 -6.585) 6.832 10.528 ( -0.110 -2.584 -7.914) 8.326 10.866 ( 2.421 0.477 -5.673) 6.186 13.218 ( 4.370 1.276 0.828) 4.627 13.544 ( 0.904 -0.313 -1.325) 1.634 13.792 ( 1.062 -1.103 -3.519) 3.838 14.170 ( 2.925 -2.225 -3.186) 4.864 14.286 ( 4.576 -0.298 -5.770) 7.370 14.407 ( -0.773 -1.630 -3.856) 4.257 14.519 ( -1.587 3.411 4.226) 5.658 14.666 ( -2.655 -3.760 0.244) 4.609 15.278 ( -3.696 -1.550 12.369) 13.002 16.277 ( -0.290 1.692 -4.409) 4.732 16.679 ( -1.972 0.192 4.996) 5.375 16.830 ( -8.129 -4.144 17.511) 19.746 17.911 ( 3.635 -1.504 -2.638) 4.737 18.413 ( -10.066 0.175 -2.837) 10.460 18.837 ( 6.539 -1.136 -1.551) 6.816 18.918 ( 9.168 -0.613 -6.391) 11.193 18.928 ( -0.608 1.318 0.497) 1.535 19.553 ( 1.797 4.761 -1.114) 5.209 19.947 ( 2.462 -4.046 19.230) 19.805 20.157 ( -9.234 9.980 9.165) 16.397 21.116 ( -1.193 1.655 4.718) 5.140 21.432 ( 0.545 -5.084 -1.060) 5.222 22.260 ( 0.584 -3.326 -6.722) 7.522 22.377 ( 1.257 4.500 -2.839) 5.467 23.262 ( -0.220 -3.745 1.483) 4.034 23.632 ( -4.632 -1.604 -3.121) 5.811 23.955 ( 9.784 -3.389 1.433) 10.453 24.333 ( -6.653 5.343 -13.517) 15.985 ======================= Grid point 75 (35/128) ======================= q-point: ( 0.43 0.43 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.119 ( -31.729 0.000 20.549) 37.802 1.655 ( 4.810 -0.000 11.131) 12.126 1.759 ( -4.817 0.000 14.503) 15.282 1.877 ( -10.747 0.000 2.670) 11.074 2.379 ( 3.410 -0.000 8.087) 8.777 2.541 ( -2.800 0.000 14.964) 15.224 2.887 ( 5.041 -0.000 9.075) 10.381 2.957 ( -8.118 0.000 1.832) 8.322 3.012 ( 1.951 -0.000 1.225) 2.304 3.297 ( -3.125 0.000 -2.565) 4.043 3.441 ( -5.533 0.000 4.322) 7.021 3.672 ( 12.938 -0.000 -10.481) 16.651 3.862 ( 1.914 -0.000 -6.762) 7.027 3.887 ( 5.655 -0.000 21.390) 22.125 4.018 ( -6.650 0.000 7.004) 9.658 4.108 ( 8.162 -0.000 9.828) 12.775 4.252 ( -1.833 0.000 -3.346) 3.815 4.489 ( 1.474 -0.000 -1.687) 2.240 4.653 ( -4.451 0.000 -14.607) 15.270 4.801 ( -10.833 0.000 3.343) 11.337 4.927 ( 0.245 -0.000 -0.282) 0.374 5.016 ( 0.375 -0.000 -0.082) 0.384 5.220 ( 2.666 -0.000 13.172) 13.439 5.713 ( 0.642 -0.000 -0.358) 0.735 5.728 ( -0.977 0.000 1.118) 1.485 6.086 ( -0.818 0.000 1.240) 1.485 6.174 ( -5.159 0.000 -4.735) 7.002 6.331 ( -4.509 0.000 7.807) 9.015 6.772 ( 3.141 -0.000 -6.855) 7.540 6.940 ( 19.124 -0.000 -2.953) 19.350 7.202 ( 3.696 -0.000 -5.268) 6.436 7.280 ( -9.496 0.000 -1.699) 9.647 7.527 ( -3.126 0.000 9.356) 9.864 7.662 ( -2.656 0.000 -2.604) 3.719 7.933 ( -1.394 0.000 -5.226) 5.409 8.184 ( 0.793 -0.000 -4.009) 4.087 8.488 ( 3.503 -0.000 0.020) 3.503 8.615 ( -3.300 0.000 8.104) 8.750 8.664 ( 0.753 -0.000 -5.661) 5.711 8.830 ( -2.127 0.000 1.514) 2.611 9.151 ( -0.555 0.000 5.252) 5.281 9.271 ( 3.492 -0.000 -2.862) 4.515 10.387 ( -0.474 0.000 -7.963) 7.977 10.941 ( 2.323 -0.000 -4.629) 5.179 13.622 ( -1.987 0.000 -4.144) 4.596 13.698 ( 2.643 -0.000 -0.129) 2.646 13.895 ( 0.061 -0.000 -5.209) 5.209 13.965 ( -1.424 0.000 -16.967) 17.026 14.187 ( -4.656 0.000 -5.202) 6.981 14.436 ( -2.856 0.000 3.345) 4.398 14.438 ( 1.878 -0.000 8.432) 8.638 14.535 ( -0.903 0.000 1.621) 1.856 15.148 ( -1.332 0.000 14.005) 14.068 16.376 ( 1.793 -0.000 -1.396) 2.272 16.669 ( -1.671 0.000 6.126) 6.350 16.684 ( -1.995 0.000 9.365) 9.575 17.933 ( 0.091 -0.000 -3.090) 3.091 18.372 ( -0.396 0.000 -1.487) 1.538 18.823 ( -0.004 0.000 1.532) 1.532 18.904 ( 0.916 -0.000 -1.854) 2.068 18.948 ( -1.386 0.000 -6.255) 6.407 19.607 ( 2.086 -0.000 -0.772) 2.225 19.912 ( -3.377 0.000 14.663) 15.047 21.056 ( -0.858 0.000 2.596) 2.734 21.378 ( -0.018 0.000 -1.006) 1.006 21.479 ( -0.395 0.000 1.230) 1.292 21.794 ( 0.692 -0.000 -1.144) 1.337 22.389 ( 3.276 -0.000 -2.455) 4.094 23.296 ( -0.626 0.000 -0.716) 0.951 23.336 ( -1.142 0.000 0.135) 1.150 23.491 ( 0.855 -0.000 1.158) 1.439 24.425 ( 2.754 -0.000 -5.274) 5.950 ======================= Grid point 76 (36/128) ======================= q-point: (-0.43 -0.57 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.938 ( -9.447 1.130 22.912) 24.809 1.657 ( -15.979 -8.089 0.957) 17.936 1.700 ( -12.132 -3.010 7.775) 14.721 1.999 ( 6.909 -10.950 8.354) 15.409 2.406 ( -2.773 6.235 9.953) 12.068 2.551 ( 6.980 2.778 17.514) 19.057 2.860 ( -7.932 0.543 -0.146) 7.952 2.973 ( 0.148 1.786 8.340) 8.530 3.083 ( 5.621 -6.997 3.461) 9.619 3.241 ( -6.747 -1.779 -1.127) 7.068 3.389 ( -10.906 -3.889 1.239) 11.645 3.750 ( -1.142 3.448 -1.834) 4.069 3.819 ( -2.443 -0.662 4.478) 5.144 3.873 ( 0.284 0.520 0.841) 1.028 4.024 ( -0.252 -0.538 -4.244) 4.286 4.223 ( -4.549 -4.627 2.839) 7.082 4.395 ( 6.035 -9.398 8.752) 14.190 4.446 ( -4.147 -0.710 -2.628) 4.960 4.545 ( -3.863 0.836 -5.669) 6.911 4.767 ( 4.938 2.878 -2.124) 6.097 4.950 ( 4.832 0.152 2.118) 5.278 5.009 ( 4.111 7.292 6.827) 10.801 5.300 ( 3.321 1.984 17.072) 17.505 5.384 ( 0.656 19.118 0.154) 19.130 5.929 ( -3.638 -5.868 -3.330) 7.665 6.026 ( -0.704 5.485 -5.147) 7.555 6.137 ( 0.516 -0.047 2.699) 2.748 6.354 ( -2.230 -8.199 4.236) 9.494 6.736 ( 1.773 4.285 -5.908) 7.511 7.111 ( 5.805 1.065 -5.104) 7.803 7.149 ( -3.189 0.471 4.576) 5.598 7.261 ( 5.093 -1.479 -4.382) 6.879 7.472 ( -0.343 6.263 2.303) 6.681 7.587 ( -2.873 4.295 -1.881) 5.499 7.979 ( 1.133 -6.414 -2.329) 6.917 8.144 ( -0.100 2.712 -4.860) 5.567 8.533 ( -7.389 -2.568 -2.973) 8.368 8.626 ( -6.734 -5.801 3.839) 9.682 8.682 ( 6.880 -3.281 -1.425) 7.755 8.825 ( 2.149 1.671 3.172) 4.180 9.162 ( -1.216 -0.411 3.537) 3.762 9.346 ( 5.895 -3.606 -0.180) 6.913 10.381 ( 0.707 -2.282 -8.684) 9.007 10.936 ( 1.791 1.524 -4.426) 5.012 13.520 ( -2.070 7.322 -7.394) 10.610 13.680 ( 0.992 4.151 0.075) 4.268 13.873 ( 1.659 1.312 -5.241) 5.651 13.975 ( 0.810 -5.849 -12.223) 13.575 14.135 ( -1.311 -1.308 -5.975) 6.256 14.397 ( -1.239 1.206 3.098) 3.548 14.513 ( -0.724 -2.732 3.867) 4.789 14.551 ( -1.500 -2.747 3.865) 4.973 15.177 ( -1.559 -0.322 13.924) 14.015 16.373 ( 0.206 1.160 -1.633) 2.013 16.674 ( -1.656 -0.395 6.040) 6.275 16.705 ( -1.198 -1.211 10.117) 10.260 17.915 ( 0.123 1.135 -3.095) 3.299 18.376 ( 0.077 -1.464 -2.061) 2.529 18.817 ( 0.797 1.400 0.873) 1.832 18.901 ( 0.706 0.296 -2.857) 2.958 18.944 ( -0.032 -1.580 -3.742) 4.062 19.623 ( 1.978 0.525 -0.048) 2.048 19.918 ( -2.252 0.993 14.617) 14.823 21.054 ( -1.650 2.265 1.361) 3.115 21.172 ( -2.156 17.845 2.375) 18.131 21.449 ( 1.081 3.839 1.174) 4.158 21.923 ( 0.568 -11.503 -3.111) 11.930 22.436 ( 2.361 -2.233 -2.231) 3.942 23.216 ( 0.270 4.529 0.690) 4.589 23.434 ( -0.158 -7.564 -1.105) 7.646 23.551 ( 1.651 -6.191 1.836) 6.665 24.425 ( -0.352 -0.544 -6.538) 6.570 ======================= Grid point 77 (37/128) ======================= q-point: (-0.29 -0.57 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.031 ( 13.583 0.669 21.409) 25.363 1.631 ( -12.543 -7.550 5.732) 15.722 1.722 ( -12.376 -15.829 0.841) 20.110 2.208 ( 0.757 10.085 5.773) 11.645 2.320 ( 4.227 -8.462 11.207) 14.665 2.614 ( -3.329 0.094 -0.741) 3.412 2.802 ( 0.280 -0.767 9.404) 9.440 2.944 ( -2.548 1.405 9.713) 10.139 3.141 ( -7.971 0.857 2.220) 8.318 3.321 ( -6.193 -6.162 -1.562) 8.875 3.412 ( -1.391 -16.002 5.674) 17.035 3.630 ( -15.552 -0.479 10.020) 18.506 3.759 ( -2.298 3.225 -4.809) 6.230 3.903 ( 3.290 2.674 3.746) 5.657 4.000 ( -3.681 -1.714 -7.233) 8.295 4.220 ( -2.019 5.307 -2.124) 6.062 4.397 ( -6.237 -4.909 0.554) 7.956 4.466 ( -1.271 2.612 3.765) 4.756 4.604 ( 4.343 -0.045 -0.614) 4.387 4.711 ( -3.260 5.340 4.920) 7.959 4.983 ( 7.207 3.191 12.101) 14.441 5.021 ( 11.573 5.169 6.242) 14.128 5.145 ( -0.484 7.676 1.296) 7.800 5.390 ( 5.040 2.299 9.113) 10.664 5.860 ( 0.525 2.912 -7.113) 7.704 5.988 ( 2.405 -0.382 -6.281) 6.737 6.150 ( 1.662 0.843 4.968) 5.306 6.537 ( 2.722 -9.871 0.733) 10.266 6.663 ( -2.551 2.074 -1.759) 3.729 6.980 ( -12.931 -0.054 -2.043) 13.091 7.212 ( 1.674 1.951 3.872) 4.648 7.229 ( 4.223 12.893 -4.804) 14.392 7.435 ( 5.233 -0.122 -7.367) 9.037 7.531 ( 2.754 -0.080 1.625) 3.199 8.040 ( -5.678 -0.495 -1.062) 5.798 8.122 ( 5.426 -1.569 -4.009) 6.927 8.445 ( -6.593 1.015 -2.890) 7.270 8.647 ( -6.794 -5.354 5.475) 10.237 8.830 ( 3.347 -0.169 1.503) 3.672 8.860 ( 5.706 -5.194 -1.582) 7.876 9.161 ( -2.435 -1.360 1.273) 3.066 9.479 ( 6.004 -4.304 0.039) 7.387 10.417 ( 1.813 -3.727 -8.586) 9.534 10.912 ( 1.704 2.008 -4.394) 5.123 13.356 ( -2.036 6.802 -7.162) 10.085 13.610 ( -0.207 4.421 -1.571) 4.696 13.849 ( 2.688 3.483 -1.935) 4.807 14.047 ( 1.647 -5.413 -7.666) 9.528 14.194 ( 5.291 -5.631 -9.297) 12.089 14.377 ( -1.751 0.053 0.035) 1.752 14.545 ( -1.629 -2.507 2.195) 3.709 14.582 ( -2.320 -1.064 6.003) 6.523 15.213 ( -2.043 -1.389 13.789) 14.009 16.337 ( -0.996 1.947 -2.332) 3.197 16.679 ( -1.629 -0.123 5.725) 5.954 16.749 ( -2.081 -1.827 12.139) 12.451 17.897 ( 1.769 0.672 -2.968) 3.520 18.385 ( -2.960 -1.403 -2.253) 3.975 18.823 ( 3.335 0.331 -0.141) 3.355 18.904 ( 2.279 -0.229 -3.755) 4.398 18.954 ( 0.626 -0.349 -2.465) 2.567 19.633 ( 2.118 1.070 0.618) 2.452 19.931 ( -0.717 0.720 15.486) 15.519 20.700 ( -11.767 23.712 1.184) 26.498 21.111 ( -1.577 -1.524 5.058) 5.513 21.414 ( 3.363 3.766 0.339) 5.060 22.082 ( 1.748 -8.551 -4.683) 9.905 22.466 ( 1.198 0.340 -2.854) 3.114 23.191 ( 1.394 0.455 1.340) 1.986 23.523 ( -0.803 -5.108 -1.470) 5.376 23.736 ( 6.530 -10.320 2.420) 12.450 24.388 ( -3.844 -0.082 -8.141) 9.004 ======================= Grid point 78 (38/128) ======================= q-point: (-0.14 0.43 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.250 ( 18.842 2.628 18.321) 26.411 1.687 ( -9.204 -11.758 9.368) 17.628 1.872 ( -10.708 -12.547 1.252) 16.543 2.024 ( 3.413 13.343 10.086) 17.070 2.454 ( -1.489 -2.446 -3.544) 4.556 2.633 ( -2.521 -9.143 -1.488) 9.600 2.891 ( 4.532 -0.655 10.585) 11.533 2.934 ( -4.214 1.382 3.594) 5.709 3.037 ( -7.028 0.010 10.981) 13.038 3.324 ( -7.062 -5.673 -0.988) 9.112 3.455 ( -11.913 4.103 6.615) 14.231 3.685 ( -4.537 -1.906 15.086) 15.868 3.730 ( 3.632 -9.166 -3.195) 10.364 3.867 ( 0.597 4.660 -1.913) 5.072 3.920 ( -9.346 3.621 1.786) 10.181 4.108 ( -4.452 -2.027 -1.332) 5.070 4.223 ( 2.575 14.956 4.816) 15.922 4.509 ( -0.809 -1.062 1.985) 2.393 4.647 ( 3.636 -1.363 4.353) 5.834 4.713 ( -3.435 -5.301 3.569) 7.255 4.963 ( 1.435 11.798 1.874) 12.031 5.015 ( 1.087 4.709 -2.003) 5.231 5.117 ( -0.160 -4.025 13.011) 13.620 5.490 ( 7.645 -4.699 3.395) 9.594 5.861 ( 6.584 1.809 -3.475) 7.661 6.030 ( 6.980 -0.601 -6.370) 9.469 6.190 ( 2.394 -0.828 3.766) 4.539 6.559 ( 0.217 3.863 0.793) 3.949 6.673 ( -9.860 -5.000 -3.969) 11.746 6.882 ( -1.383 5.307 -4.848) 7.320 7.057 ( 2.107 3.283 -0.942) 4.013 7.147 ( -8.805 0.643 1.756) 9.001 7.454 ( 3.196 -0.089 -9.819) 10.326 7.646 ( 8.436 -2.569 4.364) 9.840 7.953 ( -5.418 1.601 -1.650) 5.886 8.204 ( 5.740 -1.427 -2.601) 6.462 8.376 ( -1.693 1.359 0.929) 2.362 8.653 ( -7.889 -2.275 5.226) 9.733 8.868 ( 2.605 -1.239 0.414) 2.914 8.967 ( 4.483 -1.381 -1.897) 5.060 9.161 ( -3.730 -2.415 -1.009) 4.556 9.575 ( 3.882 -0.920 -2.072) 4.495 10.471 ( 2.374 -3.002 -7.579) 8.491 10.888 ( 1.647 1.455 -5.105) 5.558 13.259 ( 0.177 1.417 -3.492) 3.772 13.548 ( -0.668 1.705 -2.510) 3.107 13.821 ( 2.495 2.693 -1.257) 3.880 14.129 ( 2.803 -4.472 -6.361) 8.265 14.294 ( 3.033 -1.666 -7.487) 8.247 14.371 ( 1.119 -1.604 -3.659) 4.149 14.563 ( -0.623 0.990 3.626) 3.810 14.587 ( -2.499 -2.715 4.567) 5.872 15.256 ( -2.862 -1.685 13.506) 13.909 16.287 ( -0.778 1.818 -2.993) 3.588 16.679 ( -1.454 0.180 5.548) 5.739 16.775 ( -4.882 -0.854 14.171) 15.013 17.928 ( 5.047 -1.273 -3.009) 6.012 18.325 ( -7.025 1.103 -1.345) 7.237 18.852 ( 0.950 -0.257 -0.827) 1.285 18.934 ( -0.218 -0.106 0.807) 0.842 18.983 ( 9.767 -1.858 -9.673) 13.871 19.632 ( 2.166 2.752 0.535) 3.543 19.985 ( 0.729 -0.878 19.329) 19.363 20.235 ( -15.801 14.365 3.029) 21.568 21.129 ( -1.543 -0.514 5.319) 5.562 21.407 ( 2.234 0.926 -0.882) 2.574 22.191 ( 1.916 -4.791 -5.673) 7.669 22.437 ( 0.678 2.827 -3.172) 4.303 23.221 ( 0.694 -1.655 1.309) 2.221 23.570 ( -0.477 -2.247 -0.988) 2.500 23.981 ( 10.168 -7.529 1.306) 12.719 24.284 ( -7.097 2.628 -9.801) 12.383 ======================= Grid point 84 (39/128) ======================= q-point: (-0.43 -0.43 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.042 ( 14.421 -0.000 19.971) 24.633 1.370 ( -21.445 0.000 0.689) 21.456 1.544 ( -17.915 0.000 9.681) 20.363 2.024 ( 8.066 -0.000 8.654) 11.830 2.436 ( -3.068 0.000 1.405) 3.374 2.695 ( 0.853 -0.000 11.042) 11.075 2.811 ( -3.453 0.000 12.639) 13.102 3.044 ( 0.778 -0.000 0.350) 0.853 3.045 ( 1.521 -0.000 13.704) 13.788 3.156 ( -23.459 0.000 -0.827) 23.474 3.169 ( -5.108 0.000 -5.497) 7.504 3.627 ( -18.560 0.000 10.649) 21.398 3.781 ( 1.072 -0.000 -8.713) 8.779 3.945 ( 6.759 -0.000 -0.216) 6.762 4.016 ( 0.491 -0.000 -5.503) 5.525 4.187 ( -1.567 0.000 -5.960) 6.162 4.359 ( -7.582 0.000 -5.188) 9.188 4.367 ( -3.374 0.000 29.756) 29.947 4.536 ( 3.904 -0.000 -8.873) 9.694 4.873 ( 9.320 -0.000 -2.453) 9.637 4.990 ( 3.860 -0.000 1.016) 3.991 5.171 ( 10.693 -0.000 4.320) 11.533 5.407 ( 6.539 -0.000 17.172) 18.375 5.671 ( -3.525 0.000 -3.000) 4.629 5.758 ( 2.688 -0.000 0.805) 2.806 6.111 ( 3.366 -0.000 -6.712) 7.509 6.128 ( 3.199 -0.000 3.256) 4.564 6.248 ( -5.664 0.000 5.904) 8.182 6.743 ( -1.637 0.000 -7.375) 7.555 6.978 ( -15.798 0.000 -4.080) 16.316 7.259 ( 2.695 -0.000 -2.950) 3.996 7.320 ( 15.609 -0.000 3.695) 16.041 7.561 ( -0.296 0.000 9.708) 9.713 7.591 ( -0.691 0.000 -7.932) 7.962 7.938 ( 4.036 -0.000 -2.021) 4.513 8.150 ( -1.047 0.000 -5.325) 5.427 8.421 ( -6.292 0.000 -3.906) 7.406 8.511 ( -7.220 0.000 4.052) 8.279 8.700 ( 3.377 -0.000 -2.678) 4.310 8.876 ( 2.663 -0.000 3.658) 4.525 9.164 ( -1.276 0.000 5.112) 5.269 9.384 ( 6.686 -0.000 0.380) 6.696 10.350 ( 2.052 -0.000 -9.348) 9.571 10.950 ( 1.127 -0.000 -4.337) 4.481 13.557 ( 0.416 -0.000 -15.395) 15.400 13.696 ( -2.875 0.000 -1.550) 3.266 13.879 ( 2.409 -0.000 -6.707) 7.127 13.910 ( 3.983 -0.000 -7.043) 8.091 14.092 ( -1.926 0.000 -1.934) 2.729 14.389 ( -2.688 0.000 0.480) 2.731 14.518 ( -1.415 0.000 1.151) 1.824 14.520 ( 1.375 -0.000 6.698) 6.838 15.201 ( -1.996 0.000 14.184) 14.323 16.373 ( -1.176 0.000 -1.329) 1.775 16.675 ( -1.199 0.000 6.152) 6.268 16.717 ( -0.808 0.000 11.426) 11.454 17.919 ( 0.613 -0.000 -3.671) 3.722 18.359 ( 0.313 -0.000 -2.166) 2.188 18.838 ( 0.417 -0.000 1.651) 1.703 18.912 ( 0.553 -0.000 -0.969) 1.116 18.920 ( 2.483 -0.000 -6.738) 7.181 19.648 ( 1.894 -0.000 0.858) 2.079 19.944 ( -2.247 0.000 13.868) 14.049 21.054 ( -0.858 0.000 2.714) 2.846 21.369 ( -0.256 0.000 -0.536) 0.594 21.491 ( 0.756 -0.000 1.573) 1.746 21.782 ( -0.992 0.000 -1.695) 1.964 22.433 ( 1.859 -0.000 -0.778) 2.015 23.321 ( -0.206 0.000 -0.382) 0.434 23.329 ( 3.630 -0.000 0.643) 3.687 23.505 ( -0.288 0.000 1.681) 1.705 24.381 ( -3.247 0.000 -7.200) 7.899 ======================= Grid point 85 (40/128) ======================= q-point: (-0.29 -0.43 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.276 ( -9.649 -10.500 5.395) 15.246 1.335 ( 19.051 -5.410 11.445) 22.874 1.414 ( -18.388 -5.030 13.736) 23.496 2.198 ( 5.314 -8.873 3.696) 10.983 2.355 ( -5.374 3.270 -2.412) 6.738 2.556 ( -16.738 4.449 -5.060) 18.043 2.866 ( 0.091 -0.731 22.377) 22.389 2.951 ( -14.969 -2.317 7.788) 17.032 3.001 ( -2.947 1.664 6.069) 6.949 3.125 ( -8.225 -2.500 -1.529) 8.732 3.221 ( 4.094 -11.088 5.083) 12.867 3.522 ( -9.419 -0.398 13.032) 16.084 3.768 ( 0.748 0.422 -6.965) 7.018 3.936 ( -2.733 2.611 -4.910) 6.197 4.035 ( 2.539 5.513 0.492) 6.090 4.154 ( -4.545 -8.610 -2.914) 10.162 4.251 ( -2.356 1.990 -2.107) 3.735 4.474 ( -3.794 -4.150 15.697) 16.674 4.571 ( 2.457 -3.369 -6.487) 7.712 4.874 ( 1.065 7.849 2.412) 8.280 5.061 ( 1.321 -3.564 2.756) 4.695 5.229 ( 10.184 9.389 6.572) 15.331 5.413 ( 2.104 16.842 0.085) 16.974 5.540 ( 8.221 1.361 13.149) 15.567 5.849 ( -1.193 -1.989 -5.108) 5.610 6.037 ( 6.220 5.754 -9.406) 12.659 6.219 ( 4.491 0.048 4.022) 6.029 6.340 ( -1.876 -12.899 4.591) 13.819 6.676 ( -3.019 2.422 -4.006) 5.570 6.815 ( -14.107 -1.794 -2.615) 14.459 7.261 ( -0.135 2.081 -1.581) 2.617 7.400 ( 2.626 6.466 2.793) 7.516 7.519 ( 2.418 5.759 -9.422) 11.304 7.609 ( 10.215 -0.013 5.990) 11.842 7.989 ( 0.186 -0.145 -0.678) 0.718 8.124 ( -0.150 -1.328 -3.017) 3.299 8.353 ( -6.196 -1.783 -3.432) 7.303 8.513 ( -4.723 -5.532 4.253) 8.426 8.772 ( 2.853 -6.252 -3.687) 7.798 8.902 ( 2.491 1.004 2.059) 3.384 9.150 ( -2.016 1.438 4.425) 5.071 9.484 ( 6.083 -3.400 0.211) 6.972 10.371 ( 3.673 -2.459 -8.869) 9.909 10.937 ( 0.840 1.130 -4.392) 4.612 13.412 ( -2.447 7.805 -15.559) 17.578 13.650 ( -2.215 2.172 -5.042) 5.920 13.896 ( 2.153 -0.780 -4.697) 5.225 13.990 ( 5.492 -2.669 -2.794) 6.715 14.120 ( 2.995 -6.128 -3.826) 7.821 14.358 ( -2.071 0.358 -1.580) 2.629 14.511 ( -1.211 -0.844 1.801) 2.328 14.564 ( -0.194 -1.370 5.528) 5.699 15.220 ( -2.695 -0.287 14.390) 14.643 16.341 ( -2.048 1.194 -1.436) 2.771 16.681 ( -1.240 0.008 6.018) 6.144 16.755 ( -0.545 -0.445 14.055) 14.072 17.914 ( 1.844 0.139 -3.687) 4.125 18.353 ( -0.778 0.612 -1.975) 2.210 18.847 ( 0.984 0.045 0.533) 1.120 18.913 ( 1.243 -0.206 -1.362) 1.856 18.948 ( 3.687 -1.273 -7.083) 8.086 19.669 ( 1.986 0.387 1.902) 2.777 19.962 ( -2.069 -0.555 12.922) 13.098 20.968 ( -8.471 22.967 -0.007) 24.479 21.109 ( -3.804 6.056 5.477) 9.007 21.522 ( 4.071 3.159 1.165) 5.283 21.924 ( 1.809 -13.286 -3.514) 13.861 22.462 ( 1.172 -1.128 -1.042) 1.932 23.255 ( 2.640 4.125 0.605) 4.934 23.451 ( 2.279 -4.928 0.087) 5.430 23.614 ( 3.596 -12.567 2.104) 13.240 24.310 ( -5.946 -0.048 -7.898) 9.886 ======================= Grid point 86 (41/128) ======================= q-point: (-0.14 -0.43 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( -10.285 -12.277 11.892) 19.948 1.439 ( -11.296 -12.192 9.806) 19.298 1.671 ( 18.268 -2.873 10.475) 21.253 2.181 ( -3.029 1.389 -9.822) 10.372 2.353 ( -10.328 -3.475 -1.983) 11.076 2.465 ( 1.179 -10.853 6.047) 12.480 2.890 ( -12.976 -3.640 13.512) 19.084 2.928 ( -2.933 -0.097 11.456) 11.826 2.994 ( -4.225 -4.308 7.730) 9.807 3.084 ( -0.895 0.657 4.431) 4.568 3.472 ( -0.711 -6.643 3.482) 7.534 3.485 ( -2.275 -6.421 10.076) 12.162 3.733 ( 0.634 1.744 -4.060) 4.464 3.843 ( -4.824 2.415 -2.909) 6.129 3.930 ( -3.552 6.066 3.464) 7.837 4.084 ( -4.862 2.059 -5.774) 7.825 4.411 ( 3.944 -8.933 1.355) 9.859 4.493 ( -1.517 1.420 5.340) 5.730 4.611 ( -2.983 -2.315 1.534) 4.076 4.718 ( 0.785 9.498 7.868) 12.358 5.082 ( -2.047 2.277 0.681) 3.137 5.135 ( -2.055 8.374 7.575) 11.478 5.261 ( 7.250 13.624 0.091) 15.433 5.582 ( 7.217 3.525 5.930) 9.984 5.873 ( 0.869 -3.669 -2.248) 4.390 6.034 ( 3.460 -0.403 -9.097) 9.741 6.294 ( 7.464 0.386 3.849) 8.407 6.426 ( -10.607 -4.905 -5.284) 12.825 6.680 ( 5.741 1.607 3.285) 6.806 6.735 ( -8.978 -7.887 3.981) 12.596 7.130 ( -5.048 8.904 -0.216) 10.237 7.282 ( 3.434 12.110 -5.906) 13.904 7.443 ( 0.814 1.267 -10.486) 10.593 7.751 ( 9.858 0.369 6.567) 11.851 7.922 ( -4.261 2.212 -1.016) 4.907 8.196 ( 2.994 -4.966 -0.790) 5.853 8.347 ( -0.836 -3.217 -1.802) 3.781 8.555 ( -4.612 -3.005 5.588) 7.844 8.865 ( 0.198 -2.467 -4.766) 5.370 8.950 ( 3.747 -4.585 -1.058) 6.016 9.109 ( -3.279 1.585 3.423) 4.998 9.587 ( 3.833 -2.430 -1.773) 4.873 10.443 ( 5.462 -3.098 -7.293) 9.624 10.910 ( 0.739 1.566 -5.000) 5.291 13.249 ( -3.748 2.499 -9.456) 10.474 13.569 ( -1.123 3.165 -4.706) 5.781 13.887 ( 0.959 2.689 -0.430) 2.887 14.074 ( 3.965 -3.952 -6.420) 8.518 14.254 ( 1.038 -3.259 -6.699) 7.521 14.361 ( 5.245 -2.668 -3.382) 6.787 14.525 ( -1.803 -1.888 2.910) 3.909 14.592 ( 0.512 -0.640 4.853) 4.922 15.246 ( -2.920 -1.292 14.380) 14.731 16.295 ( -1.310 1.365 -2.008) 2.759 16.686 ( -1.125 0.048 5.981) 6.086 16.785 ( -1.885 1.297 16.338) 16.497 17.949 ( 4.496 -1.732 -3.315) 5.848 18.297 ( -3.233 2.889 -1.010) 4.453 18.855 ( 0.570 0.057 -0.868) 1.040 18.926 ( -0.716 -0.550 1.213) 1.512 19.008 ( 7.603 -2.519 -11.918) 14.359 19.689 ( 2.265 1.091 2.783) 3.751 20.010 ( -1.153 -3.589 11.538) 12.138 20.341 ( -22.940 27.198 6.913) 36.246 21.106 ( -1.786 -1.640 4.979) 5.538 21.490 ( 2.883 5.339 0.063) 6.068 22.112 ( 3.986 -7.769 -4.947) 10.036 22.461 ( -0.106 1.324 -2.548) 2.873 23.244 ( 2.513 1.856 0.712) 3.204 23.542 ( 3.212 -3.113 0.712) 4.530 23.934 ( 11.395 -14.204 0.660) 18.222 24.206 ( -7.608 0.786 -8.521) 11.450 ======================= Grid point 92 (42/128) ======================= q-point: (-0.29 -0.29 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.919 ( -21.780 0.000 5.620) 22.493 1.209 ( -21.329 0.000 19.434) 28.855 1.671 ( 28.870 -0.000 11.280) 30.996 2.162 ( -34.318 0.000 -8.221) 35.289 2.176 ( 1.727 -0.000 6.140) 6.378 2.353 ( -12.480 0.000 -6.360) 14.007 2.808 ( -2.678 0.000 7.232) 7.712 3.001 ( -0.612 0.000 28.548) 28.554 3.045 ( -3.421 0.000 -3.468) 4.871 3.090 ( 4.512 -0.000 1.032) 4.629 3.161 ( 1.937 -0.000 15.390) 15.511 3.477 ( -5.842 0.000 13.007) 14.259 3.774 ( 2.664 -0.000 -3.401) 4.320 3.970 ( -2.026 0.000 -4.679) 5.099 3.980 ( 0.320 -0.000 -6.817) 6.824 4.106 ( -2.385 0.000 -7.894) 8.247 4.227 ( -3.234 0.000 -0.967) 3.375 4.449 ( -3.975 0.000 24.998) 25.312 4.544 ( 2.053 -0.000 -9.316) 9.540 4.940 ( -3.802 0.000 4.637) 5.996 5.036 ( 1.168 -0.000 -1.121) 1.619 5.445 ( 9.257 -0.000 2.409) 9.565 5.547 ( -3.178 0.000 -5.890) 6.692 5.659 ( 7.089 -0.000 8.952) 11.419 5.791 ( 0.401 -0.000 -2.335) 2.370 6.138 ( -9.272 0.000 6.181) 11.144 6.246 ( 9.198 -0.000 -8.035) 12.213 6.263 ( 5.448 -0.000 2.268) 5.901 6.617 ( -12.432 0.000 -2.268) 12.638 6.688 ( 2.718 -0.000 -3.371) 4.330 7.253 ( -1.475 0.000 -3.161) 3.488 7.494 ( -2.968 0.000 10.970) 11.364 7.558 ( 3.056 -0.000 -10.225) 10.672 7.761 ( 14.343 -0.000 6.861) 15.899 8.047 ( 6.285 -0.000 -2.147) 6.641 8.064 ( -5.126 0.000 -0.004) 5.126 8.257 ( -6.418 0.000 -2.396) 6.850 8.431 ( -1.964 0.000 -0.090) 1.966 8.724 ( -0.071 0.000 -2.210) 2.211 8.935 ( 1.413 -0.000 0.508) 1.502 9.163 ( -1.865 0.000 6.339) 6.608 9.513 ( 5.083 -0.000 -1.547) 5.313 10.369 ( 4.838 -0.000 -8.279) 9.589 10.938 ( 0.307 -0.000 -4.608) 4.618 13.404 ( -3.194 0.000 -28.624) 28.802 13.588 ( -4.349 0.000 -4.720) 6.418 13.902 ( 2.733 -0.000 -5.645) 6.272 14.040 ( 7.391 -0.000 2.775) 7.894 14.080 ( 0.377 -0.000 2.345) 2.375 14.340 ( 0.191 -0.000 -3.350) 3.355 14.496 ( -1.127 0.000 1.117) 1.587 14.572 ( 0.313 -0.000 4.370) 4.381 15.227 ( -3.880 0.000 14.891) 15.388 16.320 ( -2.806 0.000 -1.089) 3.009 16.685 ( -1.446 0.000 5.907) 6.081 16.813 ( 2.456 -0.000 18.958) 19.117 17.919 ( 1.589 -0.000 -3.914) 4.224 18.360 ( 0.912 -0.000 -2.108) 2.297 18.856 ( 0.705 -0.000 -0.007) 0.705 18.913 ( -0.456 0.000 0.980) 1.080 18.958 ( 5.480 -0.000 -11.088) 12.369 19.700 ( 1.865 -0.000 3.572) 4.030 19.951 ( -4.615 0.000 7.686) 8.965 21.052 ( -0.870 0.000 2.938) 3.064 21.377 ( 0.831 -0.000 3.407) 3.507 21.528 ( 1.707 -0.000 1.472) 2.254 21.736 ( -2.139 0.000 -1.892) 2.856 22.465 ( 1.439 -0.000 0.803) 1.648 23.322 ( 0.539 -0.000 -0.644) 0.840 23.453 ( 7.340 -0.000 1.417) 7.476 23.500 ( -1.172 0.000 1.976) 2.297 24.214 ( -7.767 0.000 -7.824) 11.024 ======================= Grid point 93 (43/128) ======================= q-point: (-0.14 -0.29 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.981 ( -13.836 -24.355 7.682) 29.045 1.116 ( -20.567 -9.741 19.567) 30.012 1.798 ( -31.179 -9.537 8.391) 33.667 1.995 ( 18.676 -0.790 9.705) 21.062 2.218 ( -3.766 -1.313 -8.362) 9.264 2.310 ( -1.897 -9.862 3.696) 10.702 2.793 ( -3.295 2.289 7.337) 8.362 2.967 ( -4.055 2.917 6.880) 8.502 3.054 ( 3.851 4.123 13.556) 14.684 3.166 ( 7.199 0.138 16.925) 18.393 3.331 ( 3.931 -9.158 5.877) 11.570 3.463 ( -5.131 -0.812 9.550) 10.871 3.766 ( 1.668 3.957 -2.731) 5.089 3.856 ( -0.958 3.505 -4.930) 6.124 3.981 ( -5.489 4.440 -4.516) 8.380 4.047 ( -0.134 0.004 -5.813) 5.815 4.281 ( 1.508 -10.823 0.746) 10.953 4.491 ( -3.002 -0.643 16.750) 17.029 4.548 ( -0.723 -2.110 -5.960) 6.364 4.853 ( -4.771 5.501 8.146) 10.926 5.070 ( 0.704 -1.227 0.720) 1.587 5.300 ( -4.744 13.680 -7.651) 16.376 5.520 ( 7.461 8.232 3.920) 11.781 5.707 ( 0.636 1.992 -1.849) 2.791 5.814 ( -0.520 -0.921 2.087) 2.339 6.032 ( -12.200 7.729 -8.059) 16.539 6.148 ( -5.502 -9.500 1.672) 11.105 6.417 ( 3.082 -3.350 -2.098) 5.012 6.603 ( 3.188 -1.725 4.347) 5.660 6.765 ( 9.175 -1.821 2.034) 9.572 7.219 ( -2.274 2.789 -1.720) 3.988 7.383 ( -4.854 8.828 5.733) 11.591 7.533 ( 5.481 6.042 -10.050) 12.944 7.887 ( 7.324 5.174 2.354) 9.271 7.943 ( -3.147 3.242 3.798) 5.903 8.152 ( 4.868 -3.568 -0.047) 6.035 8.255 ( -0.743 -6.195 -3.318) 7.066 8.474 ( -1.600 -5.933 0.758) 6.191 8.758 ( -1.578 -5.787 -4.298) 7.379 8.945 ( 1.241 -0.459 0.016) 1.323 9.138 ( -2.157 2.803 6.337) 7.257 9.573 ( 2.927 -2.465 -3.907) 5.469 10.438 ( 7.012 -3.682 -6.774) 10.422 10.919 ( 0.162 0.845 -5.228) 5.298 13.202 ( -7.789 4.138 -18.407) 20.411 13.561 ( -1.812 -1.023 -7.350) 7.639 13.910 ( 1.678 0.177 -4.178) 4.506 14.069 ( 1.738 0.442 0.558) 1.878 14.182 ( 0.803 -5.207 -1.692) 5.534 14.383 ( 8.450 -2.289 -3.529) 9.439 14.497 ( -0.690 -0.811 1.130) 1.552 14.595 ( 0.875 -1.553 3.361) 3.804 15.236 ( -4.053 -1.084 15.246) 15.813 16.284 ( -2.114 0.317 -1.450) 2.583 16.688 ( -1.613 -0.197 5.683) 5.911 16.896 ( 4.722 3.890 24.315) 25.073 17.945 ( 2.834 -2.251 -3.406) 4.969 18.333 ( 0.336 3.510 -1.470) 3.820 18.861 ( 0.601 0.181 -0.856) 1.062 18.913 ( -0.981 -0.363 1.395) 1.744 18.998 ( 5.390 -2.342 -14.528) 15.672 19.733 ( 1.785 0.096 5.891) 6.156 19.915 ( -9.166 -2.609 -1.123) 9.596 20.710 ( -18.183 45.828 14.765) 51.466 21.084 ( -2.167 0.100 5.124) 5.565 21.599 ( 2.264 4.245 0.368) 4.825 21.982 ( 6.304 -15.869 -4.542) 17.669 22.474 ( 0.360 1.272 -1.276) 1.837 23.311 ( 2.079 2.405 -0.089) 3.181 23.553 ( 7.237 -2.861 1.734) 7.973 23.757 ( 10.533 -24.314 -1.125) 26.521 24.099 ( -8.995 0.233 -7.729) 11.861 ======================= Grid point 101 (44/128) ======================= q-point: (-0.14 -0.14 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.580 ( -15.109 0.000 19.228) 24.454 0.817 ( -28.292 0.000 13.195) 31.218 1.379 ( -35.091 0.000 36.484) 50.620 2.152 ( 3.876 -0.000 0.491) 3.907 2.204 ( -1.294 0.000 7.225) 7.340 2.270 ( 15.580 -0.000 7.371) 17.236 2.816 ( -4.947 0.000 11.755) 12.754 2.939 ( -5.296 0.000 1.102) 5.409 3.231 ( 6.576 -0.000 9.767) 11.775 3.314 ( 13.916 -0.000 0.149) 13.917 3.359 ( 8.758 -0.000 37.078) 38.098 3.441 ( -0.155 0.000 1.428) 1.437 3.828 ( 2.791 -0.000 -5.952) 6.573 3.906 ( 0.955 -0.000 -8.304) 8.359 3.954 ( -1.225 0.000 -3.128) 3.359 3.982 ( -4.326 0.000 -3.262) 5.418 4.160 ( -3.589 0.000 1.075) 3.747 4.492 ( -1.927 0.000 -11.236) 11.400 4.538 ( 1.175 -0.000 25.263) 25.290 4.864 ( -5.756 0.000 13.226) 14.424 5.096 ( 6.955 -0.000 -1.643) 7.146 5.329 ( -6.081 0.000 -14.410) 15.641 5.642 ( -3.882 0.000 -13.143) 13.705 5.663 ( 1.752 -0.000 4.626) 4.946 5.867 ( 1.353 -0.000 6.285) 6.429 5.892 ( -13.744 0.000 4.335) 14.411 5.990 ( -19.873 0.000 -18.049) 26.846 6.363 ( 2.935 -0.000 1.246) 3.189 6.744 ( 13.827 -0.000 8.982) 16.488 6.853 ( 11.050 -0.000 1.673) 11.176 7.180 ( -3.598 0.000 -1.305) 3.827 7.511 ( 0.520 -0.000 9.101) 9.116 7.600 ( 6.505 -0.000 -10.126) 12.036 7.953 ( -4.181 0.000 10.382) 11.192 8.075 ( -2.794 0.000 -5.818) 6.454 8.130 ( 13.305 -0.000 3.619) 13.789 8.202 ( 2.705 -0.000 -0.093) 2.707 8.348 ( -5.467 0.000 -6.529) 8.516 8.679 ( -2.290 0.000 -1.698) 2.850 8.947 ( 0.332 -0.000 -0.859) 0.921 9.158 ( -3.110 0.000 6.061) 6.812 9.562 ( 1.749 -0.000 -6.282) 6.521 10.445 ( 5.559 -0.000 -4.756) 7.316 10.909 ( 0.026 -0.000 -5.799) 5.799 13.069 ( -11.334 0.000 -18.845) 21.991 13.490 ( -1.765 0.000 -4.626) 4.951 13.920 ( 2.043 -0.000 -5.041) 5.439 14.110 ( -1.660 0.000 0.602) 1.766 14.122 ( 1.124 -0.000 5.362) 5.479 14.449 ( 6.463 -0.000 -2.476) 6.921 14.506 ( 6.559 -0.000 -1.103) 6.651 14.583 ( -1.105 0.000 1.878) 2.179 15.225 ( -4.532 0.000 16.068) 16.695 16.257 ( -2.145 0.000 -1.067) 2.396 16.683 ( -1.914 0.000 5.288) 5.623 17.160 ( 20.127 -0.000 34.265) 39.739 17.935 ( 1.900 -0.000 -3.447) 3.936 18.371 ( 1.152 -0.000 -1.714) 2.065 18.867 ( 0.647 -0.000 -0.787) 1.019 18.904 ( -1.097 0.000 1.379) 1.762 18.960 ( -0.155 0.000 -19.296) 19.296 19.710 ( -17.551 0.000 1.763) 17.639 19.801 ( 1.585 -0.000 -3.084) 3.468 21.053 ( -0.839 0.000 3.150) 3.259 21.486 ( 6.467 -0.000 9.424) 11.429 21.574 ( 1.619 -0.000 0.825) 1.817 21.679 ( -1.876 0.000 -1.453) 2.373 22.497 ( 0.287 -0.000 -2.895) 2.909 23.336 ( 1.110 -0.000 -0.439) 1.193 23.481 ( -1.699 0.000 1.808) 2.481 23.647 ( 9.960 -0.000 1.491) 10.070 23.983 ( -9.161 0.000 -6.271) 11.102 ======================= Grid point 102 (45/128) ======================= q-point: ( 0.00 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.164 ( 5.832 -0.000 27.441) 28.054 1.169 ( 1.617 -0.000 27.506) 27.554 2.235 ( -8.448 0.000 42.257) 43.093 2.509 ( -1.918 0.000 13.809) 13.942 2.764 ( 1.945 -0.000 13.671) 13.808 2.832 ( -3.951 0.000 -1.158) 4.117 2.947 ( -3.450 0.000 5.662) 6.631 2.987 ( 12.493 -0.000 21.343) 24.730 3.268 ( -9.003 0.000 6.227) 10.947 3.365 ( -0.904 0.000 -11.842) 11.876 3.487 ( 2.514 -0.000 -11.273) 11.550 3.520 ( -5.943 0.000 10.123) 11.739 3.681 ( -6.998 0.000 -6.749) 9.722 3.901 ( 3.669 -0.000 -5.444) 6.565 3.967 ( 0.448 -0.000 4.235) 4.258 4.048 ( -4.064 0.000 -0.238) 4.071 4.210 ( 3.740 -0.000 3.310) 4.994 4.302 ( 7.786 -0.000 5.222) 9.375 4.792 ( -0.550 0.000 -14.429) 14.440 5.030 ( 3.560 -0.000 -0.015) 3.560 5.114 ( -6.696 0.000 1.079) 6.782 5.268 ( 13.886 -0.000 -6.336) 15.263 5.314 ( 5.673 -0.000 1.690) 5.919 5.561 ( -8.537 0.000 1.209) 8.622 5.602 ( -13.438 0.000 14.001) 19.407 5.756 ( -4.097 0.000 -1.683) 4.429 6.187 ( 0.898 -0.000 17.858) 17.880 6.449 ( 0.781 -0.000 2.908) 3.011 7.059 ( 3.478 -0.000 -5.895) 6.845 7.075 ( -5.346 0.000 -3.702) 6.503 7.137 ( -16.281 0.000 1.359) 16.337 7.426 ( 6.371 -0.000 -2.952) 7.022 7.452 ( 9.886 -0.000 -12.960) 16.300 7.948 ( 5.969 -0.000 -2.349) 6.414 8.002 ( -0.693 0.000 0.824) 1.076 8.048 ( -11.837 0.000 4.668) 12.724 8.126 ( -0.436 0.000 -4.312) 4.334 8.437 ( 7.950 -0.000 1.036) 8.017 8.598 ( -0.597 0.000 -4.496) 4.536 9.023 ( -0.187 0.000 5.256) 5.259 9.255 ( -0.047 0.000 -14.483) 14.483 9.321 ( -2.572 0.000 12.469) 12.731 10.438 ( 3.137 -0.000 -5.632) 6.446 10.668 ( 2.630 -0.000 -13.392) 13.648 13.312 ( 14.513 -0.000 1.330) 14.573 13.402 ( 3.511 -0.000 -2.809) 4.497 13.843 ( 1.783 -0.000 -4.174) 4.539 14.127 ( 3.057 -0.000 -1.141) 3.263 14.331 ( 2.198 -0.000 6.162) 6.542 14.331 ( 0.900 -0.000 -8.797) 8.843 14.536 ( -4.417 0.000 -0.021) 4.417 14.584 ( 2.567 -0.000 0.631) 2.643 15.450 ( -5.011 0.000 9.112) 10.399 16.180 ( 0.613 -0.000 -3.582) 3.634 16.810 ( -3.215 0.000 8.950) 9.509 17.808 ( -21.016 0.000 6.276) 21.934 17.862 ( 2.129 -0.000 -5.870) 6.244 18.352 ( 2.492 -0.000 -2.318) 3.403 18.636 ( 8.907 -0.000 -0.594) 8.927 18.837 ( -0.606 0.000 -2.109) 2.194 18.922 ( -1.122 0.000 2.363) 2.616 19.323 ( -0.654 0.000 -2.793) 2.869 20.155 ( 4.817 -0.000 14.114) 14.914 21.128 ( -1.367 0.000 3.103) 3.390 21.557 ( -1.076 0.000 -0.323) 1.123 21.615 ( -4.588 0.000 -0.346) 4.601 21.683 ( 1.475 -0.000 0.861) 1.708 22.213 ( -4.949 0.000 -3.561) 6.097 23.368 ( 2.075 -0.000 0.048) 2.075 23.489 ( -2.853 0.000 2.686) 3.918 23.636 ( -8.221 0.000 -5.701) 10.004 23.880 ( 10.636 -0.000 -1.892) 10.803 ======================= Grid point 103 (46/128) ======================= q-point: ( 0.14 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.347 ( 9.706 -3.623 24.812) 26.887 1.455 ( 3.285 -17.157 22.372) 28.384 2.326 ( -3.976 -1.660 30.724) 31.025 2.524 ( -5.798 -1.932 12.245) 13.685 2.672 ( -1.005 8.543 0.961) 8.655 2.825 ( -4.655 4.425 17.485) 18.627 2.928 ( -4.231 -1.644 -5.879) 7.427 3.028 ( -3.312 6.269 1.975) 7.360 3.205 ( -8.820 -3.182 18.292) 20.555 3.297 ( 0.068 5.203 1.279) 5.358 3.434 ( -3.937 -5.826 4.410) 8.300 3.546 ( -0.033 -0.915 -4.445) 4.539 3.715 ( 5.052 -6.432 -0.353) 8.186 3.872 ( 3.519 4.256 -1.931) 5.850 3.973 ( -9.307 -6.030 -2.759) 11.428 4.077 ( 4.408 -2.165 -0.357) 4.924 4.221 ( 0.558 3.271 4.023) 5.215 4.477 ( 1.931 -10.003 5.444) 11.551 4.642 ( 1.233 8.421 -5.305) 10.029 4.982 ( -8.970 6.819 6.631) 13.074 5.152 ( 1.677 -4.467 -2.873) 5.569 5.331 ( -8.148 9.757 12.797) 18.037 5.395 ( 15.168 -4.421 -2.115) 15.940 5.494 ( 6.407 -2.592 -2.854) 7.477 5.597 ( 2.734 -2.269 -3.795) 5.198 5.843 ( -0.317 -11.563 2.150) 11.766 6.180 ( -1.856 7.155 17.248) 18.765 6.414 ( -1.361 4.633 3.101) 5.739 6.881 ( -21.135 3.379 -6.094) 22.254 6.989 ( -5.840 3.242 -2.209) 7.035 7.046 ( -0.100 0.987 -7.399) 7.465 7.274 ( 4.319 11.655 -8.941) 15.311 7.643 ( 10.139 -4.081 -6.004) 12.470 7.810 ( 0.519 13.937 0.457) 13.955 7.970 ( -9.432 -2.026 3.877) 10.397 8.073 ( 7.284 -0.064 -0.542) 7.305 8.215 ( 0.979 -8.260 0.248) 8.322 8.464 ( 2.860 -1.217 -0.273) 3.121 8.714 ( 2.879 -8.721 -5.996) 10.968 9.062 ( -2.333 -3.759 3.936) 5.922 9.233 ( -0.814 -2.838 -9.013) 9.485 9.319 ( -2.182 1.520 9.415) 9.783 10.423 ( -0.375 1.000 -7.723) 7.796 10.671 ( 4.870 -0.011 -12.344) 13.270 13.364 ( 8.780 5.700 -0.568) 10.484 13.484 ( 5.427 -1.478 -3.418) 6.582 13.814 ( 1.760 3.769 -3.839) 5.661 14.134 ( -1.689 0.733 -9.097) 9.281 14.279 ( 5.167 3.484 0.403) 6.245 14.378 ( -1.343 2.003 -1.986) 3.124 14.483 ( -2.488 -3.046 4.625) 6.071 14.669 ( 0.376 -5.022 0.999) 5.134 15.443 ( -4.493 -2.123 8.793) 10.100 16.178 ( 2.142 0.717 -3.986) 4.582 16.809 ( -2.830 -0.396 9.207) 9.640 17.487 ( -25.076 7.654 14.987) 30.199 17.863 ( 2.498 0.379 -5.976) 6.488 18.360 ( -0.960 0.890 -1.803) 2.228 18.751 ( 10.415 -0.911 -5.132) 11.646 18.824 ( -0.767 -0.378 -2.455) 2.600 18.925 ( -0.568 -0.722 2.299) 2.476 19.363 ( 4.166 -2.684 -2.904) 5.744 20.247 ( 2.345 -1.012 14.467) 14.691 21.026 ( -2.846 30.486 15.219) 34.193 21.140 ( -2.360 0.072 2.661) 3.558 21.618 ( -1.252 4.440 1.443) 4.834 21.951 ( -0.322 -14.724 -9.984) 17.793 22.193 ( 0.049 -2.157 -3.301) 3.944 23.396 ( 0.761 1.742 1.367) 2.342 23.545 ( -6.966 -2.688 -4.579) 8.758 23.594 ( -3.921 -14.799 -3.644) 15.738 23.989 ( 10.330 -0.399 -2.895) 10.736 ======================= Grid point 104 (47/128) ======================= q-point: ( 0.29 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.592 ( 12.914 -2.604 20.630) 24.477 1.797 ( -2.762 -15.739 17.089) 23.396 2.235 ( -7.842 9.986 11.768) 17.312 2.474 ( -8.775 4.640 3.189) 10.426 2.587 ( -2.400 4.279 6.438) 8.094 2.648 ( -5.211 10.526 10.348) 15.653 2.922 ( -4.451 -1.496 0.661) 4.742 2.980 ( 2.442 -7.295 -4.481) 8.903 3.212 ( -10.862 -4.677 5.594) 13.083 3.290 ( 0.612 -0.474 14.075) 14.096 3.557 ( 2.885 -3.667 9.780) 10.836 3.600 ( 0.379 -6.091 7.458) 9.637 3.838 ( 3.797 -2.659 -0.902) 4.722 3.872 ( 1.011 -2.047 2.337) 3.267 3.999 ( -7.505 -5.459 -5.142) 10.610 4.014 ( 1.337 8.500 -1.996) 8.833 4.310 ( 4.220 -8.910 5.078) 11.090 4.514 ( -2.684 2.276 5.851) 6.828 4.703 ( 3.000 -8.408 3.899) 9.742 4.798 ( -7.618 7.537 8.815) 13.876 5.092 ( -8.729 12.239 8.073) 17.064 5.177 ( 1.605 2.544 3.137) 4.346 5.467 ( -2.693 2.091 5.669) 6.615 5.673 ( 6.878 -8.413 -0.319) 10.871 5.752 ( 14.580 -3.555 -10.682) 18.421 6.003 ( 1.462 2.051 12.187) 12.444 6.115 ( 2.174 -3.891 5.450) 7.040 6.339 ( -1.917 1.732 0.690) 2.674 6.594 ( -18.513 2.734 -9.162) 20.837 6.831 ( -2.167 9.990 2.135) 10.443 7.012 ( -1.370 -0.903 -6.135) 6.351 7.163 ( 1.509 2.758 -16.247) 16.549 7.578 ( -1.141 15.154 0.799) 15.217 7.758 ( 7.737 -0.882 -3.250) 8.438 7.920 ( -7.065 -1.088 3.869) 8.128 8.150 ( 9.885 1.076 -1.978) 10.138 8.339 ( -0.606 -6.510 -0.421) 6.551 8.559 ( 1.813 -5.844 2.593) 6.646 8.813 ( 1.752 -3.120 -7.272) 8.105 9.076 ( -2.525 -0.881 0.371) 2.700 9.248 ( -4.129 1.602 10.682) 11.564 9.323 ( -0.033 -6.194 -6.718) 9.138 10.375 ( 0.243 1.150 -9.123) 9.198 10.685 ( 4.407 0.073 -11.477) 12.294 13.352 ( 6.209 6.192 -0.338) 8.775 13.507 ( 1.863 1.883 -3.588) 4.460 13.778 ( 3.131 2.191 -1.715) 4.189 14.039 ( -4.269 1.242 -13.108) 13.842 14.244 ( -1.454 4.307 -2.816) 5.347 14.352 ( 3.562 0.806 -0.667) 3.713 14.559 ( -1.110 -5.181 6.055) 8.046 14.725 ( -0.680 -1.429 3.544) 3.882 15.467 ( -4.042 -2.982 9.089) 10.384 16.180 ( 3.020 0.911 -4.543) 5.531 16.819 ( -2.255 -0.678 9.645) 9.928 17.220 ( -16.892 4.078 18.550) 25.418 17.872 ( 3.452 0.071 -6.040) 6.957 18.306 ( -2.543 2.413 -0.862) 3.610 18.797 ( 0.630 0.033 -4.080) 4.129 18.849 ( 5.271 -0.417 -5.607) 7.706 18.945 ( -0.040 -1.299 2.016) 2.399 19.450 ( 4.018 -3.785 -3.497) 6.534 20.301 ( -4.299 -0.484 15.149) 15.755 20.672 ( 0.787 19.084 19.182) 27.069 21.165 ( -0.860 -3.306 2.210) 4.069 21.518 ( -1.853 6.507 2.006) 7.057 22.043 ( -0.547 -4.049 -10.373) 11.148 22.248 ( 3.376 -3.036 -5.143) 6.861 23.340 ( -3.004 3.080 1.347) 4.508 23.538 ( -0.913 -2.644 -1.199) 3.043 23.762 ( -5.991 -14.075 -7.830) 17.185 24.085 ( 9.496 0.396 -3.968) 10.299 ======================= Grid point 105 (48/128) ======================= q-point: ( 0.43 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.709 ( -9.759 5.898 4.042) 12.098 1.898 ( 4.265 -1.803 15.403) 16.084 2.135 ( -1.219 2.417 12.090) 12.390 2.351 ( -3.072 11.751 16.986) 20.882 2.461 ( -3.727 -7.135 -0.973) 8.108 2.556 ( 1.783 5.818 3.634) 7.088 2.944 ( -1.568 -2.015 2.136) 3.329 3.101 ( 0.861 -2.881 1.443) 3.335 3.169 ( -6.743 -4.256 1.348) 8.087 3.398 ( -1.345 -7.254 14.448) 16.223 3.633 ( -4.645 2.747 17.844) 18.642 3.669 ( 1.289 -3.109 -2.975) 4.492 3.803 ( -1.747 8.512 -8.405) 12.089 3.859 ( 2.369 1.484 -1.516) 3.180 3.996 ( -0.638 -0.720 -0.514) 1.090 4.061 ( -1.573 -4.071 5.778) 7.240 4.292 ( -4.917 7.393 17.052) 19.225 4.635 ( -5.490 -1.225 4.733) 7.351 4.702 ( 8.184 -8.492 2.379) 12.031 4.854 ( -3.766 -1.075 -3.465) 5.229 4.893 ( -2.249 -2.859 8.599) 9.337 5.143 ( -0.453 5.400 13.920) 14.937 5.401 ( -4.327 4.696 9.674) 11.592 5.746 ( -9.594 -3.983 11.171) 15.255 5.870 ( 9.052 0.924 -11.936) 15.009 6.003 ( 7.057 7.196 6.893) 12.210 6.270 ( 2.750 -3.200 -0.003) 4.219 6.364 ( -10.750 -2.286 -6.226) 12.631 6.418 ( 2.825 -10.903 -6.540) 13.024 6.734 ( 4.348 2.446 2.446) 5.557 7.004 ( -2.572 -0.834 -3.206) 4.194 7.079 ( -0.225 2.236 -15.454) 15.616 7.363 ( 0.133 10.689 1.102) 10.747 7.823 ( 4.192 -0.053 -5.002) 6.526 7.872 ( -5.721 -0.838 4.165) 7.125 8.230 ( 10.467 1.933 -3.306) 11.145 8.392 ( -2.637 -3.319 -3.460) 5.472 8.643 ( -1.000 -0.859 4.658) 4.841 8.817 ( -0.215 -0.533 -5.015) 5.048 9.082 ( 0.292 -1.725 3.286) 3.723 9.181 ( -2.662 4.760 7.966) 9.654 9.413 ( -0.734 -6.779 -7.993) 10.506 10.349 ( 3.044 0.792 -8.963) 9.499 10.691 ( 2.880 -0.411 -11.459) 11.822 13.289 ( 2.016 7.448 -1.022) 7.783 13.473 ( 1.157 2.143 -3.119) 3.957 13.798 ( 1.167 -1.124 -1.121) 1.970 13.963 ( -0.303 -0.462 -12.069) 12.082 14.159 ( -2.550 1.819 -4.104) 5.163 14.371 ( 3.776 1.654 -1.652) 4.441 14.635 ( -1.056 -3.329 5.449) 6.472 14.726 ( -0.954 1.637 5.397) 5.720 15.498 ( -3.622 -2.306 9.872) 10.765 16.186 ( 2.765 0.363 -5.005) 5.729 16.839 ( -1.767 -0.682 9.935) 10.114 17.112 ( -9.416 -0.674 18.898) 21.125 17.895 ( 3.762 -0.260 -5.912) 7.013 18.247 ( -1.255 1.670 -0.560) 2.162 18.787 ( -0.318 -0.297 -4.255) 4.277 18.874 ( 3.104 0.596 -5.513) 6.355 18.967 ( -0.075 -0.543 1.519) 1.615 19.537 ( 2.296 -4.434 -4.219) 6.537 20.250 ( -10.773 1.938 15.704) 19.142 20.540 ( 2.622 9.261 18.056) 20.461 21.236 ( -0.284 -5.055 4.301) 6.644 21.407 ( -2.097 5.016 1.038) 5.534 22.052 ( 1.702 -0.976 -10.027) 10.217 22.302 ( 2.853 -1.649 -6.475) 7.265 23.279 ( -2.269 1.311 2.144) 3.386 23.581 ( 2.501 -1.543 0.386) 2.964 23.848 ( -6.685 -9.005 -7.959) 13.752 24.145 ( 8.650 2.784 -5.338) 10.539 ======================= Grid point 106 (49/128) ======================= q-point: (-0.43 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.418 ( -18.206 7.213 3.400) 19.876 1.974 ( 1.341 14.636 14.420) 20.590 2.116 ( 0.551 -2.006 16.146) 16.279 2.286 ( 9.682 0.320 8.494) 12.884 2.503 ( 0.907 3.122 3.589) 4.842 2.666 ( 2.886 -9.578 11.805) 15.474 2.925 ( -3.813 -1.217 -0.583) 4.045 3.133 ( -1.953 -2.615 8.308) 8.926 3.186 ( -4.949 1.704 -0.967) 5.323 3.360 ( -10.490 13.474 15.776) 23.248 3.606 ( 4.947 -0.658 14.805) 15.624 3.669 ( -7.121 2.061 -6.442) 9.821 3.749 ( 4.348 -2.103 -1.195) 4.975 3.773 ( -3.230 6.844 0.478) 7.583 3.887 ( 2.668 7.024 5.790) 9.486 4.012 ( -2.395 2.971 0.599) 3.863 4.355 ( -0.340 -4.795 -0.217) 4.812 4.572 ( -1.386 3.835 1.086) 4.220 4.801 ( -2.710 -3.979 1.472) 5.034 4.895 ( -1.175 -4.257 0.687) 4.469 5.033 ( -3.954 -4.397 15.688) 16.766 5.157 ( -1.610 -4.095 14.351) 15.010 5.324 ( -0.748 -0.281 9.668) 9.701 5.745 ( -5.760 -1.627 2.089) 6.339 5.838 ( 0.199 8.492 -0.177) 8.496 5.898 ( -7.215 0.456 -5.676) 9.191 6.236 ( -0.289 1.145 -3.047) 3.267 6.439 ( 5.906 -4.489 4.865) 8.871 6.659 ( 1.319 -9.597 -0.548) 9.703 6.804 ( 2.991 -3.740 -10.207) 11.275 6.953 ( 1.684 -4.894 1.683) 5.442 7.093 ( 5.013 -2.241 -4.591) 7.157 7.262 ( 0.602 3.633 -0.864) 3.782 7.781 ( -6.302 -0.387 -1.687) 6.535 7.893 ( 2.524 -1.415 -4.112) 5.028 8.278 ( 8.055 3.725 -3.112) 9.404 8.365 ( -2.289 1.555 -5.394) 6.062 8.581 ( -5.540 3.690 3.583) 7.559 8.825 ( 1.387 0.633 -0.711) 1.682 9.111 ( 0.132 4.797 6.350) 7.959 9.153 ( 1.265 -3.841 5.773) 7.048 9.448 ( -0.926 -2.262 -10.282) 10.569 10.355 ( 5.608 1.105 -8.759) 10.459 10.694 ( 1.615 -1.485 -11.667) 11.872 13.174 ( -0.681 6.982 -0.799) 7.061 13.455 ( 1.681 1.228 -2.964) 3.623 13.799 ( -2.581 -1.731 -5.977) 6.737 13.990 ( 4.953 -2.340 -5.257) 7.593 14.120 ( -1.384 -1.034 -2.811) 3.299 14.372 ( 3.718 2.072 -3.835) 5.729 14.648 ( -1.620 2.434 5.351) 6.098 14.710 ( -0.452 0.711 4.636) 4.712 15.517 ( -3.285 -0.894 10.222) 10.774 16.194 ( 1.311 -0.414 -5.085) 5.268 16.851 ( -2.621 0.110 9.546) 9.900 17.160 ( -2.323 -6.144 19.958) 21.011 17.915 ( 2.059 -0.160 -5.431) 5.811 18.238 ( 3.162 0.231 -0.928) 3.303 18.771 ( -1.354 -0.405 -5.454) 5.634 18.869 ( 1.745 1.172 -4.489) 4.956 18.967 ( -1.004 0.336 1.792) 2.081 19.600 ( -0.603 -3.802 -6.216) 7.311 20.134 ( -10.555 3.780 15.138) 18.838 20.525 ( -1.739 -0.037 19.837) 19.913 21.274 ( -3.250 2.535 8.609) 9.545 21.393 ( 0.915 -6.248 -2.360) 6.742 22.054 ( 4.027 0.946 -9.590) 10.444 22.321 ( 1.103 -0.959 -6.930) 7.082 23.271 ( -0.039 -0.973 2.427) 2.615 23.636 ( 5.244 0.047 0.874) 5.316 23.860 ( -6.933 -4.982 -7.400) 11.298 24.137 ( 7.662 7.420 -7.774) 13.198 ======================= Grid point 107 (50/128) ======================= q-point: (-0.29 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.184 ( -11.552 5.640 15.132) 19.855 1.684 ( -3.394 24.163 16.089) 29.227 2.253 ( -0.618 -7.472 14.598) 16.411 2.467 ( 9.324 0.281 16.721) 19.147 2.515 ( 1.714 -0.983 6.787) 7.069 2.735 ( 3.171 8.702 17.806) 20.071 2.840 ( -11.018 15.006 17.306) 25.418 3.048 ( -0.319 -11.806 4.772) 12.738 3.173 ( -2.758 -2.766 -1.605) 4.223 3.265 ( 1.380 3.298 1.986) 4.089 3.560 ( -1.738 -0.653 -4.481) 4.851 3.608 ( -4.501 0.423 2.139) 5.001 3.766 ( 1.638 0.797 -2.572) 3.152 3.803 ( -3.690 3.617 3.829) 6.431 3.874 ( 8.807 -0.439 12.764) 15.514 3.990 ( 3.945 -0.316 -0.507) 3.990 4.354 ( -0.775 0.963 -8.832) 8.918 4.475 ( 1.736 9.371 -0.677) 9.555 4.778 ( -7.540 1.934 -5.760) 9.683 4.949 ( -0.817 -6.617 8.052) 10.455 5.086 ( -3.934 -3.385 10.370) 11.597 5.149 ( -6.551 -0.610 15.965) 17.268 5.537 ( 2.062 -12.101 4.296) 13.006 5.610 ( -5.998 10.027 -6.765) 13.501 5.657 ( -9.002 0.192 -1.530) 9.133 5.933 ( -0.466 -4.704 10.148) 11.195 6.202 ( -2.114 3.964 -1.735) 4.815 6.448 ( -3.007 6.735 -3.567) 8.194 6.711 ( 3.557 -8.418 4.624) 10.242 7.026 ( 4.362 -9.156 3.145) 10.618 7.131 ( 8.348 -2.881 -2.451) 9.165 7.184 ( 1.657 -10.019 -6.019) 11.805 7.267 ( 2.836 -3.780 -0.721) 4.780 7.739 ( -4.800 -3.131 -1.378) 5.894 7.931 ( 1.846 -3.604 -7.974) 8.943 8.238 ( 0.100 6.303 -1.781) 6.551 8.298 ( -0.790 2.225 -3.102) 3.898 8.477 ( -1.366 6.072 1.513) 6.405 8.795 ( 1.115 4.319 -1.509) 4.709 9.075 ( 1.754 3.956 5.880) 7.300 9.240 ( 0.219 -3.152 6.665) 7.376 9.408 ( -0.957 1.419 -11.204) 11.334 10.376 ( 6.756 1.338 -8.648) 11.055 10.697 ( 0.900 -1.613 -11.980) 12.122 13.086 ( 1.346 4.018 2.479) 4.909 13.440 ( 1.730 1.860 -3.994) 4.734 13.788 ( -0.819 -2.171 -6.576) 6.973 14.069 ( 3.177 -2.473 -0.375) 4.043 14.145 ( 1.166 -3.024 -1.917) 3.765 14.369 ( 4.087 1.417 -5.733) 7.182 14.585 ( -2.090 4.269 4.927) 6.846 14.700 ( 0.206 2.385 2.509) 3.468 15.514 ( -3.597 0.546 9.936) 10.581 16.194 ( -0.293 -0.784 -4.543) 4.620 16.841 ( -3.401 0.571 9.095) 9.727 17.372 ( 3.789 -12.178 19.493) 23.295 17.909 ( -0.156 0.029 -4.737) 4.739 18.297 ( 8.023 -0.122 -1.786) 8.220 18.725 ( -4.376 0.503 -6.722) 8.037 18.855 ( 1.092 0.983 -2.662) 3.040 18.951 ( -1.667 0.529 2.225) 2.830 19.567 ( -7.526 0.554 -8.127) 11.090 20.044 ( -3.251 2.881 15.886) 16.469 20.656 ( -5.740 -14.959 21.658) 26.941 21.216 ( -3.415 2.235 6.124) 7.359 21.516 ( 0.611 -7.627 0.214) 7.654 22.039 ( 5.542 4.494 -8.853) 11.370 22.318 ( -0.992 -1.372 -7.028) 7.229 23.313 ( 1.297 -2.160 1.853) 3.128 23.696 ( 7.793 1.274 0.515) 7.913 23.818 ( -7.139 -2.085 -6.839) 10.104 24.006 ( 4.991 15.286 -10.745) 19.340 ======================= Grid point 108 (51/128) ======================= q-point: (-0.14 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.096 ( -2.772 3.831 25.587) 26.020 1.307 ( -2.365 23.957 21.414) 32.219 2.283 ( -12.597 5.449 35.653) 38.203 2.491 ( -0.438 1.230 18.389) 18.435 2.630 ( 4.679 -4.023 12.731) 14.148 2.752 ( 6.856 0.042 20.654) 21.762 2.815 ( 5.878 -2.501 5.242) 8.263 3.060 ( -3.995 7.338 0.621) 8.378 3.241 ( -3.860 -10.032 1.274) 10.824 3.307 ( 3.266 -4.721 -3.286) 6.615 3.529 ( -4.899 0.389 -4.899) 6.940 3.617 ( 3.179 5.306 3.076) 6.908 3.720 ( -5.849 -3.338 -1.487) 6.896 3.775 ( 2.883 -4.689 -4.764) 7.280 3.971 ( 4.193 1.063 6.049) 7.437 4.105 ( 8.840 -1.504 8.888) 12.626 4.212 ( -8.429 8.807 -4.131) 12.871 4.337 ( 6.117 11.010 -4.074) 13.238 4.724 ( -3.139 -7.922 -10.941) 13.868 5.072 ( 1.267 -4.099 3.835) 5.754 5.124 ( -2.884 -4.059 4.398) 6.644 5.141 ( 3.061 4.550 4.636) 7.181 5.392 ( -2.801 8.099 -4.687) 9.768 5.540 ( -15.124 -7.706 4.093) 17.460 5.710 ( -3.188 -3.439 2.394) 5.266 5.955 ( -9.759 11.199 2.590) 15.079 6.081 ( 1.151 -3.105 14.314) 14.693 6.403 ( 1.428 -1.861 0.084) 2.347 6.940 ( 7.066 -9.118 2.936) 11.903 7.123 ( -1.622 -1.027 -2.289) 2.987 7.160 ( 5.585 0.602 3.192) 6.461 7.312 ( -8.946 -9.072 -3.045) 13.099 7.427 ( 10.577 -3.818 -10.872) 15.641 7.800 ( -0.140 -9.524 -2.054) 9.744 8.001 ( 1.924 -3.675 -6.221) 7.477 8.139 ( -3.046 3.379 3.356) 5.653 8.223 ( -6.155 2.328 -3.365) 7.391 8.382 ( 5.789 7.250 0.364) 9.285 8.708 ( 0.433 7.325 -3.379) 8.078 9.042 ( 1.493 4.604 5.011) 6.967 9.283 ( -1.564 -1.580 2.091) 3.052 9.336 ( -1.267 2.049 -5.890) 6.364 10.406 ( 6.158 0.565 -6.698) 9.116 10.687 ( 0.889 -0.693 -12.753) 12.803 13.131 ( 9.280 -1.514 5.789) 11.043 13.412 ( 2.715 2.862 -3.972) 5.598 13.812 ( 1.095 -2.751 -5.048) 5.852 14.112 ( 1.614 0.369 1.329) 2.123 14.223 ( 2.666 -4.946 -1.524) 5.822 14.378 ( 3.701 1.666 -5.186) 6.586 14.525 ( -2.318 0.748 2.884) 3.775 14.650 ( 0.418 5.144 0.855) 5.231 15.486 ( -4.552 1.182 9.448) 10.554 16.187 ( -0.596 -0.622 -3.797) 3.893 16.823 ( -3.468 0.434 8.883) 9.545 17.697 ( 4.396 -15.015 11.247) 19.268 17.889 ( -1.498 -0.334 -3.686) 3.992 18.364 ( 7.179 2.767 -3.683) 8.530 18.629 ( -5.335 1.410 -3.047) 6.304 18.847 ( 0.355 0.293 -1.889) 1.945 18.933 ( -1.677 0.344 2.400) 2.948 19.413 ( -8.678 3.019 -5.096) 10.506 20.071 ( 3.633 0.944 14.505) 14.983 21.011 ( -3.578 -26.859 14.465) 30.716 21.189 ( -4.642 -4.858 6.737) 9.515 21.623 ( -0.030 -5.011 0.815) 5.077 21.949 ( 5.308 13.053 -8.449) 16.430 22.289 ( -4.388 -0.471 -6.619) 7.955 23.359 ( 1.621 -0.682 0.891) 1.971 23.687 ( -1.259 18.171 -5.559) 19.044 23.734 ( -4.362 0.566 -5.150) 6.773 23.790 ( 6.952 2.236 -2.796) 7.820 ======================= Grid point 110 (52/128) ======================= q-point: ( 0.14 0.14 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.422 ( 6.611 -0.000 24.543) 25.418 1.556 ( 15.651 -0.000 22.633) 27.517 2.362 ( -2.597 0.000 25.376) 25.508 2.476 ( -8.712 0.000 9.531) 12.913 2.715 ( -11.830 0.000 4.777) 12.758 2.801 ( 2.655 -0.000 -0.651) 2.734 2.876 ( -22.574 0.000 -1.828) 22.648 2.957 ( -3.121 0.000 16.941) 17.226 3.247 ( -2.309 0.000 -9.763) 10.033 3.276 ( 0.046 -0.000 19.438) 19.438 3.431 ( -1.748 0.000 23.639) 23.703 3.490 ( 2.226 -0.000 -11.208) 11.427 3.732 ( 7.909 -0.000 -3.249) 8.550 3.785 ( -6.187 0.000 -4.917) 7.903 3.977 ( -2.188 0.000 1.529) 2.670 4.096 ( 8.363 -0.000 -1.077) 8.432 4.299 ( 1.597 -0.000 -0.532) 1.683 4.400 ( -1.870 0.000 13.799) 13.925 4.746 ( 2.783 -0.000 -6.068) 6.676 4.917 ( -11.846 0.000 -3.176) 12.264 5.099 ( 3.807 -0.000 0.010) 3.807 5.410 ( -6.991 0.000 21.772) 22.867 5.435 ( -9.404 0.000 -1.282) 9.491 5.488 ( 9.866 -0.000 -1.108) 9.928 5.714 ( 17.942 -0.000 -1.304) 17.989 5.801 ( 12.874 -0.000 -6.324) 14.343 6.277 ( -0.480 0.000 12.891) 12.900 6.459 ( -2.177 0.000 7.229) 7.549 6.633 ( -23.112 0.000 -10.025) 25.192 6.892 ( -7.686 0.000 -4.684) 9.001 7.036 ( 0.247 -0.000 -12.240) 12.243 7.489 ( -1.209 0.000 1.427) 1.871 7.592 ( 8.388 -0.000 -8.308) 11.806 7.863 ( -8.558 0.000 3.811) 9.369 7.992 ( -2.946 0.000 -9.321) 9.775 8.061 ( 3.660 -0.000 3.275) 4.911 8.167 ( 7.893 -0.000 4.036) 8.865 8.575 ( 1.289 -0.000 -6.744) 6.866 8.593 ( 6.296 -0.000 2.673) 6.839 9.013 ( -3.773 0.000 5.325) 6.526 9.169 ( -0.368 0.000 -11.484) 11.490 9.341 ( -3.208 0.000 12.625) 13.026 10.386 ( -2.359 0.000 -9.733) 10.015 10.696 ( 5.982 -0.000 -11.073) 12.585 13.487 ( 5.352 -0.000 -1.591) 5.583 13.528 ( 7.127 -0.000 -4.930) 8.666 13.849 ( 0.977 -0.000 -4.221) 4.333 14.067 ( -5.965 0.000 -14.253) 15.451 14.372 ( 5.485 -0.000 0.650) 5.523 14.373 ( -2.693 0.000 -0.908) 2.842 14.457 ( -1.543 0.000 5.762) 5.965 14.616 ( -0.078 0.000 1.095) 1.098 15.406 ( -4.395 0.000 10.448) 11.335 16.205 ( 3.592 -0.000 -3.656) 5.125 16.807 ( -2.370 0.000 9.548) 9.838 17.306 ( -25.014 0.000 16.643) 30.045 17.863 ( 1.503 -0.000 -6.299) 6.476 18.381 ( 0.914 -0.000 -1.054) 1.395 18.804 ( -0.542 0.000 -2.421) 2.481 18.816 ( 6.911 -0.000 -6.998) 9.836 18.918 ( -0.892 0.000 2.005) 2.194 19.397 ( 6.621 -0.000 -3.504) 7.491 20.287 ( -2.001 0.000 15.955) 16.080 21.113 ( -1.195 0.000 1.333) 1.791 21.470 ( -6.657 0.000 1.011) 6.734 21.539 ( -1.090 0.000 2.278) 2.525 21.722 ( 1.759 -0.000 -0.035) 1.759 22.179 ( 2.671 -0.000 -3.162) 4.139 23.412 ( 1.168 -0.000 -0.132) 1.176 23.445 ( -6.683 0.000 -3.632) 7.606 23.447 ( -1.748 0.000 2.838) 3.333 24.082 ( 9.840 -0.000 -4.280) 10.730 ======================= Grid point 111 (53/128) ======================= q-point: ( 0.29 0.14 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.646 ( 4.578 -8.738 19.393) 21.758 1.808 ( 16.617 -1.098 22.286) 27.821 2.279 ( -19.498 8.864 5.714) 22.167 2.362 ( -9.795 0.232 4.592) 10.820 2.578 ( -14.854 -4.553 13.443) 20.544 2.812 ( 0.287 -3.821 2.537) 4.595 2.830 ( -3.922 -0.861 6.390) 7.546 2.906 ( 1.363 7.094 6.493) 9.713 3.137 ( -0.585 4.067 -0.158) 4.111 3.306 ( -3.565 -0.368 8.020) 8.784 3.545 ( 1.806 -6.389 2.329) 7.036 3.563 ( 0.169 -4.380 14.149) 14.812 3.765 ( -5.204 -6.614 -4.590) 9.586 3.840 ( 8.201 -2.620 -1.375) 8.719 3.938 ( 2.210 2.916 4.850) 6.076 4.196 ( 5.414 7.624 -5.626) 10.913 4.253 ( 2.787 -4.264 4.752) 6.966 4.478 ( -3.431 -4.572 10.804) 12.223 4.689 ( -1.659 2.443 0.979) 3.111 4.823 ( -4.356 0.887 1.742) 4.775 5.171 ( 2.848 -3.165 -3.213) 5.334 5.214 ( -10.254 10.604 7.511) 16.553 5.426 ( -5.902 -2.469 10.590) 12.373 5.637 ( 3.450 -2.286 6.203) 7.457 5.861 ( 9.828 -0.502 -1.958) 10.033 5.965 ( 7.512 -6.658 -5.719) 11.553 6.264 ( 7.214 6.109 5.931) 11.159 6.383 ( -14.782 1.154 -7.372) 16.558 6.410 ( -2.319 5.686 5.460) 8.217 6.824 ( -6.325 -1.649 -2.110) 6.869 7.007 ( 1.678 -0.342 -11.305) 11.434 7.306 ( 2.522 14.742 -3.541) 15.369 7.702 ( -3.373 -0.588 0.496) 3.459 7.809 ( -6.397 0.685 0.885) 6.494 7.830 ( 2.381 3.946 -6.870) 8.273 8.182 ( -1.961 -8.010 -3.817) 9.087 8.281 ( 10.229 0.087 0.489) 10.242 8.560 ( 4.245 -1.426 3.315) 5.572 8.738 ( 2.255 -5.640 -4.182) 7.374 9.004 ( -5.241 -2.863 4.338) 7.381 9.165 ( -0.004 -3.945 -7.869) 8.803 9.322 ( -3.561 2.367 11.443) 12.216 10.333 ( -1.938 -0.775 -11.185) 11.378 10.718 ( 5.555 1.066 -10.364) 11.807 13.504 ( 5.844 4.569 -1.666) 7.603 13.556 ( 2.930 2.240 -3.454) 5.053 13.831 ( 1.251 1.507 -3.280) 3.821 13.940 ( -7.189 -0.110 -16.010) 17.550 14.272 ( -5.082 4.774 -3.257) 7.696 14.406 ( 3.287 1.354 1.521) 3.867 14.509 ( 1.201 -3.265 5.334) 6.368 14.670 ( -1.251 -5.162 2.538) 5.887 15.411 ( -3.926 -1.823 11.294) 12.095 16.227 ( 4.343 1.179 -3.786) 5.881 16.817 ( -1.925 -0.492 9.939) 10.136 17.122 ( -17.135 0.660 17.555) 24.541 17.866 ( 1.394 -0.867 -6.376) 6.584 18.351 ( 0.026 3.470 -0.735) 3.547 18.790 ( 0.241 0.613 -2.925) 2.998 18.864 ( 3.292 -1.122 -6.108) 7.029 18.925 ( -0.629 -1.560 1.263) 2.103 19.459 ( 5.573 -0.788 -3.724) 6.749 20.293 ( -6.346 0.487 17.543) 18.662 21.098 ( 2.043 23.866 9.221) 25.666 21.120 ( -0.557 -1.053 1.001) 1.556 21.579 ( -3.507 3.117 2.355) 5.250 21.879 ( -0.605 -11.770 -6.137) 13.288 22.230 ( 4.466 -2.656 -4.576) 6.924 23.337 ( -5.291 2.455 -0.456) 5.851 23.486 ( 1.672 -3.918 0.356) 4.275 23.502 ( -3.251 -9.435 -1.483) 10.089 24.167 ( 8.569 -0.223 -5.596) 10.237 ======================= Grid point 112 (54/128) ======================= q-point: ( 0.43 0.14 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.672 ( -16.218 7.084 6.667) 18.911 2.032 ( 6.204 1.141 20.488) 21.437 2.137 ( 0.275 -8.914 11.227) 14.338 2.273 ( -2.679 -1.976 1.189) 3.535 2.549 ( -12.209 -3.286 9.087) 15.570 2.632 ( -5.091 15.134 15.791) 22.457 2.908 ( 1.332 0.159 -1.265) 1.844 2.992 ( 1.093 -10.546 2.999) 11.019 3.121 ( 3.976 0.676 0.101) 4.035 3.321 ( -3.582 -3.415 9.784) 10.965 3.594 ( -3.762 -3.111 -5.127) 7.079 3.674 ( 1.880 -2.492 13.313) 13.674 3.804 ( -3.410 -5.263 -6.900) 9.324 3.912 ( 3.407 2.765 -3.770) 5.785 4.017 ( 7.587 -0.424 4.958) 9.073 4.097 ( 4.495 3.549 6.633) 8.763 4.388 ( 0.033 -0.134 12.432) 12.433 4.542 ( 0.146 -3.943 3.121) 5.031 4.678 ( -6.111 -6.345 6.445) 10.915 4.800 ( 2.387 2.750 2.092) 4.199 4.955 ( -6.722 11.143 3.756) 13.545 5.204 ( -0.435 0.077 -3.669) 3.696 5.432 ( -4.818 0.548 15.757) 16.487 5.572 ( -17.547 -1.918 18.109) 25.289 5.934 ( 4.858 2.436 -9.149) 10.641 6.095 ( -4.615 -2.185 -7.544) 9.110 6.231 ( -1.376 -3.437 0.311) 3.715 6.325 ( 11.673 3.711 -0.336) 12.254 6.369 ( 4.618 1.162 2.583) 5.417 6.799 ( 0.402 -1.362 1.284) 1.915 7.031 ( 4.907 -1.450 -6.237) 8.067 7.106 ( 2.243 12.308 -10.108) 16.084 7.522 ( -4.194 10.722 -1.356) 11.593 7.758 ( -9.342 -2.144 1.797) 9.752 7.859 ( 4.678 -1.085 -5.497) 7.299 8.245 ( -4.706 -6.808 -5.143) 9.744 8.369 ( 10.378 2.205 -3.115) 11.057 8.677 ( 4.284 -2.752 7.494) 9.060 8.766 ( -1.925 -1.004 -5.315) 5.742 9.019 ( -4.641 -4.318 4.127) 7.564 9.240 ( 1.169 -4.742 -1.373) 5.073 9.277 ( -2.589 0.672 3.952) 4.772 10.314 ( -0.217 -2.672 -11.326) 11.639 10.716 ( 4.619 2.119 -10.209) 11.404 13.432 ( 0.744 8.579 -2.226) 8.894 13.527 ( 2.580 3.054 -1.765) 4.370 13.785 ( -2.760 1.374 -7.531) 8.137 13.898 ( 1.455 -3.607 -8.962) 9.770 14.149 ( -3.915 2.809 -4.065) 6.304 14.413 ( 1.319 1.060 0.008) 1.692 14.588 ( 0.349 -3.711 4.305) 5.694 14.728 ( -1.504 -2.287 4.488) 5.257 15.441 ( -3.838 -2.760 11.192) 12.149 16.234 ( 4.115 2.146 -4.421) 6.410 16.839 ( -1.801 -0.778 9.990) 10.181 17.039 ( -10.034 -1.845 17.704) 20.434 17.876 ( 0.405 -1.418 -6.081) 6.257 18.301 ( 1.896 3.144 -0.841) 3.767 18.771 ( -0.294 0.681 -3.504) 3.582 18.879 ( 0.757 -0.346 -3.796) 3.886 18.953 ( -0.058 -1.713 -0.194) 1.725 19.513 ( 3.602 -1.223 -3.501) 5.170 20.242 ( -8.309 2.720 18.415) 20.385 20.844 ( 4.052 17.722 11.782) 21.664 21.168 ( 0.150 -4.331 1.546) 4.601 21.468 ( -4.031 5.979 2.884) 7.766 21.982 ( 0.506 -5.647 -8.293) 10.046 22.298 ( 4.206 -1.548 -6.121) 7.587 23.265 ( -3.775 0.646 1.512) 4.118 23.567 ( 2.485 -4.040 1.086) 4.866 23.616 ( -4.026 -9.786 -4.175) 11.376 24.231 ( 6.894 0.345 -7.056) 9.871 ======================= Grid point 113 (55/128) ======================= q-point: (-0.43 0.14 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.386 ( -14.272 7.330 10.532) 19.192 2.052 ( -5.377 -2.736 9.368) 11.142 2.304 ( 5.295 12.573 13.426) 19.141 2.386 ( 0.027 -6.043 14.931) 16.107 2.470 ( -14.472 -4.917 7.913) 17.212 2.519 ( 8.888 -4.509 5.899) 11.581 2.879 ( -5.353 -0.542 -2.788) 6.060 3.137 ( 2.192 1.327 -1.274) 2.862 3.154 ( 1.950 -3.465 10.914) 11.616 3.386 ( -0.820 -3.636 1.516) 4.024 3.560 ( -4.523 -1.575 -6.432) 8.020 3.769 ( 4.598 -0.326 10.229) 11.220 3.797 ( -2.120 1.370 -8.082) 8.467 3.870 ( 4.225 7.298 12.352) 14.956 4.049 ( 3.220 1.782 1.997) 4.187 4.094 ( -0.372 10.860 6.971) 12.910 4.385 ( 4.131 5.120 11.742) 13.459 4.523 ( -4.695 -2.572 2.927) 6.101 4.737 ( -4.631 0.049 -3.740) 5.953 4.791 ( -3.902 -3.947 0.965) 5.633 4.927 ( 0.304 -9.647 8.602) 12.929 5.151 ( -4.807 0.736 3.637) 6.073 5.384 ( -4.398 5.033 19.269) 20.396 5.590 ( -9.959 -10.034 18.356) 23.169 5.816 ( -8.498 5.647 -7.455) 12.636 5.951 ( -1.007 5.930 -6.783) 9.066 6.309 ( 0.929 3.398 0.079) 3.523 6.387 ( 3.298 -4.967 3.075) 6.709 6.522 ( 9.455 -10.476 -5.785) 15.252 6.870 ( -3.750 7.145 -10.833) 13.508 6.943 ( 12.723 -0.073 4.465) 13.484 7.102 ( 6.176 -2.110 -6.519) 9.224 7.349 ( -2.040 6.442 -0.654) 6.789 7.690 ( -8.405 -1.424 -0.277) 8.529 7.892 ( 3.050 0.004 -6.707) 7.368 8.258 ( -6.190 -4.159 -4.445) 8.682 8.400 ( 5.775 3.821 -5.001) 8.542 8.674 ( 1.717 6.176 4.463) 7.811 8.810 ( 0.928 -4.119 0.099) 4.224 9.058 ( -4.981 -4.385 6.577) 9.343 9.239 ( 1.599 2.491 7.619) 8.174 9.342 ( 1.142 -5.579 -10.331) 11.797 10.339 ( 1.242 -3.775 -10.678) 11.393 10.695 ( 3.972 2.051 -10.442) 11.358 13.282 ( -1.682 8.030 -1.620) 8.362 13.505 ( 2.445 2.738 -1.269) 3.884 13.728 ( -1.859 -0.488 -7.868) 8.099 13.973 ( 4.252 -4.197 -5.998) 8.466 14.089 ( -1.334 -0.210 -3.242) 3.512 14.402 ( 0.263 0.941 -2.330) 2.526 14.649 ( -0.678 -2.252 4.320) 4.919 14.734 ( -1.584 0.949 5.276) 5.589 15.479 ( -3.600 -2.718 10.567) 11.490 16.220 ( 2.815 2.443 -5.356) 6.525 16.851 ( -3.013 -0.076 9.445) 9.914 17.081 ( -4.291 -6.220 18.842) 20.301 17.874 ( -1.802 -1.346 -5.381) 5.832 18.308 ( 6.157 0.661 -1.959) 6.494 18.737 ( -1.820 0.866 -3.987) 4.468 18.875 ( 0.153 0.032 -3.047) 3.051 18.965 ( -0.587 -0.213 0.539) 0.825 19.547 ( 1.230 -0.912 -3.638) 3.947 20.163 ( -6.055 4.025 18.041) 19.451 20.672 ( -0.651 12.009 13.935) 18.407 21.261 ( -0.057 -5.362 5.086) 7.391 21.351 ( -2.920 3.838 0.364) 4.836 22.038 ( 2.491 -3.303 -9.491) 10.353 22.321 ( 2.689 0.719 -6.790) 7.338 23.251 ( -1.512 -1.562 2.673) 3.446 23.668 ( 3.355 -4.119 0.175) 5.315 23.683 ( -3.323 -5.878 -3.942) 7.819 24.250 ( 4.764 2.463 -9.316) 10.749 ======================= Grid point 114 (56/128) ======================= q-point: (-0.29 0.14 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.251 ( -3.144 4.789 20.959) 21.727 2.036 ( -3.945 15.036 18.558) 24.208 2.166 ( -1.354 -3.350 10.719) 11.311 2.401 ( -10.203 -6.577 1.406) 12.220 2.560 ( 1.497 -4.032 13.647) 14.309 2.798 ( 3.327 -9.142 -3.570) 10.363 2.831 ( -0.121 -3.429 8.926) 9.563 3.048 ( -5.249 4.557 -0.378) 6.961 3.242 ( 2.621 4.449 13.033) 14.018 3.345 ( -2.452 4.588 -1.722) 5.480 3.527 ( -1.105 6.113 10.136) 11.888 3.654 ( 0.309 5.224 -2.094) 5.636 3.793 ( -3.613 3.514 5.121) 7.185 3.845 ( 5.021 1.774 -1.318) 5.486 4.040 ( 4.163 2.888 7.035) 8.669 4.051 ( 6.423 3.362 6.210) 9.546 4.358 ( 1.007 3.936 -2.735) 4.898 4.558 ( 0.362 -1.311 -0.007) 1.360 4.681 ( -7.723 -1.714 -1.196) 8.000 4.833 ( -5.123 -6.715 7.416) 11.239 5.059 ( -1.772 -2.303 11.493) 11.855 5.101 ( -7.380 -0.498 9.909) 12.365 5.399 ( -1.327 -6.373 7.899) 10.236 5.621 ( -5.607 4.066 1.841) 7.166 5.682 ( -1.429 0.917 0.633) 1.812 5.874 ( -1.565 -0.557 6.703) 6.906 6.255 ( -0.292 3.814 -3.038) 4.885 6.490 ( -1.555 0.936 -2.076) 2.757 6.597 ( -2.237 -1.389 -4.019) 4.805 6.866 ( 5.996 -13.455 -3.037) 15.040 7.087 ( 2.062 -2.295 -2.208) 3.794 7.187 ( 6.063 -0.394 -7.889) 9.958 7.311 ( 6.413 -1.080 5.571) 8.563 7.637 ( -6.254 -2.832 -2.001) 7.151 7.892 ( 2.321 -0.436 -8.850) 9.159 8.221 ( -6.765 -1.092 -2.305) 7.230 8.344 ( 1.438 5.777 -1.696) 6.190 8.624 ( 4.607 6.607 2.641) 8.476 8.845 ( 0.994 0.868 -2.816) 3.109 9.084 ( -3.878 -3.151 7.523) 9.031 9.263 ( 0.344 -0.056 6.843) 6.852 9.376 ( 2.948 -0.391 -11.466) 11.846 10.380 ( 1.837 -3.130 -9.847) 10.494 10.679 ( 3.657 1.061 -11.197) 11.826 13.173 ( 0.948 4.376 1.022) 4.593 13.485 ( 1.986 2.094 -2.280) 3.678 13.715 ( -0.395 -2.230 -6.458) 6.843 14.069 ( 5.053 -3.901 -5.339) 8.322 14.103 ( 0.801 -2.226 -0.943) 2.547 14.380 ( -0.387 0.325 -4.598) 4.626 14.646 ( -1.950 3.296 6.035) 7.148 14.723 ( -0.845 -0.063 3.147) 3.259 15.505 ( -3.180 -1.052 9.574) 10.143 16.191 ( 1.229 1.663 -5.748) 6.109 16.840 ( -3.512 0.456 9.109) 9.773 17.242 ( -2.908 -11.258 19.635) 22.819 17.853 ( -2.532 -1.265 -5.052) 5.791 18.385 ( 7.643 -1.229 -4.175) 8.796 18.680 ( -2.368 1.854 -3.074) 4.300 18.863 ( -0.138 0.376 -2.640) 2.670 18.955 ( -0.827 0.832 1.780) 2.132 19.525 ( -1.689 2.605 -4.174) 5.202 20.123 ( -0.288 2.637 16.965) 17.171 20.566 ( -6.152 1.951 18.425) 19.523 21.244 ( -3.227 3.588 5.708) 7.474 21.402 ( 0.856 -7.609 -0.181) 7.659 22.081 ( 3.804 -1.450 -10.280) 11.057 22.299 ( 0.759 1.735 -6.453) 6.725 23.289 ( 0.201 -2.865 2.636) 3.898 23.686 ( -5.644 -3.338 -4.855) 8.159 23.780 ( 7.727 -1.558 0.448) 7.895 24.179 ( 1.481 7.535 -12.541) 14.705 ======================= Grid point 115 (57/128) ======================= q-point: (-0.14 0.14 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.261 ( 4.332 4.853 26.143) 26.941 1.735 ( -2.131 23.606 18.278) 29.931 2.275 ( -5.765 -6.103 17.759) 19.643 2.496 ( -1.193 -11.767 -0.106) 11.828 2.601 ( -4.370 3.820 23.001) 23.722 2.773 ( -6.812 -1.107 6.884) 9.747 2.920 ( 3.229 -1.558 0.546) 3.626 3.088 ( -3.180 6.111 -2.319) 7.269 3.143 ( 2.805 -5.687 13.106) 14.560 3.306 ( -1.740 3.592 5.988) 7.196 3.462 ( -0.822 -0.132 5.986) 6.044 3.624 ( -3.353 2.776 -1.210) 4.518 3.744 ( 3.132 1.995 1.988) 4.212 3.829 ( 4.752 5.416 -4.232) 8.356 4.047 ( 1.719 -0.601 -0.716) 1.957 4.120 ( -1.128 -1.006 12.226) 12.320 4.241 ( -2.995 6.857 -8.538) 11.353 4.566 ( 5.790 4.248 -1.290) 7.296 4.599 ( -3.977 2.620 0.598) 4.800 4.916 ( -8.045 -9.056 9.718) 15.530 5.081 ( 3.325 -2.753 5.418) 6.927 5.187 ( -3.697 -8.990 14.343) 17.327 5.425 ( -0.349 3.199 -3.798) 4.978 5.566 ( 4.241 10.870 -5.261) 12.799 5.603 ( -0.732 -2.626 -0.067) 2.727 5.978 ( -4.715 -6.289 18.712) 20.296 6.106 ( -3.129 9.084 -0.631) 9.629 6.383 ( -1.137 0.575 -2.914) 3.180 6.778 ( 0.576 -15.589 2.041) 15.733 7.028 ( -12.265 -6.447 -2.823) 14.141 7.094 ( -0.287 -1.333 -3.038) 3.330 7.196 ( 3.716 -0.632 -12.451) 13.010 7.489 ( 11.608 -5.744 0.329) 12.956 7.661 ( -0.921 -6.112 -1.271) 6.310 7.941 ( 4.094 -4.822 -5.994) 8.715 8.126 ( -7.620 3.107 1.804) 8.425 8.280 ( 2.950 5.404 1.557) 6.350 8.548 ( 2.257 8.404 -1.288) 8.797 8.803 ( 1.829 4.253 -5.148) 6.923 9.111 ( -1.188 0.007 3.503) 3.699 9.269 ( -3.242 -0.152 9.881) 10.401 9.346 ( 2.290 3.463 -11.252) 11.993 10.412 ( 1.607 -2.157 -8.220) 8.649 10.670 ( 3.585 0.518 -12.318) 12.840 13.200 ( 6.801 -2.063 2.828) 7.649 13.473 ( 2.994 1.571 -3.164) 4.631 13.748 ( 0.987 -3.774 -4.888) 6.254 14.141 ( 0.294 -1.846 -3.359) 3.844 14.170 ( 5.556 -3.419 -1.984) 6.818 14.366 ( -0.756 -1.546 -4.882) 5.176 14.567 ( -2.580 5.294 5.637) 8.152 14.717 ( -0.027 1.811 1.893) 2.620 15.494 ( -3.488 1.550 8.452) 9.274 16.170 ( 0.838 0.081 -4.994) 5.065 16.822 ( -3.286 0.601 9.017) 9.616 17.447 ( -10.624 -14.580 17.928) 25.434 17.842 ( 0.521 -1.195 -5.446) 5.600 18.413 ( -2.830 0.613 -5.669) 6.365 18.665 ( 8.177 1.373 -1.469) 8.421 18.845 ( -0.568 0.442 -2.409) 2.514 18.938 ( -0.667 1.017 2.407) 2.697 19.423 ( -0.911 5.468 -3.469) 6.540 20.178 ( 4.809 0.882 14.650) 15.444 20.643 ( -7.854 -15.452 22.473) 28.381 21.181 ( -2.407 2.525 3.685) 5.074 21.526 ( -0.090 -7.229 1.163) 7.322 22.085 ( 3.686 2.777 -11.006) 11.934 22.250 ( -1.027 2.021 -5.370) 5.829 23.347 ( 0.651 -2.815 2.084) 3.563 23.638 ( -6.018 -0.426 -4.549) 7.556 23.874 ( 7.096 2.300 -1.976) 7.717 23.957 ( -0.769 13.686 -12.035) 18.241 ======================= Grid point 118 (58/128) ======================= q-point: ( 0.29 0.29 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.713 ( 7.630 -0.000 19.500) 20.939 1.957 ( -10.359 0.000 16.616) 19.580 2.211 ( -5.428 0.000 14.414) 15.402 2.254 ( -15.886 0.000 5.633) 16.855 2.371 ( -10.086 0.000 10.016) 14.215 2.710 ( -0.225 0.000 0.613) 0.653 2.932 ( 7.478 -0.000 0.715) 7.512 3.044 ( -1.754 0.000 18.921) 19.002 3.200 ( 5.326 -0.000 -8.847) 10.327 3.272 ( -6.312 0.000 16.267) 17.449 3.399 ( -4.243 0.000 -11.367) 12.133 3.585 ( -1.168 0.000 12.327) 12.382 3.685 ( 1.022 -0.000 -7.445) 7.515 3.939 ( 10.101 -0.000 3.764) 10.779 4.002 ( 3.556 -0.000 10.710) 11.285 4.253 ( -1.600 0.000 -1.685) 2.324 4.315 ( 10.019 -0.000 -3.574) 10.637 4.437 ( -3.870 0.000 16.265) 16.719 4.606 ( -13.199 0.000 -5.366) 14.248 4.834 ( 6.371 -0.000 -1.458) 6.536 5.152 ( -12.887 0.000 -2.513) 13.129 5.197 ( 2.853 -0.000 2.291) 3.659 5.407 ( -7.749 0.000 25.537) 26.687 5.716 ( 6.312 -0.000 3.780) 7.357 5.827 ( -11.030 0.000 5.153) 12.174 5.979 ( 8.486 -0.000 -12.446) 15.064 6.243 ( -4.672 0.000 -7.094) 8.494 6.475 ( 16.696 -0.000 1.791) 16.792 6.489 ( 0.247 -0.000 10.327) 10.330 6.723 ( -6.477 0.000 -3.378) 7.305 6.992 ( 4.320 -0.000 -11.527) 12.310 7.447 ( -4.292 0.000 3.608) 5.607 7.666 ( 0.734 -0.000 -3.799) 3.869 7.721 ( -6.493 0.000 3.429) 7.342 7.839 ( -2.788 0.000 -13.372) 13.659 8.115 ( 0.594 -0.000 -2.575) 2.642 8.366 ( 7.859 -0.000 1.476) 7.996 8.558 ( 0.647 -0.000 -6.821) 6.852 8.746 ( 5.401 -0.000 6.141) 8.178 8.930 ( -6.899 0.000 4.948) 8.490 9.125 ( 2.498 -0.000 -7.823) 8.212 9.336 ( -4.151 0.000 12.428) 13.103 10.264 ( -2.193 0.000 -12.852) 13.038 10.757 ( 5.408 -0.000 -9.774) 11.170 13.596 ( 5.524 -0.000 -1.175) 5.648 13.601 ( 2.085 -0.000 -2.438) 3.208 13.800 ( -7.829 0.000 -17.521) 19.190 13.824 ( -0.816 0.000 -5.394) 5.456 14.246 ( -5.856 0.000 -2.898) 6.534 14.461 ( 1.805 -0.000 -0.284) 1.827 14.513 ( 1.384 -0.000 6.698) 6.840 14.603 ( -1.760 0.000 2.236) 2.846 15.402 ( -2.683 0.000 13.110) 13.381 16.273 ( 4.420 -0.000 -3.441) 5.602 16.823 ( -1.867 0.000 10.165) 10.335 17.016 ( -12.531 0.000 16.504) 20.723 17.853 ( 1.236 -0.000 -6.393) 6.511 18.368 ( -1.320 0.000 -1.886) 2.302 18.807 ( 2.019 -0.000 -1.421) 2.469 18.858 ( 1.640 -0.000 -6.134) 6.350 18.901 ( -1.657 0.000 1.536) 2.259 19.501 ( 5.074 -0.000 -3.763) 6.317 20.282 ( -6.980 0.000 18.479) 19.754 21.099 ( -0.510 0.000 0.253) 0.570 21.387 ( -1.996 0.000 0.381) 2.032 21.536 ( -1.221 0.000 4.404) 4.570 21.752 ( 1.317 -0.000 -1.100) 1.715 22.244 ( 4.946 -0.000 -4.343) 6.582 23.322 ( -3.306 0.000 -1.694) 3.715 23.383 ( -2.387 0.000 0.978) 2.579 23.481 ( 1.842 -0.000 1.725) 2.523 24.228 ( 6.770 -0.000 -7.069) 9.788 ======================= Grid point 119 (59/128) ======================= q-point: ( 0.43 0.29 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.635 ( -20.991 8.334 11.612) 25.395 1.968 ( -0.978 -11.825 15.271) 19.339 2.065 ( -12.917 2.526 8.041) 15.424 2.276 ( -16.030 -6.730 18.230) 25.191 2.434 ( 15.263 0.541 8.607) 17.531 2.759 ( -3.678 -1.105 8.442) 9.274 2.916 ( -0.801 7.922 3.355) 8.640 3.003 ( 4.110 0.427 1.054) 4.265 3.214 ( 3.714 3.599 3.553) 6.274 3.297 ( 0.493 -0.681 10.375) 10.409 3.438 ( -0.951 -8.970 -10.360) 13.737 3.614 ( -5.325 -5.285 5.417) 9.254 3.721 ( 3.417 -3.619 -3.360) 6.005 3.964 ( 0.400 2.602 -1.773) 3.174 4.141 ( 10.043 1.077 6.295) 11.901 4.184 ( -1.844 2.670 2.775) 4.270 4.410 ( 5.750 -2.692 2.477) 6.815 4.456 ( -12.411 -8.171 1.700) 14.956 4.541 ( 1.420 -0.613 4.681) 4.930 4.878 ( 3.874 1.902 -0.690) 4.370 5.017 ( -7.794 3.020 1.505) 8.493 5.188 ( -4.731 0.426 7.849) 9.175 5.435 ( -2.229 -1.471 20.914) 21.084 5.530 ( -9.315 12.152 10.354) 18.483 5.926 ( -3.236 -9.029 -7.272) 12.037 6.003 ( 3.328 3.912 -6.221) 8.067 6.193 ( -1.467 -1.394 3.594) 4.124 6.472 ( 1.436 5.122 6.875) 8.693 6.555 ( 7.210 6.943 -2.739) 10.378 6.761 ( 8.941 -5.287 -3.395) 10.928 7.038 ( 6.996 -1.586 -8.152) 10.858 7.327 ( -1.022 10.270 1.598) 10.444 7.558 ( -8.379 4.756 -1.341) 9.728 7.656 ( -6.230 1.686 -3.176) 7.193 7.859 ( 3.837 -3.841 -6.805) 8.705 8.106 ( -2.600 -2.527 -4.478) 5.762 8.479 ( 8.610 -0.491 -2.903) 9.099 8.582 ( -2.440 -7.398 -4.021) 8.767 8.804 ( 3.736 1.854 4.805) 6.362 8.895 ( -7.895 -3.809 6.152) 10.709 9.170 ( 4.565 -3.226 -6.377) 8.480 9.317 ( -2.999 1.591 11.425) 11.919 10.224 ( -1.056 -2.393 -13.456) 13.708 10.769 ( 4.706 1.633 -9.525) 10.749 13.519 ( -5.150 6.036 -5.190) 9.481 13.613 ( 4.196 4.036 -1.829) 6.103 13.725 ( -0.428 -1.701 -12.333) 12.457 13.833 ( 0.330 -4.136 -5.067) 6.550 14.145 ( -4.351 3.595 -2.665) 6.241 14.442 ( -0.329 1.866 -0.004) 1.894 14.559 ( 0.554 -1.997 3.789) 4.319 14.653 ( -1.856 -5.599 3.623) 6.922 15.421 ( -2.237 -0.491 13.320) 13.515 16.294 ( 3.629 1.546 -3.640) 5.368 16.837 ( -2.286 -0.519 10.002) 10.273 16.969 ( -7.314 -1.452 16.307) 17.931 17.848 ( 0.576 -0.318 -6.168) 6.203 18.337 ( -0.372 0.882 -2.671) 2.837 18.793 ( 1.100 2.720 -2.170) 3.649 18.866 ( 0.465 -0.567 -3.280) 3.361 18.913 ( -0.746 -2.675 0.689) 2.861 19.539 ( 4.060 0.106 -3.340) 5.258 20.254 ( -6.669 1.479 18.517) 19.737 21.105 ( -0.999 0.421 0.530) 1.206 21.202 ( 2.725 14.714 4.755) 15.701 21.517 ( -3.563 3.964 4.079) 6.712 21.852 ( 0.759 -8.577 -4.666) 9.793 22.301 ( 4.741 -1.828 -5.217) 7.282 23.252 ( -2.507 2.455 0.745) 3.587 23.440 ( -1.827 -7.296 -0.822) 7.566 23.536 ( 2.093 -3.852 1.575) 4.658 24.267 ( 4.494 -0.272 -8.364) 9.498 ======================= Grid point 120 (60/128) ======================= q-point: (-0.43 0.29 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.383 ( -11.830 4.453 17.048) 21.223 1.949 ( -10.978 -2.992 5.337) 12.568 2.166 ( -12.464 -9.886 16.112) 22.643 2.286 ( -4.367 -8.250 7.666) 12.078 2.573 ( 1.254 5.874 13.325) 14.616 2.667 ( 4.486 5.667 14.784) 16.456 2.811 ( -2.238 2.854 -7.333) 8.181 3.153 ( 1.911 -4.029 8.652) 9.734 3.168 ( 0.460 0.182 -0.876) 1.006 3.345 ( 1.268 -0.949 3.176) 3.549 3.508 ( 2.864 -2.130 -6.851) 7.725 3.708 ( -1.559 -9.293 1.800) 9.593 3.822 ( 3.498 -2.958 4.811) 6.644 3.904 ( -2.030 0.754 -1.979) 2.934 4.110 ( -3.313 1.456 2.286) 4.280 4.196 ( -3.237 2.678 4.312) 6.020 4.466 ( -4.528 -5.231 -2.741) 7.442 4.550 ( 1.340 -6.788 5.383) 8.767 4.583 ( 2.887 0.359 1.925) 3.488 4.839 ( -3.125 10.071 10.020) 14.546 4.911 ( 4.300 3.572 4.324) 7.067 5.128 ( -1.689 4.079 -5.126) 6.765 5.396 ( -10.520 -3.592 35.477) 37.178 5.513 ( 2.094 0.261 12.709) 12.883 5.831 ( -7.716 9.430 -4.220) 12.895 5.931 ( -3.026 -1.782 -8.783) 9.459 6.274 ( -2.388 -2.543 6.930) 7.759 6.452 ( 3.797 1.244 -0.015) 3.996 6.536 ( 7.840 0.508 -5.437) 9.555 6.899 ( 7.025 1.838 -9.062) 11.613 7.129 ( 7.125 -1.551 -4.848) 8.757 7.171 ( 7.026 10.300 3.400) 12.923 7.377 ( -8.153 4.056 -2.031) 9.330 7.571 ( -7.582 -0.737 -2.130) 7.910 7.918 ( 5.196 0.271 -7.479) 9.111 8.119 ( -4.344 -4.885 -2.627) 7.045 8.483 ( 1.081 3.263 -4.514) 5.674 8.701 ( 1.121 -7.597 -4.105) 8.708 8.808 ( 3.178 3.327 4.428) 6.385 8.923 ( -7.232 -7.088 7.943) 12.870 9.227 ( -0.555 -1.309 -2.105) 2.540 9.337 ( 4.524 -1.229 3.973) 6.145 10.237 ( 0.332 -4.748 -12.891) 13.741 10.752 ( 4.168 2.715 -9.450) 10.679 13.347 ( -5.264 5.675 -5.060) 9.248 13.563 ( 0.822 3.659 -4.445) 5.816 13.727 ( 3.729 1.343 -5.187) 6.528 13.910 ( 1.679 -5.695 -5.072) 7.809 14.069 ( -0.801 0.669 -3.107) 3.278 14.405 ( -1.558 1.258 -1.920) 2.774 14.609 ( -0.627 -3.024 3.590) 4.736 14.714 ( -2.292 -2.878 4.749) 6.008 15.449 ( -2.230 -1.126 12.423) 12.672 16.278 ( 2.205 2.990 -4.434) 5.785 16.843 ( -3.229 -0.202 9.539) 10.073 17.010 ( -3.392 -4.331 17.321) 18.174 17.833 ( -0.618 -0.019 -5.579) 5.613 18.338 ( 1.979 -1.230 -3.836) 4.489 18.750 ( 0.364 2.706 -2.333) 3.592 18.864 ( -0.184 -0.171 -2.439) 2.452 18.948 ( -0.203 -1.665 1.076) 1.993 19.563 ( 3.177 0.547 -2.965) 4.380 20.216 ( -4.510 2.423 18.022) 18.735 20.914 ( -3.590 16.292 6.847) 18.033 21.202 ( 1.680 -3.496 3.364) 5.134 21.409 ( -2.531 6.096 3.649) 7.542 21.960 ( 1.616 -6.110 -7.501) 9.809 22.344 ( 3.596 0.145 -6.542) 7.467 23.220 ( -1.447 -0.557 2.460) 2.908 23.527 ( -2.003 -6.448 -2.006) 7.044 23.652 ( 4.171 -6.073 1.384) 7.496 24.274 ( 1.769 0.390 -9.810) 9.976 ======================= Grid point 121 (61/128) ======================= q-point: (-0.29 0.29 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.361 ( 2.004 1.230 23.282) 23.401 1.985 ( -4.297 -9.517 6.860) 12.494 2.152 ( -15.584 -7.431 10.234) 20.070 2.323 ( -8.035 7.843 16.336) 19.823 2.507 ( 0.222 -1.290 3.677) 3.903 2.696 ( -7.301 -4.957 -3.089) 9.350 2.837 ( 12.075 -0.224 6.580) 13.754 3.055 ( -5.214 3.451 -1.574) 6.447 3.303 ( 0.534 -2.820 8.205) 8.693 3.348 ( -0.935 2.222 1.707) 2.954 3.581 ( 5.271 -4.120 -1.116) 6.783 3.732 ( 1.471 4.143 -7.618) 8.795 3.875 ( -0.478 5.020 2.589) 5.669 3.934 ( -6.594 -1.080 15.849) 17.200 4.053 ( -6.464 -7.404 0.521) 9.843 4.141 ( 1.585 3.211 5.278) 6.378 4.425 ( -9.418 3.075 5.142) 11.162 4.553 ( 7.771 10.650 2.728) 13.463 4.626 ( -4.439 -5.774 2.227) 7.616 4.784 ( 6.150 0.887 7.125) 9.454 4.943 ( -0.850 -3.358 3.508) 4.931 5.106 ( -1.111 -1.087 3.746) 4.055 5.406 ( -4.879 5.625 15.472) 17.171 5.597 ( -4.931 -6.617 28.707) 29.869 5.658 ( 1.327 2.521 -7.605) 8.121 5.900 ( -0.721 0.765 -6.117) 6.207 6.250 ( -3.543 -0.057 2.399) 4.280 6.496 ( 5.284 0.532 0.774) 5.366 6.628 ( 3.856 1.227 -13.421) 14.018 6.791 ( 0.426 3.587 -4.422) 5.709 7.089 ( -1.120 2.811 -0.958) 3.174 7.211 ( 1.676 0.193 -12.211) 12.327 7.370 ( 3.363 -2.207 11.152) 11.856 7.515 ( -1.906 -2.832 -4.645) 5.765 7.914 ( 3.430 2.119 -7.721) 8.710 8.139 ( -2.624 -2.646 -1.427) 3.990 8.421 ( -0.548 3.102 -0.494) 3.188 8.756 ( 2.695 3.683 0.316) 4.575 8.821 ( 0.688 -2.707 -4.512) 5.307 8.990 ( -4.872 -6.045 9.736) 12.453 9.222 ( -2.504 -1.645 -0.712) 3.079 9.420 ( 6.222 -0.138 -1.997) 6.536 10.290 ( 1.331 -5.290 -11.397) 12.635 10.722 ( 3.902 2.673 -9.972) 11.037 13.228 ( -1.662 2.858 -2.116) 3.926 13.509 ( -0.494 1.419 -4.873) 5.099 13.723 ( 4.153 2.709 -2.329) 5.478 14.000 ( 1.216 -5.751 -6.202) 8.545 14.095 ( 4.004 -2.425 -2.683) 5.395 14.360 ( -2.253 0.678 -3.950) 4.597 14.655 ( -1.254 -2.039 4.542) 5.134 14.719 ( -2.613 0.393 5.274) 5.898 15.483 ( -2.133 -1.542 10.966) 11.277 16.228 ( 0.963 3.360 -5.369) 6.406 16.837 ( -3.213 0.243 9.362) 9.901 17.118 ( -3.978 -6.799 18.696) 20.288 17.813 ( 0.246 -0.326 -5.240) 5.256 18.373 ( -0.031 -2.359 -5.060) 5.583 18.718 ( 3.234 2.082 -2.319) 4.491 18.854 ( -0.494 0.074 -2.431) 2.482 18.963 ( -0.237 0.011 1.976) 1.991 19.562 ( 2.329 2.501 -3.258) 4.721 20.206 ( -0.681 1.592 17.166) 17.253 20.645 ( -9.396 11.650 12.348) 19.403 21.281 ( -2.612 -0.733 9.089) 9.485 21.330 ( 2.256 0.323 -2.597) 3.456 22.036 ( 2.571 -4.161 -9.363) 10.564 22.332 ( 2.254 2.441 -6.955) 7.708 23.248 ( -0.449 -2.847 2.938) 4.116 23.577 ( -2.353 -3.703 -2.353) 4.978 23.808 ( 7.205 -5.344 0.450) 8.981 24.219 ( -1.563 3.171 -11.548) 12.077 ======================= Grid point 122 (62/128) ======================= q-point: (-0.14 0.29 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.462 ( 7.768 2.642 23.507) 24.898 2.050 ( -6.286 12.409 16.447) 21.540 2.131 ( -8.845 -7.128 10.771) 15.655 2.278 ( 0.213 -13.344 6.473) 14.833 2.534 ( -5.744 -5.690 4.128) 9.079 2.680 ( -8.277 -2.535 -3.705) 9.417 2.946 ( 0.735 2.537 -0.570) 2.702 3.029 ( 3.300 -4.411 3.369) 6.458 3.256 ( -0.746 6.592 3.997) 7.745 3.334 ( -3.295 1.302 11.725) 12.249 3.605 ( 0.296 7.742 3.955) 8.699 3.717 ( -2.048 9.559 7.700) 12.444 3.754 ( 4.865 -6.113 1.464) 7.948 3.919 ( 0.516 -0.261 -5.645) 5.675 3.992 ( -6.999 7.010 5.961) 11.561 4.145 ( -4.238 1.908 6.135) 7.696 4.369 ( -6.174 -3.168 5.806) 9.048 4.487 ( 6.083 5.920 -0.176) 8.490 4.703 ( -2.262 -6.240 7.522) 10.032 4.818 ( 1.851 6.253 5.968) 8.840 5.001 ( -6.225 -7.531 3.824) 10.492 5.095 ( -1.607 -1.413 8.767) 9.025 5.399 ( -0.765 -4.371 6.914) 8.216 5.642 ( 8.696 2.796 -2.781) 9.549 5.778 ( 6.866 0.109 6.707) 9.598 5.856 ( -5.170 -3.014 10.621) 12.191 6.220 ( 0.227 4.344 -1.101) 4.487 6.425 ( -0.388 10.272 -7.867) 12.944 6.595 ( 1.186 -6.786 -1.360) 7.022 6.800 ( -10.948 -4.767 -3.885) 12.557 7.064 ( -0.380 -0.525 -4.505) 4.551 7.185 ( 1.666 0.007 -15.039) 15.131 7.401 ( -6.167 -8.126 3.679) 10.844 7.648 ( 11.007 -2.912 0.111) 11.386 7.920 ( 2.438 -1.226 -2.051) 3.413 8.123 ( -0.491 1.455 -2.015) 2.533 8.387 ( 1.780 3.037 3.185) 4.747 8.673 ( -1.150 7.051 -1.039) 7.219 8.839 ( 1.793 0.086 -7.006) 7.232 9.062 ( -2.091 -4.028 6.829) 8.199 9.224 ( -3.632 -2.518 2.561) 5.108 9.430 ( 3.272 4.638 -5.145) 7.661 10.349 ( 1.720 -3.894 -9.452) 10.366 10.694 ( 3.606 1.811 -11.215) 11.919 13.227 ( 3.327 -2.170 0.288) 3.983 13.487 ( 0.236 -0.609 -4.242) 4.292 13.731 ( 3.753 0.488 -1.736) 4.164 14.059 ( -0.875 -3.923 -8.573) 9.469 14.182 ( 4.322 -2.925 -2.411) 5.748 14.327 ( -0.588 -0.598 -3.772) 3.864 14.636 ( -2.334 3.995 6.336) 7.845 14.719 ( -1.233 -1.304 4.122) 4.496 15.503 ( -2.559 0.334 9.428) 9.775 16.178 ( 1.109 1.650 -5.499) 5.848 16.827 ( -2.769 0.578 9.404) 9.820 17.218 ( -10.117 -7.171 19.353) 22.985 17.830 ( 3.740 -1.290 -5.351) 6.655 18.348 ( -5.431 -0.325 -3.685) 6.571 18.757 ( 7.643 -0.232 -4.372) 8.809 18.839 ( -0.020 0.340 -2.702) 2.723 18.958 ( -0.305 0.975 2.502) 2.703 19.509 ( 2.046 5.469 -3.767) 6.949 20.268 ( 2.900 -0.862 14.353) 14.668 20.489 ( -10.494 -1.387 20.075) 22.695 21.225 ( -1.320 4.187 4.289) 6.138 21.419 ( 0.133 -6.505 1.122) 6.603 22.079 ( 2.037 -1.666 -10.650) 10.970 22.287 ( 1.899 3.221 -6.118) 7.170 23.302 ( -0.831 -3.421 2.452) 4.290 23.578 ( -2.097 -0.458 -2.097) 3.001 23.951 ( 7.456 -1.502 -1.757) 7.806 24.063 ( -3.454 7.828 -11.756) 14.540 ======================= Grid point 126 (63/128) ======================= q-point: (-0.57 -0.57 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.508 ( -21.571 0.000 18.041) 28.120 1.845 ( -15.403 0.000 7.696) 17.219 2.030 ( 3.105 -0.000 11.606) 12.014 2.100 ( -15.729 0.000 18.288) 24.121 2.571 ( 1.524 -0.000 9.008) 9.136 2.837 ( 13.375 -0.000 14.193) 19.502 2.961 ( -10.770 0.000 5.715) 12.192 3.021 ( 0.736 -0.000 -2.490) 2.596 3.201 ( -4.791 0.000 -5.160) 7.041 3.360 ( 1.102 -0.000 18.444) 18.477 3.425 ( 15.131 -0.000 -12.320) 19.513 3.501 ( -10.594 0.000 8.349) 13.488 3.712 ( 6.018 -0.000 -7.874) 9.910 3.970 ( -2.936 0.000 -3.481) 4.554 4.173 ( -18.477 0.000 5.458) 19.267 4.181 ( -2.337 0.000 -2.800) 3.647 4.281 ( 6.568 -0.000 -2.975) 7.211 4.431 ( -2.037 0.000 -3.052) 3.670 4.618 ( 10.443 -0.000 10.411) 14.746 4.907 ( 1.401 -0.000 -2.524) 2.887 5.027 ( 5.092 -0.000 -0.079) 5.092 5.123 ( -13.299 0.000 28.928) 31.839 5.493 ( 3.872 -0.000 16.086) 16.546 5.710 ( -0.182 0.000 -2.778) 2.784 5.719 ( -4.301 0.000 -2.992) 5.240 6.089 ( 5.440 -0.000 -1.367) 5.609 6.141 ( -5.614 0.000 6.147) 8.324 6.515 ( -6.630 0.000 8.164) 10.517 6.596 ( 1.303 -0.000 -8.459) 8.559 6.909 ( 20.061 -0.000 -0.183) 20.062 7.081 ( 7.117 -0.000 -6.181) 9.426 7.308 ( -10.496 0.000 4.476) 11.410 7.547 ( -5.716 0.000 -8.599) 10.325 7.676 ( 0.122 -0.000 4.568) 4.570 7.793 ( 3.528 -0.000 -8.210) 8.936 8.069 ( -1.469 0.000 -6.501) 6.665 8.453 ( -1.792 0.000 -3.799) 4.200 8.554 ( 4.854 -0.000 -3.863) 6.204 8.792 ( -9.098 0.000 7.164) 11.579 8.875 ( 3.266 -0.000 4.563) 5.612 9.193 ( 7.203 -0.000 -5.657) 9.159 9.326 ( -3.508 0.000 11.609) 12.128 10.154 ( -0.052 0.000 -14.468) 14.468 10.800 ( 3.997 -0.000 -9.372) 10.189 13.461 ( -8.531 0.000 -11.939) 14.674 13.698 ( 4.399 -0.000 -0.630) 4.444 13.723 ( 5.458 -0.000 -4.992) 7.397 13.739 ( -3.230 0.000 -8.465) 9.061 14.132 ( -3.346 0.000 -0.746) 3.428 14.443 ( -2.515 0.000 -1.676) 3.022 14.578 ( 1.243 -0.000 5.074) 5.224 14.579 ( -1.732 0.000 2.314) 2.890 15.443 ( -1.534 0.000 14.108) 14.191 16.330 ( 2.455 -0.000 -3.168) 4.008 16.837 ( -2.720 0.000 9.954) 10.319 16.947 ( -3.816 0.000 15.869) 16.321 17.836 ( 0.774 -0.000 -6.362) 6.409 18.320 ( -1.027 0.000 -3.800) 3.936 18.835 ( -0.405 0.000 -4.364) 4.383 18.855 ( 1.991 -0.000 -2.447) 3.155 18.879 ( -0.514 0.000 3.763) 3.798 19.573 ( 3.852 -0.000 -3.062) 4.920 20.253 ( -5.919 0.000 17.377) 18.357 21.097 ( 0.114 -0.000 0.569) 0.581 21.371 ( -0.072 0.000 0.852) 0.855 21.538 ( -1.242 0.000 5.043) 5.194 21.760 ( 0.274 -0.000 -2.053) 2.071 22.321 ( 4.688 -0.000 -4.442) 6.458 23.286 ( 0.534 -0.000 -0.216) 0.576 23.344 ( -1.723 0.000 0.712) 1.864 23.524 ( 1.043 -0.000 2.019) 2.272 24.272 ( 1.940 -0.000 -9.328) 9.527 ======================= Grid point 127 (64/128) ======================= q-point: (-0.43 -0.57 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.389 ( -5.568 1.650 21.295) 22.072 1.728 ( -17.984 -6.568 6.237) 20.136 2.000 ( -14.011 -1.672 19.498) 24.068 2.187 ( 4.086 -6.491 9.542) 12.243 2.567 ( -8.319 -0.746 5.360) 9.924 2.774 ( -9.634 7.830 4.442) 13.185 2.959 ( 8.982 4.903 8.534) 13.325 3.081 ( 0.519 -6.335 0.806) 6.407 3.190 ( 1.443 0.249 2.346) 2.766 3.364 ( -6.797 -3.240 0.900) 7.583 3.457 ( -3.435 -0.348 11.839) 12.332 3.574 ( 5.768 -5.454 -0.272) 7.942 3.809 ( 5.347 -2.937 -7.021) 9.301 3.899 ( -1.950 -0.426 -6.434) 6.736 4.000 ( -16.657 0.618 9.651) 19.261 4.194 ( -0.443 -3.440 -1.188) 3.666 4.278 ( -5.110 -0.960 -7.346) 9.000 4.428 ( -2.260 -5.355 -3.493) 6.781 4.761 ( 12.408 2.344 7.221) 14.546 4.946 ( 0.207 0.358 4.262) 4.282 5.024 ( 6.590 4.021 9.422) 12.181 5.173 ( -2.569 -2.245 17.287) 17.620 5.477 ( -3.278 12.668 9.549) 16.199 5.584 ( 4.108 -0.368 10.391) 11.180 5.806 ( -1.912 -5.436 -8.794) 10.514 5.941 ( -4.724 12.807 3.245) 14.031 6.242 ( 0.747 -4.087 5.600) 6.972 6.468 ( -1.941 -1.100 5.113) 5.579 6.582 ( 1.927 0.795 -7.301) 7.593 7.019 ( 4.080 3.840 -3.056) 6.382 7.141 ( 2.002 -1.894 -7.464) 7.957 7.293 ( 3.935 -2.779 8.905) 10.124 7.398 ( -3.377 9.243 -7.166) 12.173 7.574 ( 0.881 8.245 -0.811) 8.331 7.924 ( 5.348 -7.001 -4.755) 10.011 8.024 ( -1.915 0.353 -5.544) 5.876 8.443 ( -6.545 -3.091 -4.793) 8.682 8.621 ( 6.101 -3.766 -3.757) 8.095 8.761 ( -8.253 -5.146 7.514) 12.290 8.897 ( 1.919 2.073 3.778) 4.718 9.239 ( 2.758 1.697 -0.999) 3.389 9.354 ( 1.929 -2.920 5.488) 6.509 10.143 ( 1.812 -3.055 -14.048) 14.490 10.797 ( 3.302 1.539 -9.322) 10.008 13.318 ( -6.765 2.393 -10.597) 12.798 13.617 ( -1.405 4.968 -7.162) 8.829 13.764 ( 4.567 -2.299 -2.298) 5.605 13.829 ( 3.820 -4.540 -3.681) 6.982 14.081 ( -0.665 2.349 -0.273) 2.456 14.393 ( -3.290 1.144 -2.653) 4.378 14.574 ( -1.037 -1.473 2.994) 3.495 14.647 ( -0.865 -4.195 3.987) 5.852 15.466 ( -1.606 0.323 13.748) 13.846 16.323 ( 0.957 1.974 -3.328) 3.986 16.838 ( -2.764 -0.049 9.766) 10.150 16.986 ( -1.360 -2.071 16.734) 16.917 17.821 ( 0.591 0.462 -6.169) 6.215 18.311 ( 0.087 -1.196 -4.474) 4.632 18.793 ( 0.495 2.481 -2.986) 3.914 18.853 ( -0.268 -0.044 -2.023) 2.041 18.924 ( 0.880 -2.099 2.431) 3.330 19.600 ( 3.695 0.458 -2.818) 4.670 20.240 ( -5.019 0.348 15.932) 16.708 21.075 ( -2.281 5.977 0.699) 6.435 21.259 ( -0.441 8.780 5.564) 10.404 21.499 ( -0.156 5.038 4.344) 6.653 21.841 ( 0.773 -8.171 -4.695) 9.455 22.361 ( 3.841 -0.486 -5.230) 6.508 23.239 ( 0.399 3.178 1.603) 3.582 23.418 ( 0.272 -6.306 -0.426) 6.326 23.589 ( 1.931 -6.176 1.882) 6.739 24.250 ( -0.749 -0.071 -10.063) 10.091 ======================= Grid point 128 (65/128) ======================= q-point: (-0.29 -0.57 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.485 ( 8.869 -0.759 22.208) 23.926 1.743 ( -9.774 -13.534 4.766) 17.361 1.958 ( -13.451 -4.175 16.865) 21.973 2.283 ( -6.381 -1.778 3.874) 7.673 2.485 ( -6.752 0.735 2.311) 7.174 2.626 ( -5.292 0.620 8.347) 9.903 3.010 ( 6.947 2.576 7.042) 10.222 3.062 ( -3.624 4.254 0.390) 5.602 3.253 ( 1.701 -1.733 0.976) 2.617 3.393 ( -2.646 -3.215 10.376) 11.180 3.513 ( -2.738 -9.812 4.483) 11.130 3.705 ( -3.616 -8.878 3.233) 10.116 3.777 ( -1.670 -0.099 -9.508) 9.654 3.846 ( -13.489 2.411 12.987) 18.879 3.944 ( 2.389 0.557 -3.339) 4.143 4.152 ( -5.783 0.710 -1.703) 6.070 4.372 ( -1.205 -14.147 -1.549) 14.283 4.480 ( -0.287 -1.936 -2.819) 3.432 4.799 ( 3.950 9.161 10.081) 14.182 4.922 ( 3.435 4.001 14.855) 15.763 5.077 ( -1.177 8.912 -4.763) 10.174 5.101 ( 6.681 3.029 5.370) 9.091 5.444 ( -6.496 -1.519 24.130) 25.035 5.626 ( 0.728 3.628 11.434) 12.018 5.723 ( 3.107 6.766 -1.115) 7.528 5.837 ( -0.233 -3.555 -6.055) 7.026 6.258 ( 0.349 1.917 4.496) 4.900 6.565 ( 2.831 -5.365 1.794) 6.326 6.567 ( 0.536 -0.115 -7.221) 7.242 6.927 ( -0.063 8.120 -2.447) 8.481 7.122 ( -6.923 0.825 -11.210) 13.201 7.173 ( 0.478 8.373 -2.655) 8.797 7.360 ( -3.462 2.930 0.514) 4.565 7.578 ( 13.738 -0.478 4.034) 14.326 7.961 ( 0.349 2.768 -5.553) 6.214 8.062 ( 1.873 -5.395 -3.688) 6.799 8.400 ( -4.837 -1.985 -1.943) 5.578 8.738 ( 3.481 -4.734 -4.672) 7.507 8.789 ( -6.376 -3.704 2.875) 7.914 8.906 ( 1.286 -1.601 5.892) 6.240 9.211 ( -1.084 2.282 2.507) 3.559 9.451 ( 4.437 -2.719 -1.721) 5.481 10.199 ( 3.866 -4.980 -12.063) 13.611 10.769 ( 2.797 2.422 -9.680) 10.363 13.208 ( -3.995 0.440 -6.204) 7.392 13.517 ( -1.221 3.079 -6.734) 7.504 13.823 ( 4.440 1.530 -0.741) 4.754 13.912 ( 2.647 -3.429 -4.946) 6.575 14.093 ( 4.253 -2.369 -1.844) 5.206 14.329 ( -3.445 0.828 -4.153) 5.459 14.609 ( -1.449 -3.092 3.840) 5.138 14.696 ( -1.968 -2.118 4.684) 5.504 15.486 ( -1.685 -0.194 12.527) 12.641 16.272 ( -0.110 3.389 -4.061) 5.290 16.838 ( -2.519 0.186 9.698) 10.022 17.068 ( -1.571 -2.944 18.231) 18.534 17.809 ( 2.096 0.009 -5.725) 6.096 18.318 ( -1.211 -1.365 -4.502) 4.858 18.769 ( 2.850 1.141 -3.764) 4.857 18.844 ( -0.178 0.073 -2.160) 2.169 18.961 ( 0.034 -0.945 2.540) 2.710 19.617 ( 3.619 1.465 -3.131) 5.004 20.242 ( -3.567 -0.862 14.576) 15.031 20.796 ( -10.399 17.914 8.032) 22.216 21.244 ( -1.262 -2.205 7.063) 7.506 21.428 ( 2.384 6.542 1.740) 7.177 21.956 ( 2.425 -6.377 -7.489) 10.131 22.368 ( 2.422 1.603 -6.744) 7.343 23.230 ( 0.747 -0.181 2.597) 2.708 23.505 ( 0.697 -4.162 -0.466) 4.245 23.764 ( 5.847 -9.590 0.454) 11.241 24.190 ( -3.543 1.173 -10.613) 11.250 ======================= Grid point 129 (66/128) ======================= q-point: (-0.14 -0.57 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.638 ( 6.976 0.177 16.704) 18.103 1.901 ( -11.541 -7.865 2.529) 14.193 1.992 ( -1.966 -12.376 13.459) 18.389 2.222 ( -5.721 -1.081 10.740) 12.217 2.447 ( -2.571 -2.723 5.122) 6.345 2.612 ( -1.439 3.958 1.580) 4.499 2.975 ( -1.980 1.585 0.305) 2.554 3.070 ( 5.003 0.797 7.090) 8.714 3.264 ( -2.748 0.084 -0.436) 2.784 3.426 ( 0.670 1.858 16.612) 16.729 3.650 ( -4.840 -3.657 5.584) 8.245 3.664 ( -10.567 -1.873 3.659) 11.339 3.773 ( 2.888 -0.568 -3.256) 4.389 3.863 ( -4.642 -0.485 -0.706) 4.720 3.908 ( -6.975 -13.424 1.425) 15.195 4.109 ( -5.977 -1.413 2.777) 6.741 4.355 ( -1.900 13.051 7.219) 15.035 4.569 ( 0.250 -8.850 1.099) 8.921 4.757 ( 5.554 4.883 6.576) 9.896 4.922 ( -1.598 6.712 -3.903) 7.927 4.986 ( 5.974 3.767 12.768) 14.591 5.070 ( -6.805 2.899 11.814) 13.938 5.366 ( -5.257 0.318 9.032) 10.456 5.733 ( -0.099 -5.971 19.506) 20.399 5.774 ( 12.134 0.154 -3.693) 12.685 5.869 ( 1.728 -1.994 -6.181) 6.720 6.262 ( 3.614 1.571 2.348) 4.587 6.508 ( -10.297 -1.910 -7.485) 12.872 6.612 ( 3.098 8.856 -0.074) 9.382 6.742 ( 2.430 10.599 -6.956) 12.908 7.044 ( -1.131 -3.638 -3.227) 4.993 7.103 ( -5.210 0.611 -6.926) 8.688 7.274 ( -2.355 -0.426 -2.683) 3.595 7.748 ( 11.236 -0.488 1.949) 11.414 7.913 ( -2.901 0.206 0.415) 2.938 8.132 ( 4.898 -1.884 -5.554) 7.641 8.406 ( -0.809 -2.268 0.092) 2.409 8.717 ( -5.963 2.711 0.575) 6.575 8.811 ( 1.675 -2.348 -5.533) 6.240 9.012 ( 1.602 -5.195 7.944) 9.626 9.173 ( -2.551 0.740 2.195) 3.446 9.491 ( 2.052 1.235 -5.625) 6.114 10.289 ( 4.819 -4.254 -9.650) 11.595 10.726 ( 2.276 2.460 -10.822) 11.329 13.195 ( -0.379 -3.541 -2.332) 4.257 13.464 ( -0.225 0.288 -5.021) 5.034 13.813 ( 3.422 3.808 0.382) 5.133 13.968 ( 0.784 -3.461 -8.732) 9.426 14.166 ( 1.610 -1.223 -4.155) 4.621 14.305 ( 1.774 -2.007 -3.293) 4.245 14.652 ( -1.684 -2.011 5.038) 5.680 14.702 ( -1.833 -0.074 5.511) 5.808 15.509 ( -2.017 -0.302 10.870) 11.060 16.206 ( 0.351 2.802 -4.903) 5.659 16.838 ( -2.116 0.441 9.798) 10.034 17.128 ( -5.335 -1.533 19.197) 19.983 17.843 ( 5.328 -1.363 -5.372) 7.688 18.284 ( -4.174 0.282 -2.878) 5.078 18.791 ( 3.191 -0.393 -5.275) 6.177 18.841 ( 1.897 -0.335 -3.358) 3.871 18.970 ( -0.607 0.157 2.712) 2.783 19.599 ( 2.872 4.137 -4.364) 6.664 20.277 ( -4.500 -2.795 11.592) 12.745 20.488 ( -9.981 8.414 18.759) 22.854 21.279 ( -2.610 -0.209 9.215) 9.580 21.374 ( 2.414 2.235 -2.295) 4.011 22.036 ( 2.980 -3.255 -9.362) 10.350 22.333 ( 1.786 2.563 -7.050) 7.711 23.260 ( -0.186 -1.639 2.580) 3.062 23.559 ( 1.525 -1.484 -0.167) 2.135 23.969 ( 7.284 -5.717 -2.245) 9.527 24.071 ( -4.536 3.316 -10.399) 11.819 ======================= Grid point 134 (67/128) ======================= q-point: (-0.43 -0.43 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.473 ( 7.263 -0.000 21.271) 22.476 1.480 ( -19.814 0.000 9.787) 22.099 1.891 ( -15.773 0.000 20.392) 25.780 2.228 ( 5.303 -0.000 10.827) 12.056 2.453 ( -14.313 0.000 4.572) 15.025 2.779 ( -7.851 0.000 4.711) 9.156 2.932 ( -2.020 0.000 -7.966) 8.218 3.081 ( -16.361 0.000 -0.608) 16.373 3.166 ( -0.128 0.000 2.333) 2.336 3.285 ( 7.408 -0.000 21.530) 22.769 3.554 ( -1.909 0.000 27.107) 27.174 3.579 ( 6.409 -0.000 -9.370) 11.353 3.794 ( -7.923 0.000 -0.837) 7.967 3.840 ( 7.840 -0.000 -9.946) 12.664 3.909 ( -8.751 0.000 3.556) 9.446 4.097 ( -6.496 0.000 -3.573) 7.413 4.275 ( -4.214 0.000 -2.103) 4.710 4.322 ( 2.870 -0.000 -11.144) 11.507 4.919 ( 6.956 -0.000 8.622) 11.078 4.958 ( 2.986 -0.000 -5.276) 6.063 5.143 ( -5.666 0.000 39.854) 40.255 5.219 ( 11.889 -0.000 0.223) 11.891 5.546 ( -8.212 0.000 -9.019) 12.198 5.617 ( 1.862 -0.000 -3.987) 4.400 5.755 ( 4.618 -0.000 6.579) 8.038 6.108 ( -1.245 0.000 8.045) 8.141 6.190 ( 4.178 -0.000 2.290) 4.765 6.443 ( -3.811 0.000 11.529) 12.143 6.567 ( -0.318 0.000 -8.991) 8.997 6.942 ( -14.325 0.000 2.023) 14.468 7.159 ( 3.620 -0.000 -6.627) 7.551 7.407 ( -1.966 0.000 -9.089) 9.299 7.427 ( 16.144 -0.000 6.248) 17.311 7.733 ( 1.171 -0.000 6.598) 6.701 7.851 ( 5.873 -0.000 -7.393) 9.441 8.013 ( 0.860 -0.000 -7.368) 7.418 8.323 ( -5.951 0.000 -6.049) 8.485 8.645 ( -8.906 0.000 8.064) 12.015 8.648 ( 4.224 -0.000 -1.661) 4.539 8.935 ( 0.538 -0.000 2.063) 2.132 9.317 ( 7.181 -0.000 -7.509) 10.390 9.328 ( -2.804 0.000 10.993) 11.345 10.107 ( 4.197 -0.000 -13.782) 14.407 10.811 ( 2.440 -0.000 -9.391) 9.703 13.229 ( -6.133 0.000 -12.601) 14.015 13.595 ( -4.832 0.000 -8.464) 9.746 13.773 ( 3.290 -0.000 -2.531) 4.151 13.860 ( 8.877 -0.000 -0.805) 8.913 14.104 ( 0.250 -0.000 2.082) 2.097 14.352 ( -4.314 0.000 -3.455) 5.527 14.555 ( -1.818 0.000 2.114) 2.788 14.622 ( 0.452 -0.000 3.388) 3.418 15.493 ( -2.026 0.000 13.971) 14.117 16.333 ( -0.446 0.000 -2.790) 2.825 16.841 ( -2.450 0.000 9.752) 10.055 17.022 ( 1.377 -0.000 17.778) 17.831 17.815 ( 1.117 -0.000 -6.490) 6.586 18.291 ( 0.788 -0.000 -4.738) 4.803 18.802 ( -0.025 0.000 -4.503) 4.503 18.845 ( -0.238 0.000 -1.459) 1.479 18.929 ( 1.275 -0.000 3.327) 3.563 19.635 ( 3.828 -0.000 -2.924) 4.817 20.222 ( -6.511 0.000 12.974) 14.516 21.108 ( 0.165 -0.000 1.869) 1.877 21.397 ( 1.521 -0.000 3.533) 3.847 21.546 ( -0.600 0.000 4.124) 4.168 21.738 ( -0.990 0.000 -2.447) 2.639 22.384 ( 3.652 -0.000 -4.204) 5.569 23.321 ( -0.734 0.000 0.308) 0.796 23.340 ( 4.342 -0.000 0.542) 4.375 23.547 ( -0.146 0.000 2.455) 2.459 24.199 ( -3.008 0.000 -10.124) 10.561 ======================= Grid point 135 (68/128) ======================= q-point: (-0.29 -0.43 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.422 ( -14.794 -12.636 10.835) 22.269 1.677 ( 17.680 -0.879 16.962) 24.517 1.787 ( -18.234 -2.829 15.010) 23.786 2.228 ( -7.525 2.869 8.559) 11.752 2.433 ( -2.438 -7.589 10.478) 13.165 2.606 ( -8.478 7.156 6.377) 12.797 2.974 ( -10.237 -7.905 3.007) 13.279 3.027 ( -2.926 -8.822 -0.087) 9.295 3.158 ( -2.392 -0.272 3.644) 4.367 3.384 ( 4.506 6.236 12.526) 14.700 3.531 ( -0.377 3.488 15.362) 15.758 3.658 ( -1.000 -3.060 4.558) 5.580 3.725 ( -2.226 1.703 2.853) 4.000 3.823 ( -5.027 0.985 1.451) 5.325 3.935 ( 2.433 -5.272 -6.972) 9.073 4.013 ( -9.735 -0.841 -8.679) 13.069 4.242 ( 3.031 -3.689 -0.294) 4.784 4.395 ( 0.744 -6.102 -7.034) 9.342 4.940 ( 1.262 2.389 -1.056) 2.901 4.984 ( -2.933 -0.618 13.839) 14.160 5.157 ( -3.829 6.985 13.225) 15.439 5.315 ( 11.874 5.201 0.739) 12.984 5.405 ( -8.014 0.390 6.384) 10.253 5.649 ( 1.632 -2.813 -5.911) 6.746 5.823 ( 3.322 0.272 5.771) 6.665 5.951 ( 2.439 14.161 4.350) 15.014 6.307 ( 3.804 -1.992 1.017) 4.412 6.426 ( -10.679 -2.169 4.641) 11.844 6.600 ( 7.693 -3.422 -2.097) 8.677 6.841 ( -12.171 -4.158 6.746) 14.524 7.145 ( 2.977 3.335 -8.268) 9.399 7.317 ( 0.504 6.998 -8.549) 11.059 7.472 ( 2.608 12.919 2.153) 13.354 7.748 ( 13.011 1.087 6.383) 14.533 7.933 ( -1.769 -1.718 -3.690) 4.438 8.027 ( 4.798 -2.710 -7.004) 8.912 8.276 ( -5.572 -3.863 -5.237) 8.567 8.633 ( -7.094 -6.447 5.315) 10.961 8.705 ( 2.177 -2.908 -0.805) 3.721 8.933 ( 0.602 0.649 1.450) 1.699 9.271 ( -0.236 4.401 4.426) 6.246 9.422 ( 2.674 -4.447 -3.741) 6.397 10.154 ( 6.841 -3.301 -11.775) 14.012 10.794 ( 1.757 1.335 -9.744) 9.991 13.135 ( -4.902 -0.468 -8.696) 9.993 13.512 ( -3.053 1.267 -7.885) 8.550 13.807 ( 1.948 -1.964 -3.491) 4.454 13.972 ( 8.632 0.001 -0.763) 8.666 14.113 ( 3.203 0.047 1.864) 3.706 14.287 ( -4.010 0.594 -4.660) 6.176 14.560 ( -1.707 -2.143 2.774) 3.899 14.655 ( -0.704 -2.413 3.183) 4.056 15.507 ( -2.499 0.317 13.257) 13.494 16.297 ( -1.392 2.001 -3.011) 3.874 16.844 ( -2.489 -0.007 9.643) 9.959 17.110 ( 3.279 -0.039 19.605) 19.878 17.814 ( 2.552 -0.423 -6.166) 6.687 18.289 ( 0.469 0.007 -4.527) 4.551 18.787 ( 1.253 0.196 -5.325) 5.474 18.839 ( 0.120 0.052 -1.656) 1.661 18.955 ( 0.014 -0.784 3.083) 3.182 19.662 ( 3.830 0.567 -3.735) 5.380 20.192 ( -8.229 -1.836 10.632) 13.570 21.024 ( -3.488 15.779 4.488) 16.771 21.260 ( -3.147 6.917 8.844) 11.661 21.554 ( 2.676 4.229 2.344) 5.526 21.835 ( 1.765 -10.123 -5.055) 11.452 22.396 ( 2.363 1.253 -5.484) 6.102 23.275 ( 1.764 2.835 1.394) 3.618 23.457 ( 3.644 -4.739 0.319) 5.987 23.644 ( 2.426 -10.970 1.079) 11.287 24.124 ( -5.054 0.371 -9.881) 11.105 ======================= Grid point 136 (69/128) ======================= q-point: (-0.14 -0.43 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.504 ( -16.514 -8.545 3.192) 18.866 1.732 ( -11.387 -13.586 10.674) 20.692 1.967 ( 19.382 -1.325 15.582) 24.904 2.201 ( -0.805 -0.633 14.033) 14.070 2.447 ( -1.137 2.669 8.869) 9.332 2.616 ( -1.145 -6.878 10.773) 12.832 3.033 ( -0.741 5.230 2.586) 5.881 3.060 ( -7.864 -12.074 9.619) 17.324 3.185 ( -8.578 -3.986 8.696) 12.849 3.324 ( -1.910 0.315 -2.727) 3.344 3.569 ( 1.306 -1.469 16.328) 16.446 3.631 ( -5.396 0.497 3.294) 6.341 3.750 ( 2.963 0.731 5.468) 6.262 3.785 ( -0.798 -1.956 -1.588) 2.643 3.861 ( -6.487 4.385 -5.884) 9.794 4.000 ( -3.739 -4.470 -1.503) 6.019 4.426 ( 3.344 -11.487 0.271) 11.967 4.433 ( -1.663 -0.818 -6.498) 6.757 4.883 ( -0.068 6.190 3.964) 7.351 4.973 ( -6.212 2.866 5.009) 8.479 5.027 ( -1.938 1.192 13.146) 13.342 5.303 ( -2.723 10.903 11.266) 15.912 5.333 ( 2.270 3.717 3.371) 5.507 5.713 ( 0.088 -5.424 5.277) 7.568 5.811 ( -1.351 2.969 -1.632) 3.648 5.895 ( 6.087 0.316 -2.132) 6.457 6.309 ( -8.037 -0.366 -5.170) 9.563 6.390 ( 3.398 0.450 6.138) 7.031 6.700 ( 0.558 -1.238 0.090) 1.361 6.887 ( 0.317 -6.626 8.280) 10.609 7.019 ( 4.038 16.311 -10.156) 19.634 7.168 ( 1.295 8.334 -5.237) 9.928 7.292 ( -1.380 6.650 -2.502) 7.238 7.864 ( -1.435 2.954 -4.315) 5.423 7.876 ( 4.038 0.340 3.774) 5.537 8.135 ( 7.777 -4.442 -4.528) 10.036 8.308 ( -2.043 -6.805 -3.406) 7.879 8.639 ( -9.160 -2.285 1.570) 9.571 8.775 ( 1.840 -3.627 -2.145) 4.598 8.984 ( 3.044 -4.042 4.825) 6.992 9.212 ( -0.874 4.295 4.970) 6.627 9.476 ( 0.632 -2.149 -7.588) 7.912 10.264 ( 7.924 -3.985 -9.654) 13.110 10.749 ( 1.166 2.290 -10.746) 11.049 13.109 ( -2.531 -3.822 -3.275) 5.634 13.456 ( -0.440 0.594 -5.750) 5.797 13.838 ( -0.170 -1.356 -4.988) 5.171 13.992 ( 4.932 3.870 -1.266) 6.395 14.163 ( 0.120 0.919 -2.462) 2.631 14.280 ( 4.551 -3.760 -4.469) 7.404 14.598 ( -1.801 -3.622 4.255) 5.870 14.689 ( -1.141 -1.731 4.107) 4.600 15.516 ( -2.604 -0.196 11.697) 11.985 16.234 ( -0.948 2.625 -3.943) 4.831 16.847 ( -2.497 -0.117 9.613) 9.933 17.179 ( 1.548 3.184 20.459) 20.763 17.860 ( 5.465 -2.096 -5.313) 7.905 18.259 ( -1.314 1.582 -2.974) 3.616 18.791 ( 1.328 -0.416 -6.352) 6.503 18.841 ( 1.453 -0.669 -2.917) 3.327 18.967 ( -1.091 -0.405 2.816) 3.047 19.664 ( 2.529 2.273 -6.064) 6.952 20.166 ( -11.277 -3.695 9.729) 15.345 20.662 ( -7.836 18.935 18.108) 27.346 21.242 ( -2.921 -2.080 7.765) 8.553 21.489 ( 2.111 7.218 0.271) 7.525 21.980 ( 4.350 -6.022 -7.835) 10.797 22.362 ( 0.869 2.322 -6.980) 7.407 23.271 ( 1.519 1.153 2.021) 2.779 23.559 ( 4.452 -2.760 0.713) 5.286 23.900 ( 7.435 -12.883 -3.257) 15.227 24.017 ( -6.490 1.628 -9.405) 11.542 ======================= Grid point 142 (70/128) ======================= q-point: (-0.29 -0.29 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.178 ( -15.839 0.000 18.089) 24.044 1.543 ( -26.192 0.000 6.279) 26.934 1.951 ( 23.223 -0.000 14.774) 27.524 2.242 ( -6.934 0.000 24.820) 25.770 2.353 ( 0.787 -0.000 10.915) 10.943 2.559 ( -20.845 0.000 21.451) 29.910 2.863 ( -0.057 0.000 -0.742) 0.744 2.942 ( 4.869 -0.000 -3.783) 6.166 3.175 ( 0.459 -0.000 4.234) 4.259 3.523 ( -0.965 0.000 13.780) 13.814 3.598 ( -7.894 0.000 24.676) 25.908 3.640 ( 4.011 -0.000 -8.588) 9.478 3.709 ( -3.346 0.000 11.503) 11.979 3.798 ( -4.038 0.000 -11.245) 11.948 3.833 ( 3.160 -0.000 -2.828) 4.240 3.960 ( -0.376 0.000 -6.010) 6.022 4.252 ( -1.533 0.000 2.540) 2.967 4.305 ( 2.294 -0.000 -12.781) 12.986 4.943 ( 1.088 -0.000 -9.667) 9.728 4.966 ( -6.266 0.000 14.667) 15.949 5.250 ( -5.134 0.000 25.247) 25.764 5.275 ( -8.394 0.000 -12.944) 15.428 5.516 ( 13.331 -0.000 -0.683) 13.349 5.604 ( -2.306 0.000 0.107) 2.308 5.891 ( 3.779 -0.000 6.058) 7.140 6.090 ( -5.452 0.000 -5.946) 8.067 6.268 ( -7.228 0.000 2.379) 7.610 6.317 ( -3.887 0.000 2.897) 4.848 6.663 ( 10.530 -0.000 2.754) 10.884 6.752 ( -2.600 0.000 14.475) 14.707 7.171 ( 1.293 -0.000 -4.996) 5.161 7.347 ( 1.613 -0.000 -10.081) 10.210 7.659 ( -0.479 0.000 4.966) 4.989 7.900 ( 12.871 -0.000 7.095) 14.697 7.925 ( 4.879 -0.000 -9.089) 10.316 8.012 ( 1.948 -0.000 -5.126) 5.483 8.171 ( -3.516 0.000 -7.244) 8.052 8.506 ( -9.105 0.000 6.288) 11.065 8.689 ( 0.110 -0.000 -0.620) 0.630 8.942 ( 0.119 -0.000 0.808) 0.816 9.336 ( -2.845 0.000 10.485) 10.864 9.374 ( 3.608 -0.000 -12.114) 12.640 10.178 ( 9.002 -0.000 -10.045) 13.488 10.788 ( 0.907 -0.000 -10.088) 10.128 13.053 ( -4.557 0.000 -6.234) 7.722 13.457 ( -3.206 0.000 -7.321) 7.992 13.810 ( 2.160 -0.000 -3.653) 4.244 14.069 ( 9.960 -0.000 -0.326) 9.965 14.155 ( 2.295 -0.000 4.488) 5.041 14.236 ( -3.004 0.000 -5.808) 6.538 14.532 ( -1.396 0.000 2.150) 2.564 14.635 ( -0.828 0.000 1.915) 2.087 15.517 ( -3.597 0.000 13.026) 13.514 16.284 ( -2.307 0.000 -2.665) 3.525 16.843 ( -2.943 0.000 9.362) 9.813 17.246 ( 9.274 -0.000 21.720) 23.617 17.815 ( 2.600 -0.000 -6.199) 6.722 18.293 ( 1.954 -0.000 -4.723) 5.111 18.776 ( 0.280 -0.000 -6.458) 6.464 18.838 ( 0.447 -0.000 -1.391) 1.461 18.956 ( -0.645 0.000 3.066) 3.133 19.689 ( 2.758 -0.000 -6.111) 6.705 20.098 ( -11.527 0.000 9.621) 15.014 21.123 ( -0.343 0.000 3.327) 3.345 21.485 ( 3.950 -0.000 6.097) 7.265 21.564 ( 0.416 -0.000 2.104) 2.145 21.695 ( -1.670 0.000 -1.851) 2.492 22.418 ( 1.903 -0.000 -5.204) 5.541 23.316 ( 0.268 -0.000 0.003) 0.268 23.471 ( 7.620 -0.000 0.555) 7.641 23.547 ( -1.289 0.000 2.772) 3.058 24.039 ( -6.179 0.000 -9.017) 10.931 ======================= Grid point 143 (71/128) ======================= q-point: (-0.14 -0.29 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.216 ( -14.185 -9.300 13.392) 21.611 1.371 ( -17.935 -14.887 12.002) 26.217 2.236 ( 20.012 1.118 14.541) 24.762 2.284 ( 5.594 1.530 21.579) 22.345 2.439 ( -15.962 -4.721 31.664) 35.772 2.498 ( -0.981 -9.233 15.080) 17.709 2.820 ( -2.170 1.553 -0.774) 2.779 3.056 ( 1.163 -6.221 2.307) 6.736 3.203 ( 4.515 1.960 4.318) 6.547 3.380 ( -4.701 10.612 -5.766) 12.960 3.562 ( -5.437 0.590 12.561) 13.700 3.685 ( -3.178 -3.634 -7.201) 8.669 3.721 ( 2.221 3.347 14.290) 14.844 3.774 ( -0.793 -1.691 5.051) 5.385 3.862 ( 0.580 2.103 -4.788) 5.262 3.950 ( 2.442 -0.858 -1.979) 3.259 4.288 ( 1.904 -8.422 -1.684) 8.797 4.347 ( -1.572 -5.264 -7.219) 9.071 4.870 ( -4.292 2.530 -7.448) 8.961 5.003 ( 0.124 -1.542 10.652) 10.764 5.093 ( -3.729 5.857 -0.213) 6.946 5.253 ( -8.932 0.947 9.514) 13.084 5.568 ( -1.847 -0.829 6.288) 6.606 5.622 ( 3.749 1.980 -0.929) 4.340 5.857 ( -11.716 9.455 -3.022) 15.356 5.935 ( 2.658 1.318 4.319) 5.240 6.196 ( -8.785 -4.487 1.220) 9.939 6.382 ( 0.230 -4.621 -1.133) 4.763 6.728 ( 6.390 4.447 7.550) 10.845 6.902 ( 10.151 -5.178 10.120) 15.240 7.151 ( 0.993 2.271 -4.139) 4.825 7.307 ( 4.450 4.974 -11.094) 12.947 7.481 ( -2.976 17.398 2.132) 17.779 7.854 ( -2.497 4.863 -3.272) 6.371 7.990 ( 3.695 4.583 -3.819) 7.017 8.140 ( 10.704 -5.893 -0.199) 12.220 8.170 ( -1.310 -5.819 -4.057) 7.214 8.475 ( -9.899 -5.655 0.981) 11.443 8.720 ( -0.151 -4.277 -0.617) 4.324 8.971 ( 1.993 -2.695 3.318) 4.717 9.288 ( -1.013 3.950 5.053) 6.494 9.406 ( -0.198 -3.316 -8.804) 9.410 10.276 ( 9.530 -2.731 -8.676) 13.174 10.753 ( 0.332 1.259 -10.973) 11.050 13.027 ( -1.517 -2.403 0.007) 2.842 13.424 ( -0.843 -1.362 -6.161) 6.366 13.817 ( 1.392 0.167 -4.713) 4.917 14.099 ( 1.697 3.912 1.226) 4.437 14.178 ( 0.274 1.640 -0.482) 1.731 14.269 ( 8.092 -4.028 -5.135) 10.396 14.543 ( -1.496 -2.138 2.966) 3.951 14.651 ( -1.040 -2.700 2.152) 3.606 15.514 ( -3.972 -0.249 11.769) 12.424 16.239 ( -2.023 1.380 -3.203) 4.032 16.841 ( -3.217 -0.341 9.184) 9.737 17.383 ( 10.577 6.375 21.359) 24.672 17.856 ( 4.383 -3.030 -5.101) 7.377 18.284 ( 1.843 2.023 -3.650) 4.562 18.762 ( -0.835 -1.072 -7.692) 7.811 18.840 ( 0.868 -0.099 -1.645) 1.863 18.956 ( -1.536 -0.289 2.727) 3.143 19.666 ( -3.023 0.310 -10.404) 10.839 20.029 ( -9.920 -2.109 12.948) 16.447 21.001 ( -3.012 22.816 10.673) 25.368 21.237 ( -4.289 6.664 9.300) 12.218 21.609 ( 1.185 5.047 0.901) 5.262 21.873 ( 5.007 -12.711 -5.864) 14.867 22.384 ( -0.344 2.651 -6.787) 7.294 23.319 ( 1.720 1.226 0.776) 2.251 23.580 ( 7.476 -2.514 0.859) 7.934 23.701 ( 2.973 -17.412 -2.764) 17.879 23.938 ( -6.905 0.779 -7.993) 10.591 ======================= Grid point 150 (72/128) ======================= q-point: (-0.14 -0.14 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.061 ( -7.336 0.000 25.798) 26.821 1.096 ( -15.855 0.000 18.594) 24.436 2.281 ( -18.987 0.000 39.852) 44.144 2.434 ( 0.038 -0.000 14.415) 14.415 2.488 ( 10.869 -0.000 24.646) 26.936 2.514 ( 17.731 -0.000 20.114) 26.814 2.929 ( 4.077 -0.000 0.079) 4.078 2.936 ( -4.052 0.000 -1.149) 4.212 3.309 ( 8.971 -0.000 -3.297) 9.558 3.420 ( -7.176 0.000 -3.117) 7.823 3.528 ( -7.424 0.000 18.433) 19.872 3.595 ( -2.291 0.000 -12.870) 13.073 3.745 ( 6.301 -0.000 -5.886) 8.623 3.855 ( -1.762 0.000 -0.832) 1.949 3.924 ( 9.461 -0.000 18.069) 20.396 3.964 ( 1.758 -0.000 -0.181) 1.767 4.200 ( -3.929 0.000 2.801) 4.825 4.236 ( -1.512 0.000 -13.005) 13.093 4.909 ( 1.380 -0.000 -18.661) 18.712 4.956 ( -0.384 0.000 9.236) 9.244 5.098 ( 1.398 -0.000 -5.505) 5.680 5.223 ( -7.001 0.000 11.401) 13.379 5.432 ( -12.794 0.000 0.012) 12.794 5.719 ( 3.203 -0.000 0.456) 3.235 5.848 ( -13.430 0.000 4.220) 14.078 5.926 ( -16.683 0.000 -0.992) 16.712 6.030 ( 4.280 -0.000 12.533) 13.244 6.389 ( 3.378 -0.000 1.209) 3.588 6.917 ( 9.878 -0.000 2.991) 10.321 6.992 ( 12.844 -0.000 13.541) 18.664 7.157 ( -0.885 0.000 -2.277) 2.443 7.358 ( 6.234 -0.000 -13.151) 14.554 7.569 ( -8.936 0.000 -0.874) 8.979 7.917 ( 0.891 -0.000 -8.960) 9.004 8.019 ( 0.870 -0.000 -2.503) 2.650 8.128 ( 2.441 -0.000 -6.310) 6.765 8.216 ( 12.064 -0.000 3.383) 12.529 8.300 ( -12.951 0.000 3.201) 13.341 8.653 ( -2.424 0.000 -1.274) 2.739 8.974 ( 1.521 -0.000 3.630) 3.935 9.325 ( -4.027 0.000 10.442) 11.192 9.337 ( 1.081 -0.000 -15.104) 15.143 10.331 ( 9.182 -0.000 -6.625) 11.323 10.729 ( -0.076 0.000 -11.728) 11.729 13.034 ( 5.065 -0.000 6.070) 7.906 13.385 ( 0.143 -0.000 -4.994) 4.996 13.828 ( 1.952 -0.000 -4.206) 4.637 14.115 ( -2.010 0.000 -0.212) 2.021 14.241 ( 2.619 -0.000 5.970) 6.519 14.295 ( 8.726 -0.000 -9.369) 12.803 14.531 ( 0.465 -0.000 2.405) 2.449 14.608 ( -2.507 0.000 0.718) 2.608 15.498 ( -4.945 0.000 11.030) 12.088 16.218 ( -1.943 0.000 -3.084) 3.645 16.829 ( -3.477 0.000 8.927) 9.580 17.678 ( 17.721 -0.000 18.214) 25.412 17.842 ( 2.999 -0.000 -5.716) 6.455 18.315 ( 2.599 -0.000 -3.920) 4.703 18.698 ( -5.091 0.000 -7.092) 8.731 18.844 ( 0.719 -0.000 -1.458) 1.625 18.943 ( -1.911 0.000 2.518) 3.161 19.540 ( -12.757 0.000 -10.078) 16.257 20.001 ( -0.942 0.000 14.643) 14.673 21.131 ( -0.975 0.000 3.960) 4.079 21.577 ( -0.020 0.000 -0.695) 0.695 21.607 ( 3.574 -0.000 3.402) 4.934 21.663 ( -0.382 0.000 0.380) 0.539 22.370 ( -3.654 0.000 -7.483) 8.327 23.332 ( 1.252 -0.000 -0.066) 1.254 23.527 ( -2.236 0.000 2.830) 3.607 23.660 ( 9.716 -0.000 -0.180) 9.717 23.847 ( -7.102 0.000 -7.197) 10.111 ======================= Grid point 151 (73/128) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.691 ( 2.375 -0.000 24.210) 24.326 1.696 ( 0.945 -0.000 24.245) 24.263 2.691 ( -1.217 0.000 -9.016) 9.097 2.691 ( -1.486 0.000 -1.630) 2.206 2.810 ( -3.981 0.000 1.209) 4.160 2.871 ( -8.117 0.000 14.782) 16.864 3.068 ( 8.623 -0.000 2.186) 8.896 3.205 ( -0.502 0.000 0.241) 0.557 3.256 ( 1.391 -0.000 -10.746) 10.836 3.287 ( -1.495 0.000 9.309) 9.429 3.513 ( -14.174 0.000 0.543) 14.184 3.736 ( 5.238 -0.000 24.024) 24.588 3.770 ( 0.872 -0.000 -7.240) 7.293 3.863 ( -7.520 0.000 22.053) 23.300 3.948 ( 1.578 -0.000 -4.740) 4.995 4.005 ( -1.137 0.000 -3.118) 3.319 4.294 ( 1.223 -0.000 5.936) 6.061 4.503 ( 9.978 -0.000 7.049) 12.217 4.587 ( 5.917 -0.000 -5.448) 8.043 4.940 ( 0.640 -0.000 3.058) 3.124 5.074 ( 12.538 -0.000 -12.861) 17.961 5.349 ( -10.886 0.000 10.834) 15.358 5.404 ( 0.793 -0.000 12.128) 12.154 5.551 ( -7.125 0.000 -2.920) 7.700 5.723 ( -2.113 0.000 -1.147) 2.404 5.859 ( -5.431 0.000 12.118) 13.279 6.499 ( 4.505 -0.000 1.183) 4.657 6.625 ( -5.036 0.000 19.435) 20.077 6.776 ( -0.879 0.000 -20.364) 20.383 6.932 ( -1.623 0.000 -11.681) 11.793 7.052 ( -23.805 0.000 -4.248) 24.181 7.225 ( 10.429 -0.000 -7.739) 12.987 7.368 ( 8.187 -0.000 -3.689) 8.980 7.864 ( 4.529 -0.000 -7.058) 8.386 8.071 ( 0.643 -0.000 6.289) 6.322 8.098 ( 2.679 -0.000 1.309) 2.981 8.132 ( -8.842 0.000 1.714) 9.006 8.458 ( -0.859 0.000 -8.664) 8.706 8.492 ( 5.072 -0.000 4.694) 6.911 8.981 ( 2.260 -0.000 -11.830) 12.044 9.199 ( -0.938 0.000 12.581) 12.616 9.585 ( -2.435 0.000 13.296) 13.517 10.285 ( -0.641 0.000 -10.021) 10.041 10.351 ( 6.893 -0.000 -17.078) 18.416 13.345 ( 6.504 -0.000 1.725) 6.729 13.366 ( 4.085 -0.000 -0.687) 4.142 13.765 ( 1.874 -0.000 -3.280) 3.778 13.973 ( -2.204 0.000 -10.879) 11.100 14.289 ( 4.599 -0.000 2.352) 5.165 14.408 ( -0.182 0.000 1.185) 1.199 14.560 ( -2.578 0.000 2.409) 3.528 14.615 ( 1.234 -0.000 1.556) 1.986 15.622 ( -4.557 0.000 8.060) 9.259 16.082 ( 1.221 -0.000 -6.064) 6.185 17.023 ( -3.446 0.000 11.671) 12.169 17.713 ( 2.363 -0.000 -8.813) 9.124 17.945 ( -15.173 0.000 6.999) 16.709 18.291 ( 4.973 -0.000 -3.735) 6.219 18.641 ( 4.514 -0.000 1.079) 4.641 18.789 ( -1.140 0.000 -2.617) 2.854 18.982 ( -1.634 0.000 3.542) 3.901 19.250 ( 1.214 -0.000 -4.249) 4.419 20.466 ( 3.867 -0.000 15.883) 16.347 21.138 ( -2.095 0.000 -2.808) 3.503 21.570 ( 1.564 -0.000 1.345) 2.063 21.608 ( -4.621 0.000 -0.376) 4.636 21.724 ( -0.203 0.000 3.742) 3.748 22.121 ( -1.740 0.000 -5.519) 5.787 23.370 ( 2.340 -0.000 0.312) 2.361 23.525 ( -6.420 0.000 -5.052) 8.170 23.557 ( -3.557 0.000 3.936) 5.305 23.821 ( 8.997 -0.000 -3.712) 9.732 ======================= Grid point 152 (74/128) ======================= q-point: ( 0.14 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.818 ( 4.505 -2.301 20.990) 21.591 1.882 ( 2.178 -10.857 19.620) 22.529 2.591 ( -5.476 6.848 -3.944) 9.614 2.641 ( 1.254 5.320 -0.361) 5.478 2.759 ( -4.525 3.003 -4.720) 7.195 2.809 ( -11.271 0.149 5.708) 12.635 2.967 ( -1.832 6.643 -0.912) 6.951 3.127 ( -2.940 6.619 5.300) 8.974 3.296 ( -3.138 -1.541 -1.232) 3.707 3.329 ( -0.537 -7.429 3.670) 8.303 3.482 ( 0.499 -3.678 3.098) 4.835 3.745 ( 0.362 3.712 -0.381) 3.749 3.840 ( -6.165 -6.356 -4.958) 10.148 3.897 ( 2.234 -0.560 9.371) 9.650 3.953 ( 1.941 -3.646 24.853) 25.194 4.060 ( 2.203 -3.159 0.089) 3.853 4.327 ( -3.643 -2.702 6.284) 7.751 4.565 ( 8.256 -0.319 -0.586) 8.283 4.757 ( 1.548 -8.435 11.094) 14.022 4.987 ( -1.371 -6.486 -1.352) 6.766 5.131 ( 2.714 7.653 -1.536) 8.264 5.301 ( 4.514 -4.406 -2.199) 6.680 5.471 ( 0.754 1.536 4.318) 4.644 5.555 ( 3.128 0.411 2.303) 3.906 5.585 ( -0.606 5.455 4.992) 7.419 5.951 ( -2.244 -8.630 8.661) 12.430 6.486 ( 3.408 7.757 2.685) 8.888 6.563 ( -8.036 3.766 7.233) 11.448 6.710 ( -6.932 0.267 -14.028) 15.649 6.800 ( -16.162 -0.115 1.434) 16.225 6.887 ( -3.355 -2.007 -9.005) 9.817 7.138 ( 7.022 16.820 -2.754) 18.433 7.477 ( 10.586 -1.362 -9.926) 14.576 7.771 ( -1.642 7.751 -5.254) 9.507 8.044 ( -7.809 -0.004 1.104) 7.887 8.096 ( 6.819 3.948 2.473) 8.258 8.197 ( -2.696 -8.746 -0.562) 9.170 8.489 ( 4.506 -5.923 0.021) 7.442 8.608 ( 3.736 -4.361 -1.536) 5.945 8.979 ( 1.564 -1.226 -10.027) 10.222 9.253 ( -3.021 -4.480 11.800) 12.978 9.575 ( -2.852 3.059 13.175) 13.823 10.210 ( -3.098 0.550 -13.605) 13.964 10.394 ( 8.167 0.176 -14.303) 16.471 13.362 ( 5.537 3.742 0.348) 6.692 13.432 ( 3.809 -0.367 -2.153) 4.391 13.752 ( 2.700 2.275 -1.856) 3.989 13.893 ( -6.278 0.504 -11.791) 13.368 14.313 ( 2.895 4.378 1.567) 5.477 14.348 ( -1.166 3.409 -1.011) 3.742 14.588 ( -0.904 -4.606 4.724) 6.659 14.698 ( 0.756 -6.260 1.197) 6.418 15.612 ( -3.084 -0.927 8.114) 8.730 16.076 ( 2.931 1.212 -5.982) 6.771 17.027 ( -2.969 -0.340 11.939) 12.307 17.696 ( -2.809 1.942 -5.339) 6.337 17.763 ( -12.686 1.761 7.759) 14.975 18.313 ( 2.171 1.634 -2.967) 4.023 18.698 ( 4.736 -0.331 -0.623) 4.788 18.770 ( -0.941 -0.309 -2.864) 3.030 18.985 ( -1.113 -0.974 3.638) 3.927 19.287 ( 3.978 -2.164 -4.530) 6.405 20.557 ( 2.529 -0.779 15.523) 15.747 21.119 ( -1.564 -1.608 -4.155) 4.722 21.280 ( -4.216 19.110 10.075) 22.011 21.692 ( -1.625 3.200 5.757) 6.784 21.777 ( 0.992 -7.456 -7.560) 10.664 22.102 ( 0.955 -0.586 -5.644) 5.754 23.413 ( -0.020 0.229 0.347) 0.416 23.467 ( -3.316 -3.589 -2.896) 5.681 23.578 ( -3.988 -6.420 1.359) 7.679 23.909 ( 8.406 -0.815 -4.773) 9.701 ======================= Grid point 153 (75/128) ======================= q-point: ( 0.29 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.943 ( 3.070 1.148 13.534) 13.925 2.095 ( -2.737 -6.075 12.288) 13.978 2.364 ( -8.796 7.229 1.799) 11.527 2.485 ( -8.408 3.669 0.823) 9.211 2.642 ( 6.076 9.142 0.652) 10.997 2.768 ( 3.084 3.413 1.104) 4.731 2.945 ( -1.561 -2.078 0.568) 2.660 3.034 ( -3.269 0.624 4.322) 5.455 3.234 ( -10.432 -2.467 -3.997) 11.441 3.469 ( 5.383 -4.250 2.306) 7.236 3.564 ( 2.035 -2.105 5.478) 6.211 3.674 ( -3.750 0.863 -5.872) 7.020 3.830 ( -4.146 -3.874 -0.476) 5.694 4.022 ( 1.323 -4.399 6.175) 7.696 4.074 ( -4.145 -4.449 18.772) 19.733 4.150 ( 2.408 -2.644 10.918) 11.489 4.430 ( 1.301 -11.270 5.686) 12.690 4.640 ( 4.233 0.247 0.032) 4.240 4.860 ( -7.590 -0.257 11.203) 13.534 5.009 ( -4.173 -0.928 14.082) 14.716 5.093 ( 2.020 -1.918 -4.910) 5.645 5.233 ( -9.605 13.847 4.216) 17.372 5.465 ( 10.963 -4.553 -12.358) 17.136 5.600 ( 3.211 -4.736 4.813) 7.477 5.748 ( 15.860 -0.599 4.103) 16.393 6.063 ( -1.146 -5.277 0.810) 5.461 6.337 ( -8.897 6.815 -5.808) 12.623 6.433 ( -1.561 5.262 3.869) 6.716 6.558 ( -14.136 0.652 16.068) 21.411 6.733 ( 0.790 1.756 -11.639) 11.797 6.875 ( -3.238 -3.263 -3.992) 6.088 6.956 ( 5.395 11.421 0.764) 12.654 7.492 ( 3.514 7.769 -9.981) 13.128 7.664 ( 1.922 0.856 -4.833) 5.271 7.974 ( -6.705 -0.359 -0.002) 6.714 8.107 ( 8.746 4.382 -2.377) 10.067 8.292 ( -4.066 -7.493 -0.547) 8.542 8.657 ( 3.278 -7.020 -2.881) 8.266 8.678 ( 3.905 -0.977 2.039) 4.513 8.994 ( 1.533 -2.475 -8.279) 8.776 9.327 ( -4.711 -5.751 8.891) 11.590 9.507 ( -3.645 6.097 12.797) 14.637 10.148 ( -0.798 -0.930 -13.124) 13.181 10.420 ( 6.448 0.879 -14.351) 15.758 13.348 ( 4.225 5.376 -0.068) 6.838 13.434 ( 2.518 2.497 -3.560) 5.025 13.756 ( -2.562 0.761 -5.002) 5.671 13.789 ( -0.800 -1.136 -5.638) 5.807 14.198 ( -4.165 4.830 -1.868) 6.646 14.344 ( 3.900 2.658 -0.444) 4.741 14.672 ( -1.445 -5.321 4.758) 7.284 14.792 ( 0.276 -3.673 2.514) 4.459 15.632 ( -2.181 -1.935 7.547) 8.091 16.071 ( 3.797 1.643 -6.009) 7.295 17.042 ( -2.431 -0.574 11.957) 12.215 17.544 ( -12.843 2.517 11.542) 17.449 17.740 ( 1.834 -0.971 -5.015) 5.427 18.273 ( -0.043 3.304 -2.621) 4.218 18.721 ( 0.715 0.417 -2.519) 2.652 18.778 ( 2.196 -0.610 -2.497) 3.381 19.007 ( -1.032 -1.618 4.002) 4.438 19.357 ( 4.097 -2.930 -5.578) 7.515 20.615 ( -2.068 0.550 15.300) 15.449 21.015 ( -2.886 13.694 14.408) 20.086 21.142 ( 0.022 -4.003 -3.686) 5.441 21.618 ( -2.599 5.479 7.401) 9.568 21.825 ( 1.558 -1.658 -10.921) 11.156 22.121 ( 3.086 -1.060 -7.405) 8.092 23.368 ( -3.596 0.906 1.469) 3.989 23.524 ( 1.963 -2.904 -0.308) 3.518 23.658 ( -4.637 -8.970 -2.670) 10.445 23.987 ( 7.230 -0.275 -5.409) 9.034 ======================= Grid point 154 (76/128) ======================= q-point: (-0.57 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.794 ( -12.455 9.141 6.517) 16.768 2.166 ( 8.139 1.385 8.405) 11.782 2.271 ( -4.609 -0.074 4.557) 6.482 2.441 ( 1.931 4.193 0.301) 4.626 2.630 ( 3.574 -1.325 9.422) 10.164 2.719 ( -0.297 4.887 7.624) 9.061 2.962 ( -3.514 -2.883 -0.599) 4.585 3.070 ( 1.747 -1.113 -3.423) 4.001 3.171 ( -2.762 -4.481 -4.006) 6.614 3.566 ( 7.081 1.575 -8.568) 11.226 3.594 ( -3.681 -1.749 9.394) 10.240 3.647 ( -7.328 -6.642 -1.049) 9.946 3.855 ( -4.328 -3.478 3.577) 6.605 4.050 ( 1.140 4.043 4.855) 6.420 4.141 ( -5.378 -1.223 24.690) 25.299 4.204 ( -0.022 1.695 6.977) 7.180 4.602 ( -2.550 6.052 7.930) 10.297 4.692 ( -3.151 -1.385 -1.031) 3.593 4.749 ( -2.790 -3.386 -0.790) 4.458 4.833 ( -0.023 11.229 11.537) 16.100 5.145 ( -4.850 -10.356 15.543) 19.296 5.212 ( -0.477 -6.180 -3.825) 7.284 5.565 ( 6.022 -1.392 -12.956) 14.355 5.657 ( -0.536 6.091 10.069) 11.780 5.865 ( 7.162 4.743 1.121) 8.663 6.086 ( -7.232 -1.093 -5.823) 9.349 6.221 ( 5.534 -5.645 -7.553) 10.933 6.389 ( 3.205 3.497 5.309) 7.120 6.514 ( -10.085 -4.596 18.883) 21.895 6.676 ( 0.818 1.099 -9.537) 9.635 6.895 ( -1.122 -3.026 2.955) 4.376 6.931 ( 5.322 0.375 -3.429) 6.342 7.345 ( -2.617 5.966 -4.335) 7.826 7.690 ( 4.146 -0.461 -7.581) 8.653 7.906 ( -6.157 0.746 1.403) 6.359 8.137 ( 9.687 3.058 -5.209) 11.416 8.322 ( -5.217 -3.224 -2.120) 6.489 8.676 ( 1.602 1.726 -2.659) 3.552 8.787 ( 1.950 -3.043 1.356) 3.860 9.040 ( 3.110 -2.983 -8.433) 9.471 9.381 ( -5.451 -5.187 7.309) 10.491 9.398 ( -2.799 7.840 12.214) 14.781 10.145 ( 2.285 -1.870 -11.035) 11.423 10.420 ( 4.635 0.731 -14.940) 15.660 13.276 ( 0.942 6.761 -0.295) 6.832 13.417 ( 3.473 2.533 -2.228) 4.842 13.672 ( -5.858 -1.697 -9.863) 11.596 13.855 ( 4.030 -2.628 0.579) 4.846 14.104 ( -2.837 1.184 -1.505) 3.423 14.327 ( 2.801 3.410 -2.547) 5.095 14.738 ( -1.609 -3.146 4.351) 5.605 14.825 ( -0.305 0.641 4.041) 4.103 15.664 ( -2.302 -2.158 6.948) 7.631 16.071 ( 3.114 0.744 -6.206) 6.983 17.061 ( -2.446 -0.409 11.616) 11.878 17.460 ( -7.404 -0.972 13.377) 15.320 17.771 ( 2.772 -1.626 -4.769) 5.751 18.214 ( 0.533 2.892 -3.088) 4.264 18.706 ( -0.488 0.358 -2.838) 2.902 18.798 ( 2.116 0.075 -2.565) 3.326 19.029 ( -1.545 -1.055 4.234) 4.629 19.421 ( 2.928 -2.690 -6.859) 7.928 20.571 ( -7.396 4.108 15.385) 17.558 20.891 ( -0.453 6.225 16.170) 17.333 21.224 ( 1.095 -6.682 -3.934) 7.831 21.527 ( -3.841 4.426 9.222) 10.926 21.826 ( 3.053 -0.284 -12.108) 12.490 22.143 ( 3.194 -0.605 -9.022) 9.590 23.335 ( -2.219 0.226 3.306) 3.988 23.587 ( 3.636 -1.391 0.120) 3.894 23.719 ( -5.008 -6.618 -4.732) 9.554 24.026 ( 5.528 2.157 -5.854) 8.335 ======================= Grid point 155 (77/128) ======================= q-point: (-0.43 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.614 ( -5.819 4.548 14.754) 16.500 2.198 ( 5.003 9.118 6.721) 12.383 2.277 ( -4.038 -2.920 5.779) 7.630 2.442 ( 14.926 2.183 3.271) 15.436 2.628 ( -5.050 0.823 7.990) 9.488 2.808 ( -1.512 -10.889 -1.582) 11.107 2.980 ( -3.805 -6.034 -4.113) 8.234 3.029 ( -0.431 2.080 1.179) 2.429 3.296 ( 7.011 -3.542 2.024) 8.111 3.519 ( -7.654 5.658 1.356) 9.614 3.591 ( 2.794 -1.566 -8.250) 8.850 3.662 ( -6.625 -0.946 5.358) 8.573 3.859 ( -3.739 -1.279 5.578) 6.836 4.017 ( 3.633 3.660 8.690) 10.105 4.079 ( 0.976 19.376 24.018) 30.875 4.152 ( -7.127 0.389 11.978) 13.943 4.326 ( -3.651 11.429 0.747) 12.021 4.601 ( -2.465 2.077 0.733) 3.305 4.784 ( -1.825 1.915 -0.217) 2.654 4.969 ( 0.544 -9.788 4.341) 10.722 5.259 ( 2.452 3.055 -5.473) 6.731 5.324 ( -5.802 -10.298 15.310) 19.342 5.481 ( -0.210 4.651 -0.595) 4.694 5.602 ( -2.216 0.730 -0.574) 2.403 5.780 ( -7.795 1.612 -3.794) 8.818 6.050 ( 3.497 0.528 3.686) 5.108 6.325 ( 1.511 1.291 9.629) 9.832 6.483 ( 2.765 3.008 -6.378) 7.575 6.590 ( 0.291 -17.452 -1.994) 17.568 6.685 ( -3.627 -7.743 3.528) 9.249 6.965 ( 4.564 -1.502 -1.487) 5.029 6.989 ( 3.619 -2.449 -5.380) 6.931 7.273 ( -1.584 -1.642 0.227) 2.293 7.718 ( 2.761 -1.610 -7.342) 8.007 7.830 ( -6.226 1.379 4.966) 8.083 8.173 ( 8.762 3.292 -5.064) 10.642 8.284 ( -5.022 -0.631 -3.601) 6.212 8.644 ( 0.717 3.892 2.119) 4.489 8.801 ( -0.710 1.568 -3.959) 4.317 9.075 ( 3.151 -0.399 -11.250) 11.690 9.295 ( -0.662 6.819 10.619) 12.637 9.437 ( -3.718 -5.011 10.027) 11.810 10.170 ( 4.962 -0.030 -9.414) 10.642 10.414 ( 2.851 -0.929 -15.730) 16.013 13.187 ( 0.094 4.816 1.745) 5.123 13.405 ( 2.899 2.829 -1.797) 4.431 13.635 ( -2.817 -2.926 -8.241) 9.187 13.942 ( 3.124 -4.013 -1.066) 5.197 14.097 ( -0.377 -1.966 0.066) 2.003 14.292 ( 2.436 2.933 -3.578) 5.228 14.752 ( -1.086 1.643 4.390) 4.812 14.798 ( -0.892 2.948 3.884) 4.957 15.685 ( -2.962 -1.328 6.732) 7.474 16.077 ( 1.212 -0.953 -6.354) 6.539 17.065 ( -3.529 0.346 11.204) 11.752 17.500 ( -0.712 -4.619 10.986) 11.939 17.813 ( 1.185 -2.236 -2.440) 3.516 18.192 ( 4.177 1.404 -3.966) 5.928 18.682 ( -1.451 0.502 -2.614) 3.032 18.806 ( 1.509 0.272 -2.339) 2.797 19.030 ( -2.155 -0.081 4.231) 4.749 19.448 ( 0.573 -0.849 -8.236) 8.299 20.459 ( -7.046 5.392 16.143) 18.421 20.896 ( -1.581 -1.845 16.438) 16.617 21.306 ( -1.211 -3.358 -4.175) 5.493 21.490 ( -2.532 -1.914 10.437) 10.909 21.832 ( 4.373 -0.123 -12.094) 12.861 22.154 ( 2.144 -0.844 -9.298) 9.579 23.334 ( -0.349 -0.491 3.610) 3.660 23.643 ( 5.480 0.398 -0.261) 5.500 23.728 ( -5.211 -3.524 -5.496) 8.353 23.989 ( 3.096 6.547 -6.107) 9.474 ======================= Grid point 156 (78/128) ======================= q-point: (-0.29 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.593 ( 0.080 3.179 22.904) 23.124 1.995 ( -1.449 19.235 15.484) 24.736 2.418 ( 1.719 -12.843 0.105) 12.958 2.614 ( 2.993 -2.364 4.488) 5.889 2.650 ( 7.612 -5.565 3.883) 10.197 2.900 ( -4.741 -6.938 -6.188) 10.436 2.970 ( -0.310 -0.019 -4.791) 4.801 3.122 ( -1.326 -8.236 3.553) 9.068 3.287 ( -5.011 13.047 7.343) 15.788 3.378 ( 3.534 1.332 4.868) 6.161 3.578 ( -0.895 -1.197 -4.487) 4.729 3.657 ( 0.648 0.822 2.196) 2.433 3.765 ( -2.996 13.821 26.000) 29.597 3.951 ( -4.000 -2.877 -1.679) 5.205 4.037 ( -0.989 1.774 9.983) 10.187 4.115 ( -2.756 0.697 7.392) 7.919 4.237 ( 9.454 6.175 3.349) 11.778 4.528 ( -2.425 7.207 5.541) 9.409 4.665 ( -2.606 7.212 -4.826) 9.060 5.039 ( -0.255 3.633 2.057) 4.183 5.122 ( 3.262 7.188 -8.700) 11.747 5.396 ( -3.547 -1.329 13.314) 13.843 5.501 ( -8.717 -2.309 -0.155) 9.019 5.573 ( -11.907 -9.963 1.109) 15.564 5.718 ( -0.006 0.144 2.287) 2.292 6.137 ( 0.920 -0.718 0.475) 1.260 6.286 ( -3.264 1.897 2.727) 4.657 6.441 ( 1.628 -1.317 13.415) 13.577 6.801 ( -1.961 -11.824 2.821) 12.313 6.907 ( 7.197 -10.729 -11.028) 16.986 6.963 ( 0.671 0.683 -15.046) 15.076 7.061 ( 2.886 -5.994 -4.789) 8.197 7.352 ( -0.222 -4.901 5.045) 7.037 7.699 ( -3.571 -0.830 -8.680) 9.422 7.848 ( 0.894 -5.420 8.102) 9.788 8.183 ( 7.016 5.056 -1.460) 8.771 8.234 ( -3.485 -0.603 -3.500) 4.976 8.569 ( -1.140 7.488 5.601) 9.420 8.717 ( -1.567 4.391 -7.770) 9.062 9.052 ( 2.096 1.718 -12.847) 13.130 9.237 ( 2.030 5.890 9.165) 11.082 9.507 ( -3.390 -3.954 12.253) 13.314 10.198 ( 7.449 0.898 -9.226) 11.891 10.409 ( 1.007 -1.702 -16.137) 16.258 13.161 ( 2.216 0.834 4.321) 4.927 13.380 ( 2.390 3.028 -1.752) 4.237 13.654 ( 0.203 -3.990 -6.017) 7.223 14.040 ( 2.283 -4.845 -4.091) 6.740 14.114 ( 0.986 0.247 -0.193) 1.035 14.296 ( 2.608 -1.547 -1.017) 3.199 14.688 ( -1.414 5.878 4.919) 7.794 14.750 ( -0.331 3.923 2.004) 4.418 15.681 ( -4.059 -0.295 6.923) 8.031 16.084 ( -0.347 -1.801 -6.297) 6.559 17.048 ( -4.098 0.700 11.095) 11.848 17.624 ( 3.885 -5.027 1.934) 6.641 17.859 ( -1.640 -4.675 3.668) 6.164 18.231 ( 7.658 0.645 -4.886) 9.107 18.644 ( -2.333 0.854 -1.462) 2.882 18.809 ( 0.791 0.124 -2.105) 2.253 19.015 ( -2.360 0.436 4.051) 4.708 19.400 ( -2.826 2.201 -8.232) 8.977 20.383 ( -2.608 3.709 16.909) 17.506 21.016 ( -1.954 -9.820 13.830) 17.074 21.283 ( -4.820 -0.740 -0.030) 4.877 21.581 ( -0.519 -6.374 6.630) 9.212 21.838 ( 4.637 1.681 -10.706) 11.788 22.159 ( 0.397 -1.489 -8.501) 8.639 23.358 ( 1.066 -0.514 2.371) 2.650 23.683 ( -0.109 0.557 -3.688) 3.731 23.696 ( 2.003 0.082 -3.185) 3.763 23.848 ( -0.310 11.158 -4.574) 12.062 ======================= Grid point 157 (79/128) ======================= q-point: (-0.14 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.625 ( 1.072 2.976 25.339) 25.535 1.750 ( -1.973 14.669 21.987) 26.504 2.632 ( 0.603 -10.565 -5.414) 11.886 2.677 ( -1.798 -4.803 5.495) 7.516 2.827 ( 3.008 -0.346 2.101) 3.686 2.912 ( 3.708 -2.134 -3.859) 5.761 2.951 ( -3.445 0.651 5.586) 6.595 3.150 ( -2.487 -4.257 5.150) 7.129 3.190 ( 2.408 1.994 1.754) 3.585 3.397 ( -1.825 1.936 -3.426) 4.338 3.622 ( -1.357 3.339 19.969) 20.291 3.632 ( 1.676 -0.245 2.800) 3.273 3.700 ( 3.242 -2.766 3.401) 5.452 3.914 ( -10.131 -0.043 13.533) 16.905 4.028 ( 2.718 2.896 0.901) 4.073 4.049 ( -5.159 5.703 -5.745) 9.600 4.317 ( 5.061 -1.910 7.267) 9.059 4.362 ( 2.982 9.022 4.257) 10.412 4.599 ( 5.960 4.494 0.032) 7.465 4.954 ( 4.330 5.202 -8.516) 10.878 5.056 ( 4.903 5.343 -5.113) 8.873 5.395 ( -10.053 -3.268 8.653) 13.660 5.417 ( -8.391 0.442 13.145) 15.601 5.623 ( -10.639 -8.099 2.676) 13.636 5.705 ( -1.939 0.244 -2.583) 3.239 5.982 ( -5.327 8.671 2.599) 10.503 6.395 ( 4.317 -6.390 0.288) 7.716 6.559 ( -0.797 -3.565 22.690) 22.982 6.863 ( -0.023 2.310 -16.820) 16.978 6.975 ( 1.124 -0.241 -12.159) 12.214 7.028 ( 3.030 -13.584 -3.790) 14.425 7.215 ( -3.198 -8.875 -8.192) 12.494 7.328 ( -3.614 2.707 -1.226) 4.679 7.748 ( 4.604 -6.577 -4.059) 8.996 7.982 ( 1.640 -5.578 5.037) 7.693 8.158 ( 5.464 6.972 1.677) 9.015 8.202 ( -5.669 -1.525 -1.578) 6.079 8.447 ( -1.213 5.483 4.570) 7.241 8.596 ( -0.742 6.813 -7.181) 9.927 9.007 ( 2.173 1.527 -12.756) 13.030 9.201 ( 1.331 4.659 10.413) 11.485 9.556 ( -3.199 -2.118 13.175) 13.722 10.250 ( 8.313 -0.202 -9.214) 12.412 10.382 ( -0.287 -0.698 -16.825) 16.842 13.233 ( 5.332 -2.650 4.297) 7.343 13.361 ( 3.375 2.715 -1.009) 4.448 13.717 ( 1.926 -4.103 -4.098) 6.110 14.033 ( -0.842 1.660 -9.220) 9.406 14.194 ( 4.389 -4.294 2.075) 6.481 14.366 ( 1.602 -3.335 1.064) 3.850 14.597 ( -2.038 4.239 3.836) 6.070 14.676 ( 0.244 5.959 1.206) 6.085 15.653 ( -4.987 0.259 7.474) 8.989 16.086 ( -0.259 -1.268 -6.174) 6.308 17.030 ( -3.884 0.441 11.305) 11.962 17.703 ( 3.331 -1.252 -7.490) 8.293 17.956 ( -4.322 -7.677 7.924) 11.850 18.271 ( 5.551 1.927 -5.421) 7.995 18.614 ( 0.195 0.644 0.854) 1.087 18.805 ( -0.238 0.022 -2.241) 2.254 18.995 ( -2.155 0.454 3.763) 4.360 19.298 ( -2.965 2.718 -5.942) 7.175 20.393 ( 2.119 1.512 16.513) 16.717 21.159 ( -0.560 -1.974 0.575) 2.131 21.328 ( -5.208 -15.449 7.213) 17.827 21.679 ( -0.560 -4.248 4.957) 6.552 21.787 ( 2.759 7.414 -7.443) 10.862 22.152 ( -1.635 -1.260 -7.085) 7.380 23.372 ( 1.947 1.666 0.382) 2.591 23.614 ( -5.955 0.368 -5.692) 8.246 23.649 ( -3.192 8.902 0.938) 9.504 23.747 ( 8.568 1.287 -2.379) 8.985 ======================= Grid point 159 (80/128) ======================= q-point: ( 0.14 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.887 ( 3.603 -0.000 20.891) 21.200 1.961 ( 12.596 -0.000 17.502) 21.564 2.586 ( -8.695 0.000 -4.317) 9.708 2.630 ( -9.033 0.000 4.528) 10.104 2.673 ( -11.590 0.000 -0.352) 11.596 2.765 ( 3.836 -0.000 -4.204) 5.691 2.979 ( -14.297 0.000 9.164) 16.982 3.078 ( -5.114 0.000 -6.098) 7.959 3.281 ( 1.481 -0.000 -6.544) 6.709 3.305 ( 1.338 -0.000 10.716) 10.800 3.466 ( 1.861 -0.000 3.869) 4.294 3.682 ( -5.492 0.000 -4.792) 7.289 3.791 ( -5.324 0.000 13.332) 14.355 3.983 ( 2.293 -0.000 2.223) 3.194 4.033 ( 8.687 -0.000 -4.742) 9.897 4.044 ( 4.535 -0.000 23.730) 24.160 4.297 ( -3.559 0.000 0.783) 3.644 4.659 ( 5.637 -0.000 -4.289) 7.083 4.665 ( 0.548 -0.000 1.027) 1.164 4.905 ( -9.109 0.000 14.773) 17.355 5.238 ( -3.607 0.000 13.788) 14.252 5.349 ( 10.568 -0.000 -12.026) 16.009 5.390 ( 0.032 -0.000 -6.633) 6.633 5.709 ( 19.149 -0.000 4.805) 19.743 5.714 ( 1.663 -0.000 -0.312) 1.692 5.856 ( -2.265 0.000 16.774) 16.927 6.410 ( -21.065 0.000 -9.200) 22.986 6.604 ( 2.952 -0.000 3.310) 4.435 6.674 ( -11.231 0.000 23.351) 25.912 6.689 ( 5.076 -0.000 -14.764) 15.612 6.787 ( -6.088 0.000 -8.869) 10.757 7.413 ( 11.018 -0.000 -9.037) 14.250 7.464 ( 3.202 -0.000 -2.808) 4.259 7.772 ( -5.916 0.000 -12.081) 13.451 7.955 ( -9.430 0.000 4.555) 10.473 8.104 ( -0.736 0.000 1.268) 1.466 8.212 ( 7.174 -0.000 0.291) 7.180 8.449 ( 2.284 -0.000 -4.769) 5.288 8.642 ( 7.006 -0.000 2.316) 7.379 8.957 ( 1.687 -0.000 -9.809) 9.953 9.212 ( -5.393 0.000 14.004) 15.006 9.609 ( -3.184 0.000 13.476) 13.847 10.127 ( -3.958 0.000 -15.619) 16.113 10.442 ( 8.019 -0.000 -13.747) 15.915 13.459 ( 5.006 -0.000 -1.398) 5.198 13.462 ( 5.135 -0.000 -2.576) 5.745 13.774 ( 0.357 -0.000 -2.597) 2.621 13.787 ( -8.275 0.000 -11.444) 14.122 14.333 ( -5.368 0.000 -2.270) 5.828 14.403 ( 3.962 -0.000 1.718) 4.318 14.568 ( 0.630 -0.000 4.196) 4.243 14.639 ( 0.226 -0.000 0.750) 0.784 15.606 ( -1.933 0.000 9.563) 9.756 16.109 ( 4.463 -0.000 -5.671) 7.217 17.032 ( -2.593 0.000 12.230) 12.502 17.602 ( -19.373 0.000 13.149) 23.414 17.705 ( 2.126 -0.000 -9.172) 9.415 18.347 ( 1.342 -0.000 -2.491) 2.829 18.738 ( 3.797 -0.000 -1.312) 4.017 18.750 ( -0.135 0.000 -2.880) 2.883 18.975 ( -1.359 0.000 3.650) 3.895 19.312 ( 5.831 -0.000 -4.861) 7.592 20.613 ( -0.107 0.000 15.700) 15.700 21.077 ( -1.024 0.000 -5.164) 5.265 21.484 ( -5.780 0.000 0.631) 5.814 21.619 ( 1.157 -0.000 4.239) 4.394 21.740 ( -0.337 0.000 2.935) 2.954 22.096 ( 2.220 -0.000 -5.163) 5.620 23.380 ( -4.820 0.000 -2.660) 5.505 23.423 ( 1.628 -0.000 1.378) 2.133 23.506 ( -2.647 0.000 2.905) 3.930 23.971 ( 7.772 -0.000 -6.373) 10.051 ======================= Grid point 160 (81/128) ======================= q-point: ( 0.29 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.000 ( -0.529 -0.439 14.606) 14.623 2.171 ( 16.988 0.344 13.862) 21.929 2.360 ( -17.146 6.592 4.932) 19.020 2.422 ( -11.438 3.691 2.087) 12.199 2.722 ( -1.909 -6.222 -5.479) 8.507 2.813 ( 7.171 -0.699 2.456) 7.612 2.892 ( -7.348 -2.697 4.911) 9.240 3.003 ( -4.070 2.258 -4.311) 6.345 3.183 ( -3.689 6.768 7.298) 10.615 3.409 ( 1.170 -6.275 -1.766) 6.623 3.510 ( -2.108 -2.802 0.152) 3.510 3.669 ( -5.888 -6.157 -1.183) 8.601 3.734 ( -0.268 4.915 3.906) 6.284 4.012 ( -0.079 -0.972 5.414) 5.501 4.092 ( 3.683 0.944 10.639) 11.298 4.214 ( 5.191 -1.429 9.849) 11.224 4.300 ( 2.725 -7.824 1.024) 8.349 4.678 ( -0.795 -2.711 -2.551) 3.806 4.757 ( -2.025 -7.982 -1.885) 8.448 4.847 ( -10.092 1.217 13.523) 16.917 5.168 ( -3.803 4.042 3.991) 6.836 5.316 ( -5.001 1.879 9.418) 10.828 5.544 ( 16.253 0.164 -16.654) 23.271 5.627 ( 2.824 5.186 6.935) 9.109 5.931 ( 2.386 -6.759 5.370) 8.957 5.978 ( 12.339 0.361 5.297) 13.433 6.190 ( -14.876 -2.106 -0.680) 15.039 6.539 ( -2.490 7.082 4.222) 8.613 6.600 ( -5.525 6.566 15.096) 17.365 6.708 ( 2.540 -1.061 -14.544) 14.803 6.774 ( 0.193 -3.875 1.124) 4.039 7.262 ( 5.522 16.611 -1.220) 17.548 7.582 ( 1.980 2.808 -14.458) 14.861 7.645 ( -1.466 -1.102 -5.729) 6.015 7.883 ( -9.090 -1.238 4.787) 10.348 8.125 ( -3.318 -5.225 -1.345) 6.334 8.265 ( 8.201 2.922 -1.383) 8.815 8.538 ( 0.897 -8.587 -4.553) 9.761 8.728 ( 6.026 -0.658 1.960) 6.370 8.959 ( 2.481 -1.406 -8.859) 9.306 9.219 ( -6.945 -3.737 12.818) 15.050 9.585 ( -3.846 3.484 13.595) 14.552 10.054 ( -2.799 -2.024 -15.920) 16.291 10.473 ( 7.228 1.263 -13.731) 15.569 13.469 ( 4.623 3.983 -2.823) 6.724 13.492 ( 3.538 2.024 -3.311) 5.252 13.651 ( -8.782 0.457 -10.413) 13.630 13.787 ( 0.865 -2.171 -0.715) 2.444 14.218 ( -5.390 5.076 -2.182) 7.719 14.415 ( 2.084 2.380 -0.246) 3.173 14.608 ( 0.082 -3.123 3.872) 4.975 14.711 ( -0.284 -6.603 1.165) 6.711 15.622 ( -1.237 -0.258 9.932) 10.013 16.131 ( 5.099 1.653 -5.565) 7.726 17.045 ( -2.417 -0.392 12.119) 12.364 17.454 ( -14.880 0.166 14.941) 21.087 17.711 ( 1.814 -1.414 -8.442) 8.750 18.317 ( -0.722 2.615 -2.907) 3.976 18.732 ( 1.042 1.370 -2.266) 2.845 18.783 ( 2.425 -1.137 -2.414) 3.606 18.982 ( -1.404 -1.393 4.124) 4.574 19.365 ( 5.570 -0.776 -5.482) 7.854 20.638 ( -4.049 0.538 16.024) 16.536 21.074 ( 0.350 -2.451 -5.365) 5.909 21.273 ( -1.478 15.098 7.964) 17.134 21.674 ( -3.167 1.978 6.422) 7.428 21.763 ( 1.190 -3.930 -4.805) 6.320 22.120 ( 3.840 -0.980 -6.356) 7.490 23.329 ( -3.922 -0.174 -0.209) 3.932 23.482 ( -0.614 -5.667 0.660) 5.738 23.519 ( -0.187 -2.548 1.626) 3.028 24.032 ( 6.411 -0.613 -7.433) 9.835 ======================= Grid point 161 (82/128) ======================= q-point: ( 0.43 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.842 ( -11.997 9.718 9.920) 18.351 2.215 ( -7.605 2.489 2.237) 8.309 2.369 ( 5.169 -4.636 7.056) 9.899 2.376 ( 9.003 -0.144 9.048) 12.765 2.724 ( -5.538 -0.036 0.974) 5.623 2.809 ( -4.057 2.997 7.280) 8.857 2.891 ( -2.349 5.207 2.457) 6.218 3.041 ( 3.533 -7.315 -4.043) 9.074 3.099 ( 3.357 -0.062 -0.314) 3.372 3.474 ( -5.512 -5.024 -3.964) 8.446 3.522 ( -3.142 -3.271 8.043) 9.234 3.628 ( -3.480 2.073 -5.557) 6.877 3.773 ( 2.978 -4.508 2.839) 6.104 4.054 ( -1.424 -4.279 4.788) 6.577 4.159 ( 1.306 -0.867 11.362) 11.470 4.292 ( 4.038 0.294 11.186) 11.897 4.536 ( 5.432 -12.494 0.967) 13.658 4.653 ( -6.153 1.156 3.224) 7.042 4.723 ( -9.046 3.837 2.739) 10.201 4.880 ( -3.685 -12.424 -0.889) 12.989 5.078 ( -7.726 7.691 4.810) 11.915 5.180 ( -0.257 8.921 14.594) 17.107 5.612 ( 8.011 -2.077 -9.275) 12.430 5.698 ( 3.036 -0.183 2.201) 3.754 5.890 ( -10.058 2.115 -5.005) 11.432 6.100 ( 3.284 -1.451 15.609) 16.017 6.237 ( 10.426 -0.606 1.472) 10.546 6.434 ( -4.090 2.678 6.997) 8.535 6.488 ( -4.124 4.086 7.536) 9.513 6.687 ( 2.442 2.718 -13.858) 14.332 6.862 ( 4.833 -3.695 2.671) 6.644 7.094 ( 6.411 11.700 1.634) 13.441 7.391 ( -4.949 7.644 -10.961) 14.250 7.698 ( 4.195 -1.121 -8.727) 9.748 7.830 ( -9.102 -1.956 6.409) 11.302 8.171 ( -4.611 -5.905 -2.587) 7.926 8.291 ( 8.639 4.117 -3.367) 10.145 8.643 ( -0.713 -6.382 -6.642) 9.238 8.788 ( 3.031 0.260 1.645) 3.459 9.010 ( 4.491 -3.214 -6.966) 8.890 9.251 ( -7.215 -5.474 10.135) 13.592 9.512 ( -3.276 5.687 13.200) 14.742 10.046 ( -0.797 -5.214 -14.564) 15.489 10.472 ( 6.380 2.675 -13.626) 15.282 13.386 ( -1.167 7.277 -2.546) 7.797 13.472 ( -0.005 0.831 -5.258) 5.323 13.579 ( 0.380 -0.183 -6.766) 6.779 13.848 ( 1.727 -3.295 0.517) 3.756 14.091 ( -3.899 3.055 -1.766) 5.259 14.383 ( 0.407 2.727 -2.541) 3.750 14.677 ( -0.716 -4.204 3.896) 5.776 14.800 ( -0.905 -4.340 2.306) 4.997 15.643 ( -1.502 -0.475 9.151) 9.286 16.128 ( 4.485 3.020 -5.835) 7.955 17.061 ( -2.866 -0.467 11.542) 11.902 17.390 ( -8.719 -2.354 15.929) 18.311 17.732 ( 0.935 -2.260 -7.513) 7.901 18.259 ( 0.145 2.430 -3.680) 4.413 18.711 ( 0.562 1.600 -1.856) 2.514 18.807 ( 1.472 -0.391 -2.845) 3.227 19.007 ( -1.260 -1.544 4.462) 4.887 19.414 ( 4.390 -0.802 -6.035) 7.506 20.601 ( -6.716 2.881 16.319) 17.880 21.081 ( -1.538 10.090 10.450) 14.607 21.135 ( 3.301 -3.202 -3.156) 5.577 21.588 ( -4.285 5.463 8.028) 10.613 21.803 ( 2.035 -1.922 -9.000) 9.425 22.151 ( 4.035 -0.059 -8.364) 9.287 23.306 ( -2.864 -1.171 2.562) 4.017 23.558 ( -3.465 -6.603 -1.592) 7.625 23.590 ( 3.518 -3.254 1.126) 4.922 24.073 ( 4.449 0.028 -8.019) 9.171 ======================= Grid point 162 (83/128) ======================= q-point: (-0.43 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.687 ( -3.191 3.611 17.061) 17.729 2.150 ( -5.668 -3.359 3.179) 7.316 2.457 ( 6.903 3.860 2.101) 8.183 2.529 ( 5.615 -3.361 2.481) 6.999 2.618 ( -11.973 -0.280 2.993) 12.344 2.708 ( -0.142 8.512 5.604) 10.192 2.850 ( -3.253 -5.103 2.292) 6.471 3.048 ( 1.251 1.171 -5.034) 5.318 3.282 ( 4.996 -7.664 0.102) 9.150 3.503 ( -5.982 -3.072 -1.435) 6.876 3.527 ( -0.314 -1.004 8.168) 8.236 3.568 ( -2.055 -0.644 -3.153) 3.819 3.877 ( 2.603 -1.904 5.820) 6.654 4.104 ( 0.782 -0.085 1.907) 2.063 4.194 ( 0.949 3.314 6.567) 7.417 4.365 ( 4.342 0.636 19.067) 19.566 4.519 ( -7.382 13.215 5.670) 16.164 4.565 ( -3.180 1.015 0.825) 3.438 4.792 ( 1.411 -8.866 6.612) 11.149 4.828 ( -5.719 7.770 3.063) 10.123 5.051 ( -6.288 -15.381 -1.571) 16.691 5.213 ( -1.334 -6.077 13.923) 15.250 5.624 ( 3.803 10.444 -9.945) 14.915 5.670 ( -10.728 3.857 -4.967) 12.436 5.719 ( 1.791 2.821 7.983) 8.655 6.173 ( 4.141 3.801 10.429) 11.847 6.361 ( -9.139 0.125 8.480) 12.468 6.388 ( 7.592 -5.981 -3.076) 10.143 6.490 ( -1.420 -4.801 3.673) 6.210 6.605 ( 2.360 3.290 -8.067) 9.026 6.989 ( 5.687 -1.799 -5.351) 8.013 7.047 ( 6.599 4.843 2.146) 8.462 7.248 ( 0.112 0.737 -6.115) 6.160 7.712 ( 1.039 0.595 -10.263) 10.333 7.776 ( -8.252 -1.157 10.107) 13.099 8.172 ( -5.101 -2.946 -5.867) 8.314 8.318 ( 8.876 3.524 -0.624) 9.570 8.685 ( -0.155 -2.423 -5.653) 6.153 8.788 ( -0.132 1.730 -2.348) 2.919 9.076 ( 3.855 -0.991 -6.925) 7.988 9.298 ( -5.982 -5.606 9.479) 12.532 9.444 ( -0.613 4.365 12.250) 13.019 10.100 ( 0.645 -6.535 -12.547) 14.162 10.447 ( 5.763 3.382 -13.857) 15.384 13.259 ( -2.215 4.963 -0.668) 5.476 13.444 ( -1.082 -0.095 -5.465) 5.572 13.585 ( 4.266 1.091 -3.665) 5.729 13.913 ( 1.554 -3.036 -1.316) 3.656 14.056 ( -0.866 -2.072 -0.141) 2.250 14.330 ( -0.532 2.391 -4.213) 4.874 14.737 ( -0.888 -2.928 4.008) 5.042 14.830 ( -1.510 0.154 3.668) 3.969 15.660 ( -2.010 -0.755 7.749) 8.041 16.100 ( 2.864 3.121 -6.343) 7.627 17.063 ( -3.868 0.087 11.102) 11.757 17.441 ( -2.714 -5.621 15.062) 16.304 17.747 ( -1.600 -2.526 -6.008) 6.711 18.241 ( 3.356 0.268 -4.954) 5.989 18.682 ( -0.232 1.767 -1.212) 2.156 18.813 ( 0.754 -0.048 -2.813) 2.913 19.022 ( -1.256 -0.347 4.487) 4.672 19.439 ( 2.653 0.332 -6.666) 7.182 20.525 ( -5.327 4.452 16.887) 18.259 20.964 ( -3.164 6.116 14.525) 16.074 21.223 ( 2.075 -4.415 -5.114) 7.067 21.497 ( -3.989 2.839 9.852) 11.002 21.825 ( 3.314 -1.350 -11.255) 11.810 22.155 ( 3.147 0.821 -9.421) 9.966 23.318 ( -1.356 -1.861 3.861) 4.495 23.602 ( -3.609 -4.573 -2.963) 6.535 23.684 ( 5.205 -2.473 0.339) 5.772 24.064 ( 1.905 2.705 -8.371) 9.001 ======================= Grid point 163 (84/128) ======================= q-point: (-0.29 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.730 ( 2.944 1.722 24.063) 24.304 2.231 ( -1.673 -10.263 1.332) 10.483 2.336 ( 1.795 17.615 9.673) 20.177 2.498 ( -10.289 -4.427 4.597) 12.107 2.657 ( 2.161 -4.637 -7.445) 9.034 2.695 ( -3.571 -8.283 -5.640) 10.638 2.974 ( 4.819 -6.819 5.272) 9.875 3.015 ( -2.284 0.915 -1.133) 2.709 3.357 ( -5.074 0.475 4.274) 6.651 3.441 ( 1.077 2.525 -1.273) 3.026 3.521 ( -2.448 -0.118 0.009) 2.451 3.673 ( 3.947 -6.273 2.688) 7.884 3.875 ( 0.353 6.819 6.405) 9.362 4.062 ( -3.689 5.975 10.744) 12.836 4.126 ( -1.399 7.397 10.129) 12.620 4.278 ( 5.598 14.520 6.156) 16.736 4.437 ( 3.707 4.643 13.277) 14.546 4.558 ( -1.206 -0.699 1.498) 2.047 4.692 ( -0.287 2.353 2.122) 3.182 4.965 ( -3.957 -8.829 5.869) 11.316 5.206 ( -8.254 -15.461 1.197) 17.567 5.302 ( -3.332 6.530 13.126) 15.034 5.415 ( -3.015 1.985 -3.582) 5.086 5.531 ( 2.666 8.039 -7.158) 11.090 5.706 ( -2.336 1.748 5.156) 5.924 6.186 ( 5.136 2.227 0.453) 5.616 6.260 ( -7.472 1.785 -4.358) 8.832 6.451 ( -4.028 -2.041 16.328) 16.941 6.581 ( -1.070 -9.681 -0.901) 9.782 6.763 ( 7.189 -12.369 -3.388) 14.702 6.952 ( -0.649 2.957 -15.451) 15.745 7.034 ( -0.033 1.325 -2.007) 2.405 7.357 ( 9.562 -2.694 0.091) 9.935 7.606 ( -8.006 -0.211 -7.455) 10.941 7.819 ( 1.840 -3.314 7.886) 8.749 8.143 ( -3.511 -1.750 -6.305) 7.425 8.348 ( 6.647 4.164 2.907) 8.365 8.686 ( 1.237 2.815 -0.006) 3.075 8.713 ( -2.507 3.176 -8.309) 9.242 9.069 ( 1.656 2.081 -8.075) 8.501 9.335 ( -1.101 -0.176 8.635) 8.706 9.455 ( -1.581 -1.737 11.551) 11.788 10.171 ( 1.564 -5.494 -10.776) 12.197 10.410 ( 5.169 3.061 -14.970) 16.131 13.202 ( 0.554 1.084 1.752) 2.133 13.420 ( -0.232 0.237 -4.198) 4.211 13.614 ( 4.347 -0.354 -2.522) 5.038 13.972 ( 0.216 -3.839 -4.796) 6.147 14.108 ( 1.750 -3.157 1.114) 3.778 14.288 ( -0.419 0.130 -3.759) 3.784 14.759 ( -1.025 1.758 4.742) 5.161 14.796 ( -1.286 2.386 3.512) 4.436 15.665 ( -2.418 0.071 6.679) 7.104 16.064 ( 1.282 1.357 -6.638) 6.895 17.048 ( -4.023 0.534 11.130) 11.847 17.579 ( 1.324 -7.297 10.540) 12.888 17.742 ( -4.950 -3.328 -2.791) 6.585 18.279 ( 4.192 -1.240 -6.363) 7.720 18.651 ( 0.455 1.723 0.050) 1.783 18.808 ( -0.021 0.113 -2.694) 2.697 19.019 ( -1.174 0.775 4.320) 4.543 19.409 ( 0.582 3.176 -6.751) 7.483 20.475 ( -1.190 3.493 17.074) 17.469 20.929 ( -5.700 -2.217 17.114) 18.174 21.242 ( -1.144 0.652 -4.871) 5.046 21.510 ( -1.379 -4.168 9.212) 10.205 21.848 ( 3.850 -1.162 -12.398) 13.034 22.141 ( 1.921 0.757 -8.894) 9.131 23.353 ( -0.067 -1.992 3.569) 4.088 23.602 ( -3.781 -1.726 -3.520) 5.447 23.773 ( 6.952 -0.661 -1.015) 7.057 23.967 ( -1.118 7.329 -7.903) 10.837 ======================= Grid point 164 (85/128) ======================= q-point: (-0.14 0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.778 ( 1.489 4.193 23.805) 24.217 2.063 ( -1.235 18.207 14.981) 23.610 2.454 ( 3.126 -12.619 -1.303) 13.066 2.539 ( -6.552 -9.269 4.348) 12.155 2.731 ( -2.260 -7.471 -8.427) 11.486 2.784 ( -2.891 -10.043 -7.882) 13.090 2.970 ( -3.107 2.068 4.782) 6.066 3.091 ( -3.282 -1.873 7.011) 7.964 3.303 ( 5.018 4.661 3.880) 7.872 3.390 ( -1.448 0.584 -2.445) 2.901 3.544 ( -3.986 -1.792 4.467) 6.249 3.703 ( 3.759 4.726 -3.878) 7.176 3.851 ( -0.963 -2.781 5.893) 6.587 3.949 ( 0.504 10.569 24.815) 26.977 4.031 ( -2.593 4.353 1.050) 5.174 4.158 ( -1.228 10.220 1.988) 10.484 4.383 ( -2.757 4.011 13.002) 13.883 4.539 ( 5.389 4.818 -1.575) 7.398 4.748 ( 9.389 2.903 10.299) 14.235 5.024 ( -3.893 -4.503 0.141) 5.954 5.147 ( -0.730 8.538 0.394) 8.578 5.362 ( 1.256 1.317 -5.489) 5.783 5.373 ( -6.010 -9.843 2.605) 11.823 5.448 ( 2.236 3.596 9.423) 10.330 5.660 ( -5.688 1.332 2.257) 6.262 6.081 ( -2.372 7.485 1.288) 7.957 6.318 ( 3.773 -7.640 -2.024) 8.757 6.518 ( -5.855 -4.846 19.134) 20.588 6.782 ( 0.976 -15.957 -4.460) 16.597 6.832 ( -4.318 0.962 -13.744) 14.439 6.940 ( 0.483 -3.677 -8.757) 9.510 6.985 ( -9.251 -1.522 -1.657) 9.521 7.399 ( 7.702 1.361 -9.490) 12.298 7.651 ( 1.478 -8.110 -1.114) 8.319 7.942 ( 4.973 -5.210 4.910) 8.717 8.108 ( -4.789 -0.999 -3.762) 6.171 8.332 ( 2.834 6.506 2.297) 7.459 8.564 ( -0.291 8.640 1.894) 8.850 8.665 ( 1.584 3.104 -6.402) 7.289 9.021 ( 1.321 2.232 -9.481) 9.830 9.321 ( 0.288 5.074 8.286) 9.721 9.510 ( -3.669 -4.182 12.737) 13.898 10.228 ( 0.646 -3.719 -10.357) 11.023 10.377 ( 5.735 2.023 -16.031) 17.146 13.249 ( 4.029 -2.813 2.261) 5.409 13.413 ( 1.814 0.220 -2.924) 3.448 13.676 ( 4.078 -2.588 -1.740) 5.133 13.971 ( -4.232 -1.485 -9.700) 10.687 14.200 ( 4.673 -3.569 2.112) 6.248 14.304 ( -0.627 -3.454 -1.739) 3.918 14.681 ( -2.053 6.275 5.145) 8.371 14.766 ( 0.563 3.597 2.236) 4.272 15.644 ( -3.100 1.335 6.734) 7.532 16.054 ( 1.348 -0.865 -6.397) 6.594 17.033 ( -3.526 0.577 11.472) 12.015 17.697 ( 3.464 -1.118 -7.669) 8.489 17.760 ( -10.505 -8.975 12.379) 18.551 18.300 ( 0.766 -0.446 -5.788) 5.856 18.655 ( 4.053 0.784 0.550) 4.164 18.793 ( -0.832 0.220 -2.737) 2.869 19.003 ( -1.073 1.219 3.985) 4.303 19.330 ( 0.847 4.436 -5.461) 7.087 20.497 ( 2.622 1.622 16.124) 16.416 21.032 ( -5.556 -12.341 16.494) 21.336 21.184 ( -2.507 1.807 -3.699) 4.820 21.608 ( -0.830 -5.832 6.790) 8.989 21.852 ( 2.884 1.220 -11.707) 12.119 22.121 ( 0.954 0.568 -7.303) 7.387 23.393 ( 0.452 -1.410 2.286) 2.723 23.555 ( -3.878 1.084 -3.686) 5.459 23.773 ( -3.754 10.890 -4.313) 12.300 23.846 ( 8.153 0.811 -3.005) 8.727 ======================= Grid point 167 (86/128) ======================= q-point: ( 0.29 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.071 ( 2.856 -0.000 14.793) 15.066 2.198 ( -21.998 0.000 11.396) 24.775 2.371 ( -16.417 0.000 5.498) 17.313 2.401 ( 11.833 -0.000 6.267) 13.390 2.584 ( 7.501 -0.000 1.263) 7.606 2.825 ( -7.953 0.000 14.999) 16.977 2.870 ( 7.258 -0.000 -8.988) 11.553 3.024 ( 5.130 -0.000 -6.516) 8.293 3.215 ( -3.321 0.000 -4.727) 5.777 3.335 ( -6.998 0.000 10.014) 12.217 3.479 ( -1.355 0.000 0.214) 1.372 3.566 ( -1.598 0.000 -4.194) 4.488 3.777 ( -2.136 0.000 9.042) 9.291 4.008 ( -2.357 0.000 1.549) 2.821 4.184 ( -0.302 0.000 -3.079) 3.094 4.235 ( 1.576 -0.000 11.289) 11.399 4.291 ( 9.457 -0.000 -0.435) 9.467 4.504 ( -10.329 0.000 -1.134) 10.391 4.775 ( 6.693 -0.000 -5.179) 8.463 4.834 ( -6.920 0.000 18.556) 19.804 5.081 ( -12.187 0.000 -5.354) 13.311 5.384 ( 6.134 -0.000 18.762) 19.739 5.640 ( 8.095 -0.000 -18.540) 20.230 5.788 ( -9.753 0.000 1.638) 9.890 5.803 ( 10.454 -0.000 2.815) 10.827 5.999 ( -11.577 0.000 19.692) 22.843 6.242 ( 18.059 -0.000 6.519) 19.200 6.558 ( -8.033 0.000 -12.766) 15.083 6.632 ( 2.089 -0.000 -2.773) 3.472 6.659 ( -0.939 0.000 16.206) 16.233 6.845 ( 8.423 -0.000 2.007) 8.659 7.490 ( 0.104 -0.000 -0.024) 0.107 7.522 ( 1.395 -0.000 -16.899) 16.956 7.587 ( -1.489 0.000 -3.072) 3.414 7.789 ( -8.537 0.000 5.024) 9.906 8.053 ( -3.078 0.000 -3.085) 4.358 8.359 ( 6.221 -0.000 -1.448) 6.388 8.450 ( 0.372 -0.000 -4.019) 4.036 8.789 ( 5.276 -0.000 0.486) 5.299 8.954 ( 4.150 -0.000 -9.796) 10.639 9.150 ( -8.075 0.000 14.153) 16.294 9.610 ( -4.502 0.000 14.330) 15.020 9.955 ( -2.565 0.000 -17.189) 17.379 10.517 ( 6.862 -0.000 -13.799) 15.411 13.483 ( -5.655 0.000 -12.669) 13.874 13.544 ( 4.103 -0.000 -4.871) 6.368 13.588 ( 0.686 -0.000 0.608) 0.917 13.743 ( -1.804 0.000 -1.374) 2.267 14.205 ( -4.831 0.000 -1.477) 5.052 14.447 ( -0.187 0.000 -1.226) 1.240 14.609 ( 1.048 -0.000 2.904) 3.087 14.636 ( -0.874 0.000 1.035) 1.354 15.647 ( -0.451 0.000 11.460) 11.469 16.184 ( 5.237 -0.000 -5.258) 7.421 17.051 ( -2.754 0.000 11.832) 12.148 17.354 ( -11.998 0.000 16.599) 20.481 17.696 ( 2.139 -0.000 -8.997) 9.248 18.304 ( -2.826 0.000 -4.600) 5.398 18.767 ( 2.712 -0.000 -2.342) 3.583 18.781 ( 1.271 -0.000 -1.862) 2.254 18.967 ( -1.509 0.000 4.934) 5.160 19.404 ( 5.589 -0.000 -5.780) 8.040 20.639 ( -6.044 0.000 16.160) 17.253 21.045 ( 1.190 -0.000 -5.606) 5.731 21.409 ( -1.848 0.000 1.930) 2.672 21.663 ( -0.117 0.000 6.280) 6.281 21.739 ( -0.999 0.000 1.314) 1.650 22.138 ( 4.674 -0.000 -6.149) 7.724 23.297 ( -1.951 0.000 -0.654) 2.058 23.413 ( -2.859 0.000 1.987) 3.482 23.521 ( 1.876 -0.000 2.307) 2.973 24.062 ( 4.941 -0.000 -8.852) 10.138 ======================= Grid point 168 (87/128) ======================= q-point: ( 0.43 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.894 ( -13.524 9.654 13.150) 21.190 2.179 ( -13.482 2.690 6.225) 15.092 2.240 ( -0.664 -7.495 10.610) 13.007 2.489 ( -7.244 -6.270 2.957) 10.026 2.719 ( 9.145 4.901 -3.953) 11.103 2.795 ( 2.137 2.883 19.947) 20.268 2.973 ( 6.091 -7.974 -3.959) 10.787 3.047 ( 4.702 5.888 1.103) 7.615 3.141 ( -0.146 3.665 -2.378) 4.372 3.325 ( -6.334 -6.517 1.132) 9.157 3.473 ( -2.419 -2.879 1.214) 3.952 3.564 ( -1.298 -1.332 -4.004) 4.415 3.784 ( 2.077 -1.226 0.195) 2.420 3.978 ( -4.342 -1.513 1.889) 4.971 4.171 ( -0.862 -1.085 4.384) 4.597 4.287 ( -3.237 -5.913 2.566) 7.213 4.449 ( -8.435 -5.015 4.242) 10.691 4.457 ( 3.421 -6.182 2.612) 7.533 4.740 ( -3.404 5.120 2.778) 6.747 4.870 ( 7.889 -0.390 2.021) 8.153 4.984 ( -7.677 -2.564 -0.515) 8.110 5.435 ( 0.999 11.286 14.848) 18.677 5.612 ( -0.531 -0.658 3.090) 3.204 5.698 ( -2.135 -1.317 -11.035) 11.317 5.887 ( 5.485 3.148 0.964) 6.398 6.053 ( -4.318 -6.661 22.133) 23.513 6.385 ( 4.331 1.807 14.166) 14.923 6.442 ( -6.095 -0.175 -10.929) 12.515 6.564 ( 4.525 8.908 -0.122) 9.992 6.765 ( 7.355 1.514 7.081) 10.321 6.910 ( 8.744 0.344 -2.933) 9.229 7.349 ( 3.445 10.560 -4.362) 11.934 7.413 ( -5.416 6.964 -6.468) 10.940 7.651 ( -2.076 -5.083 -3.432) 6.475 7.736 ( -4.061 -0.528 2.470) 4.782 8.037 ( -3.465 -3.898 -2.860) 5.948 8.426 ( 8.045 1.435 -1.333) 8.280 8.479 ( -3.499 -6.849 -6.220) 9.891 8.831 ( 2.873 0.427 -0.529) 2.952 8.992 ( 4.931 -2.192 -8.035) 9.679 9.136 ( -7.113 -3.538 11.529) 14.001 9.581 ( -4.300 2.977 14.073) 15.013 9.914 ( -0.818 -3.890 -16.333) 16.810 10.532 ( 6.115 1.542 -13.689) 15.072 13.362 ( -8.717 0.440 -8.528) 12.203 13.501 ( 1.426 5.192 -7.159) 8.958 13.626 ( 5.886 0.231 -0.455) 5.908 13.780 ( -0.748 -5.347 -0.182) 5.402 14.116 ( -2.936 4.560 -0.589) 5.455 14.407 ( -1.787 2.261 -2.823) 4.035 14.629 ( -0.183 -2.291 2.768) 3.597 14.705 ( -0.841 -6.285 1.311) 6.475 15.671 ( -0.587 0.924 11.526) 11.578 16.203 ( 4.336 2.248 -5.330) 7.229 17.057 ( -3.350 -0.285 11.233) 11.726 17.318 ( -7.050 -2.038 17.485) 18.963 17.696 ( 1.461 -0.794 -8.617) 8.776 18.254 ( -2.049 0.363 -5.789) 6.151 18.753 ( 1.215 2.463 -1.334) 3.053 18.803 ( 1.135 -0.691 -2.699) 3.009 18.985 ( -0.821 -1.550 5.502) 5.775 19.442 ( 4.900 0.057 -6.063) 7.795 20.608 ( -7.092 0.961 15.825) 17.368 21.062 ( 1.177 -1.852 -4.771) 5.251 21.313 ( 0.990 9.868 6.180) 11.685 21.650 ( -3.291 4.221 8.356) 9.923 21.757 ( 0.747 -3.098 -4.438) 5.464 22.173 ( 4.796 -0.046 -7.399) 8.817 23.276 ( -1.434 0.136 1.630) 2.175 23.436 ( -2.185 -5.080 0.241) 5.535 23.574 ( 2.386 -3.072 2.308) 4.524 24.081 ( 2.932 -0.432 -9.530) 9.980 ======================= Grid point 169 (88/128) ======================= q-point: (-0.43 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.743 ( -3.749 2.002 15.978) 16.534 2.056 ( -9.696 -0.659 7.142) 12.061 2.376 ( -1.354 -7.577 4.391) 8.861 2.431 ( -15.140 -1.785 1.410) 15.310 2.665 ( -1.944 1.884 -2.957) 4.009 2.859 ( 5.729 7.744 15.038) 17.859 2.922 ( 3.241 9.568 6.983) 12.280 3.074 ( 0.188 2.754 -7.373) 7.873 3.177 ( 2.806 -9.135 1.151) 9.626 3.395 ( -0.014 -4.524 -3.235) 5.562 3.538 ( -0.292 -3.320 2.200) 3.993 3.568 ( 4.625 -1.246 -0.588) 4.826 3.870 ( 2.822 -4.151 1.136) 5.146 3.990 ( -7.151 -7.882 1.473) 10.744 4.209 ( -1.615 -2.601 7.839) 8.416 4.375 ( -2.933 -9.045 -1.499) 9.626 4.436 ( -10.503 -2.568 15.373) 18.794 4.531 ( -6.902 -4.778 -0.018) 8.395 4.726 ( 7.572 -0.643 0.222) 7.603 4.899 ( 2.091 1.592 -3.374) 4.277 5.030 ( 4.812 1.215 6.492) 8.172 5.225 ( -4.182 10.653 13.348) 17.583 5.588 ( -6.572 0.534 -1.925) 6.869 5.728 ( 3.994 0.083 -7.554) 8.545 5.830 ( -1.171 7.835 9.980) 12.742 6.164 ( -4.965 -5.556 15.906) 17.565 6.364 ( -5.406 0.625 6.264) 8.297 6.437 ( 1.148 0.757 0.605) 1.503 6.467 ( 6.315 6.184 0.033) 8.838 6.738 ( 5.992 9.398 -2.106) 11.343 7.012 ( 5.282 -0.329 -6.903) 8.698 7.214 ( -4.367 8.880 -2.290) 10.157 7.297 ( 12.247 3.008 -1.981) 12.765 7.626 ( -11.453 -1.543 2.720) 11.872 7.755 ( 4.213 -1.005 -2.625) 5.065 8.059 ( -3.170 -4.054 -3.705) 6.341 8.440 ( 1.745 1.955 -0.155) 2.625 8.560 ( 1.429 -6.812 -8.773) 11.199 8.827 ( 0.848 2.117 -2.229) 3.189 9.065 ( 2.823 -3.427 -4.397) 6.249 9.173 ( -4.717 -5.258 8.182) 10.809 9.528 ( -2.637 3.590 12.156) 12.946 9.959 ( 1.329 -6.947 -13.590) 15.321 10.516 ( 5.312 2.905 -13.613) 14.899 13.252 ( -6.353 0.618 -3.732) 7.394 13.423 ( 0.180 2.562 -7.520) 7.946 13.683 ( 7.260 1.775 -0.316) 7.480 13.853 ( -0.862 -4.672 -1.293) 4.924 14.042 ( 0.077 1.553 0.243) 1.574 14.335 ( -2.692 2.269 -4.428) 5.657 14.684 ( -0.709 -3.896 3.468) 5.264 14.784 ( -1.650 -4.449 1.977) 5.141 15.677 ( -1.023 1.303 10.303) 10.436 16.173 ( 2.801 4.169 -5.803) 7.675 17.055 ( -3.721 -0.072 10.984) 11.597 17.374 ( -3.021 -4.855 17.698) 18.599 17.692 ( 0.038 -0.728 -8.011) 8.044 18.232 ( 0.432 -1.311 -6.773) 6.912 18.718 ( 0.451 2.502 -0.598) 2.612 18.808 ( 0.423 -0.098 -2.768) 2.802 19.017 ( -0.454 -1.057 5.240) 5.365 19.465 ( 3.963 0.754 -6.454) 7.611 20.566 ( -5.734 1.447 15.946) 17.007 21.036 ( -4.499 4.282 2.914) 6.860 21.244 ( 4.667 3.197 3.280) 6.540 21.551 ( -3.866 5.767 9.249) 11.565 21.795 ( 1.986 -2.345 -8.489) 9.028 22.183 ( 3.883 1.476 -9.177) 10.073 23.283 ( -1.178 -1.725 3.684) 4.235 23.498 ( -1.276 -4.797 -1.185) 5.103 23.677 ( 3.923 -4.912 1.336) 6.427 24.072 ( 0.466 0.510 -9.600) 9.625 ======================= Grid point 170 (89/128) ======================= q-point: (-0.29 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.828 ( 3.680 -2.150 20.666) 21.101 2.057 ( -4.745 -8.444 3.687) 10.364 2.284 ( -16.648 -3.855 -0.612) 17.100 2.475 ( -4.028 -6.937 -0.881) 8.070 2.631 ( -2.349 -0.962 -0.991) 2.725 2.664 ( 0.663 16.643 8.147) 18.542 2.957 ( 2.963 1.196 3.344) 4.625 3.063 ( 4.052 0.472 4.741) 6.255 3.281 ( -3.608 -4.587 -0.346) 5.846 3.426 ( 4.277 -1.453 -12.117) 12.932 3.548 ( 0.028 1.928 4.764) 5.139 3.686 ( 6.360 -2.110 6.290) 9.190 3.930 ( -2.103 -1.767 5.831) 6.446 4.061 ( -4.462 -5.834 -1.032) 7.417 4.207 ( -7.766 1.748 12.555) 14.865 4.424 ( -8.803 -1.440 16.093) 18.400 4.478 ( 4.797 -3.221 -2.294) 6.216 4.520 ( -4.116 -2.625 4.155) 6.411 4.831 ( 1.529 -5.009 -1.405) 5.423 4.871 ( -1.832 9.221 8.457) 12.645 4.969 ( 6.478 -0.620 4.055) 7.668 5.298 ( 0.914 -6.957 13.380) 15.108 5.474 ( -2.801 6.747 -3.141) 7.952 5.607 ( -3.893 5.469 -1.187) 6.817 5.781 ( 0.279 4.255 0.782) 4.335 6.196 ( -0.695 -0.301 -7.216) 7.255 6.300 ( -0.453 6.548 9.120) 11.236 6.385 ( -5.122 -2.012 7.345) 9.177 6.549 ( 4.087 0.577 4.330) 5.983 6.704 ( 4.566 -1.706 -0.863) 4.950 6.956 ( -0.580 4.286 -13.107) 13.802 7.063 ( -3.718 4.765 -0.269) 6.050 7.450 ( 10.782 -3.060 -0.554) 11.221 7.494 ( -7.940 2.924 -2.485) 8.818 7.835 ( 6.160 -2.261 2.330) 6.963 8.065 ( -2.803 -2.244 -4.750) 5.954 8.426 ( -1.323 -0.390 -1.521) 2.053 8.647 ( 4.438 -2.976 -6.901) 8.728 8.772 ( -1.134 3.932 -1.347) 4.308 9.093 ( 1.492 1.048 -6.078) 6.345 9.255 ( -3.695 -7.376 10.174) 13.098 9.495 ( -1.433 2.404 8.703) 9.142 10.057 ( 2.909 -6.988 -11.067) 13.407 10.474 ( 4.485 3.641 -14.229) 15.357 13.200 ( -2.148 -0.922 -0.452) 2.381 13.385 ( -0.204 -0.349 -6.233) 6.246 13.711 ( 6.682 3.863 0.722) 7.752 13.892 ( -2.075 -3.428 -4.729) 6.199 14.079 ( 2.754 -3.116 0.691) 4.216 14.268 ( -2.170 0.593 -4.620) 5.139 14.746 ( -0.708 -3.157 4.212) 5.311 14.809 ( -2.118 -0.323 3.239) 3.884 15.675 ( -1.248 0.924 8.300) 8.444 16.107 ( 1.512 4.320 -6.379) 7.852 17.049 ( -3.425 0.294 11.153) 11.671 17.493 ( -3.020 -6.813 17.707) 19.211 17.677 ( 0.686 -0.530 -8.029) 8.076 18.251 ( 0.642 -2.333 -7.171) 7.568 18.691 ( 1.341 1.636 -0.207) 2.126 18.800 ( -0.171 0.226 -2.730) 2.745 19.033 ( -0.539 0.279 4.801) 4.840 19.455 ( 2.779 2.734 -6.894) 7.920 20.547 ( -2.774 1.160 16.111) 16.389 20.909 ( -8.404 3.645 12.320) 15.352 21.267 ( 3.800 2.244 -2.908) 5.285 21.486 ( -2.999 0.511 10.660) 11.086 21.823 ( 3.006 -1.817 -11.377) 11.907 22.161 ( 2.882 1.967 -9.692) 10.301 23.320 ( -0.890 -2.652 4.139) 4.995 23.539 ( -0.764 -2.348 -1.655) 2.972 23.804 ( 5.966 -4.037 -0.557) 7.225 24.006 ( -2.206 3.478 -9.039) 9.933 ======================= Grid point 171 (90/128) ======================= q-point: (-0.14 0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.895 ( -1.049 1.579 17.825) 17.926 2.185 ( -11.251 -5.516 3.806) 13.095 2.284 ( 0.121 -11.797 1.925) 11.953 2.461 ( 2.097 6.758 7.241) 10.124 2.517 ( -5.620 -5.009 -3.062) 8.127 2.675 ( 1.131 -3.964 0.900) 4.220 2.960 ( 0.099 0.633 2.473) 2.555 3.088 ( -1.819 1.658 1.988) 3.164 3.312 ( -1.883 -3.749 -1.902) 4.606 3.439 ( 5.563 2.047 -10.228) 11.822 3.544 ( 0.885 1.521 9.966) 10.120 3.751 ( 0.077 1.033 -0.115) 1.042 3.893 ( -2.605 4.983 8.425) 10.129 4.056 ( -2.125 0.139 1.926) 2.871 4.123 ( -4.745 4.131 16.810) 17.948 4.285 ( -9.505 8.327 7.195) 14.541 4.531 ( 6.181 7.958 9.969) 14.174 4.591 ( 2.238 -1.904 4.473) 5.352 4.845 ( -3.182 -7.358 4.730) 9.308 4.902 ( -3.838 -5.943 4.614) 8.446 5.070 ( 0.159 -3.954 4.055) 5.666 5.269 ( -5.831 6.618 10.137) 13.437 5.458 ( 9.042 1.332 -3.938) 9.952 5.596 ( 3.404 -0.133 0.578) 3.455 5.689 ( 1.760 5.741 0.238) 6.009 6.136 ( 1.091 3.523 -9.184) 9.897 6.273 ( 3.384 -1.046 -3.304) 4.844 6.405 ( -8.511 -5.047 10.493) 14.423 6.607 ( -2.003 -5.237 11.509) 12.802 6.727 ( -7.718 0.102 -2.963) 8.268 6.887 ( 2.180 0.479 -8.081) 8.384 6.958 ( -2.684 3.035 -5.495) 6.827 7.403 ( -2.094 -2.962 -4.571) 5.836 7.599 ( 7.785 -2.317 -2.743) 8.573 7.958 ( 7.713 -3.026 1.794) 8.477 8.038 ( -4.024 -0.943 -5.146) 6.600 8.404 ( -1.818 1.732 -1.581) 2.967 8.686 ( 0.347 1.011 -4.583) 4.706 8.698 ( 3.632 4.572 1.728) 6.090 9.049 ( 1.020 2.985 -7.317) 7.968 9.364 ( -1.419 -4.697 9.810) 10.969 9.458 ( -4.310 1.208 8.368) 9.490 10.148 ( 2.687 -4.134 -10.282) 11.403 10.422 ( 4.317 2.657 -15.278) 16.097 13.237 ( 1.932 -3.778 0.846) 4.327 13.391 ( 0.873 -2.040 -4.658) 5.160 13.729 ( 5.490 2.131 1.337) 6.039 13.870 ( -4.893 -1.040 -9.216) 10.487 14.159 ( -0.011 -4.005 -0.337) 4.019 14.268 ( 2.181 -2.305 -2.196) 3.859 14.753 ( -2.227 3.388 4.816) 6.295 14.803 ( -0.069 -0.227 3.664) 3.671 15.665 ( -1.734 1.708 6.834) 7.255 16.055 ( 1.857 1.423 -6.487) 6.896 17.043 ( -2.842 0.538 11.541) 11.898 17.573 ( -9.840 -4.947 13.258) 17.236 17.705 ( 5.156 -1.623 -4.816) 7.240 18.258 ( -1.420 -1.755 -5.412) 5.865 18.701 ( 2.880 0.038 -1.102) 3.084 18.784 ( -0.081 0.477 -2.726) 2.768 19.028 ( -0.786 1.267 4.350) 4.599 19.402 ( 2.409 4.428 -6.470) 8.202 20.573 ( -0.551 -0.265 15.325) 15.337 20.871 ( -7.664 -5.046 16.893) 19.225 21.220 ( 1.129 4.884 -3.637) 6.193 21.533 ( -1.921 -4.780 8.989) 10.361 21.841 ( 2.799 -0.950 -12.684) 13.024 22.134 ( 2.568 1.425 -8.758) 9.237 23.360 ( -1.579 -2.364 3.331) 4.379 23.544 ( 0.205 0.583 -1.455) 1.581 23.857 ( -4.217 7.348 -6.504) 10.681 23.915 ( 6.999 -1.339 -3.383) 7.888 ======================= Grid point 175 (91/128) ======================= q-point: (-0.57 -0.57 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.896 ( -14.089 0.000 20.038) 24.495 2.001 ( -16.316 0.000 7.725) 18.052 2.260 ( 3.990 -0.000 9.207) 10.034 2.359 ( -7.884 0.000 4.059) 8.868 2.777 ( -3.281 0.000 11.269) 11.737 2.860 ( -1.502 0.000 -10.244) 10.353 3.064 ( 2.586 -0.000 11.922) 12.199 3.163 ( 3.092 -0.000 9.477) 9.968 3.168 ( 0.599 -0.000 0.124) 0.611 3.223 ( 14.869 -0.000 -6.741) 16.326 3.364 ( -9.227 0.000 -3.524) 9.877 3.559 ( 3.426 -0.000 -6.146) 7.037 3.754 ( -2.760 0.000 -4.829) 5.562 3.945 ( -2.660 0.000 5.909) 6.480 4.149 ( -1.021 0.000 -0.969) 1.407 4.175 ( -5.047 0.000 0.809) 5.111 4.380 ( -4.963 0.000 -2.068) 5.377 4.407 ( -8.718 0.000 15.694) 17.953 4.774 ( 0.155 -0.000 -11.982) 11.983 4.893 ( 5.424 -0.000 14.398) 15.386 4.996 ( 7.268 -0.000 -2.808) 7.792 5.572 ( -6.892 0.000 -3.079) 7.548 5.590 ( -3.830 0.000 -9.024) 9.803 5.635 ( 4.332 -0.000 18.947) 19.436 5.991 ( -5.359 0.000 27.150) 27.674 6.030 ( 9.094 -0.000 -5.521) 10.638 6.356 ( -1.419 0.000 -11.262) 11.351 6.436 ( -6.166 0.000 19.464) 20.418 6.683 ( 2.018 -0.000 2.721) 3.388 6.928 ( 16.225 -0.000 1.816) 16.326 6.993 ( 4.455 -0.000 -0.501) 4.483 7.350 ( -5.137 0.000 -11.099) 12.231 7.455 ( -4.626 0.000 8.313) 9.513 7.613 ( 3.715 -0.000 -8.046) 8.863 7.708 ( 0.269 -0.000 0.970) 1.006 7.968 ( -2.521 0.000 -2.343) 3.441 8.343 ( -4.394 0.000 -7.096) 8.346 8.524 ( 6.381 -0.000 0.798) 6.431 8.844 ( -0.679 0.000 0.276) 0.733 9.014 ( 7.220 -0.000 -12.475) 14.414 9.063 ( -6.969 0.000 11.433) 13.390 9.600 ( -4.732 0.000 15.001) 15.729 9.830 ( 1.031 -0.000 -16.871) 16.903 10.563 ( 5.347 -0.000 -13.795) 14.796 13.251 ( -7.757 0.000 -7.162) 10.558 13.528 ( -1.500 0.000 -10.207) 10.317 13.687 ( 6.282 -0.000 -0.023) 6.282 13.725 ( 0.416 -0.000 1.406) 1.466 14.134 ( -1.316 0.000 0.700) 1.490 14.388 ( -3.570 0.000 -3.445) 4.961 14.618 ( -1.444 0.000 1.543) 2.114 14.644 ( 0.851 -0.000 1.630) 1.838 15.710 ( -0.726 0.000 12.318) 12.340 16.247 ( 3.281 -0.000 -5.032) 6.007 17.052 ( -3.343 0.000 10.969) 11.467 17.297 ( -3.737 0.000 18.047) 18.430 17.681 ( 1.513 -0.000 -8.766) 8.896 18.211 ( -1.754 0.000 -7.128) 7.340 18.775 ( -0.642 0.000 -1.637) 1.758 18.802 ( 1.556 -0.000 -2.516) 2.959 18.985 ( -0.039 0.000 6.490) 6.490 19.475 ( 4.632 -0.000 -6.449) 7.940 20.578 ( -8.025 0.000 14.394) 16.480 21.058 ( 2.840 -0.000 -4.448) 5.277 21.422 ( 1.104 -0.000 4.009) 4.158 21.684 ( -2.607 0.000 8.884) 9.259 21.715 ( -0.623 0.000 -2.291) 2.374 22.206 ( 5.179 -0.000 -6.920) 8.643 23.290 ( 1.220 -0.000 0.553) 1.339 23.364 ( -2.415 0.000 1.093) 2.651 23.574 ( 1.307 -0.000 3.174) 3.433 24.069 ( 1.120 -0.000 -10.258) 10.319 ======================= Grid point 176 (92/128) ======================= q-point: (-0.43 -0.57 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.777 ( -5.151 2.611 14.647) 15.745 1.933 ( -13.475 -3.846 15.213) 20.683 2.254 ( -12.200 1.177 1.104) 12.307 2.352 ( 2.547 -1.483 5.968) 6.656 2.676 ( -3.459 5.623 4.106) 7.774 2.927 ( -10.861 -3.184 16.518) 20.024 2.984 ( -2.634 -7.703 -4.120) 9.124 3.119 ( 2.671 7.090 1.244) 7.677 3.298 ( 13.629 9.677 5.546) 17.611 3.356 ( -5.464 -10.705 0.734) 12.041 3.379 ( 7.117 -4.398 -4.234) 9.376 3.573 ( 4.745 -1.345 -8.890) 10.166 3.802 ( 0.715 -6.972 -2.844) 7.563 3.903 ( -3.983 2.598 8.719) 9.932 4.140 ( -8.466 -2.414 -0.602) 8.824 4.175 ( -0.853 -6.536 -1.414) 6.741 4.361 ( -11.477 -1.585 19.838) 22.973 4.364 ( -4.248 -6.367 -0.679) 7.684 4.771 ( 3.784 -1.933 -12.606) 13.303 4.999 ( 7.607 2.896 5.656) 9.912 5.087 ( 9.801 -1.997 3.809) 10.703 5.382 ( -8.042 10.332 -1.601) 13.190 5.523 ( -4.608 -0.769 -7.420) 8.768 5.744 ( 1.261 -0.401 14.184) 14.246 5.974 ( -1.057 6.412 13.385) 14.879 6.111 ( 2.315 -2.468 3.532) 4.891 6.324 ( -4.228 1.092 4.402) 6.201 6.433 ( -1.475 -2.526 5.451) 6.186 6.648 ( 1.203 6.757 6.218) 9.262 6.950 ( 4.671 8.486 -2.574) 10.023 7.051 ( 3.143 1.214 -1.037) 3.525 7.238 ( -3.829 3.966 -8.290) 9.956 7.492 ( 7.380 -1.026 6.804) 10.090 7.537 ( -2.175 6.837 -0.076) 7.175 7.775 ( 6.247 -2.689 -6.466) 9.384 7.968 ( -1.749 -2.869 0.320) 3.375 8.313 ( -7.265 -5.521 -8.928) 12.766 8.587 ( 6.606 0.184 0.967) 6.679 8.832 ( -2.556 -0.457 -1.088) 2.816 9.017 ( -1.444 -1.421 2.387) 3.131 9.099 ( 1.816 -3.757 -4.679) 6.269 9.575 ( -4.052 2.305 13.068) 13.874 9.849 ( 3.872 -4.988 -13.754) 15.135 10.561 ( 4.409 1.555 -13.806) 14.576 13.166 ( -5.850 -0.836 -3.650) 6.946 13.445 ( -1.636 2.930 -8.786) 9.405 13.751 ( 2.551 -1.613 0.047) 3.018 13.785 ( 4.772 -2.825 -1.237) 5.681 14.099 ( 1.069 3.715 1.837) 4.280 14.318 ( -4.232 1.845 -4.360) 6.350 14.630 ( -1.151 -2.842 2.443) 3.920 14.698 ( -0.450 -4.673 1.163) 4.837 15.724 ( -1.314 1.496 11.700) 11.868 16.237 ( 1.764 2.729 -5.203) 6.135 17.052 ( -3.078 -0.013 10.956) 11.380 17.349 ( -0.780 -2.420 18.339) 18.514 17.670 ( 1.302 -0.013 -8.525) 8.624 18.188 ( 0.067 -1.249 -7.812) 7.911 18.748 ( -0.759 1.521 -1.211) 2.087 18.806 ( 0.593 0.119 -2.323) 2.400 19.015 ( 0.025 -0.976 6.002) 6.081 19.498 ( 4.075 0.446 -7.068) 8.171 20.539 ( -7.969 -0.869 13.573) 15.764 21.065 ( 1.269 2.179 -2.328) 3.432 21.380 ( 1.477 6.944 6.358) 9.530 21.635 ( -2.948 5.108 8.749) 10.552 21.740 ( 0.544 -3.579 -5.178) 6.318 22.225 ( 4.333 1.554 -8.102) 9.319 23.282 ( 0.438 1.155 2.563) 2.845 23.412 ( 0.265 -5.437 -0.520) 5.468 23.634 ( 1.686 -4.693 2.804) 5.721 24.041 ( -0.948 -0.114 -10.168) 10.213 ======================= Grid point 177 (93/128) ======================= q-point: (-0.29 -0.57 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.854 ( 0.397 -9.250 8.447) 12.533 1.906 ( -6.888 -0.795 15.247) 16.750 2.084 ( -12.222 0.096 -0.179) 12.224 2.392 ( -1.356 -0.129 4.326) 4.536 2.602 ( -2.980 0.861 6.072) 6.819 2.890 ( -3.822 4.649 16.558) 17.618 3.006 ( 0.952 5.348 -3.988) 6.739 3.137 ( 2.330 -6.291 3.638) 7.632 3.224 ( 1.627 7.481 -0.881) 7.706 3.468 ( 9.792 1.750 -7.742) 12.606 3.555 ( -1.596 -13.604 7.007) 15.386 3.645 ( -0.209 -4.498 -1.432) 4.725 3.778 ( -4.250 -4.037 -2.791) 6.493 3.968 ( -0.564 -2.708 10.527) 10.884 4.071 ( -14.656 -4.246 5.481) 16.213 4.331 ( -0.517 -10.859 0.119) 10.872 4.353 ( -9.468 -4.039 16.383) 19.348 4.435 ( -0.067 -5.564 1.395) 5.737 4.802 ( 1.913 -1.693 -11.194) 11.482 5.041 ( 10.083 6.661 4.079) 12.754 5.139 ( -3.188 7.773 2.060) 8.650 5.241 ( 1.987 -5.443 6.810) 8.941 5.488 ( 0.782 -1.584 -9.244) 9.411 5.694 ( -3.243 11.287 11.421) 16.382 5.866 ( -1.556 7.100 6.592) 9.813 6.181 ( 3.218 -1.909 -1.751) 4.131 6.275 ( -11.162 -2.021 15.533) 19.235 6.450 ( 1.691 3.941 -3.236) 5.373 6.633 ( 6.193 0.399 5.437) 8.251 6.823 ( 2.214 11.431 -1.588) 11.752 6.999 ( 0.382 4.667 -5.590) 7.292 7.098 ( -4.184 6.053 -2.571) 7.795 7.402 ( -7.698 3.767 4.899) 9.872 7.616 ( 12.363 1.934 -3.024) 12.874 7.877 ( 8.377 -3.085 -4.250) 9.887 7.986 ( -3.447 -1.815 0.558) 3.936 8.306 ( -5.049 -6.276 -7.225) 10.820 8.670 ( 5.832 -1.465 -0.893) 6.079 8.784 ( -3.619 1.202 -2.505) 4.563 9.070 ( -0.059 -4.148 0.251) 4.156 9.152 ( -0.359 -3.975 -0.179) 3.995 9.532 ( -3.274 2.493 9.289) 10.160 9.964 ( 6.045 -6.830 -10.207) 13.689 10.525 ( 3.327 2.972 -14.238) 14.921 13.138 ( -3.007 -2.495 -0.550) 3.946 13.377 ( -0.150 1.243 -6.509) 6.628 13.790 ( -1.212 -2.621 -2.792) 4.017 13.853 ( 6.301 2.169 -1.056) 6.747 14.093 ( 3.682 0.400 1.672) 4.064 14.234 ( -3.572 0.889 -4.880) 6.112 14.687 ( -1.074 -4.479 3.693) 5.903 14.763 ( -1.337 -3.772 1.884) 4.423 15.712 ( -1.667 1.891 9.916) 10.232 16.173 ( 0.572 4.578 -5.743) 7.367 17.053 ( -2.761 0.108 11.145) 11.483 17.445 ( -1.049 -2.962 18.035) 18.306 17.669 ( 3.405 -0.616 -7.710) 8.451 18.197 ( 0.378 -1.992 -7.638) 7.903 18.718 ( -0.031 1.033 -1.160) 1.554 18.799 ( 0.256 0.471 -2.229) 2.293 19.041 ( -0.668 -0.442 5.176) 5.238 19.500 ( 3.227 1.569 -7.893) 8.670 20.525 ( -7.363 -2.568 13.540) 15.625 20.967 ( -3.924 8.516 6.900) 11.642 21.341 ( 2.287 2.363 2.898) 4.383 21.539 ( -2.531 6.085 9.279) 11.381 21.787 ( 2.514 -2.820 -9.090) 9.844 22.201 ( 3.018 2.770 -9.546) 10.388 23.295 ( 0.040 -1.089 3.794) 3.948 23.495 ( 1.702 -3.755 -0.876) 4.215 23.767 ( 3.940 -7.369 0.392) 8.365 23.984 ( -3.096 1.168 -9.348) 9.916 ======================= Grid point 178 (94/128) ======================= q-point: (-0.14 -0.57 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.814 ( -15.471 -4.886 3.967) 16.702 2.064 ( 1.664 -1.459 9.958) 10.201 2.144 ( 7.964 -12.987 6.016) 16.379 2.361 ( -6.067 -0.753 3.577) 7.083 2.628 ( -0.498 -3.270 8.033) 8.687 2.743 ( 2.947 14.560 5.742) 15.927 2.993 ( -0.560 -0.147 4.201) 4.240 3.126 ( -0.067 4.565 -5.841) 7.413 3.225 ( -1.721 -2.296 1.023) 3.046 3.501 ( 7.958 1.756 -8.390) 11.697 3.597 ( 1.270 0.181 0.101) 1.287 3.775 ( -3.293 -1.573 4.521) 5.810 3.898 ( -0.188 -10.637 5.768) 12.102 3.953 ( -6.649 2.252 5.777) 9.091 4.056 ( -11.479 -9.872 18.558) 23.951 4.286 ( -10.705 2.686 11.876) 16.212 4.448 ( -6.157 -11.093 3.976) 13.296 4.605 ( 2.597 -10.295 3.406) 11.150 4.781 ( 0.838 2.158 -7.003) 7.376 4.905 ( 1.289 13.161 6.509) 14.739 5.185 ( 8.352 1.159 -2.140) 8.699 5.339 ( -4.767 3.933 18.802) 19.791 5.480 ( -4.738 -8.955 -1.282) 10.212 5.595 ( 8.805 4.810 -0.256) 10.036 5.776 ( 1.864 3.350 -1.933) 4.293 6.188 ( -1.886 0.875 -8.983) 9.220 6.257 ( -7.095 -2.938 10.815) 13.264 6.376 ( 6.785 7.494 -8.273) 13.063 6.640 ( -4.159 9.000 12.078) 15.626 6.705 ( -0.605 1.676 4.733) 5.057 6.928 ( 3.339 3.260 -7.399) 8.748 6.971 ( -2.109 4.209 -3.884) 6.103 7.321 ( -4.616 -0.806 4.231) 6.313 7.669 ( 6.972 1.592 -6.473) 9.646 7.951 ( -5.619 -1.698 -3.411) 6.789 8.011 ( 9.374 -2.210 -3.039) 10.099 8.355 ( -1.460 -4.213 -1.808) 4.812 8.677 ( -1.702 0.938 -5.296) 5.641 8.776 ( 2.608 -0.303 2.651) 3.731 9.081 ( 2.031 1.698 -9.164) 9.539 9.257 ( -2.136 -8.316 10.835) 13.824 9.477 ( -4.043 3.109 6.570) 8.318 10.098 ( 6.094 -4.853 -8.949) 11.865 10.458 ( 2.519 3.342 -15.319) 15.881 13.178 ( -0.192 -4.746 0.655) 4.795 13.368 ( 1.718 -1.067 -4.106) 4.577 13.770 ( -4.268 -0.054 -6.840) 8.062 13.856 ( 5.063 3.943 0.060) 6.417 14.118 ( -0.533 0.064 -0.884) 1.034 14.240 ( 2.922 -3.824 -2.907) 5.622 14.752 ( -1.302 -2.763 4.515) 5.451 14.793 ( -1.081 -1.396 3.420) 3.849 15.694 ( -1.848 1.589 7.664) 8.042 16.092 ( 0.897 3.584 -6.245) 7.256 17.057 ( -2.451 0.248 11.424) 11.686 17.490 ( -5.060 -0.668 13.875) 14.784 17.729 ( 6.445 -1.537 -3.870) 7.673 18.200 ( -0.975 -1.527 -5.709) 5.990 18.711 ( 0.498 -0.158 -2.212) 2.273 18.789 ( 0.928 0.393 -2.246) 2.462 19.044 ( -1.381 0.473 4.555) 4.784 19.467 ( 2.318 3.185 -8.053) 8.965 20.542 ( -7.329 -3.978 13.941) 16.245 20.844 ( -4.025 3.684 15.285) 16.230 21.318 ( 2.062 5.169 -2.865) 6.259 21.488 ( -3.148 -0.375 11.090) 11.534 21.820 ( 3.520 -1.238 -11.919) 12.489 22.161 ( 2.605 2.016 -9.642) 10.189 23.326 ( -0.873 -1.456 3.866) 4.222 23.555 ( 2.806 -1.176 -0.560) 3.093 23.876 ( -4.576 3.887 -7.289) 9.444 23.921 ( 5.388 -5.402 -3.267) 8.300 ======================= Grid point 183 (95/128) ======================= q-point: (-0.43 -0.43 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.736 ( -14.205 0.000 14.627) 20.390 1.869 ( -0.349 0.000 16.491) 16.495 2.126 ( -16.144 0.000 4.288) 16.704 2.422 ( 5.780 -0.000 7.326) 9.332 2.801 ( -2.830 0.000 -2.846) 4.014 2.807 ( 2.172 -0.000 -4.205) 4.733 2.812 ( -10.431 0.000 27.722) 29.620 3.150 ( -9.373 0.000 6.682) 11.511 3.201 ( 1.834 -0.000 1.466) 2.348 3.449 ( 7.174 -0.000 -2.941) 7.753 3.564 ( 8.469 -0.000 -5.040) 9.855 3.623 ( 6.308 -0.000 -9.853) 11.700 3.680 ( 2.212 -0.000 6.005) 6.400 3.931 ( -4.471 0.000 11.849) 12.664 3.992 ( -12.532 0.000 -6.571) 14.151 4.118 ( 0.636 -0.000 -6.964) 6.993 4.273 ( 0.459 -0.000 0.213) 0.506 4.300 ( -11.343 0.000 26.628) 28.944 4.726 ( 1.701 -0.000 -17.548) 17.631 5.132 ( 3.611 -0.000 9.997) 10.629 5.170 ( 9.678 -0.000 -5.614) 11.189 5.371 ( -9.721 0.000 -6.472) 11.679 5.415 ( -1.609 0.000 -6.916) 7.101 5.835 ( 3.921 -0.000 21.420) 21.776 6.047 ( -4.753 0.000 20.572) 21.113 6.145 ( 7.810 -0.000 -10.047) 12.726 6.314 ( -14.129 0.000 11.321) 18.105 6.384 ( 4.778 -0.000 -4.245) 6.391 6.707 ( -3.489 0.000 11.009) 11.549 7.029 ( 1.476 -0.000 -5.381) 5.580 7.078 ( -3.472 0.000 9.512) 10.126 7.220 ( -0.772 0.000 -10.102) 10.131 7.580 ( 10.323 -0.000 9.308) 13.900 7.658 ( 5.874 -0.000 -10.525) 12.054 7.776 ( 5.141 -0.000 -2.956) 5.930 7.950 ( 0.780 -0.000 4.230) 4.301 8.157 ( -7.206 0.000 -10.036) 12.355 8.650 ( 4.018 -0.000 1.120) 4.172 8.769 ( -6.649 0.000 2.263) 7.024 9.005 ( -3.511 0.000 6.816) 7.667 9.070 ( 5.654 -0.000 -16.444) 17.389 9.592 ( -4.519 0.000 14.736) 15.413 9.823 ( 7.503 -0.000 -13.772) 15.683 10.573 ( 3.438 -0.000 -13.900) 14.319 13.097 ( -4.229 0.000 -0.841) 4.312 13.411 ( -2.986 0.000 -8.767) 9.261 13.742 ( 0.631 -0.000 -1.144) 1.306 13.841 ( 8.392 -0.000 -1.293) 8.491 14.159 ( 2.282 -0.000 3.174) 3.910 14.272 ( -4.856 0.000 -4.011) 6.298 14.595 ( -1.619 0.000 1.868) 2.472 14.662 ( 0.132 -0.000 0.785) 0.796 15.753 ( -2.299 0.000 11.605) 11.831 16.255 ( 0.311 -0.000 -5.032) 5.042 17.054 ( -2.900 0.000 10.963) 11.340 17.398 ( 2.923 -0.000 18.577) 18.806 17.662 ( 1.932 -0.000 -8.473) 8.690 18.160 ( 1.343 -0.000 -8.367) 8.474 18.742 ( -1.511 0.000 -1.569) 2.178 18.807 ( 0.498 -0.000 -1.840) 1.906 19.025 ( -0.229 0.000 5.895) 5.899 19.519 ( 3.446 -0.000 -8.179) 8.875 20.475 ( -9.367 0.000 12.282) 15.446 21.104 ( 3.302 -0.000 -2.497) 4.140 21.495 ( 2.847 -0.000 5.414) 6.117 21.645 ( -3.508 0.000 2.398) 4.249 21.705 ( -0.794 0.000 2.352) 2.482 22.263 ( 4.100 -0.000 -7.573) 8.612 23.329 ( -1.250 0.000 0.282) 1.281 23.353 ( 4.338 -0.000 0.819) 4.415 23.610 ( -0.053 0.000 3.960) 3.960 23.991 ( -2.384 0.000 -10.024) 10.303 ======================= Grid point 184 (96/128) ======================= q-point: (-0.29 -0.43 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.685 ( -11.822 -4.451 13.790) 18.701 1.853 ( -11.919 -2.475 5.296) 13.275 2.070 ( 5.427 -0.033 14.798) 15.761 2.463 ( 3.265 4.692 7.041) 9.069 2.661 ( 0.674 7.028 2.113) 7.369 2.843 ( -4.641 -5.806 21.650) 22.891 2.999 ( 1.952 -10.892 0.984) 11.109 3.167 ( 1.334 4.216 -1.309) 4.612 3.219 ( -7.208 -10.275 15.413) 19.877 3.372 ( -1.200 9.048 -4.149) 10.026 3.593 ( -0.490 -3.680 -5.107) 6.314 3.653 ( 9.327 -1.272 -3.817) 10.158 3.728 ( -1.193 6.485 -8.183) 10.509 3.873 ( -9.295 -4.055 3.691) 10.792 3.961 ( 0.189 -3.129 9.169) 9.690 4.169 ( 0.718 -6.603 -3.350) 7.439 4.262 ( -10.875 -1.768 24.832) 27.166 4.361 ( 0.847 -6.008 2.735) 6.655 4.709 ( -0.590 -3.727 -16.969) 17.383 5.126 ( -4.685 -0.342 -3.267) 5.722 5.178 ( -6.866 0.079 -3.880) 7.887 5.281 ( 10.619 5.332 -1.475) 11.974 5.462 ( 3.675 -2.116 2.343) 4.845 5.899 ( 4.870 6.155 11.622) 14.024 5.986 ( -5.162 8.771 11.348) 15.243 6.146 ( -15.812 -0.065 17.186) 23.353 6.202 ( 4.988 -0.713 -9.630) 10.869 6.439 ( -1.667 -3.394 -3.295) 5.016 6.711 ( 1.750 0.549 10.713) 10.869 6.984 ( 2.786 5.502 -6.139) 8.702 7.051 ( -3.046 3.074 8.383) 9.434 7.151 ( 0.215 4.667 -7.686) 8.994 7.506 ( 0.353 12.696 2.311) 12.909 7.765 ( 11.169 2.544 -3.768) 12.059 7.844 ( 1.801 -4.843 -6.766) 8.513 7.982 ( 2.051 0.192 4.321) 4.787 8.132 ( -2.590 -7.583 -5.342) 9.630 8.688 ( 1.395 -1.930 1.133) 2.637 8.715 ( -6.952 -0.903 -1.743) 7.223 9.016 ( 0.131 -2.846 5.037) 5.787 9.096 ( 2.373 -2.689 -12.814) 13.307 9.566 ( -3.990 2.457 12.399) 13.255 9.921 ( 9.507 -4.725 -10.722) 15.089 10.549 ( 2.321 1.701 -14.206) 14.495 13.078 ( -1.994 -1.595 2.190) 3.364 13.360 ( -1.339 -0.049 -6.682) 6.815 13.743 ( -0.242 -0.367 -3.029) 3.061 13.939 ( 8.285 -0.807 -2.505) 8.693 14.172 ( 3.683 2.668 3.556) 5.773 14.196 ( -4.284 1.548 -3.799) 5.931 14.616 ( -1.412 -3.717 2.730) 4.823 14.695 ( -0.607 -3.655 0.937) 3.822 15.746 ( -3.115 1.364 10.358) 10.902 16.214 ( -0.826 2.703 -5.358) 6.058 17.056 ( -3.068 -0.163 11.029) 11.449 17.498 ( 4.287 0.719 17.255) 17.794 17.674 ( 4.281 -1.449 -6.808) 8.172 18.162 ( 1.928 -0.796 -8.179) 8.441 18.716 ( -1.296 0.351 -1.720) 2.182 18.804 ( 0.471 0.403 -1.674) 1.785 19.039 ( -1.188 -0.427 5.152) 5.304 19.519 ( 2.127 0.457 -9.485) 9.731 20.428 ( -9.717 -2.334 12.659) 16.129 21.092 ( 1.573 5.826 1.165) 6.146 21.428 ( -1.386 7.519 6.819) 10.245 21.639 ( -0.847 4.284 6.261) 7.633 21.728 ( 1.553 -4.841 -5.176) 7.255 22.250 ( 2.598 3.016 -8.623) 9.497 23.310 ( 0.709 0.634 1.816) 2.050 23.455 ( 4.341 -4.536 -0.534) 6.301 23.676 ( 0.677 -7.082 2.564) 7.562 23.929 ( -3.828 0.250 -9.176) 9.946 ======================= Grid point 185 (97/128) ======================= q-point: (-0.14 -0.43 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.618 ( -12.572 -2.381 9.578) 15.983 1.949 ( -2.316 -13.887 11.595) 18.239 2.234 ( 15.659 -0.173 10.347) 18.770 2.389 ( -0.577 7.467 3.475) 8.256 2.627 ( -0.024 1.246 8.581) 8.671 2.958 ( -1.364 -4.528 14.548) 15.297 3.016 ( 2.077 13.974 -4.473) 14.819 3.105 ( -2.247 0.536 -2.992) 3.780 3.266 ( 2.704 1.107 0.948) 3.071 3.424 ( -9.818 -17.259 2.449) 20.006 3.596 ( 3.077 1.364 -2.955) 4.479 3.651 ( 1.701 -1.051 1.397) 2.439 3.781 ( -8.915 -11.676 7.788) 16.627 3.872 ( 3.141 -1.809 7.244) 8.101 4.005 ( -1.044 4.286 11.194) 12.031 4.224 ( -10.239 -0.543 11.966) 15.759 4.240 ( -7.085 -6.912 -0.791) 9.930 4.501 ( 1.607 -8.460 5.551) 10.245 4.744 ( -0.132 -6.146 -10.262) 11.963 5.056 ( -2.776 2.740 3.071) 4.964 5.164 ( -1.265 -6.409 -10.452) 12.325 5.343 ( 7.213 -0.448 2.419) 7.621 5.491 ( 0.429 5.792 11.211) 12.626 5.764 ( -4.561 11.449 4.428) 13.095 5.838 ( -2.391 3.458 -3.402) 5.408 6.071 ( -8.014 0.561 10.887) 13.530 6.256 ( 3.115 -1.412 3.773) 5.093 6.446 ( -0.877 -2.248 -4.415) 5.031 6.765 ( 2.129 2.084 8.612) 9.112 6.855 ( 2.578 14.429 -4.884) 15.450 6.979 ( 0.212 3.525 -2.252) 4.189 7.046 ( 1.620 6.346 -5.771) 8.729 7.343 ( -2.257 7.032 6.625) 9.921 7.754 ( 4.499 4.664 -6.924) 9.484 7.857 ( -4.932 -1.625 -1.160) 5.321 8.057 ( 7.627 -2.525 -4.845) 9.382 8.258 ( 1.014 -6.985 1.569) 7.230 8.637 ( -5.913 -0.238 -2.426) 6.396 8.756 ( 0.727 -4.311 -0.512) 4.402 9.079 ( 3.253 -1.226 -12.461) 12.936 9.156 ( -0.306 -6.582 8.105) 10.445 9.514 ( -3.682 3.561 10.226) 11.437 10.071 ( 8.884 -4.990 -9.118) 13.674 10.484 ( 1.316 3.160 -15.106) 15.489 13.114 ( -0.142 -3.262 3.071) 4.482 13.355 ( 1.249 -1.516 -3.953) 4.414 13.717 ( -2.060 0.858 -6.131) 6.525 13.976 ( 4.789 4.390 -1.121) 6.593 14.131 ( -1.459 1.474 -1.776) 2.730 14.215 ( 4.705 -2.007 -0.679) 5.160 14.686 ( -1.175 -5.224 4.230) 6.824 14.752 ( -0.888 -3.618 2.045) 4.250 15.716 ( -3.262 1.437 8.303) 9.036 16.134 ( -0.676 3.660 -5.917) 6.990 17.061 ( -3.225 -0.384 11.155) 11.618 17.531 ( 1.118 3.526 10.520) 11.151 17.767 ( 7.253 -2.071 -0.592) 7.566 18.166 ( 1.456 -0.451 -6.405) 6.584 18.698 ( -1.003 -0.237 -2.480) 2.685 18.798 ( 0.928 0.345 -1.817) 2.069 19.041 ( -2.112 -0.153 4.490) 4.964 19.490 ( 0.431 1.114 -9.884) 9.956 20.421 ( -9.043 -4.429 14.226) 17.429 20.969 ( -1.469 9.968 11.506) 15.294 21.357 ( -2.362 1.325 2.355) 3.589 21.554 ( -1.008 6.670 7.441) 10.044 21.801 ( 4.248 -2.603 -9.723) 10.925 22.193 ( 1.645 2.919 -9.366) 9.947 23.324 ( 0.630 -0.133 2.986) 3.055 23.562 ( 5.005 -2.849 -0.579) 5.788 23.836 ( 1.220 -8.088 -3.333) 8.833 23.844 ( -3.400 -0.140 -6.409) 7.256 ======================= Grid point 191 (98/128) ======================= q-point: (-0.29 -0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.588 ( -9.919 0.000 21.308) 23.504 1.669 ( -17.312 0.000 10.090) 20.038 2.233 ( 15.930 -0.000 12.262) 20.103 2.586 ( 4.369 -0.000 10.320) 11.206 2.758 ( 0.262 -0.000 7.963) 7.967 2.852 ( -2.074 0.000 8.960) 9.197 2.883 ( 5.009 -0.000 -1.808) 5.326 3.119 ( -3.296 0.000 31.694) 31.865 3.234 ( -1.951 0.000 -0.585) 2.037 3.464 ( -4.725 0.000 -10.157) 11.202 3.493 ( -0.260 0.000 -3.577) 3.587 3.575 ( -1.676 0.000 -9.208) 9.359 3.791 ( -2.127 0.000 6.017) 6.382 3.857 ( 4.718 -0.000 -4.126) 6.268 3.958 ( 2.631 -0.000 -3.449) 4.338 4.124 ( -1.144 0.000 15.248) 15.291 4.243 ( -9.345 0.000 21.742) 23.665 4.291 ( 0.024 -0.000 -0.951) 0.951 4.621 ( -0.644 0.000 -18.014) 18.026 5.031 ( -6.969 0.000 -6.267) 9.373 5.071 ( -7.039 0.000 -8.285) 10.871 5.456 ( 13.877 -0.000 -5.194) 14.817 5.492 ( 0.375 -0.000 12.897) 12.903 5.892 ( -16.017 0.000 2.710) 16.245 6.055 ( -8.377 0.000 1.547) 8.519 6.152 ( 7.240 -0.000 29.655) 30.526 6.193 ( -3.215 0.000 -8.823) 9.391 6.355 ( -2.825 0.000 1.009) 3.000 6.768 ( 5.118 -0.000 3.688) 6.309 7.024 ( 2.352 -0.000 -9.693) 9.974 7.089 ( -1.425 0.000 14.434) 14.504 7.168 ( 0.306 -0.000 -7.930) 7.936 7.712 ( 4.757 -0.000 -11.228) 12.194 7.727 ( -3.914 0.000 2.974) 4.916 7.902 ( 8.711 -0.000 -2.783) 9.145 7.993 ( -1.027 0.000 -7.950) 8.016 8.067 ( 6.503 -0.000 8.946) 11.060 8.601 ( -10.091 0.000 1.678) 10.229 8.680 ( -1.176 0.000 -2.104) 2.411 9.016 ( 0.720 -0.000 7.736) 7.769 9.054 ( 3.051 -0.000 -17.650) 17.911 9.582 ( -4.653 0.000 13.733) 14.500 9.967 ( 12.226 -0.000 -10.907) 16.384 10.538 ( 1.197 -0.000 -14.287) 14.337 13.069 ( 0.363 -0.000 5.695) 5.706 13.322 ( -1.019 0.000 -5.423) 5.517 13.741 ( 0.853 -0.000 -3.269) 3.379 14.002 ( 7.665 -0.000 -6.058) 9.770 14.163 ( -2.797 0.000 -1.048) 2.987 14.250 ( 3.567 -0.000 4.661) 5.869 14.578 ( -1.082 0.000 2.242) 2.489 14.656 ( -1.103 0.000 0.381) 1.167 15.746 ( -4.491 0.000 9.778) 10.760 16.204 ( -1.897 0.000 -5.443) 5.764 17.051 ( -3.658 0.000 10.945) 11.541 17.649 ( 9.973 -0.000 17.732) 20.345 17.672 ( 3.618 -0.000 -7.919) 8.706 18.162 ( 3.506 -0.000 -8.307) 9.017 18.695 ( -2.047 0.000 -1.846) 2.757 18.809 ( 0.576 -0.000 -1.434) 1.545 19.035 ( -1.935 0.000 4.714) 5.096 19.499 ( -0.675 0.000 -11.003) 11.023 20.347 ( -9.039 0.000 13.982) 16.650 21.157 ( 2.247 -0.000 -0.468) 2.296 21.585 ( -2.233 0.000 -1.238) 2.553 21.592 ( 3.039 -0.000 4.172) 5.162 21.703 ( -1.163 0.000 4.060) 4.223 22.276 ( 1.362 -0.000 -8.413) 8.522 23.316 ( 0.056 -0.000 -0.202) 0.209 23.478 ( 7.035 -0.000 0.143) 7.036 23.619 ( -1.506 0.000 4.436) 4.685 23.859 ( -4.590 0.000 -8.591) 9.740 ======================= Grid point 192 (99/128) ======================= q-point: (-0.14 -0.29 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.534 ( -7.525 -0.483 18.738) 20.198 1.714 ( -7.003 -14.119 19.799) 25.306 2.450 ( 18.341 0.339 8.123) 20.062 2.574 ( 3.966 10.129 4.703) 11.851 2.714 ( 0.351 5.937 4.462) 7.435 2.894 ( -1.693 -4.735 11.820) 12.845 3.027 ( 0.084 -9.137 -2.562) 9.490 3.178 ( -3.969 0.308 6.636) 7.738 3.233 ( -4.294 7.986 -5.669) 10.693 3.282 ( 3.656 -3.383 17.534) 18.228 3.523 ( -2.672 -4.328 1.106) 5.205 3.630 ( -0.656 -3.133 -2.521) 4.075 3.715 ( -0.415 5.444 -0.181) 5.462 3.920 ( 4.923 -2.228 3.351) 6.359 4.044 ( 4.091 -7.357 -3.669) 9.183 4.120 ( -9.826 2.105 18.133) 20.732 4.187 ( -4.053 4.118 9.623) 11.224 4.376 ( -1.520 -10.060 3.236) 10.676 4.589 ( -0.599 -4.634 -12.790) 13.617 5.001 ( -3.845 -3.139 -8.978) 10.259 5.024 ( -0.045 -5.494 -4.909) 7.367 5.453 ( -1.705 5.377 12.388) 13.612 5.594 ( 5.282 0.467 0.813) 5.364 5.717 ( -14.992 -1.775 1.172) 15.142 5.859 ( -10.256 10.663 1.642) 14.885 6.152 ( -5.496 -3.318 -2.863) 7.030 6.269 ( 4.283 3.350 18.117) 18.916 6.384 ( 2.700 -1.211 5.120) 5.914 6.838 ( 5.645 -0.292 -1.015) 5.743 6.998 ( 2.789 2.881 -9.833) 10.619 7.054 ( -0.119 6.955 -1.538) 7.124 7.134 ( 2.297 3.619 -3.371) 5.454 7.508 ( -3.083 12.830 1.785) 13.316 7.757 ( -2.939 -1.093 -7.435) 8.070 7.911 ( 3.997 6.597 2.528) 8.117 8.043 ( 4.488 -5.195 -4.638) 8.285 8.208 ( 5.286 -4.037 3.647) 7.586 8.522 ( -9.151 -3.165 2.404) 9.977 8.679 ( -1.719 -3.839 -4.780) 6.367 9.044 ( 2.785 -1.564 -15.819) 16.139 9.098 ( 1.797 -4.769 9.001) 10.343 9.556 ( -4.089 2.202 12.822) 13.637 10.089 ( 11.415 -2.581 -9.999) 15.393 10.487 ( 0.134 1.799 -14.890) 14.999 13.109 ( 2.355 -0.441 6.448) 6.879 13.324 ( 0.998 -2.138 -3.319) 4.073 13.721 ( 0.501 2.361 -4.729) 5.310 14.059 ( 4.094 -1.300 -7.653) 8.776 14.123 ( 0.151 3.114 0.808) 3.220 14.283 ( 4.226 2.062 3.357) 5.777 14.608 ( -1.163 -4.038 3.292) 5.338 14.682 ( -1.049 -4.306 0.903) 4.523 15.715 ( -4.946 0.740 8.453) 9.821 16.148 ( -1.796 2.022 -5.828) 6.425 17.048 ( -3.941 -0.483 11.002) 11.697 17.650 ( 4.362 4.158 -1.302) 6.166 17.829 ( 8.632 -1.156 8.987) 12.514 18.178 ( 4.429 0.171 -6.927) 8.223 18.667 ( -2.476 -0.395 -2.042) 3.234 18.808 ( 0.712 0.307 -1.593) 1.771 19.026 ( -2.587 -0.200 4.210) 4.945 19.445 ( -3.639 -0.640 -10.646) 11.269 20.330 ( -6.029 -2.327 15.787) 17.059 21.137 ( 1.158 6.100 2.982) 6.888 21.398 ( -4.531 9.648 5.676) 12.076 21.661 ( -0.470 4.817 4.829) 6.837 21.754 ( 3.686 -6.616 -5.695) 9.476 22.225 ( -0.094 3.134 -8.647) 9.198 23.336 ( 1.213 -1.031 0.654) 1.721 23.579 ( 7.377 -2.573 -0.927) 7.867 23.687 ( -1.022 -8.969 1.602) 9.169 23.780 ( -5.271 0.272 -7.480) 9.154 ======================= Grid point 199 (100/128) ======================= q-point: (-0.14 -0.14 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.549 ( -4.303 0.000 24.492) 24.867 1.578 ( -4.207 0.000 24.708) 25.064 2.655 ( 13.732 -0.000 4.776) 14.539 2.702 ( 0.528 -0.000 8.036) 8.054 2.822 ( 3.832 -0.000 -4.368) 5.811 2.882 ( -0.450 0.000 17.097) 17.102 2.900 ( -3.496 0.000 -3.046) 4.637 3.151 ( 2.377 -0.000 -7.373) 7.747 3.285 ( -4.641 0.000 14.476) 15.202 3.373 ( -4.498 0.000 -8.290) 9.431 3.406 ( 6.128 -0.000 21.372) 22.233 3.701 ( 8.833 -0.000 -1.081) 8.899 3.747 ( -4.941 0.000 3.126) 5.847 3.942 ( -0.401 0.000 -4.121) 4.141 3.971 ( 5.049 -0.000 1.017) 5.150 4.051 ( -14.460 0.000 12.136) 18.878 4.265 ( -1.910 0.000 2.921) 3.490 4.282 ( 3.679 -0.000 13.686) 14.172 4.531 ( 3.019 -0.000 -15.402) 15.695 4.918 ( -0.123 0.000 -4.279) 4.280 4.970 ( 2.831 -0.000 -8.231) 8.704 5.486 ( -10.073 0.000 18.358) 20.940 5.529 ( -15.151 0.000 6.020) 16.303 5.672 ( 7.103 -0.000 -5.050) 8.715 5.878 ( -16.893 0.000 -3.188) 17.191 5.930 ( -5.580 0.000 3.138) 6.402 6.402 ( 4.355 -0.000 -0.591) 4.395 6.490 ( 5.162 -0.000 26.489) 26.987 6.866 ( 4.523 -0.000 -13.027) 13.790 7.001 ( 1.566 -0.000 -12.147) 12.248 7.130 ( 1.831 -0.000 -7.370) 7.594 7.194 ( 6.378 -0.000 3.689) 7.368 7.509 ( -15.642 0.000 -3.912) 16.124 7.759 ( 6.208 -0.000 -6.230) 8.795 8.017 ( 1.884 -0.000 4.667) 5.033 8.022 ( 4.711 -0.000 -2.292) 5.239 8.248 ( 3.039 -0.000 0.663) 3.110 8.414 ( -6.070 0.000 6.398) 8.819 8.583 ( -4.581 0.000 -7.231) 8.560 9.010 ( 2.509 -0.000 -15.016) 15.224 9.111 ( 2.167 -0.000 10.391) 10.614 9.569 ( -3.904 0.000 13.340) 13.900 10.166 ( 11.689 -0.000 -10.137) 15.472 10.450 ( -1.042 0.000 -15.200) 15.236 13.178 ( 5.598 -0.000 7.297) 9.197 13.309 ( 1.847 -0.000 -2.201) 2.873 13.746 ( 1.732 -0.000 -3.850) 4.222 14.030 ( 1.049 -0.000 -8.496) 8.560 14.196 ( 3.952 -0.000 0.389) 3.971 14.350 ( 2.971 -0.000 4.492) 5.386 14.583 ( 0.310 -0.000 2.397) 2.417 14.618 ( -2.715 0.000 0.412) 2.746 15.688 ( -5.780 0.000 8.163) 10.002 16.126 ( -1.643 0.000 -5.967) 6.189 17.034 ( -4.037 0.000 11.094) 11.805 17.703 ( 3.470 -0.000 -8.025) 8.743 17.965 ( 8.183 -0.000 11.183) 13.857 18.209 ( 5.166 -0.000 -6.546) 8.339 18.627 ( -3.083 0.000 -0.797) 3.184 18.811 ( 0.314 -0.000 -1.776) 1.803 19.007 ( -2.729 0.000 3.872) 4.737 19.351 ( -6.034 0.000 -8.618) 10.521 20.323 ( -1.220 0.000 16.544) 16.589 21.178 ( -0.414 0.000 -0.210) 0.464 21.550 ( 0.079 -0.000 -1.566) 1.568 21.650 ( 0.416 -0.000 1.188) 1.259 21.708 ( -0.674 0.000 4.206) 4.260 22.215 ( -2.201 0.000 -7.914) 8.214 23.330 ( 1.364 -0.000 -0.209) 1.380 23.600 ( -2.785 0.000 4.442) 5.242 23.641 ( 7.824 -0.000 -1.714) 8.010 23.702 ( -5.076 0.000 -6.754) 8.449 ======================= Grid point 200 (101/128) ======================= q-point: ( 0.00 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.131 ( -1.705 0.000 19.175) 19.251 2.135 ( 0.018 -0.000 18.748) 18.748 2.455 ( -0.664 0.000 -13.045) 13.062 2.477 ( 3.501 -0.000 -14.871) 15.278 2.877 ( -3.562 0.000 4.270) 5.560 2.970 ( -0.038 0.000 -2.819) 2.820 3.032 ( -0.094 0.000 -1.660) 1.663 3.080 ( 1.944 -0.000 -6.024) 6.330 3.343 ( -5.824 0.000 8.766) 10.524 3.420 ( 4.482 -0.000 2.415) 5.091 3.541 ( -7.924 0.000 2.774) 8.396 3.628 ( 2.494 -0.000 -6.059) 6.552 3.861 ( 1.895 -0.000 -2.620) 3.233 3.891 ( -1.017 0.000 -5.476) 5.570 4.219 ( -4.037 0.000 19.853) 20.259 4.331 ( -4.684 0.000 21.891) 22.387 4.419 ( -0.686 0.000 4.025) 4.083 4.499 ( 2.639 -0.000 -4.661) 5.356 4.529 ( 8.142 -0.000 -2.307) 8.463 4.751 ( 10.322 -0.000 -18.877) 21.515 5.160 ( 6.762 -0.000 14.438) 15.943 5.422 ( -8.052 0.000 -10.100) 12.917 5.547 ( -7.866 0.000 10.273) 12.938 5.692 ( 3.224 -0.000 -3.309) 4.620 5.800 ( -8.649 0.000 23.517) 25.057 6.134 ( -0.833 0.000 15.291) 15.313 6.302 ( 5.321 -0.000 -25.091) 25.649 6.428 ( 4.802 -0.000 -10.451) 11.501 6.690 ( 7.438 -0.000 -7.485) 10.553 6.694 ( -16.482 0.000 -5.365) 17.333 7.159 ( 4.656 -0.000 0.871) 4.736 7.193 ( -10.311 0.000 4.135) 11.110 7.343 ( 6.426 -0.000 9.857) 11.766 7.652 ( 0.305 -0.000 -14.083) 14.086 8.117 ( 2.235 -0.000 0.039) 2.235 8.122 ( -3.938 0.000 -0.583) 3.981 8.214 ( -3.828 0.000 5.638) 6.815 8.311 ( 4.012 -0.000 -5.023) 6.429 8.614 ( 0.822 -0.000 7.092) 7.140 8.776 ( 2.018 -0.000 -8.880) 9.106 9.527 ( -1.297 0.000 19.164) 19.207 9.849 ( -2.944 0.000 12.660) 12.998 9.939 ( 0.717 -0.000 -20.609) 20.622 10.092 ( 4.811 -0.000 -11.350) 12.328 13.370 ( 2.483 -0.000 0.662) 2.570 13.372 ( 1.607 -0.000 0.706) 1.755 13.726 ( 2.657 -0.000 -0.021) 2.658 13.788 ( -3.714 0.000 -6.428) 7.424 14.347 ( 4.580 -0.000 2.920) 5.431 14.397 ( -3.298 0.000 -1.766) 3.741 14.610 ( -0.496 0.000 2.007) 2.067 14.632 ( 0.551 -0.000 -0.047) 0.553 15.783 ( -3.448 0.000 7.959) 8.673 15.942 ( 2.212 -0.000 -7.580) 7.897 17.269 ( -3.032 0.000 12.323) 12.690 17.509 ( 2.575 -0.000 -11.203) 11.495 18.083 ( -11.413 0.000 6.430) 13.100 18.201 ( 8.051 -0.000 -5.170) 9.568 18.678 ( 2.738 -0.000 2.447) 3.672 18.733 ( -1.800 0.000 -2.880) 3.396 19.063 ( -2.044 0.000 4.443) 4.891 19.158 ( 2.049 -0.000 -4.762) 5.184 20.772 ( 3.201 -0.000 13.914) 14.278 21.012 ( -2.727 0.000 -9.384) 9.772 21.591 ( 3.685 -0.000 0.639) 3.740 21.600 ( -4.373 0.000 -0.355) 4.388 21.841 ( -0.947 0.000 7.252) 7.314 21.991 ( 0.031 -0.000 -7.202) 7.203 23.388 ( 3.195 -0.000 1.589) 3.568 23.438 ( -4.634 0.000 -3.450) 5.777 23.644 ( -4.895 0.000 4.536) 6.674 23.736 ( 6.854 -0.000 -4.529) 8.215 ======================= Grid point 201 (102/128) ======================= q-point: ( 0.14 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.184 ( -0.560 -0.138 15.390) 15.401 2.231 ( -0.216 -4.489 14.126) 14.824 2.407 ( -0.774 0.959 -12.280) 12.342 2.521 ( 9.170 -3.485 -10.697) 14.515 2.757 ( -8.938 10.270 2.032) 13.765 2.812 ( -5.996 7.777 0.920) 9.863 2.993 ( -4.281 0.733 -0.543) 4.377 3.076 ( -0.284 1.601 -1.874) 2.481 3.308 ( 2.460 3.213 2.616) 4.818 3.369 ( 0.203 4.078 -2.259) 4.666 3.590 ( -7.632 -8.484 1.829) 11.557 3.727 ( 2.219 -6.148 0.272) 6.542 3.794 ( -1.376 1.990 6.967) 7.375 3.998 ( 4.730 -8.708 -6.795) 12.016 4.205 ( -4.872 0.190 14.150) 14.966 4.372 ( -0.940 -0.559 13.927) 13.970 4.454 ( -9.599 -8.279 6.304) 14.157 4.499 ( 6.069 -0.864 -6.036) 8.603 4.704 ( 2.249 -11.873 -9.191) 15.182 4.850 ( 16.364 -1.309 -16.988) 23.624 5.245 ( -6.976 3.963 5.584) 9.775 5.317 ( 3.856 -0.890 3.521) 5.297 5.561 ( 1.907 -2.922 4.396) 5.613 5.655 ( 0.026 6.569 5.155) 8.350 5.807 ( -4.146 -1.189 20.340) 20.792 6.154 ( -2.119 1.400 9.388) 9.726 6.300 ( 4.480 -0.207 -20.271) 20.761 6.391 ( 2.248 4.761 -12.837) 13.875 6.526 ( -11.038 -1.735 -1.749) 11.309 6.732 ( 5.304 4.138 1.753) 6.952 7.074 ( -4.901 5.839 4.131) 8.670 7.186 ( 2.566 0.786 1.588) 3.119 7.356 ( 2.205 6.735 8.017) 10.701 7.576 ( -1.476 1.674 -13.369) 13.554 8.048 ( -2.508 3.691 0.839) 4.541 8.105 ( 3.935 4.908 -0.031) 6.291 8.258 ( -4.932 -7.895 4.390) 10.292 8.418 ( 3.395 -7.701 -5.324) 9.959 8.673 ( 2.381 -2.738 5.403) 6.508 8.786 ( 1.740 -2.059 -8.945) 9.342 9.567 ( -4.432 -1.555 18.138) 18.736 9.813 ( -2.128 4.018 2.852) 5.367 9.896 ( -2.668 -2.184 -9.152) 9.780 10.113 ( 6.869 0.757 -13.383) 15.062 13.368 ( 1.701 2.212 -0.799) 2.903 13.384 ( 2.074 1.473 -2.086) 3.290 13.709 ( -6.670 1.237 -5.857) 8.962 13.757 ( 3.479 -0.404 2.579) 4.349 14.298 ( -4.828 4.993 -2.119) 7.262 14.362 ( 3.578 3.763 1.290) 5.350 14.661 ( -0.760 -5.376 2.441) 5.953 14.704 ( 0.942 -6.746 -0.782) 6.856 15.777 ( -1.766 0.353 8.199) 8.395 15.943 ( 3.841 1.128 -6.950) 8.020 17.276 ( -2.767 -0.078 12.315) 12.622 17.502 ( 2.648 0.163 -10.990) 11.306 17.960 ( -12.781 0.966 9.058) 15.695 18.237 ( 4.488 2.539 -4.545) 6.874 18.702 ( -0.771 0.293 -1.430) 1.650 18.719 ( 1.892 -0.555 0.063) 1.972 19.072 ( -1.080 -1.412 4.850) 5.166 19.186 ( 3.516 -1.447 -5.201) 6.442 20.851 ( 2.070 -0.574 12.814) 12.993 20.970 ( -1.345 -1.730 -9.977) 10.214 21.461 ( -4.409 8.754 7.607) 12.407 21.636 ( 2.638 0.866 -6.232) 6.823 21.835 ( -1.362 2.393 7.852) 8.321 21.969 ( 1.520 0.773 -7.239) 7.437 23.400 ( -3.840 -1.809 -1.406) 4.472 23.453 ( 3.308 -2.673 1.637) 4.557 23.626 ( -5.144 -2.960 2.963) 6.633 23.805 ( 6.239 -1.710 -5.207) 8.304 ======================= Grid point 202 (103/128) ======================= q-point: ( 0.29 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.142 ( -7.712 6.694 5.063) 11.398 2.294 ( 0.867 1.794 8.097) 8.338 2.345 ( -2.217 0.693 -2.464) 3.386 2.507 ( -5.473 5.192 1.146) 7.630 2.703 ( 11.973 -5.701 -2.519) 13.498 2.735 ( 3.357 2.659 1.651) 4.590 2.942 ( -3.602 -0.590 -6.849) 7.761 3.022 ( -1.352 3.752 6.740) 7.832 3.142 ( -5.444 8.794 -3.606) 10.953 3.435 ( 5.522 -1.668 -0.626) 5.802 3.593 ( -8.802 -6.747 -3.114) 11.519 3.816 ( -0.723 -0.573 4.961) 5.046 3.862 ( -3.589 -9.282 11.230) 15.005 4.119 ( -0.392 -3.893 -1.758) 4.289 4.235 ( 0.026 -2.234 2.815) 3.594 4.420 ( 1.214 -3.551 7.550) 8.431 4.530 ( -2.599 -10.030 -1.809) 10.518 4.591 ( 0.882 -4.405 5.747) 7.294 4.839 ( 4.467 -4.067 -12.738) 14.098 4.995 ( 5.491 -4.145 -14.550) 16.094 5.093 ( -9.078 -1.084 4.745) 10.301 5.346 ( -3.139 4.907 3.679) 6.890 5.526 ( -0.269 4.118 8.453) 9.406 5.760 ( 12.012 -3.854 13.717) 18.636 5.864 ( 3.750 0.899 11.930) 12.538 6.075 ( -7.658 3.354 1.085) 8.430 6.195 ( -0.896 8.783 -10.259) 13.535 6.331 ( 7.599 3.717 -12.875) 15.405 6.523 ( -0.924 -4.102 0.538) 4.239 6.675 ( -2.008 4.455 1.706) 5.176 6.963 ( -1.441 4.539 3.120) 5.693 7.228 ( -1.667 -2.422 8.384) 8.885 7.252 ( -2.454 7.284 -1.338) 7.801 7.527 ( 2.344 0.385 -7.334) 7.709 7.989 ( 1.021 3.180 2.184) 3.990 8.085 ( 6.842 4.504 1.688) 8.363 8.317 ( -8.282 -5.887 1.818) 10.322 8.517 ( 1.222 -4.529 -8.605) 9.801 8.747 ( 0.762 -1.377 -0.797) 1.765 8.843 ( 3.752 -4.814 -2.902) 6.758 9.581 ( -6.719 -1.666 12.886) 14.627 9.734 ( -1.326 4.773 5.340) 7.284 9.888 ( -2.164 -3.343 -6.558) 7.672 10.127 ( 6.552 1.515 -13.837) 15.384 13.325 ( 0.722 3.625 -3.081) 4.812 13.383 ( 3.679 2.030 -0.835) 4.284 13.593 ( -7.726 0.629 -5.335) 9.410 13.825 ( 3.784 -1.525 3.931) 5.665 14.164 ( -4.896 3.964 -1.594) 6.498 14.329 ( 2.096 4.272 -1.074) 4.878 14.745 ( -1.320 -5.341 2.371) 5.991 14.815 ( 0.789 -5.706 -0.363) 5.772 15.782 ( -1.037 0.193 7.300) 7.375 15.946 ( 4.287 1.603 -6.107) 7.632 17.286 ( -2.592 -0.148 11.833) 12.114 17.495 ( 2.584 0.235 -9.765) 10.104 17.865 ( -9.786 -0.875 10.774) 14.581 18.193 ( 1.283 4.586 -5.230) 7.073 18.684 ( -0.567 0.108 -1.764) 1.856 18.748 ( 1.745 -0.193 -0.075) 1.757 19.106 ( -0.950 -1.979 5.743) 6.148 19.235 ( 3.691 -1.821 -6.190) 7.433 20.875 ( -2.551 0.912 6.191) 6.758 21.002 ( 2.801 -3.655 -3.918) 6.046 21.315 ( -4.513 6.872 12.829) 15.237 21.604 ( 3.175 3.192 -10.580) 11.498 21.788 ( -2.484 3.780 8.649) 9.761 21.955 ( 2.816 1.036 -8.536) 9.048 23.395 ( -2.858 -1.924 0.950) 3.574 23.532 ( 3.638 -1.765 1.467) 4.301 23.638 ( -5.140 -4.703 0.246) 6.972 23.882 ( 4.870 -2.058 -4.586) 6.999 ======================= Grid point 203 (104/128) ======================= q-point: (-0.57 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.936 ( -6.422 6.724 4.653) 10.397 2.288 ( -0.732 1.923 6.592) 6.906 2.338 ( 3.459 0.162 0.993) 3.603 2.461 ( 0.617 0.416 1.726) 1.880 2.739 ( 0.936 1.885 -3.164) 3.800 2.797 ( -1.771 1.530 0.135) 2.345 2.915 ( -3.300 2.044 -1.386) 4.122 3.003 ( 4.342 0.146 -3.086) 5.329 3.059 ( 3.625 -5.352 0.450) 6.479 3.470 ( 1.265 0.739 -1.182) 1.883 3.634 ( -7.237 -8.013 -0.149) 10.799 3.790 ( -0.660 2.850 2.741) 4.009 3.972 ( -4.224 -4.572 10.944) 12.591 4.142 ( -0.519 -0.645 1.404) 1.630 4.230 ( -0.224 1.896 -2.009) 2.771 4.510 ( 0.407 -3.403 -0.862) 3.534 4.625 ( -3.451 1.110 10.839) 11.429 4.738 ( 1.025 -11.456 1.806) 11.643 4.811 ( -3.963 0.542 2.227) 4.578 5.004 ( 12.280 3.038 -12.841) 18.025 5.025 ( -6.764 11.872 3.965) 14.228 5.308 ( -5.078 -11.299 1.100) 12.436 5.577 ( -2.804 -6.703 9.536) 11.989 5.848 ( 4.040 11.092 5.925) 13.208 5.852 ( -3.942 7.746 0.551) 8.709 6.008 ( 0.712 -0.122 -2.601) 2.699 6.081 ( 8.823 -0.950 -2.632) 9.256 6.382 ( 9.688 -0.636 -0.224) 9.711 6.584 ( -2.803 -4.137 -1.740) 5.291 6.608 ( -2.333 -1.190 -4.275) 5.013 6.912 ( -1.283 1.850 0.435) 2.294 7.090 ( -5.385 6.181 0.318) 8.204 7.268 ( -3.319 -3.919 5.553) 7.564 7.559 ( 3.721 -0.903 -3.940) 5.494 7.983 ( 3.510 1.839 3.322) 5.171 8.128 ( 8.548 2.854 7.504) 11.727 8.270 ( -10.685 -2.319 -2.249) 11.163 8.543 ( 0.414 -1.931 -13.265) 13.411 8.739 ( -0.080 1.032 -2.785) 2.971 8.944 ( 3.034 -2.426 -0.053) 3.885 9.564 ( -5.156 -0.482 6.709) 8.475 9.674 ( -1.399 4.538 14.642) 15.393 9.923 ( -0.531 -5.919 -9.582) 11.275 10.118 ( 5.471 2.519 -13.131) 14.446 13.267 ( 0.215 3.405 -1.008) 3.558 13.390 ( 3.846 2.134 -0.371) 4.414 13.515 ( -5.426 -1.798 -4.693) 7.396 13.885 ( 1.931 -0.776 1.829) 2.771 14.093 ( -2.087 -0.364 0.221) 2.130 14.274 ( 1.018 3.712 -2.379) 4.525 14.802 ( -1.031 -2.548 1.839) 3.307 14.878 ( 0.186 -1.348 1.011) 1.695 15.792 ( -1.517 -0.676 5.762) 5.996 15.947 ( 3.031 0.958 -5.568) 6.412 17.295 ( -2.855 -0.079 11.142) 11.503 17.491 ( 2.379 0.137 -7.887) 8.240 17.853 ( -4.999 -3.477 10.229) 11.904 18.115 ( 1.517 4.303 -6.597) 8.021 18.674 ( -0.412 0.177 -0.792) 0.910 18.762 ( 1.057 -0.015 -0.854) 1.359 19.135 ( -1.799 -1.005 6.166) 6.501 19.275 ( 2.968 -1.198 -7.140) 7.825 20.827 ( -4.303 2.941 7.406) 9.056 21.076 ( 3.839 -1.488 -1.676) 4.445 21.253 ( -4.400 -0.291 12.413) 13.173 21.560 ( 3.104 1.732 -12.653) 13.142 21.735 ( -2.693 2.521 9.554) 10.242 21.947 ( 3.097 0.279 -9.865) 10.343 23.399 ( -1.575 -0.816 2.319) 2.919 23.591 ( 4.243 -0.068 0.764) 4.312 23.652 ( -4.644 -3.814 -2.048) 6.349 23.929 ( 2.669 -0.016 -3.222) 4.184 ======================= Grid point 204 (105/128) ======================= q-point: (-0.43 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.896 ( 3.141 -0.754 9.427) 9.965 2.280 ( 1.136 1.085 4.319) 4.596 2.415 ( 7.101 -2.941 -3.427) 8.415 2.451 ( -0.869 4.047 7.868) 8.891 2.692 ( -7.370 -4.666 -9.734) 13.071 2.769 ( -4.498 -1.518 5.446) 7.225 2.862 ( 0.405 0.860 0.935) 1.333 3.027 ( 0.509 -2.087 -4.119) 4.646 3.209 ( 6.443 -4.131 -8.876) 11.720 3.473 ( -1.740 -1.957 -1.537) 3.036 3.606 ( 2.962 8.521 3.106) 9.541 3.791 ( -3.649 -5.125 1.356) 6.436 3.963 ( -3.139 4.128 11.524) 12.637 4.164 ( 1.340 1.120 4.010) 4.374 4.189 ( 5.204 3.494 -2.607) 6.789 4.483 ( -5.287 6.916 4.444) 9.774 4.541 ( -10.773 1.897 11.207) 15.660 4.668 ( 1.664 10.731 15.688) 19.079 4.808 ( -5.424 6.270 1.225) 8.381 4.952 ( 10.035 1.044 -11.490) 15.291 5.100 ( 4.739 -4.731 -1.640) 6.894 5.372 ( -0.365 -0.041 -4.496) 4.511 5.608 ( -11.749 -0.440 3.412) 12.243 5.740 ( -5.152 -7.502 13.773) 16.508 5.794 ( 1.505 1.983 5.111) 5.685 6.019 ( 3.707 -1.718 -4.209) 5.866 6.234 ( 7.850 -3.382 -10.539) 13.569 6.463 ( -6.069 -3.042 -0.568) 6.813 6.561 ( -2.554 -4.244 -3.238) 5.918 6.656 ( 5.444 -1.863 -10.073) 11.600 6.887 ( 0.386 -1.002 2.992) 3.179 6.998 ( -1.178 1.972 2.963) 3.749 7.338 ( 0.400 -5.575 3.327) 6.504 7.568 ( -2.074 -0.228 -5.161) 5.567 8.013 ( 2.408 0.398 4.160) 4.824 8.145 ( -8.081 -0.990 4.254) 9.185 8.245 ( 6.867 1.599 4.305) 8.261 8.514 ( 0.505 -0.225 -17.103) 17.112 8.711 ( 0.610 2.586 0.833) 2.785 8.961 ( 0.525 2.406 -1.535) 2.902 9.517 ( -1.892 4.339 9.892) 10.966 9.681 ( -0.948 -1.686 12.086) 12.240 9.984 ( 1.118 -4.493 -9.009) 10.130 10.089 ( 3.938 2.066 -13.666) 14.372 13.231 ( -0.058 1.189 2.285) 2.576 13.387 ( 1.745 2.081 -0.032) 2.716 13.507 ( -0.554 -2.842 -3.705) 4.702 13.919 ( 0.761 -2.171 -1.412) 2.699 14.101 ( 0.445 -0.216 -0.159) 0.520 14.248 ( 0.947 -0.592 -0.305) 1.157 14.809 ( -0.076 1.450 1.174) 1.868 14.863 ( -0.524 3.512 2.293) 4.227 15.804 ( -2.662 -1.476 5.045) 5.892 15.947 ( 0.937 -0.497 -5.936) 6.031 17.292 ( -3.636 0.338 10.910) 11.505 17.496 ( 2.830 -0.272 -7.932) 8.426 17.915 ( -2.066 -4.868 8.367) 9.898 18.076 ( 5.018 1.920 -6.784) 8.654 18.662 ( -0.860 0.382 0.230) 0.969 18.768 ( 0.622 -0.100 -1.327) 1.469 19.135 ( -2.655 0.233 5.993) 6.559 19.283 ( 1.444 0.574 -7.758) 7.912 20.753 ( -3.755 4.224 11.773) 13.059 21.113 ( 2.759 0.431 -0.761) 2.894 21.286 ( -5.075 -5.327 8.370) 11.144 21.554 ( 3.331 -1.705 -12.568) 13.114 21.722 ( -2.055 -0.529 9.581) 9.813 21.956 ( 2.616 -1.391 -9.854) 10.289 23.400 ( -0.102 0.373 2.210) 2.243 23.628 ( 2.627 0.354 -1.578) 3.085 23.641 ( -1.582 -0.337 -2.161) 2.699 23.910 ( -0.063 3.486 -1.470) 3.784 ======================= Grid point 205 (106/128) ======================= q-point: (-0.29 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.013 ( 5.937 0.156 16.274) 17.324 2.283 ( 2.294 6.920 8.244) 11.005 2.410 ( -2.650 -4.509 2.731) 5.900 2.557 ( 4.024 -5.865 -4.560) 8.449 2.615 ( -5.191 -2.125 -9.387) 10.935 2.799 ( -5.168 -5.641 0.478) 7.665 2.910 ( 4.644 -2.826 -1.540) 5.650 3.097 ( 2.739 -6.517 -1.699) 7.270 3.247 ( -0.535 -0.529 -11.483) 11.507 3.442 ( -2.869 2.345 0.746) 3.780 3.526 ( 7.121 7.278 2.077) 10.392 3.861 ( -0.279 -4.118 -1.797) 4.501 3.887 ( -4.380 4.254 14.181) 15.440 4.098 ( 4.356 9.402 -3.639) 10.982 4.244 ( 4.307 -0.282 2.243) 4.865 4.290 ( -3.369 11.535 18.839) 22.345 4.461 ( -9.117 -0.529 12.619) 15.577 4.580 ( 0.580 7.849 0.096) 7.871 4.669 ( -1.206 8.078 7.399) 11.021 4.885 ( 7.603 12.603 -9.132) 17.322 5.116 ( 1.564 4.539 1.859) 5.148 5.418 ( 0.405 -6.510 -2.305) 6.918 5.575 ( -6.614 -6.386 -0.758) 9.225 5.758 ( -8.611 -1.084 7.701) 11.603 5.854 ( -6.340 -3.389 18.546) 19.890 6.132 ( 4.939 -2.510 -0.374) 5.553 6.204 ( -4.251 -1.315 -5.410) 7.005 6.410 ( 0.634 -1.151 -26.177) 26.210 6.624 ( 1.435 -4.355 -8.100) 9.308 6.775 ( 1.383 -11.173 -5.071) 12.348 6.962 ( 3.621 0.266 13.077) 13.572 7.000 ( 1.541 -3.165 -0.638) 3.577 7.429 ( -5.986 -2.743 2.286) 6.970 7.518 ( 0.842 -2.923 -8.328) 8.867 8.037 ( -0.545 -1.105 3.135) 3.368 8.110 ( -6.393 -4.731 -2.383) 8.303 8.295 ( 6.990 5.045 9.159) 12.578 8.466 ( 1.685 2.669 -12.804) 13.187 8.670 ( 0.005 4.182 4.354) 6.037 8.886 ( -0.739 4.770 -4.561) 6.641 9.477 ( 0.807 4.221 13.843) 14.495 9.751 ( -1.080 -3.930 9.076) 9.949 10.007 ( 5.222 2.968 -7.804) 9.848 10.075 ( 0.098 -3.383 -15.468) 15.834 13.247 ( 0.873 -1.409 4.140) 4.460 13.371 ( 0.634 1.381 0.522) 1.607 13.565 ( 3.159 -3.708 -2.173) 5.335 13.927 ( -1.877 0.190 -5.883) 6.178 14.132 ( 3.993 -2.307 1.427) 4.827 14.304 ( 0.319 -4.479 1.166) 4.639 14.764 ( 0.516 5.057 1.112) 5.203 14.781 ( -0.958 6.443 2.169) 6.865 15.809 ( -3.930 -1.418 5.798) 7.147 15.945 ( -0.268 -1.366 -7.049) 7.185 17.277 ( -3.852 0.502 11.296) 11.945 17.507 ( 3.033 -0.452 -9.621) 10.097 17.995 ( 0.793 -4.173 3.410) 5.447 18.120 ( 5.631 -1.133 -3.284) 6.616 18.648 ( -0.634 0.521 1.413) 1.633 18.769 ( -0.116 -0.152 -1.757) 1.768 19.112 ( -2.999 0.866 5.478) 6.305 19.241 ( -0.250 2.382 -7.272) 7.656 20.704 ( -1.193 3.370 14.244) 14.685 21.115 ( 0.434 0.605 -5.311) 5.363 21.355 ( -4.388 -7.134 9.196) 12.438 21.599 ( 3.143 -3.549 -10.841) 11.833 21.761 ( -1.478 -2.957 8.610) 9.223 21.981 ( 1.446 -2.415 -8.876) 9.312 23.395 ( 1.350 1.834 1.037) 2.502 23.589 ( -4.355 0.425 -4.024) 5.944 23.658 ( 6.422 2.523 -1.597) 7.082 23.819 ( -2.760 5.685 1.257) 6.444 ======================= Grid point 206 (107/128) ======================= q-point: (-0.14 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.080 ( 1.234 1.836 19.133) 19.260 2.178 ( -2.733 8.473 18.951) 20.938 2.478 ( -0.894 -3.622 -8.895) 9.646 2.517 ( -2.023 -0.239 -15.011) 15.148 2.774 ( 4.086 -10.533 -0.822) 11.328 2.869 ( 4.397 -5.255 -2.890) 7.436 3.000 ( 3.509 -3.187 -1.374) 4.935 3.144 ( -2.003 3.505 -5.238) 6.613 3.261 ( -0.776 -6.897 5.234) 8.693 3.376 ( -0.764 0.439 -1.360) 1.621 3.572 ( 6.125 -0.455 -0.979) 6.219 3.799 ( -9.410 7.322 8.061) 14.392 3.838 ( -1.848 0.478 -4.894) 5.253 3.965 ( 2.923 7.470 -6.379) 10.248 4.204 ( -0.996 4.782 20.795) 21.361 4.302 ( 0.607 -1.605 9.599) 9.751 4.415 ( -4.924 0.615 10.708) 11.802 4.505 ( 4.226 6.951 5.407) 9.768 4.567 ( 6.770 9.072 -2.603) 11.615 4.761 ( 2.653 4.785 -11.059) 12.338 5.092 ( 4.201 3.534 8.807) 10.378 5.478 ( -7.997 -6.046 -1.544) 10.143 5.626 ( 1.758 -2.297 -3.119) 4.254 5.661 ( -10.620 0.356 3.277) 11.120 5.836 ( -10.365 0.140 21.748) 24.092 6.107 ( -0.491 1.476 10.223) 10.341 6.336 ( 5.964 -4.022 -12.802) 14.684 6.351 ( 4.581 -0.822 -20.597) 21.116 6.656 ( 2.969 -1.393 -12.805) 13.218 6.844 ( -11.137 -3.674 -4.759) 12.656 7.058 ( 2.225 -6.008 5.375) 8.362 7.153 ( 10.577 -6.089 0.697) 12.224 7.318 ( -13.696 -0.035 6.678) 15.237 7.620 ( 5.336 -4.331 -9.934) 12.080 8.072 ( 0.150 -2.947 0.828) 3.064 8.126 ( -4.086 -4.563 -2.556) 6.637 8.279 ( 1.384 6.065 7.069) 9.416 8.370 ( 1.402 6.985 -7.210) 10.136 8.620 ( -0.204 3.674 7.049) 7.951 8.805 ( 0.874 2.757 -7.642) 8.171 9.487 ( 1.130 2.163 17.250) 17.422 9.818 ( -2.881 -3.218 10.534) 11.385 9.981 ( 5.956 2.951 -15.802) 17.143 10.083 ( 0.388 -2.368 -11.688) 11.932 13.308 ( 2.103 -2.483 3.429) 4.727 13.366 ( 1.200 0.813 0.980) 1.750 13.662 ( 3.993 -3.627 -0.833) 5.458 13.857 ( -2.968 1.780 -7.206) 7.994 14.247 ( 5.075 -4.140 2.762) 7.108 14.377 ( -1.216 -4.734 -0.105) 4.888 14.667 ( -1.259 6.179 2.819) 6.907 14.687 ( 0.711 6.017 -0.256) 6.065 15.799 ( -4.505 -0.673 7.068) 8.408 15.942 ( 0.449 -1.080 -7.776) 7.864 17.268 ( -3.442 0.237 11.903) 12.393 17.513 ( 2.744 -0.265 -10.815) 11.160 18.086 ( 2.025 -4.138 1.548) 4.860 18.163 ( 1.367 0.050 -2.189) 2.581 18.649 ( 1.271 0.323 2.463) 2.791 18.757 ( -1.158 -0.025 -2.357) 2.626 19.083 ( -2.805 0.818 4.825) 5.641 19.179 ( -0.055 2.060 -5.695) 6.057 20.713 ( 1.767 1.584 14.557) 14.749 21.072 ( -2.024 0.800 -8.112) 8.399 21.473 ( -1.028 -8.082 6.488) 10.415 21.639 ( 1.004 -1.310 -6.663) 6.864 21.814 ( -1.228 -2.091 7.437) 7.822 22.000 ( 0.160 -1.891 -7.916) 8.141 23.380 ( 2.527 2.770 0.556) 3.790 23.513 ( -4.637 1.358 -4.086) 6.328 23.685 ( 5.629 1.740 -1.986) 6.218 23.711 ( -3.151 3.702 3.059) 5.744 ======================= Grid point 208 (108/128) ======================= q-point: ( 0.14 0.14 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.237 ( -0.345 0.000 11.077) 11.083 2.281 ( 7.891 -0.000 14.508) 16.515 2.394 ( 2.252 -0.000 -12.784) 12.981 2.516 ( 6.318 -0.000 -11.997) 13.559 2.730 ( -15.967 0.000 4.862) 16.691 2.750 ( -9.059 0.000 2.385) 9.368 3.007 ( -5.618 0.000 -0.376) 5.631 3.063 ( 0.382 -0.000 0.571) 0.687 3.263 ( -4.308 0.000 2.197) 4.836 3.414 ( -1.009 0.000 3.464) 3.608 3.580 ( 1.295 -0.000 4.382) 4.570 3.626 ( -3.951 0.000 0.259) 3.959 3.857 ( -1.512 0.000 -2.245) 2.706 3.953 ( 11.395 -0.000 -2.684) 11.707 4.178 ( -7.513 0.000 10.477) 12.892 4.289 ( -8.141 0.000 -3.717) 8.950 4.428 ( 2.125 -0.000 14.935) 15.085 4.531 ( 6.585 -0.000 -7.921) 10.300 4.577 ( -2.668 0.000 -4.822) 5.511 4.979 ( 19.193 -0.000 -22.424) 29.516 5.207 ( -8.042 0.000 -11.346) 13.907 5.274 ( -9.969 0.000 15.378) 18.326 5.681 ( 12.863 -0.000 22.402) 25.832 5.738 ( 3.086 -0.000 0.703) 3.165 5.821 ( 1.606 -0.000 11.816) 11.924 6.147 ( -7.665 0.000 10.600) 13.081 6.311 ( 7.997 -0.000 -20.129) 21.659 6.391 ( -7.611 0.000 9.851) 12.448 6.399 ( 1.198 -0.000 -18.261) 18.300 6.868 ( 5.957 -0.000 9.840) 11.503 7.059 ( -6.862 0.000 9.710) 11.890 7.238 ( 2.079 -0.000 -8.882) 9.123 7.452 ( 0.167 -0.000 4.805) 4.808 7.544 ( 0.988 -0.000 -8.721) 8.777 8.053 ( -3.428 0.000 4.652) 5.778 8.126 ( -7.059 0.000 2.524) 7.496 8.209 ( 5.984 -0.000 0.090) 5.984 8.363 ( 2.455 -0.000 -4.963) 5.537 8.699 ( 4.120 -0.000 3.581) 5.458 8.757 ( 1.364 -0.000 -10.090) 10.182 9.547 ( -7.475 0.000 18.102) 19.584 9.771 ( -3.642 0.000 -18.963) 19.310 9.878 ( -1.949 0.000 13.077) 13.221 10.151 ( 7.192 -0.000 -14.772) 16.430 13.385 ( 0.166 -0.000 -4.938) 4.941 13.413 ( 2.166 -0.000 -3.556) 4.163 13.656 ( -4.937 0.000 -1.555) 5.176 13.767 ( 0.281 -0.000 2.241) 2.258 14.284 ( -5.156 0.000 -2.544) 5.750 14.428 ( 1.408 -0.000 0.514) 1.499 14.621 ( 0.378 -0.000 1.153) 1.213 14.641 ( 0.564 -0.000 -0.426) 0.707 15.798 ( -0.249 0.000 9.395) 9.399 15.982 ( 5.323 -0.000 -6.730) 8.580 17.283 ( -2.819 0.000 12.271) 12.591 17.499 ( 2.869 -0.000 -10.999) 11.367 17.847 ( -13.957 0.000 11.115) 17.842 18.275 ( 0.586 -0.000 -4.708) 4.744 18.691 ( 0.476 -0.000 -2.854) 2.893 18.741 ( 1.847 -0.000 1.164) 2.183 19.066 ( -0.623 0.000 5.386) 5.421 19.206 ( 4.826 -0.000 -5.459) 7.286 20.903 ( 0.524 -0.000 12.531) 12.542 20.911 ( -0.352 0.000 -10.904) 10.910 21.500 ( -4.330 0.000 0.916) 4.426 21.661 ( 2.228 -0.000 0.552) 2.296 21.868 ( -1.148 0.000 8.552) 8.629 21.972 ( 2.170 -0.000 -6.942) 7.273 23.340 ( -3.128 0.000 -1.255) 3.371 23.472 ( 2.692 -0.000 3.466) 4.389 23.562 ( -4.243 0.000 2.663) 5.010 23.836 ( 5.576 -0.000 -6.775) 8.775 ======================= Grid point 209 (109/128) ======================= q-point: ( 0.29 0.14 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.187 ( -5.237 6.655 -0.152) 8.470 2.327 ( -1.059 2.379 -5.476) 6.064 2.432 ( 10.574 2.983 10.849) 15.441 2.514 ( -11.010 5.042 5.139) 13.155 2.641 ( 4.357 -9.727 -9.249) 14.111 2.733 ( -1.172 -4.628 5.322) 7.149 2.916 ( -0.135 2.533 -1.187) 2.800 3.075 ( -1.306 1.985 7.832) 8.185 3.246 ( -8.213 3.435 -2.177) 9.164 3.396 ( 2.948 -0.686 1.744) 3.493 3.466 ( -3.580 2.011 -2.626) 4.874 3.729 ( -3.419 -8.767 5.640) 10.970 3.818 ( -2.500 0.363 5.856) 6.378 4.042 ( -2.341 -1.067 -4.146) 4.879 4.204 ( -0.486 -4.371 0.154) 4.400 4.278 ( 0.101 -9.745 -2.625) 10.093 4.486 ( 3.483 1.083 7.982) 8.777 4.602 ( -5.727 -10.361 -5.604) 13.098 4.617 ( 6.800 -3.077 -1.154) 7.552 5.022 ( -12.294 4.671 -0.568) 13.164 5.089 ( 15.203 2.125 -20.277) 25.433 5.261 ( -7.371 -5.502 3.634) 9.890 5.700 ( 2.361 9.110 7.443) 11.999 5.837 ( 0.498 -2.088 24.818) 24.911 5.930 ( -0.635 -2.467 2.447) 3.532 6.120 ( 10.862 4.535 6.686) 13.537 6.298 ( 5.363 5.125 -7.156) 10.307 6.335 ( 0.367 -1.834 -15.051) 15.167 6.452 ( -0.181 -4.970 4.460) 6.680 6.845 ( 1.465 11.180 8.943) 14.392 7.011 ( -4.667 2.152 7.475) 9.071 7.201 ( 0.486 0.265 -11.160) 11.174 7.368 ( -1.805 9.636 2.726) 10.176 7.558 ( 3.707 0.559 -1.248) 3.951 8.030 ( -1.769 0.832 7.748) 7.991 8.106 ( -8.323 -5.986 1.449) 10.354 8.251 ( 6.563 2.765 0.345) 7.130 8.412 ( -0.007 -5.131 -8.025) 9.525 8.737 ( 1.181 -0.368 -6.120) 6.244 8.798 ( 4.318 -4.649 -1.486) 6.516 9.517 ( -9.060 -1.093 14.769) 17.361 9.697 ( -2.782 -2.501 -15.787) 16.224 9.878 ( -2.446 2.159 13.049) 13.451 10.175 ( 7.132 0.861 -15.206) 16.817 13.354 ( -0.887 0.549 -6.441) 6.525 13.405 ( -0.339 1.101 -5.413) 5.534 13.576 ( -1.595 3.978 1.166) 4.442 13.814 ( 0.131 -3.984 3.329) 5.193 14.179 ( -4.428 4.882 -1.774) 6.825 14.396 ( -0.333 3.577 -1.636) 3.947 14.664 ( -0.205 -4.233 1.701) 4.567 14.713 ( 0.348 -6.815 -0.970) 6.892 15.819 ( 0.395 1.286 9.436) 9.532 16.008 ( 5.601 1.666 -6.359) 8.636 17.289 ( -3.128 -0.145 11.658) 12.071 17.496 ( 2.799 0.127 -10.097) 10.478 17.761 ( -11.062 -1.868 12.714) 16.956 18.225 ( -2.615 2.159 -6.294) 7.150 18.693 ( 1.863 0.716 -1.876) 2.739 18.760 ( 1.005 -0.075 0.102) 1.013 19.090 ( -0.507 -1.351 6.542) 6.700 19.245 ( 4.862 -0.502 -6.142) 7.850 20.875 ( -0.524 0.889 -3.254) 3.414 20.959 ( -0.475 -3.363 4.447) 5.596 21.418 ( -2.429 5.921 5.964) 8.748 21.659 ( 1.857 2.672 -3.596) 4.850 21.848 ( -2.078 3.588 8.440) 9.404 21.977 ( 3.151 0.568 -7.400) 8.063 23.331 ( -2.177 -2.446 0.418) 3.301 23.516 ( -2.689 -3.420 2.298) 4.920 23.559 ( 1.333 -1.240 2.593) 3.168 23.881 ( 4.307 -1.680 -7.082) 8.457 ======================= Grid point 210 (110/128) ======================= q-point: ( 0.43 0.14 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.985 ( -6.312 7.269 1.318) 9.717 2.259 ( -4.405 0.426 0.532) 4.457 2.385 ( -2.253 0.695 -3.893) 4.551 2.537 ( 9.065 3.348 6.755) 11.791 2.731 ( -5.487 -3.392 1.896) 6.723 2.848 ( 5.573 1.749 -2.070) 6.197 2.922 ( 2.911 0.823 -1.144) 3.234 3.008 ( -3.116 5.677 0.644) 6.508 3.092 ( 0.696 0.591 3.778) 3.887 3.438 ( -0.518 -6.567 -0.664) 6.620 3.475 ( -2.107 -0.427 -1.876) 2.853 3.794 ( -4.230 -4.247 9.733) 11.431 3.891 ( -0.124 -7.204 8.441) 11.098 4.042 ( -4.270 -6.054 -5.633) 9.307 4.230 ( 0.510 -1.883 -1.183) 2.281 4.465 ( -0.090 -7.965 -2.019) 8.218 4.531 ( 3.134 -2.849 -0.623) 4.281 4.704 ( -5.165 -11.002 -2.483) 12.405 4.726 ( 5.621 2.188 -0.388) 6.045 4.883 ( -12.126 -7.991 10.349) 17.832 5.094 ( 2.133 3.847 -7.254) 8.484 5.305 ( 6.272 -0.930 -9.765) 11.643 5.581 ( -2.598 8.664 15.116) 17.616 5.825 ( -10.322 1.778 0.764) 10.501 5.965 ( 0.127 -0.407 18.414) 18.419 6.139 ( 8.490 7.907 -12.069) 16.741 6.246 ( 7.881 6.307 -7.625) 12.650 6.399 ( 2.386 -0.919 3.886) 4.651 6.536 ( 0.858 -2.447 3.949) 4.724 6.713 ( 8.025 9.190 4.692) 13.072 6.934 ( -3.764 3.342 -0.808) 5.098 7.162 ( 1.544 4.576 -10.280) 11.358 7.225 ( -3.351 3.192 12.342) 13.181 7.573 ( 0.918 0.536 -1.867) 2.148 8.042 ( 0.512 0.406 8.618) 8.643 8.091 ( -11.753 -4.073 -0.099) 12.439 8.294 ( 10.101 2.584 3.368) 10.957 8.441 ( -2.072 -4.055 -13.429) 14.180 8.735 ( 0.592 -0.557 -5.623) 5.682 8.917 ( 3.197 -4.715 -1.494) 5.889 9.491 ( -7.663 -2.659 10.694) 13.422 9.694 ( -2.066 -3.957 -7.247) 8.512 9.852 ( -1.749 1.605 8.990) 9.298 10.180 ( 6.469 2.112 -14.604) 16.111 13.314 ( 0.428 3.198 -5.173) 6.097 13.344 ( -5.936 -1.925 -4.171) 7.506 13.547 ( 4.981 3.006 1.427) 5.990 13.881 ( -0.437 -2.700 2.513) 3.714 14.073 ( -2.475 2.209 -0.084) 3.319 14.320 ( -1.413 3.650 -3.471) 5.231 14.738 ( -0.615 -4.749 2.081) 5.221 14.815 ( -0.390 -6.032 -0.782) 6.095 15.821 ( 0.020 2.226 8.353) 8.645 16.006 ( 4.409 3.141 -6.065) 8.129 17.291 ( -3.573 -0.253 10.890) 11.464 17.493 ( 2.318 0.092 -8.178) 8.500 17.755 ( -6.694 -4.528 12.146) 14.589 18.143 ( -1.807 1.898 -7.864) 8.289 18.692 ( 1.618 1.390 -0.528) 2.198 18.765 ( 0.368 -0.041 -1.083) 1.144 19.125 ( -0.968 -1.038 7.119) 7.259 19.281 ( 4.118 -0.322 -6.794) 7.951 20.844 ( -1.911 1.549 3.698) 4.442 21.027 ( -0.202 -5.173 -1.733) 5.459 21.325 ( -1.153 6.553 11.185) 13.014 21.606 ( 2.268 4.159 -8.072) 9.359 21.784 ( -2.790 3.890 8.751) 9.974 21.967 ( 3.287 1.604 -9.316) 10.008 23.360 ( -1.369 -2.758 2.319) 3.855 23.537 ( -4.097 -4.075 -0.670) 5.817 23.626 ( 3.823 -1.768 2.797) 5.056 23.926 ( 2.251 -1.691 -6.106) 6.724 ======================= Grid point 211 (111/128) ======================= q-point: (-0.43 0.14 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.925 ( 2.431 -1.979 4.378) 5.385 2.244 ( -3.925 -3.150 4.143) 6.518 2.388 ( 1.243 -3.886 -8.451) 9.384 2.554 ( 0.120 3.667 -3.074) 4.786 2.647 ( -4.827 5.237 6.850) 9.882 2.757 ( -2.709 7.183 7.133) 10.479 2.897 ( 2.158 0.835 -6.443) 6.846 2.998 ( 2.013 -0.748 4.354) 4.855 3.169 ( 2.960 -2.792 -11.469) 12.169 3.416 ( -5.245 -0.717 0.563) 5.323 3.597 ( 4.784 -8.120 4.607) 10.490 3.826 ( -1.182 2.261 10.418) 10.725 4.016 ( 2.331 -2.174 7.215) 7.888 4.097 ( -3.673 -8.026 -0.935) 8.876 4.279 ( 6.101 0.514 -0.639) 6.155 4.471 ( -3.900 0.312 -1.236) 4.103 4.538 ( -3.618 4.381 2.814) 6.340 4.746 ( -4.718 -5.058 1.185) 7.018 4.845 ( 2.299 -9.639 -1.253) 9.988 4.981 ( 3.480 11.093 8.530) 14.419 5.040 ( -7.317 -16.273 5.330) 18.621 5.327 ( 11.116 5.828 -13.677) 18.563 5.509 ( -11.058 -0.791 11.565) 16.021 5.693 ( -5.913 1.898 4.749) 7.818 5.928 ( -0.661 8.132 7.888) 11.348 6.050 ( 1.787 4.481 -10.653) 11.694 6.277 ( 9.330 0.955 -10.742) 14.260 6.341 ( -5.872 3.476 2.502) 7.268 6.532 ( -0.137 0.109 -0.606) 0.631 6.751 ( 5.421 5.248 -5.533) 9.357 6.901 ( 4.086 -1.844 11.397) 12.247 7.073 ( 2.776 6.104 -0.132) 6.707 7.273 ( 1.123 -5.090 6.452) 8.295 7.534 ( -3.804 1.693 -5.326) 6.760 7.999 ( -9.717 -1.843 -4.210) 10.748 8.060 ( -1.134 1.306 8.585) 8.758 8.388 ( 6.298 1.098 5.280) 8.291 8.440 ( 2.398 -3.412 -13.055) 13.705 8.733 ( 0.646 0.046 -2.933) 3.004 8.975 ( 0.571 -0.664 -3.407) 3.518 9.508 ( -4.534 -3.650 9.190) 10.878 9.699 ( -3.147 -0.198 7.355) 8.002 9.877 ( 1.211 -4.122 -3.786) 5.726 10.156 ( 5.383 3.506 -13.832) 15.251 13.250 ( -1.453 1.713 -0.512) 2.304 13.330 ( -3.408 -3.177 -4.334) 6.363 13.573 ( 7.209 3.059 1.570) 7.987 13.893 ( -1.368 -0.654 -0.874) 1.750 14.076 ( -0.102 -2.716 1.784) 3.251 14.248 ( -1.595 1.568 -3.595) 4.235 14.800 ( -0.202 -2.784 2.066) 3.473 14.871 ( -1.128 -2.006 0.345) 2.327 15.806 ( -0.813 1.860 6.796) 7.092 15.971 ( 2.415 3.322 -6.091) 7.346 17.286 ( -3.921 -0.034 10.722) 11.417 17.495 ( 2.451 -0.255 -8.353) 8.709 17.819 ( -4.298 -6.092 11.805) 13.962 18.101 ( 1.596 -0.272 -8.963) 9.108 18.681 ( 0.917 1.613 0.710) 1.987 18.765 ( 0.016 -0.130 -1.828) 1.833 19.138 ( -1.479 0.378 6.830) 6.999 19.294 ( 2.790 0.829 -7.222) 7.786 20.810 ( -2.044 2.587 9.880) 10.415 21.091 ( -0.712 -4.550 -6.137) 7.673 21.264 ( -1.761 4.018 13.920) 14.595 21.552 ( 2.889 1.902 -10.570) 11.121 21.737 ( -2.513 1.726 8.781) 9.296 21.950 ( 2.989 0.761 -10.493) 10.937 23.395 ( -0.383 -1.761 3.141) 3.622 23.549 ( -3.371 -2.938 -2.368) 5.060 23.698 ( 4.774 -0.635 1.481) 5.039 23.931 ( -0.355 0.683 -4.528) 4.593 ======================= Grid point 212 (112/128) ======================= q-point: (-0.29 0.14 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.098 ( 9.126 -6.363 9.287) 14.492 2.279 ( -3.170 -4.415 4.393) 6.989 2.431 ( -0.215 2.084 -10.737) 10.940 2.479 ( -3.727 -8.073 -4.837) 10.122 2.564 ( -4.177 6.282 9.997) 12.524 2.643 ( -4.976 1.043 4.034) 6.491 2.921 ( 3.626 -1.464 -5.480) 6.732 3.090 ( 8.834 -2.421 3.780) 9.909 3.155 ( -2.859 -2.221 -13.583) 14.057 3.384 ( -6.083 -1.358 -1.925) 6.523 3.735 ( 4.783 4.272 5.071) 8.176 3.807 ( -0.118 -1.982 7.402) 7.663 4.004 ( -0.084 7.463 10.562) 12.933 4.168 ( -3.475 -2.819 3.900) 5.936 4.313 ( 5.491 4.919 -1.829) 7.595 4.398 ( -3.414 2.651 1.518) 4.581 4.455 ( -0.159 3.156 5.300) 6.171 4.668 ( -3.872 3.846 -1.570) 5.679 4.883 ( 7.649 10.843 15.129) 20.124 5.081 ( 0.334 -9.351 2.399) 9.660 5.203 ( 9.665 11.657 -10.738) 18.563 5.232 ( -10.127 -9.515 0.702) 13.914 5.415 ( -7.177 -1.428 6.703) 9.924 5.706 ( -4.125 -2.766 5.275) 7.245 5.845 ( -2.357 3.044 10.265) 10.963 6.027 ( -2.020 -6.952 -6.162) 9.507 6.180 ( -3.909 3.539 -1.024) 5.372 6.343 ( 5.862 -0.374 -20.285) 21.118 6.576 ( 3.541 -2.918 -2.164) 5.073 6.691 ( -1.008 0.825 -5.788) 5.933 7.024 ( -0.263 3.073 6.981) 7.632 7.039 ( 7.312 -1.621 8.956) 11.674 7.348 ( -7.210 1.053 2.141) 7.594 7.469 ( 3.455 -3.643 -5.101) 7.158 7.961 ( -4.953 -4.677 -3.025) 7.453 8.021 ( -2.970 1.309 -1.337) 3.510 8.416 ( 0.737 -0.187 2.475) 2.589 8.508 ( 7.223 1.166 -3.523) 8.120 8.725 ( 0.743 1.856 1.734) 2.647 8.930 ( -1.237 3.543 -5.748) 6.865 9.548 ( -0.974 -0.965 10.896) 10.982 9.703 ( -4.116 -2.323 10.442) 11.462 9.955 ( 2.269 -5.036 -8.772) 10.367 10.104 ( 4.388 4.322 -13.800) 15.112 13.242 ( 0.112 -1.244 2.131) 2.470 13.335 ( -2.044 -2.759 -3.559) 4.945 13.616 ( 7.366 1.786 2.425) 7.958 13.871 ( -3.985 -0.493 -4.958) 6.380 14.138 ( 2.825 -3.086 1.543) 4.459 14.236 ( -1.517 -2.950 -1.417) 3.607 14.824 ( 0.646 1.028 1.543) 1.963 14.852 ( -1.589 2.950 1.698) 3.756 15.791 ( -1.728 0.864 5.950) 6.256 15.929 ( 1.047 1.586 -6.513) 6.784 17.277 ( -3.697 0.209 11.185) 11.782 17.500 ( 2.605 -0.448 -9.901) 10.248 17.912 ( -3.465 -6.390 11.226) 13.374 18.124 ( 3.346 -2.161 -8.943) 9.790 18.672 ( 1.197 1.205 1.777) 2.458 18.756 ( -0.686 -0.022 -2.315) 2.414 19.125 ( -1.637 1.541 6.105) 6.506 19.267 ( 1.373 2.691 -7.003) 7.627 20.789 ( -0.310 2.697 13.420) 13.692 21.100 ( -1.303 -0.730 -8.756) 8.883 21.259 ( -3.997 -1.999 15.411) 16.046 21.555 ( 3.992 -1.925 -12.780) 13.527 21.736 ( -2.085 -1.343 9.002) 9.337 21.948 ( 2.343 -0.753 -9.976) 10.275 23.423 ( 0.646 -0.496 2.956) 3.066 23.536 ( -2.948 -0.657 -3.047) 4.290 23.752 ( 5.820 1.207 -0.551) 5.970 23.865 ( -2.927 4.049 -2.342) 5.517 ======================= Grid point 213 (113/128) ======================= q-point: (-0.14 0.14 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.181 ( -2.415 2.455 15.516) 15.893 2.326 ( -4.337 7.455 8.723) 12.267 2.431 ( 4.893 -3.296 -1.825) 6.175 2.452 ( 1.816 -3.088 -9.269) 9.937 2.644 ( 3.392 -7.257 -0.887) 8.059 2.658 ( -6.970 -13.355 -1.580) 15.147 2.980 ( 1.867 -2.933 0.216) 3.483 3.110 ( -4.571 -1.289 -10.174) 11.228 3.242 ( 7.337 -1.792 2.420) 7.931 3.319 ( -4.690 -1.745 -3.817) 6.293 3.698 ( 3.698 4.789 4.962) 7.825 3.812 ( -3.103 2.492 -4.322) 5.875 3.881 ( -4.971 9.397 15.773) 19.021 4.118 ( 0.923 7.203 -3.866) 8.227 4.230 ( -4.325 3.295 10.576) 11.892 4.368 ( -0.933 2.274 10.063) 10.359 4.460 ( 5.095 1.399 -0.043) 5.284 4.623 ( 1.728 4.753 2.069) 5.464 4.795 ( 3.022 7.524 -0.102) 8.109 4.948 ( 5.668 17.705 -8.563) 20.468 5.203 ( 3.352 -0.757 7.429) 8.185 5.288 ( -5.296 -4.374 -1.480) 7.026 5.496 ( -3.660 -10.764 8.114) 13.968 5.649 ( -2.374 3.655 -3.894) 5.845 5.819 ( -7.288 0.903 23.051) 24.192 6.117 ( -1.029 -3.178 1.362) 3.608 6.234 ( 4.323 -11.522 -5.691) 13.558 6.330 ( 3.854 0.174 -21.823) 22.162 6.618 ( -3.008 -1.512 -2.673) 4.299 6.681 ( -0.691 -2.504 -7.642) 8.072 7.004 ( -2.872 -2.064 5.932) 6.906 7.167 ( 8.190 -2.264 -7.931) 11.624 7.242 ( -8.254 -0.132 18.779) 20.514 7.570 ( 2.956 -3.610 -9.370) 10.468 7.995 ( -2.578 -5.310 -0.644) 5.937 8.011 ( 0.225 -3.807 -3.520) 5.190 8.395 ( -1.567 5.178 5.054) 7.404 8.505 ( 4.536 5.630 -5.002) 8.791 8.696 ( 0.521 3.984 6.006) 7.226 8.841 ( 0.492 3.555 -8.144) 8.899 9.573 ( -0.843 1.862 15.397) 15.532 9.749 ( -3.713 -5.065 8.102) 10.252 9.981 ( -1.014 0.371 -11.964) 12.013 10.070 ( 6.504 0.305 -12.900) 14.450 13.297 ( 1.968 -3.014 2.529) 4.399 13.353 ( -0.180 -2.289 -2.965) 3.750 13.689 ( 6.412 -0.346 3.010) 7.092 13.794 ( -6.475 0.122 -7.247) 9.718 14.241 ( 3.278 -4.522 1.886) 5.895 14.275 ( -1.797 -4.505 -1.443) 5.060 14.763 ( -1.725 6.185 2.819) 7.012 14.791 ( 1.291 5.167 0.034) 5.326 15.778 ( -2.517 0.243 6.690) 7.152 15.917 ( 1.909 -0.732 -6.973) 7.266 17.272 ( -3.114 0.183 11.854) 12.257 17.503 ( 2.576 -0.366 -10.731) 11.042 17.992 ( -6.425 -5.038 10.051) 12.950 18.168 ( 3.660 -2.217 -7.488) 8.624 18.684 ( 2.170 0.406 2.170) 3.096 18.736 ( -1.312 0.204 -2.806) 3.104 19.098 ( -1.500 1.935 5.286) 5.825 19.213 ( 1.586 3.082 -5.937) 6.875 20.805 ( 1.829 1.699 13.861) 14.084 21.045 ( -1.687 1.659 -9.563) 9.852 21.336 ( -4.663 -7.834 13.828) 16.563 21.600 ( 3.634 -2.965 -12.230) 13.099 21.781 ( -1.749 -3.183 8.569) 9.307 21.959 ( 1.689 -1.360 -8.595) 8.864 23.438 ( 0.729 0.807 2.261) 2.509 23.489 ( -1.992 2.014 -2.856) 4.023 23.741 ( -4.477 5.455 0.768) 7.099 23.784 ( 6.118 2.260 -2.943) 7.155 ======================= Grid point 216 (114/128) ======================= q-point: ( 0.29 0.29 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.210 ( -2.942 0.000 -4.943) 5.752 2.336 ( 1.349 -0.000 -12.013) 12.089 2.454 ( -13.865 0.000 11.652) 18.111 2.456 ( -9.641 0.000 2.708) 10.014 2.692 ( 4.714 -0.000 -3.241) 5.720 2.692 ( 17.882 -0.000 11.579) 21.304 2.953 ( 2.170 -0.000 -0.760) 2.300 3.084 ( 0.515 -0.000 7.330) 7.349 3.196 ( -2.145 0.000 1.714) 2.745 3.423 ( -0.323 0.000 -1.062) 1.110 3.536 ( -3.488 0.000 1.928) 3.985 3.544 ( -8.197 0.000 7.183) 10.899 3.777 ( -4.466 0.000 -2.066) 4.921 3.967 ( -10.866 0.000 -5.161) 12.029 4.132 ( -0.275 0.000 -3.998) 4.007 4.232 ( 9.832 -0.000 -7.089) 12.121 4.466 ( -6.807 0.000 4.883) 8.377 4.604 ( 5.677 -0.000 13.333) 14.491 4.617 ( 4.126 -0.000 -9.951) 10.772 4.942 ( -8.842 0.000 -6.986) 11.269 5.124 ( -8.799 0.000 11.004) 14.090 5.224 ( 16.093 -0.000 -21.397) 26.773 5.782 ( -10.497 0.000 7.289) 12.779 5.854 ( 5.221 -0.000 0.892) 5.297 5.944 ( -1.851 0.000 26.185) 26.251 6.235 ( -4.207 0.000 -16.440) 16.970 6.389 ( 21.640 -0.000 10.368) 23.996 6.414 ( 11.065 -0.000 -15.188) 18.791 6.417 ( -0.244 0.000 17.338) 17.340 6.983 ( 0.617 -0.000 4.335) 4.379 6.985 ( -6.807 0.000 11.297) 13.189 7.175 ( 1.929 -0.000 -14.185) 14.315 7.453 ( 0.008 -0.000 -1.539) 1.539 7.593 ( 0.596 -0.000 3.411) 3.463 7.966 ( -8.149 0.000 1.245) 8.244 8.036 ( -3.256 0.000 13.136) 13.534 8.289 ( -0.151 0.000 -6.949) 6.951 8.394 ( 5.972 -0.000 -1.793) 6.236 8.722 ( 2.249 -0.000 -12.016) 12.224 8.802 ( 3.482 -0.000 0.832) 3.580 9.447 ( -10.624 0.000 14.651) 18.098 9.592 ( -2.011 0.000 -18.020) 18.132 9.910 ( -3.290 0.000 15.296) 15.646 10.211 ( 7.140 -0.000 -16.049) 17.566 13.298 ( -4.496 0.000 -5.544) 7.138 13.403 ( 0.082 -0.000 -8.365) 8.366 13.621 ( 1.191 -0.000 2.351) 2.636 13.772 ( -1.117 0.000 3.561) 3.732 14.180 ( -3.123 0.000 -1.041) 3.292 14.407 ( -2.438 0.000 -2.712) 3.647 14.637 ( 0.750 -0.000 0.010) 0.750 14.649 ( 0.032 -0.000 0.449) 0.450 15.870 ( 0.867 -0.000 10.428) 10.464 16.064 ( 5.711 -0.000 -6.514) 8.663 17.286 ( -3.744 0.000 11.108) 11.722 17.497 ( 2.921 -0.000 -10.494) 10.893 17.678 ( -8.940 0.000 15.118) 17.564 18.174 ( -4.952 0.000 -8.422) 9.769 18.720 ( 2.769 -0.000 -2.115) 3.484 18.768 ( 0.350 -0.000 0.249) 0.430 19.097 ( -0.310 0.000 7.826) 7.832 19.276 ( 4.912 -0.000 -6.640) 8.259 20.879 ( 3.471 -0.000 -10.470) 11.030 20.919 ( -5.632 0.000 11.346) 12.667 21.463 ( -0.131 0.000 3.236) 3.238 21.687 ( 0.345 -0.000 -1.058) 1.113 21.887 ( -2.465 0.000 9.944) 10.245 21.996 ( 4.163 -0.000 -7.781) 8.825 23.295 ( -0.854 0.000 0.344) 0.921 23.454 ( -4.281 0.000 1.717) 4.613 23.584 ( 2.723 -0.000 4.256) 5.053 23.884 ( 3.266 -0.000 -8.418) 9.029 ======================= Grid point 217 (115/128) ======================= q-point: ( 0.43 0.29 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.051 ( -5.357 9.142 0.019) 10.596 2.259 ( -2.409 4.934 -3.414) 6.466 2.355 ( -3.339 0.235 -0.023) 3.347 2.475 ( -8.949 -8.708 1.265) 12.550 2.741 ( 0.057 -0.186 5.664) 5.668 2.898 ( 7.538 -3.424 -1.670) 8.446 2.986 ( 6.820 2.623 -1.755) 7.514 3.126 ( 1.839 3.903 8.844) 9.841 3.140 ( 5.778 5.507 2.012) 8.231 3.382 ( -1.408 1.743 -2.092) 3.065 3.450 ( -2.608 -2.252 3.195) 4.700 3.609 ( -9.640 -10.195 8.885) 16.607 3.796 ( -1.916 -7.135 4.254) 8.525 3.902 ( -1.886 -3.625 -7.313) 8.377 4.156 ( -0.174 -5.211 -4.698) 7.018 4.359 ( 4.111 -5.491 -6.724) 9.605 4.441 ( -8.888 -6.924 3.783) 11.885 4.556 ( -1.960 0.875 -9.978) 10.206 4.741 ( -2.461 -4.200 12.166) 13.104 4.848 ( 3.996 3.993 -1.897) 5.959 5.097 ( -1.975 -0.482 5.883) 6.225 5.335 ( 12.000 -1.507 -14.356) 18.771 5.663 ( -12.198 2.619 7.629) 14.623 5.813 ( -1.842 5.772 -2.764) 6.659 6.020 ( -0.132 -0.494 19.858) 19.864 6.168 ( 0.361 0.883 -10.911) 10.953 6.410 ( 6.285 4.449 3.066) 8.288 6.478 ( 2.468 1.832 2.740) 4.118 6.642 ( 15.094 3.194 8.611) 17.668 6.919 ( -0.698 4.025 3.048) 5.097 6.942 ( 0.879 4.631 0.180) 4.718 7.156 ( -0.111 -0.246 -4.015) 4.024 7.374 ( 2.395 8.759 -1.212) 9.161 7.575 ( -3.308 1.161 0.903) 3.621 7.924 ( -8.000 -3.213 2.070) 8.866 8.060 ( -2.105 -1.210 15.053) 15.248 8.289 ( -2.996 -4.895 -11.104) 12.500 8.443 ( 7.461 2.076 -1.140) 7.828 8.718 ( 2.751 -0.249 -9.682) 10.068 8.867 ( 1.874 -4.137 -1.962) 4.947 9.394 ( -9.706 -2.324 12.444) 15.952 9.565 ( -0.024 -4.406 -15.426) 16.043 9.903 ( -3.558 1.968 15.733) 16.250 10.227 ( 6.500 1.052 -16.004) 17.306 13.245 ( -4.848 -1.314 -2.629) 5.670 13.345 ( -0.872 2.819 -8.087) 8.609 13.640 ( 4.758 1.224 1.606) 5.169 13.810 ( -2.056 -4.291 2.685) 5.463 14.115 ( -0.881 4.308 0.493) 4.425 14.337 ( -3.284 3.030 -3.936) 5.955 14.670 ( -0.064 -3.634 1.356) 3.879 14.708 ( -0.221 -5.980 -0.766) 6.033 15.891 ( 0.336 2.232 10.115) 10.364 16.081 ( 4.573 2.446 -6.611) 8.402 17.280 ( -3.853 -0.226 10.634) 11.313 17.493 ( 2.400 0.106 -9.485) 9.785 17.670 ( -5.468 -2.859 15.124) 16.334 18.096 ( -3.649 -0.097 -9.945) 10.594 18.733 ( 2.085 1.153 -1.187) 2.662 18.766 ( -0.146 0.241 -0.574) 0.640 19.126 ( -0.531 -0.775 8.301) 8.354 19.304 ( 4.284 0.039 -7.258) 8.428 20.859 ( -2.203 1.331 4.169) 4.900 20.939 ( -0.462 -3.991 -2.574) 4.772 21.444 ( 0.946 4.643 6.404) 7.966 21.661 ( 0.487 2.580 -4.091) 4.861 21.848 ( -3.163 4.363 9.879) 11.253 22.006 ( 4.152 1.657 -8.809) 9.879 23.314 ( -0.165 -2.360 1.826) 2.988 23.440 ( -3.469 -3.009 -0.012) 4.592 23.641 ( 2.681 -1.885 4.535) 5.595 23.898 ( 1.597 -1.445 -8.217) 8.495 ======================= Grid point 218 (116/128) ======================= q-point: (-0.43 -0.71 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( 0.524 0.936 4.602) 4.725 2.174 ( -3.458 -0.016 -1.618) 3.818 2.350 ( 1.392 0.291 -4.374) 4.599 2.432 ( -15.647 -2.889 1.881) 16.023 2.730 ( -1.652 3.053 8.853) 9.509 2.888 ( 2.055 -0.650 -9.474) 9.716 2.981 ( 1.197 13.950 4.300) 14.646 3.109 ( 11.247 3.708 5.022) 12.863 3.145 ( 3.250 0.573 -6.681) 7.452 3.359 ( -6.486 1.776 0.989) 6.797 3.549 ( 6.744 -9.770 6.158) 13.373 3.792 ( -3.366 -13.436 14.323) 19.925 3.869 ( -6.329 -5.824 -2.893) 9.075 3.991 ( 4.677 -6.495 0.944) 8.059 4.277 ( 2.319 -9.187 -1.007) 9.529 4.385 ( -5.115 -3.061 -0.670) 5.999 4.516 ( -4.424 -5.750 -6.115) 9.488 4.556 ( -3.739 -11.427 -6.136) 13.498 4.754 ( -1.490 0.317 10.209) 10.322 4.869 ( 1.747 -0.074 -0.072) 1.750 5.153 ( 8.427 0.446 4.982) 9.799 5.395 ( -0.923 0.150 -1.541) 1.803 5.499 ( -9.162 4.277 4.539) 11.084 5.698 ( 1.188 4.780 -8.549) 9.866 6.028 ( -2.763 4.051 11.608) 12.601 6.104 ( -0.542 5.810 -2.378) 6.302 6.406 ( 1.148 9.340 -1.324) 9.503 6.437 ( 6.763 2.965 -0.477) 7.399 6.607 ( 2.478 8.591 2.441) 9.269 6.807 ( -2.883 4.832 -7.924) 9.718 6.997 ( 3.969 0.786 16.786) 17.267 7.174 ( 1.335 0.234 -0.821) 1.584 7.308 ( 8.541 3.966 1.200) 9.493 7.505 ( -4.093 2.070 -5.162) 6.905 7.881 ( -6.375 -0.915 2.692) 6.980 8.084 ( -2.917 1.038 6.582) 7.274 8.298 ( -3.310 -5.738 -6.910) 9.572 8.503 ( 7.083 -0.280 -2.748) 7.603 8.734 ( 3.135 -0.551 -3.399) 4.657 8.928 ( -0.385 -3.467 -5.764) 6.737 9.404 ( -6.647 -5.551 11.600) 14.477 9.615 ( 0.587 -5.455 -10.219) 11.599 9.887 ( -1.740 1.282 12.976) 13.155 10.215 ( 5.237 2.495 -15.653) 16.693 13.217 ( -4.172 -1.489 0.425) 4.450 13.284 ( 0.138 1.083 -6.208) 6.303 13.692 ( 7.108 1.242 1.199) 7.314 13.841 ( -3.818 -2.523 -0.119) 4.578 14.072 ( 1.544 1.387 2.554) 3.291 14.240 ( -3.416 2.584 -4.723) 6.376 14.743 ( -0.171 -4.785 2.233) 5.283 14.794 ( -0.929 -5.605 -0.839) 5.743 15.871 ( -0.523 3.626 8.921) 9.643 16.045 ( 2.800 4.480 -6.806) 8.616 17.276 ( -3.552 -0.207 10.659) 11.237 17.490 ( 2.293 -0.172 -9.422) 9.698 17.731 ( -3.375 -4.721 14.876) 15.968 18.056 ( -0.423 -1.864 -10.741) 10.910 18.721 ( 0.667 1.764 0.631) 1.989 18.759 ( 0.131 0.193 -1.883) 1.897 19.150 ( -1.012 -0.120 7.746) 7.813 19.317 ( 3.297 0.651 -7.749) 8.447 20.837 ( -3.491 0.138 9.699) 10.309 20.990 ( 0.126 -3.890 -5.453) 6.700 21.385 ( 0.428 6.570 9.292) 11.388 21.601 ( 1.908 3.917 -8.159) 9.249 21.773 ( -3.625 3.706 10.110) 11.361 21.981 ( 3.653 2.697 -10.600) 11.532 23.363 ( -0.300 -2.842 3.828) 4.778 23.464 ( -1.675 -3.651 -2.264) 4.611 23.722 ( 3.308 -2.675 3.424) 5.461 23.903 ( -0.666 -1.053 -6.854) 6.966 ======================= Grid point 219 (117/128) ======================= q-point: (-0.29 0.29 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.071 ( 7.216 -9.469 5.804) 13.245 2.179 ( -5.975 -7.200 -2.709) 9.741 2.242 ( -14.735 0.230 6.954) 16.295 2.409 ( 3.426 -0.621 -6.964) 7.786 2.674 ( -1.040 5.512 8.441) 10.135 2.798 ( 1.737 12.027 5.991) 13.548 2.920 ( 3.303 -1.377 -5.207) 6.318 3.073 ( -3.090 2.627 -12.584) 13.221 3.195 ( 10.401 0.469 4.588) 11.378 3.300 ( -4.902 0.001 -4.629) 6.742 3.747 ( -0.012 -5.351 10.418) 11.712 3.841 ( -0.397 -0.203 4.321) 4.344 4.018 ( -3.928 -10.866 6.032) 13.034 4.106 ( 1.888 -0.866 5.021) 5.434 4.333 ( -7.737 -2.172 -2.069) 8.297 4.433 ( 7.042 -1.430 -4.606) 8.535 4.553 ( 5.321 1.733 1.259) 5.736 4.623 ( -4.941 -3.467 0.526) 6.059 4.830 ( -10.663 -15.799 7.695) 20.556 4.964 ( 7.437 -7.605 -2.924) 11.031 5.149 ( -4.823 10.221 14.134) 18.097 5.381 ( 4.574 -1.126 -1.429) 4.923 5.417 ( -2.210 -0.396 -2.158) 3.114 5.641 ( 4.436 3.540 -7.744) 9.601 5.921 ( -5.337 6.800 10.492) 13.594 5.991 ( -1.697 5.554 2.616) 6.369 6.227 ( -2.881 8.300 -3.446) 9.437 6.403 ( 3.938 6.327 -11.285) 13.524 6.600 ( 5.440 -0.104 2.389) 5.942 6.694 ( -0.866 3.709 -9.235) 9.990 7.063 ( -2.781 -0.716 16.584) 16.831 7.123 ( -2.577 3.353 6.435) 7.700 7.352 ( 0.848 5.189 -4.270) 6.773 7.456 ( 5.680 -2.457 -3.818) 7.272 7.869 ( -1.437 -1.960 2.182) 3.266 8.003 ( -3.874 2.207 -6.081) 7.541 8.377 ( 0.459 -5.296 4.403) 6.903 8.552 ( 2.678 -0.828 -7.454) 7.964 8.778 ( 3.648 0.347 4.212) 5.583 8.920 ( -1.757 -0.034 -8.810) 8.984 9.488 ( -3.231 -7.141 11.452) 13.877 9.651 ( -2.268 -1.971 0.075) 3.006 9.920 ( 2.003 -1.869 3.191) 4.205 10.165 ( 3.644 3.831 -15.657) 16.525 13.215 ( -1.574 -2.143 1.928) 3.285 13.278 ( 0.722 -1.425 -4.251) 4.541 13.742 ( 7.027 2.729 2.326) 7.889 13.805 ( -5.441 0.009 -3.792) 6.632 14.115 ( 1.919 -2.542 2.667) 4.154 14.181 ( -1.734 -1.009 -3.842) 4.335 14.816 ( 0.231 -3.226 2.576) 4.135 14.843 ( -1.304 -2.119 0.088) 2.489 15.831 ( -1.197 3.270 7.241) 8.035 15.973 ( 1.523 4.472 -6.859) 8.328 17.275 ( -3.052 -0.023 11.069) 11.482 17.490 ( 2.468 -0.387 -10.017) 10.324 17.823 ( -2.722 -5.166 14.405) 15.543 18.074 ( 1.503 -3.398 -10.468) 11.108 18.706 ( 0.301 1.067 1.527) 1.887 18.747 ( -0.042 0.540 -2.414) 2.474 19.152 ( -1.336 1.077 6.807) 7.020 19.302 ( 2.237 2.046 -7.819) 8.386 20.839 ( -2.761 -0.322 12.282) 12.593 21.019 ( -1.354 -2.630 -4.021) 4.992 21.314 ( -0.924 5.702 9.774) 11.353 21.555 ( 3.649 1.392 -11.544) 12.187 21.730 ( -3.486 0.798 9.944) 10.567 21.950 ( 3.220 1.423 -10.926) 11.479 23.411 ( -0.900 -2.237 4.574) 5.171 23.493 ( 0.293 -1.919 -3.231) 3.770 23.805 ( 4.338 -1.585 1.161) 4.762 23.865 ( -2.987 1.394 -4.889) 5.896 ======================= Grid point 220 (118/128) ======================= q-point: (-0.14 0.29 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.138 ( -13.489 -5.302 5.722) 15.582 2.246 ( -3.908 -6.046 3.442) 7.980 2.327 ( 2.144 -7.558 1.842) 8.069 2.438 ( 3.650 -3.926 -2.108) 5.760 2.611 ( 3.910 5.057 7.173) 9.608 2.714 ( 7.380 6.357 0.627) 9.760 2.959 ( 0.792 -1.856 0.376) 2.053 2.992 ( -4.281 -2.147 -10.095) 11.173 3.201 ( -7.917 0.738 -6.874) 10.511 3.334 ( 9.902 -2.105 2.076) 10.334 3.778 ( -4.890 3.113 1.713) 6.044 3.813 ( -1.857 1.739 5.848) 6.378 4.025 ( -4.754 7.380 10.019) 13.321 4.133 ( -1.506 -2.332 5.130) 5.833 4.278 ( -3.041 0.860 -1.101) 3.346 4.448 ( 4.218 5.106 -0.138) 6.624 4.547 ( 4.225 3.321 -0.031) 5.374 4.700 ( 8.590 -2.009 -2.523) 9.175 4.896 ( -10.822 11.970 8.025) 18.022 5.018 ( -9.899 -14.126 3.695) 17.641 5.112 ( -1.508 -7.651 2.119) 8.081 5.339 ( 6.094 11.101 -8.997) 15.534 5.480 ( 7.759 2.437 11.562) 14.136 5.668 ( 4.399 -2.200 -6.825) 8.412 5.842 ( -5.717 1.306 20.436) 21.261 5.977 ( 0.562 -7.665 -0.381) 7.695 6.135 ( -0.436 -1.307 -8.598) 8.707 6.314 ( 0.275 2.664 -11.098) 11.417 6.604 ( -0.857 4.010 -3.898) 5.658 6.663 ( 2.909 -0.856 -3.908) 4.947 6.974 ( -6.855 2.814 4.359) 8.597 7.169 ( -2.849 -4.800 12.101) 13.326 7.272 ( 1.854 5.009 1.495) 5.547 7.526 ( 2.108 -1.424 -8.076) 8.467 7.909 ( 1.197 -3.666 -1.072) 4.003 7.979 ( 2.765 -1.746 -0.870) 3.384 8.430 ( -2.985 0.584 3.800) 4.867 8.554 ( 1.779 0.007 -7.066) 7.287 8.784 ( -0.369 2.940 2.029) 3.591 8.874 ( 2.405 2.338 -5.827) 6.723 9.606 ( -0.652 -3.492 13.246) 13.714 9.642 ( -5.380 -3.156 5.608) 8.388 9.964 ( 1.419 0.549 -5.269) 5.484 10.101 ( 4.134 1.697 -15.189) 15.832 13.262 ( 0.260 -3.794 1.248) 4.002 13.313 ( 2.418 -2.379 -2.548) 4.243 13.706 ( -7.490 1.286 -6.253) 9.841 13.783 ( 5.867 1.827 3.427) 7.036 14.157 ( -3.207 -3.171 -0.199) 4.515 14.233 ( 3.382 -4.200 -1.107) 5.504 14.821 ( -1.774 2.538 1.819) 3.592 14.855 ( 1.034 0.919 1.347) 1.931 15.793 ( -1.711 1.983 6.095) 6.634 15.923 ( 2.297 1.269 -6.351) 6.872 17.279 ( -2.584 0.091 11.565) 11.851 17.493 ( 2.531 -0.375 -9.920) 10.245 17.896 ( -5.064 -3.112 12.382) 13.735 18.121 ( 1.870 -4.162 -8.077) 9.276 18.700 ( -0.854 0.217 0.122) 0.889 18.735 ( 1.294 0.545 -1.363) 1.956 19.133 ( -1.362 1.911 5.968) 6.413 19.262 ( 2.242 2.849 -7.058) 7.934 20.859 ( -2.216 -0.697 11.852) 12.078 21.025 ( 0.638 -0.300 -5.387) 5.433 21.267 ( -3.808 0.534 12.924) 13.484 21.564 ( 4.222 -1.663 -13.942) 14.661 21.738 ( -3.060 -2.349 9.986) 10.705 21.942 ( 2.894 -0.234 -9.960) 10.374 23.429 ( -2.371 -0.605 2.908) 3.801 23.513 ( 2.669 0.278 -1.360) 3.009 23.768 ( -4.645 4.199 -2.366) 6.694 23.862 ( 4.925 0.615 -1.661) 5.234 ======================= Grid point 224 (119/128) ======================= q-point: (-0.57 -0.57 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.112 ( -4.828 0.000 1.645) 5.100 2.252 ( -8.807 0.000 7.433) 11.525 2.302 ( -3.378 0.000 -1.248) 3.601 2.354 ( 1.127 -0.000 0.252) 1.155 2.711 ( 0.615 -0.000 -4.027) 4.074 2.862 ( -6.934 0.000 -3.738) 7.877 3.117 ( 10.441 -0.000 -0.482) 10.452 3.224 ( 4.567 -0.000 2.739) 5.326 3.257 ( 6.646 -0.000 0.944) 6.713 3.357 ( -9.093 0.000 4.914) 10.336 3.423 ( 0.041 -0.000 15.732) 15.732 3.509 ( -0.686 0.000 1.750) 1.880 3.687 ( -1.780 0.000 5.551) 5.829 3.880 ( 6.653 -0.000 -6.284) 9.152 4.084 ( -1.267 0.000 -8.187) 8.284 4.322 ( -10.259 0.000 8.393) 13.255 4.325 ( -2.220 0.000 -4.395) 4.924 4.422 ( -5.724 0.000 -20.151) 20.948 4.756 ( -1.424 0.000 14.982) 15.049 4.921 ( 6.176 -0.000 -4.487) 7.634 5.138 ( 5.791 -0.000 9.436) 11.072 5.394 ( 6.311 -0.000 -10.102) 11.911 5.560 ( -13.248 0.000 6.602) 14.801 5.791 ( -2.620 0.000 -16.545) 16.751 6.075 ( -0.577 0.000 19.470) 19.479 6.211 ( 7.067 -0.000 -3.636) 7.948 6.446 ( -5.291 0.000 18.504) 19.245 6.601 ( 12.368 -0.000 -8.794) 15.176 6.801 ( -5.306 0.000 14.458) 15.401 6.972 ( 11.490 -0.000 2.280) 11.714 6.997 ( 3.725 -0.000 -11.249) 11.850 7.132 ( -3.629 0.000 -0.633) 3.684 7.469 ( 3.967 -0.000 -3.877) 5.547 7.539 ( -5.204 0.000 0.749) 5.258 7.858 ( -2.571 0.000 6.071) 6.593 8.074 ( -2.145 0.000 18.494) 18.618 8.167 ( -5.782 0.000 -10.152) 11.683 8.519 ( 6.237 -0.000 -7.696) 9.906 8.733 ( 5.263 -0.000 -9.053) 10.471 8.830 ( -0.971 0.000 -1.542) 1.822 9.303 ( -9.861 0.000 12.216) 15.699 9.498 ( 3.306 -0.000 -15.459) 15.808 9.922 ( -4.675 0.000 16.644) 17.288 10.253 ( 6.004 -0.000 -16.495) 17.554 13.187 ( -3.704 0.000 0.632) 3.758 13.327 ( -1.436 0.000 -9.369) 9.478 13.698 ( 4.585 -0.000 0.911) 4.675 13.761 ( -1.817 0.000 2.121) 2.793 14.157 ( 0.992 -0.000 1.574) 1.861 14.311 ( -4.258 0.000 -4.053) 5.878 14.645 ( -0.858 0.000 1.103) 1.397 14.653 ( 0.836 -0.000 -0.544) 0.998 15.941 ( -0.496 0.000 10.358) 10.369 16.125 ( 3.598 -0.000 -6.987) 7.860 17.271 ( -3.339 0.000 10.567) 11.082 17.489 ( 2.165 -0.000 -10.136) 10.365 17.651 ( -2.882 0.000 16.449) 16.700 18.025 ( -2.480 0.000 -11.399) 11.666 18.758 ( 1.782 -0.000 -1.815) 2.544 18.762 ( -0.951 0.000 0.128) 0.959 19.140 ( -0.659 0.000 8.711) 8.736 19.324 ( 3.715 -0.000 -8.082) 8.895 20.831 ( -8.281 0.000 10.617) 13.464 20.923 ( 5.809 -0.000 -8.686) 10.449 21.515 ( 2.195 -0.000 4.741) 5.224 21.664 ( -1.331 0.000 -2.831) 3.128 21.882 ( -3.735 0.000 10.259) 10.917 22.045 ( 4.929 -0.000 -8.847) 10.127 23.307 ( 1.553 -0.000 1.043) 1.871 23.378 ( -3.200 0.000 0.160) 3.204 23.662 ( 1.588 -0.000 5.665) 5.884 23.872 ( 0.539 -0.000 -8.936) 8.952 ======================= Grid point 225 (120/128) ======================= q-point: (-0.43 -0.57 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.001 ( -2.226 4.893 9.122) 10.588 2.164 ( -7.969 4.376 -6.921) 11.426 2.253 ( -8.732 -1.014 12.868) 15.585 2.399 ( 6.660 0.064 -1.691) 6.872 2.719 ( -3.793 -0.772 2.768) 4.759 2.838 ( 1.870 -5.781 -8.505) 10.452 3.143 ( -1.295 5.823 2.605) 6.509 3.227 ( 4.973 5.463 -2.169) 7.700 3.293 ( -3.061 -0.277 3.248) 4.472 3.381 ( 4.815 5.799 -2.401) 7.911 3.469 ( 5.926 -8.705 8.278) 13.395 3.532 ( -2.035 -9.206 7.322) 11.937 3.765 ( -4.963 -3.087 5.120) 7.770 3.999 ( 11.143 -2.763 0.605) 11.497 4.085 ( -7.019 -9.029 -3.230) 11.884 4.234 ( -9.376 -4.883 0.041) 10.571 4.325 ( -4.731 -9.023 -2.693) 10.538 4.427 ( 4.665 -3.445 -12.173) 13.484 4.765 ( -4.587 0.278 14.028) 14.762 4.950 ( 6.788 2.464 -6.304) 9.586 5.250 ( 6.004 -0.708 7.067) 9.300 5.362 ( -6.911 1.050 -3.568) 7.848 5.437 ( -9.182 1.401 7.681) 12.053 5.761 ( 9.513 0.925 -18.970) 21.242 6.091 ( -2.759 2.685 13.173) 13.724 6.220 ( 2.972 6.553 1.549) 7.360 6.435 ( -5.392 0.780 9.211) 10.702 6.639 ( 7.299 7.085 -3.354) 10.711 6.703 ( -7.879 3.172 8.102) 11.738 6.903 ( 5.514 9.589 -11.108) 15.677 7.056 ( -5.324 1.345 8.801) 10.373 7.161 ( 4.023 -3.291 -0.838) 5.265 7.460 ( 3.124 3.366 -2.242) 5.110 7.499 ( 3.653 2.535 -5.931) 7.413 7.869 ( -0.075 0.761 10.163) 10.192 8.060 ( -6.323 0.725 -3.584) 7.304 8.169 ( -1.313 -6.151 10.004) 11.817 8.537 ( 4.499 0.401 -13.633) 14.362 8.762 ( 3.153 0.054 -0.640) 3.218 8.839 ( -1.350 -3.697 -6.466) 7.570 9.283 ( -7.148 -4.579 12.104) 14.784 9.537 ( 5.726 -3.591 -12.850) 14.519 9.915 ( -4.396 0.613 16.021) 16.624 10.251 ( 4.908 1.459 -16.478) 17.255 13.168 ( -2.374 -0.751 3.332) 4.159 13.280 ( -0.443 0.795 -7.233) 7.290 13.756 ( -0.015 -1.331 0.425) 1.397 13.767 ( 2.819 -1.674 -0.678) 3.348 14.151 ( 2.922 3.516 3.248) 5.608 14.228 ( -4.150 2.706 -4.260) 6.534 14.673 ( -0.711 -4.100 1.797) 4.533 14.700 ( 0.089 -4.738 -0.785) 4.804 15.939 ( -1.642 2.510 9.569) 10.028 16.110 ( 2.015 2.956 -7.346) 8.171 17.272 ( -2.804 -0.109 10.717) 11.079 17.482 ( 2.233 -0.139 -9.909) 10.158 17.703 ( -0.423 -2.193 16.097) 16.251 17.989 ( 0.125 -1.659 -12.022) 12.137 18.742 ( -1.207 0.897 0.536) 1.597 18.765 ( 1.063 0.431 -1.660) 2.018 19.158 ( -1.285 -0.290 8.047) 8.154 19.332 ( 2.854 0.201 -8.816) 9.268 20.787 ( -7.994 -1.649 10.813) 13.548 20.970 ( 5.424 -0.864 -7.035) 8.925 21.511 ( 1.116 5.075 6.327) 8.187 21.631 ( -0.256 1.113 -5.614) 5.729 21.833 ( -3.918 4.330 10.347) 11.881 22.041 ( 4.275 3.169 -9.901) 11.240 23.338 ( 0.378 -1.389 2.836) 3.181 23.388 ( -0.106 -3.872 -1.898) 4.314 23.715 ( 1.332 -2.684 5.371) 6.151 23.853 ( -1.062 -1.013 -8.206) 8.336 ======================= Grid point 226 (121/128) ======================= q-point: (-0.29 -0.57 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.982 ( -11.086 -0.658 1.129) 11.163 2.047 ( 2.677 -3.369 6.089) 7.456 2.215 ( -1.609 1.515 9.089) 9.353 2.459 ( 4.516 1.208 1.389) 4.877 2.714 ( -1.047 -0.509 6.628) 6.730 2.915 ( 3.050 -0.968 -5.644) 6.488 3.000 ( -0.268 8.744 0.547) 8.765 3.132 ( 0.584 10.164 -8.662) 13.367 3.222 ( -3.801 0.755 -0.125) 3.877 3.374 ( 7.864 4.598 -2.734) 9.511 3.615 ( -10.313 -7.342 0.780) 12.684 3.744 ( 4.049 -13.687 5.532) 15.308 3.859 ( 0.455 -10.205 13.870) 17.226 4.104 ( 0.076 -4.905 -8.585) 9.888 4.163 ( -5.277 -3.445 9.115) 11.081 4.291 ( -6.892 -14.656 3.579) 16.587 4.501 ( 4.176 -7.444 3.415) 9.193 4.512 ( 3.681 -8.628 -10.466) 14.055 4.737 ( -4.243 1.828 10.464) 11.439 4.992 ( 9.526 -0.854 -7.864) 12.382 5.205 ( -11.117 2.086 6.733) 13.163 5.241 ( -9.697 0.148 -1.913) 9.885 5.494 ( 11.550 -1.050 7.100) 13.599 5.795 ( 11.437 4.707 -14.960) 19.410 5.995 ( -6.600 7.347 6.909) 12.053 6.103 ( -3.747 8.201 11.721) 14.787 6.323 ( -3.160 7.654 -6.263) 10.382 6.504 ( -5.178 7.780 3.846) 10.106 6.678 ( 6.025 2.758 -5.397) 8.546 6.786 ( 5.670 8.669 -7.593) 12.844 7.033 ( -7.075 -3.164 12.158) 14.418 7.130 ( -7.109 4.681 3.133) 9.070 7.429 ( 0.618 2.721 -6.527) 7.098 7.515 ( 9.693 2.560 -4.975) 11.192 7.888 ( 0.867 1.641 9.422) 9.603 7.974 ( -2.244 0.620 -3.938) 4.574 8.309 ( 0.768 -6.746 9.730) 11.865 8.529 ( 2.294 -0.439 -14.340) 14.528 8.786 ( -3.105 -2.228 -0.753) 3.895 8.870 ( 2.540 -2.304 -5.515) 6.494 9.363 ( -3.859 -7.954 12.369) 15.203 9.614 ( 4.016 -2.165 -6.332) 7.804 9.924 ( -1.459 -1.192 10.344) 10.514 10.208 ( 3.300 3.308 -16.576) 17.222 13.177 ( -1.025 -1.403 4.019) 4.378 13.266 ( 1.595 -0.634 -4.230) 4.565 13.731 ( -5.194 -0.382 -2.609) 5.825 13.843 ( 6.252 0.187 -0.275) 6.260 14.139 ( -2.432 1.726 -3.061) 4.274 14.153 ( 3.172 1.282 2.775) 4.405 14.752 ( -0.537 -5.488 2.454) 6.036 14.776 ( -0.157 -4.901 -0.264) 4.910 15.893 ( -2.467 3.746 8.011) 9.181 16.040 ( 0.838 4.731 -7.399) 8.822 17.279 ( -2.509 -0.129 10.974) 11.258 17.482 ( 2.582 -0.292 -9.489) 9.838 17.795 ( 1.041 -2.770 14.948) 15.239 18.003 ( 1.725 -3.194 -11.574) 12.130 18.717 ( -1.401 0.771 0.794) 1.786 18.759 ( 0.784 0.887 -1.581) 1.975 19.165 ( -1.983 0.182 7.003) 7.281 19.323 ( 1.998 0.850 -9.051) 9.308 20.779 ( -7.361 -3.491 10.992) 13.682 21.011 ( 3.810 0.112 -2.833) 4.749 21.433 ( -1.037 6.920 6.654) 9.656 21.591 ( 2.429 2.463 -9.679) 10.278 21.756 ( -3.910 3.699 10.994) 12.241 21.993 ( 3.517 3.554 -10.683) 11.795 23.375 ( -1.032 -2.395 3.439) 4.316 23.459 ( 2.843 -3.526 -2.424) 5.137 23.800 ( 1.988 -3.995 3.175) 5.476 23.822 ( -2.873 -0.350 -6.460) 7.078 ======================= Grid point 227 (122/128) ======================= q-point: (-0.14 -0.57 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.910 ( -9.374 -4.490 4.445) 11.305 2.204 ( 1.559 -4.994 6.574) 8.402 2.261 ( 5.856 -4.013 3.681) 7.997 2.450 ( -1.065 2.310 4.610) 5.265 2.741 ( 3.161 1.851 5.087) 6.268 2.858 ( -2.762 5.917 5.330) 8.429 2.943 ( -2.106 3.321 -9.165) 9.973 2.967 ( 5.477 1.979 -7.655) 9.618 3.147 ( -2.579 3.527 -6.458) 7.797 3.415 ( 7.360 0.263 0.144) 7.366 3.656 ( -6.715 -8.768 1.207) 11.110 3.887 ( -1.879 5.985 1.461) 6.441 3.985 ( -4.161 -8.079 9.445) 13.107 4.132 ( -3.035 2.135 8.513) 9.287 4.173 ( -2.583 -8.099 -4.025) 9.406 4.534 ( 4.535 -7.835 2.581) 9.414 4.564 ( -2.956 -8.070 0.750) 8.627 4.675 ( -4.661 -2.231 8.087) 9.597 4.741 ( 5.358 -8.227 3.495) 10.421 4.999 ( -8.058 3.685 2.624) 9.242 5.061 ( -0.236 8.747 0.782) 8.785 5.325 ( 4.730 -14.503 -10.339) 18.429 5.662 ( 11.212 -1.340 4.256) 12.067 5.717 ( 1.123 10.599 2.811) 11.023 5.818 ( -8.378 4.143 6.022) 11.118 6.015 ( -0.817 2.579 4.200) 4.996 6.153 ( 1.661 8.623 -9.009) 12.581 6.369 ( 0.207 5.782 1.588) 6.000 6.659 ( 3.552 3.197 -13.000) 13.851 6.705 ( 0.722 5.708 0.108) 5.754 6.966 ( -8.272 3.842 2.501) 9.458 7.060 ( -6.660 -5.035 7.526) 11.240 7.355 ( -1.481 4.456 -0.882) 4.778 7.547 ( 5.308 1.700 -5.357) 7.731 7.909 ( 4.328 -0.379 1.128) 4.488 8.004 ( 4.165 -1.260 7.185) 8.400 8.377 ( -5.738 -1.558 -0.076) 5.947 8.545 ( 3.849 -1.913 -7.643) 8.768 8.755 ( -3.856 -1.231 -6.782) 7.898 8.923 ( 3.317 -0.616 0.292) 3.387 9.501 ( -2.429 -8.550 11.358) 14.422 9.636 ( -0.395 1.093 4.905) 5.040 9.975 ( 2.014 -1.296 -0.119) 2.398 10.125 ( 2.226 3.569 -16.822) 17.340 13.215 ( -0.019 -2.655 2.583) 3.704 13.307 ( 3.699 -2.146 -1.667) 4.590 13.641 ( -6.692 2.222 -5.105) 8.705 13.874 ( 3.854 2.208 1.013) 4.555 14.109 ( -1.138 -0.323 -0.894) 1.483 14.204 ( 2.997 -2.538 0.081) 3.928 14.814 ( -0.973 -2.024 1.029) 2.471 14.848 ( 0.485 -3.446 2.278) 4.160 15.831 ( -2.571 3.130 5.869) 7.131 15.960 ( 1.226 3.268 -6.413) 7.301 17.288 ( -2.436 -0.092 11.174) 11.437 17.486 ( 2.577 -0.252 -8.543) 8.926 17.875 ( -0.452 -0.532 12.377) 12.397 18.047 ( 2.030 -4.121 -9.278) 10.353 18.692 ( -1.535 0.536 -0.226) 1.641 18.753 ( 1.177 0.401 -0.930) 1.553 19.154 ( -2.304 0.821 6.208) 6.673 19.297 ( 1.873 1.553 -8.329) 8.677 20.800 ( -6.270 -4.091 10.112) 12.582 21.039 ( 2.933 0.105 1.839) 3.464 21.328 ( -2.614 6.277 6.618) 9.489 21.560 ( 3.760 1.068 -13.402) 13.960 21.716 ( -3.488 0.364 11.091) 11.632 21.955 ( 3.212 1.689 -10.341) 10.959 23.402 ( -1.421 -1.344 2.840) 3.449 23.533 ( 4.057 -1.854 -1.115) 4.597 23.756 ( -4.359 1.814 -4.337) 6.411 23.885 ( 2.682 -2.620 0.002) 3.749 ======================= Grid point 232 (123/128) ======================= q-point: (-0.43 -0.43 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.037 ( -6.733 0.000 14.312) 15.817 2.072 ( -11.296 0.000 4.549) 12.177 2.264 ( -0.200 0.000 8.731) 8.734 2.479 ( 9.331 -0.000 -3.682) 10.031 2.714 ( -0.822 0.000 -3.902) 3.988 2.767 ( 6.359 -0.000 1.905) 6.638 3.129 ( -10.587 0.000 1.517) 10.695 3.243 ( 1.613 -0.000 2.074) 2.627 3.307 ( -0.083 0.000 -3.523) 3.524 3.426 ( 8.938 -0.000 -2.496) 9.280 3.507 ( 0.151 -0.000 0.530) 0.551 3.530 ( 0.682 -0.000 8.820) 8.846 3.769 ( 2.504 -0.000 9.806) 10.121 3.860 ( -14.141 0.000 -5.125) 15.041 4.093 ( -0.180 0.000 -22.352) 22.353 4.141 ( 6.792 -0.000 8.109) 10.578 4.170 ( -2.473 0.000 10.808) 11.087 4.438 ( 5.362 -0.000 -5.540) 7.710 4.759 ( -5.375 0.000 15.286) 16.203 5.000 ( 3.553 -0.000 -10.279) 10.875 5.216 ( -13.508 0.000 4.170) 14.137 5.274 ( -6.482 0.000 -4.616) 7.958 5.493 ( 10.152 -0.000 11.560) 15.385 5.832 ( 12.772 -0.000 -17.473) 21.643 6.110 ( -4.639 0.000 8.225) 9.443 6.324 ( 4.435 -0.000 -5.354) 6.953 6.385 ( -11.240 0.000 12.042) 16.473 6.636 ( -11.513 0.000 19.479) 22.627 6.764 ( 6.975 -0.000 -9.878) 12.093 6.964 ( -10.724 0.000 -1.331) 10.806 7.030 ( 3.370 -0.000 -5.960) 6.847 7.184 ( 4.230 -0.000 -0.251) 4.237 7.475 ( 1.303 -0.000 -5.902) 6.044 7.608 ( 10.560 -0.000 -4.985) 11.678 7.926 ( 1.230 -0.000 14.401) 14.453 7.967 ( -5.740 0.000 -7.416) 9.378 8.166 ( 0.255 -0.000 17.674) 17.675 8.531 ( 3.266 -0.000 -19.443) 19.715 8.741 ( -5.574 0.000 -3.439) 6.550 8.810 ( 3.710 -0.000 -2.271) 4.350 9.212 ( -5.101 0.000 12.640) 13.630 9.556 ( 9.860 -0.000 -12.747) 16.116 9.913 ( -5.699 0.000 16.676) 17.623 10.262 ( 4.166 -0.000 -16.520) 17.037 13.163 ( -0.647 0.000 6.411) 6.444 13.259 ( -0.225 0.000 -5.961) 5.965 13.719 ( -2.105 0.000 -1.099) 2.374 13.806 ( 5.350 -0.000 -2.099) 5.747 14.201 ( -3.460 0.000 -2.861) 4.490 14.230 ( 3.798 -0.000 3.819) 5.386 14.630 ( -1.164 0.000 1.518) 1.913 14.663 ( 0.341 -0.000 -0.573) 0.667 15.963 ( -3.102 0.000 9.153) 9.664 16.125 ( 0.580 -0.000 -7.808) 7.829 17.276 ( -2.685 0.000 10.841) 11.168 17.477 ( 2.793 -0.000 -9.702) 10.096 17.749 ( 3.051 -0.000 15.740) 16.033 17.948 ( 2.015 -0.000 -12.660) 12.819 18.733 ( -1.929 0.000 0.538) 2.002 18.776 ( 0.902 -0.000 -1.195) 1.497 19.163 ( -1.994 0.000 7.583) 7.841 19.330 ( 1.862 -0.000 -9.836) 10.010 20.717 ( -8.400 0.000 11.382) 14.146 21.008 ( 6.389 -0.000 -6.865) 9.377 21.594 ( 2.396 -0.000 4.175) 4.814 21.602 ( -2.429 0.000 -3.701) 4.427 21.858 ( -3.937 0.000 9.259) 10.061 22.086 ( 4.022 -0.000 -9.670) 10.473 23.325 ( -1.569 0.000 -0.626) 1.689 23.371 ( 3.879 -0.000 0.762) 3.953 23.714 ( -0.168 0.000 6.495) 6.497 23.804 ( -1.857 0.000 -8.294) 8.500 ======================= Grid point 233 (124/128) ======================= q-point: (-0.29 -0.43 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.922 ( -8.844 4.040 9.849) 13.840 2.055 ( -1.356 -2.585 13.088) 13.410 2.305 ( 5.920 2.754 6.929) 9.521 2.500 ( 1.739 2.475 -0.844) 3.141 2.768 ( 5.993 -0.797 6.715) 9.036 2.887 ( 4.180 -4.679 -4.251) 7.579 3.028 ( -5.191 2.395 -4.520) 7.288 3.206 ( -2.753 -0.546 0.666) 2.884 3.303 ( -6.123 -2.510 -6.642) 9.376 3.338 ( -2.020 14.422 -3.909) 15.078 3.534 ( 1.826 -3.070 -4.325) 5.609 3.665 ( 7.445 -6.459 4.551) 10.856 3.756 ( 0.781 -6.055 15.242) 16.420 3.915 ( -3.027 -7.943 -1.439) 8.622 4.079 ( -4.503 -5.031 0.604) 6.779 4.177 ( 1.965 -5.374 -0.980) 5.805 4.338 ( 3.554 -6.884 5.591) 9.554 4.497 ( 3.576 -2.799 -0.066) 4.542 4.746 ( -5.110 0.545 14.818) 15.684 4.990 ( -0.828 -3.014 -10.309) 10.773 5.055 ( -14.974 0.461 0.440) 14.988 5.242 ( 3.523 0.911 -2.820) 4.604 5.639 ( 10.325 0.802 10.708) 14.897 5.910 ( 10.770 0.959 -14.431) 18.032 6.035 ( -6.475 3.730 3.982) 8.467 6.189 ( -12.736 8.131 10.093) 18.171 6.341 ( -0.961 1.041 -6.778) 6.925 6.573 ( -4.554 5.458 17.220) 18.630 6.765 ( 4.472 2.564 -13.012) 13.996 6.870 ( -10.844 -4.836 -0.643) 11.891 6.980 ( 3.366 8.363 -3.630) 9.718 7.162 ( -3.026 5.141 0.371) 5.977 7.458 ( 2.906 2.558 -7.554) 8.489 7.653 ( 6.939 3.973 -5.639) 9.784 7.928 ( 0.006 -0.800 -1.037) 1.309 7.983 ( 1.570 0.188 15.149) 15.232 8.257 ( 0.269 -4.162 11.650) 12.374 8.502 ( 2.699 -0.506 -18.846) 19.045 8.682 ( -6.115 -2.051 -3.827) 7.500 8.851 ( 1.848 -2.344 -1.932) 3.555 9.260 ( -2.022 -5.422 13.343) 14.543 9.641 ( 9.809 -0.660 -9.943) 13.983 9.910 ( -4.517 -1.229 13.890) 14.658 10.234 ( 2.871 2.082 -16.428) 16.807 13.181 ( 0.330 0.250 6.966) 6.979 13.258 ( 1.545 -1.161 -2.889) 3.476 13.685 ( -2.671 1.014 -2.679) 3.917 13.876 ( 5.007 -2.674 -3.507) 6.673 14.137 ( -1.912 3.070 -1.850) 4.063 14.254 ( 3.993 3.371 4.207) 6.708 14.666 ( -0.803 -4.924 1.952) 5.357 14.700 ( -0.061 -4.322 -0.234) 4.328 15.931 ( -4.173 2.295 8.052) 9.355 16.078 ( -0.522 2.709 -7.970) 8.434 17.281 ( -2.941 -0.271 10.986) 11.376 17.482 ( 3.444 -0.025 -9.250) 9.871 17.849 ( 5.336 -0.635 14.276) 15.254 17.955 ( 3.543 -1.704 -12.241) 12.857 18.709 ( -2.194 0.395 0.709) 2.339 18.775 ( 0.630 0.672 -1.122) 1.452 19.160 ( -2.812 -0.126 6.708) 7.274 19.314 ( 0.787 -0.105 -10.122) 10.153 20.685 ( -7.599 -2.293 12.165) 14.526 21.054 ( 5.434 0.181 -4.947) 7.350 21.523 ( -2.588 4.803 1.455) 5.647 21.621 ( 2.176 1.271 -2.803) 3.770 21.813 ( -3.458 3.743 9.221) 10.535 22.059 ( 2.957 3.890 -9.972) 11.105 23.334 ( -0.490 -2.463 0.189) 2.518 23.441 ( 4.680 -2.720 -0.477) 5.434 23.755 ( -1.283 -2.715 2.174) 3.707 23.763 ( -2.258 -1.522 -3.882) 4.742 ======================= Grid point 234 (125/128) ======================= q-point: (-0.14 -0.43 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.859 ( -1.692 1.152 11.951) 12.125 2.170 ( 3.241 -5.397 8.573) 10.636 2.344 ( 8.662 2.942 1.767) 9.317 2.477 ( -2.480 1.620 6.350) 7.007 2.793 ( -1.826 2.166 5.136) 5.865 2.901 ( -2.957 4.280 -3.675) 6.370 2.932 ( -4.817 3.064 -5.486) 7.918 3.066 ( 2.469 7.926 -10.691) 13.535 3.219 ( 5.100 3.079 -5.523) 8.123 3.381 ( -0.246 -12.790 3.192) 13.185 3.527 ( -0.350 1.954 -3.665) 4.168 3.848 ( -1.206 -7.087 11.445) 13.516 3.930 ( -1.230 0.803 -0.756) 1.652 4.003 ( 4.052 -12.191 -1.443) 12.927 4.140 ( -2.869 -2.710 6.803) 7.865 4.276 ( -2.781 -10.285 16.351) 19.516 4.524 ( 1.750 -7.594 -6.823) 10.358 4.612 ( 3.690 -11.097 4.083) 12.386 4.687 ( -11.004 2.550 17.370) 20.719 4.928 ( -6.710 -1.207 -6.336) 9.307 5.074 ( 0.844 -8.463 -4.257) 9.511 5.283 ( 10.846 2.256 -3.978) 11.771 5.718 ( 1.453 0.939 0.754) 1.887 5.839 ( -6.127 7.065 7.825) 12.194 5.929 ( -6.084 11.211 8.769) 15.479 6.016 ( 1.115 0.422 -1.656) 2.040 6.276 ( 2.012 4.137 -9.487) 10.543 6.494 ( 1.868 5.890 7.518) 9.732 6.710 ( 1.984 2.942 -17.147) 17.510 6.790 ( -9.420 6.849 -4.013) 12.318 6.890 ( 0.221 0.996 2.355) 2.567 7.028 ( -3.666 4.450 2.219) 6.178 7.408 ( 1.326 4.463 -3.180) 5.638 7.618 ( 1.258 3.273 -5.245) 6.309 7.967 ( 3.869 0.205 4.269) 5.765 8.063 ( 4.796 -1.430 13.800) 14.680 8.289 ( -5.820 -0.658 -1.726) 6.106 8.520 ( 3.492 -2.718 -13.376) 14.090 8.664 ( -2.786 -3.458 -2.052) 4.892 8.908 ( 0.737 -3.611 -1.096) 3.845 9.392 ( -0.751 -7.427 13.040) 15.025 9.688 ( 3.689 2.254 1.087) 4.457 9.955 ( 0.955 -3.529 2.712) 4.552 10.157 ( 1.462 4.192 -16.670) 17.251 13.204 ( 0.454 -0.359 5.268) 5.300 13.308 ( 3.540 -2.312 -0.384) 4.245 13.608 ( -3.823 2.987 -4.374) 6.532 13.937 ( 3.121 0.592 -2.644) 4.133 14.089 ( 0.081 0.095 -1.665) 1.669 14.251 ( 3.138 3.044 3.151) 5.389 14.753 ( -0.191 -5.206 1.327) 5.376 14.781 ( -0.182 -5.779 1.706) 6.029 15.863 ( -4.174 3.025 6.209) 8.070 15.998 ( -0.413 3.325 -7.150) 7.896 17.288 ( -3.213 -0.497 11.041) 11.510 17.491 ( 3.330 0.151 -8.408) 9.045 17.938 ( 3.140 1.608 10.494) 11.071 17.998 ( 5.182 -2.752 -9.233) 10.939 18.681 ( -2.144 0.391 0.311) 2.201 18.768 ( 0.740 0.536 -1.078) 1.414 19.148 ( -3.249 -0.036 6.012) 6.834 19.293 ( 0.453 -0.256 -9.220) 9.235 20.700 ( -5.933 -4.025 12.482) 14.395 21.084 ( 3.518 0.667 -0.972) 3.710 21.410 ( -3.849 6.225 4.286) 8.482 21.594 ( 3.143 2.981 -9.531) 10.469 21.748 ( -2.706 3.450 10.026) 10.943 21.996 ( 2.514 3.389 -9.735) 10.610 23.374 ( -0.003 -2.191 1.311) 2.553 23.539 ( 5.297 -3.024 -1.105) 6.198 23.709 ( -4.127 0.026 -5.413) 6.807 23.839 ( -0.133 -5.167 2.270) 5.645 ======================= Grid point 240 (126/128) ======================= q-point: (-0.29 -0.29 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.949 ( -4.604 0.000 16.074) 16.720 2.006 ( -5.574 0.000 19.295) 20.084 2.427 ( 10.454 -0.000 6.230) 12.169 2.632 ( 7.609 -0.000 -5.482) 9.378 2.722 ( 0.607 -0.000 -3.507) 3.559 2.904 ( -1.823 0.000 -2.410) 3.022 2.980 ( -1.802 0.000 -0.899) 2.014 3.134 ( -5.613 0.000 -3.222) 6.473 3.269 ( 0.479 -0.000 -5.994) 6.013 3.419 ( -4.060 0.000 -2.963) 5.026 3.559 ( 4.366 -0.000 3.675) 5.706 3.615 ( 4.900 -0.000 0.859) 4.975 3.820 ( 8.309 -0.000 1.071) 8.377 3.874 ( -0.012 0.000 16.267) 16.267 4.038 ( -8.297 0.000 11.128) 13.881 4.041 ( 7.806 -0.000 -17.970) 19.593 4.407 ( 2.062 -0.000 11.175) 11.364 4.481 ( -0.859 0.000 0.793) 1.169 4.731 ( -10.659 0.000 22.005) 24.450 4.878 ( -5.180 0.000 -11.604) 12.708 4.923 ( -8.460 0.000 -0.419) 8.470 5.316 ( 11.593 -0.000 -8.306) 14.262 5.765 ( 3.594 -0.000 10.597) 11.190 5.973 ( 6.425 -0.000 -11.518) 13.189 5.991 ( -8.555 0.000 8.081) 11.768 6.133 ( -14.116 0.000 8.828) 16.649 6.317 ( -0.719 0.000 -7.052) 7.088 6.649 ( -12.262 0.000 -14.893) 19.291 6.695 ( 3.584 -0.000 22.994) 23.271 6.773 ( 1.913 -0.000 -16.258) 16.370 7.071 ( 1.438 -0.000 -0.528) 1.532 7.189 ( -1.796 0.000 -3.432) 3.874 7.513 ( 6.031 -0.000 -7.365) 9.519 7.692 ( -2.873 0.000 -5.373) 6.093 7.922 ( 3.312 -0.000 0.837) 3.416 8.066 ( 3.826 -0.000 14.664) 15.155 8.265 ( 0.007 -0.000 10.377) 10.377 8.450 ( 0.941 -0.000 -20.817) 20.838 8.595 ( -5.670 0.000 -0.029) 5.670 8.831 ( 0.029 -0.000 -3.200) 3.200 9.253 ( 0.799 -0.000 14.878) 14.900 9.728 ( 12.764 -0.000 -12.878) 18.132 9.884 ( -6.200 0.000 15.865) 17.034 10.228 ( 1.845 -0.000 -15.899) 16.005 13.225 ( 1.693 -0.000 8.826) 8.987 13.254 ( 1.699 -0.000 -0.965) 1.954 13.677 ( -0.361 0.000 -3.057) 3.079 13.872 ( 2.852 -0.000 -6.082) 6.717 14.163 ( 0.934 -0.000 0.601) 1.111 14.338 ( 3.697 -0.000 3.995) 5.444 14.618 ( -0.747 0.000 1.635) 1.797 14.656 ( -0.761 0.000 -0.247) 0.800 15.921 ( -5.450 0.000 7.721) 9.451 16.063 ( -1.528 0.000 -8.420) 8.557 17.277 ( -3.523 0.000 11.139) 11.683 17.495 ( 4.119 -0.000 -9.539) 10.390 17.955 ( 5.819 -0.000 -12.099) 13.426 17.959 ( 7.602 -0.000 12.927) 14.996 18.688 ( -2.694 0.000 0.875) 2.833 18.783 ( 0.344 -0.000 -1.083) 1.136 19.145 ( -3.505 0.000 6.100) 7.035 19.281 ( -0.812 0.000 -10.183) 10.215 20.632 ( -6.104 0.000 13.610) 14.916 21.094 ( 4.701 -0.000 -5.870) 7.520 21.532 ( -1.617 0.000 -3.337) 3.708 21.655 ( 1.231 -0.000 2.198) 2.519 21.834 ( -3.088 0.000 7.851) 8.436 22.090 ( 1.766 -0.000 -9.790) 9.948 23.307 ( 0.191 -0.000 -0.655) 0.682 23.476 ( 5.816 -0.000 -0.486) 5.836 23.699 ( -3.592 0.000 -6.999) 7.867 23.731 ( -2.098 0.000 6.641) 6.964 ======================= Grid point 241 (127/128) ======================= q-point: (-0.14 -0.29 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 221 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.931 ( 0.313 2.049 18.874) 18.987 2.112 ( -2.136 -8.175 17.957) 19.846 2.527 ( 1.627 7.683 -3.286) 8.513 2.553 ( 13.197 4.690 0.652) 14.021 2.730 ( -7.730 -0.263 -8.018) 11.140 2.897 ( -6.428 -2.901 -9.412) 11.761 2.940 ( 2.337 2.708 -1.926) 4.062 3.146 ( 5.819 5.033 2.464) 8.079 3.206 ( 0.372 -5.179 -2.074) 5.591 3.411 ( 1.201 6.948 0.751) 7.091 3.483 ( 0.861 -1.073 -4.716) 4.913 3.848 ( 5.271 -7.418 2.765) 9.511 3.878 ( 0.456 -1.859 0.806) 2.077 3.916 ( 1.318 -1.763 6.298) 6.672 4.047 ( 0.389 -7.554 12.061) 14.237 4.234 ( 4.458 -7.123 -1.050) 8.468 4.372 ( -1.122 -2.962 5.484) 6.333 4.540 ( -1.880 -4.915 4.159) 6.707 4.625 ( -16.481 0.887 21.134) 26.816 4.805 ( -3.932 -1.865 -8.996) 9.994 4.975 ( 4.135 -6.800 0.271) 7.964 5.414 ( 11.891 1.335 -7.857) 14.315 5.733 ( -7.213 3.574 2.144) 8.331 5.897 ( -6.489 4.957 4.575) 9.360 5.937 ( -12.446 2.731 19.076) 22.940 6.076 ( 2.541 -2.219 -0.641) 3.434 6.279 ( -0.191 2.023 -6.613) 6.918 6.497 ( -4.590 -0.529 -22.363) 22.835 6.706 ( 1.187 3.445 -10.715) 11.318 6.834 ( 6.926 -0.173 11.517) 13.440 7.007 ( -0.913 9.018 -1.573) 9.200 7.085 ( -2.553 6.174 -2.330) 7.075 7.512 ( 4.630 5.365 -4.161) 8.218 7.602 ( -7.147 0.850 -5.962) 9.346 8.006 ( 4.667 -2.278 3.094) 6.045 8.139 ( 3.311 -0.249 13.471) 13.874 8.246 ( -3.664 2.588 -1.118) 4.623 8.442 ( 0.631 -4.344 -16.101) 16.688 8.588 ( -1.637 -3.800 5.299) 6.722 8.842 ( -0.519 -3.156 -4.193) 5.274 9.350 ( 1.785 -3.943 15.206) 15.810 9.782 ( 4.923 3.450 -0.916) 6.081 9.912 ( 1.188 -4.113 2.461) 4.938 10.173 ( 0.503 2.541 -15.471) 15.686 13.243 ( 1.444 1.653 5.832) 6.231 13.308 ( 2.767 -2.316 2.413) 4.341 13.632 ( 0.076 3.988 -3.824) 5.525 13.913 ( 1.367 -3.736 -6.287) 7.440 14.146 ( 2.688 4.291 1.429) 5.261 14.350 ( 2.571 3.831 2.924) 5.463 14.667 ( -0.295 -5.585 2.130) 5.985 14.690 ( -0.741 -5.111 0.215) 5.169 15.869 ( -5.551 1.698 6.830) 8.964 16.005 ( -1.388 1.757 -8.067) 8.372 17.276 ( -3.743 -0.451 11.293) 11.906 17.506 ( 3.736 0.280 -9.583) 10.289 17.993 ( 6.086 0.095 -8.397) 10.372 18.064 ( 6.879 1.005 8.200) 10.750 18.661 ( -2.537 0.083 0.973) 2.719 18.777 ( 0.165 0.416 -1.343) 1.416 19.125 ( -3.762 -0.250 5.541) 6.702 19.247 ( -1.398 -1.180 -8.827) 9.014 20.640 ( -3.601 -2.168 14.361) 14.964 21.114 ( 2.354 0.060 -5.217) 5.724 21.472 ( -1.915 4.947 1.395) 5.485 21.647 ( 1.451 2.493 -3.347) 4.419 21.804 ( -2.219 2.844 7.913) 8.697 22.043 ( 1.012 3.290 -9.159) 9.785 23.340 ( 1.114 -2.953 -0.245) 3.166 23.554 ( 6.165 -2.104 -1.436) 6.671 23.643 ( -4.097 -0.531 -5.707) 7.045 23.757 ( -2.616 -4.117 4.997) 6.982 ======================= Grid point 248 (128/128) ======================= q-point: (-0.14 -0.14 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 1.97e-04 6.10e-05 6.10e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.034 ( -0.531 0.000 22.191) 22.197 2.040 ( -2.578 0.000 20.498) 20.660 2.575 ( -2.050 0.000 -9.856) 10.067 2.601 ( -6.407 0.000 -14.767) 16.097 2.781 ( 12.215 -0.000 -0.343) 12.219 2.815 ( 6.304 -0.000 -3.283) 7.108 3.032 ( 3.653 -0.000 -0.450) 3.681 3.104 ( -1.224 0.000 -3.078) 3.313 3.292 ( 4.187 -0.000 -0.714) 4.247 3.364 ( -2.233 0.000 7.438) 7.766 3.639 ( 1.850 -0.000 -3.988) 4.396 3.711 ( 2.262 -0.000 -7.259) 7.604 3.888 ( -8.384 0.000 5.825) 10.209 3.925 ( 2.472 -0.000 -6.596) 7.044 4.030 ( 3.988 -0.000 21.977) 22.336 4.272 ( 15.891 -0.000 -0.910) 15.917 4.387 ( -6.917 0.000 9.157) 11.476 4.433 ( -3.583 0.000 4.083) 5.432 4.522 ( -13.394 0.000 18.585) 22.909 4.754 ( 1.035 -0.000 -13.052) 13.093 4.979 ( 4.628 -0.000 9.405) 10.482 5.522 ( 10.165 -0.000 -9.653) 14.018 5.683 ( -9.604 0.000 6.987) 11.876 5.812 ( -15.592 0.000 -2.989) 15.876 5.894 ( -12.303 0.000 20.687) 24.069 6.056 ( -0.042 0.000 12.038) 12.038 6.328 ( 7.069 -0.000 -7.156) 10.059 6.392 ( 1.582 -0.000 -30.159) 30.201 6.692 ( 1.037 -0.000 -16.778) 16.810 6.934 ( -0.966 0.000 14.706) 14.738 7.092 ( 1.071 -0.000 1.298) 1.683 7.121 ( 4.594 -0.000 -6.567) 8.015 7.465 ( -14.307 0.000 -0.080) 14.307 7.622 ( 7.433 -0.000 -8.255) 11.108 8.044 ( 5.117 -0.000 2.871) 5.868 8.176 ( -0.965 0.000 7.051) 7.117 8.258 ( -3.283 0.000 1.895) 3.791 8.336 ( -0.647 0.000 -14.926) 14.940 8.561 ( -0.528 0.000 8.602) 8.618 8.797 ( 0.208 -0.000 -6.571) 6.574 9.395 ( 2.521 -0.000 17.174) 17.358 9.853 ( -5.122 0.000 14.526) 15.402 9.903 ( 11.187 -0.000 -15.986) 19.512 10.148 ( -0.648 0.000 -14.036) 14.051 13.306 ( 2.494 -0.000 2.087) 3.252 13.314 ( 1.992 -0.000 5.978) 6.301 13.678 ( 2.168 -0.000 -2.715) 3.475 13.863 ( 0.281 -0.000 -6.994) 7.000 14.232 ( 4.141 -0.000 2.458) 4.816 14.416 ( 1.391 -0.000 1.898) 2.353 14.620 ( 0.092 -0.000 1.128) 1.132 14.629 ( -1.741 0.000 0.652) 1.859 15.841 ( -5.862 0.000 7.178) 9.268 15.980 ( -0.956 0.000 -8.341) 8.395 17.267 ( -3.657 0.000 11.679) 12.239 17.516 ( 3.253 -0.000 -10.485) 10.978 18.051 ( 9.060 -0.000 -9.006) 12.775 18.152 ( 2.266 -0.000 7.557) 7.889 18.642 ( -1.490 0.000 1.835) 2.364 18.773 ( -0.538 0.000 -1.844) 1.921 19.098 ( -3.720 0.000 5.015) 6.244 19.192 ( -1.717 0.000 -7.054) 7.260 20.647 ( -0.500 0.000 14.920) 14.929 21.104 ( -0.403 0.000 -7.050) 7.062 21.522 ( 2.259 -0.000 -1.247) 2.580 21.663 ( -1.303 0.000 0.221) 1.322 21.826 ( -1.830 0.000 7.009) 7.245 22.047 ( -0.269 0.000 -8.704) 8.708 23.327 ( 1.925 -0.000 0.114) 1.928 23.563 ( -3.188 0.000 -5.342) 6.220 23.613 ( 5.401 -0.000 -2.464) 5.936 23.706 ( -3.829 0.000 5.945) 7.072 =================== 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 3/31752 10.0 905.564 421.200 737.626 0.000 66.857 -0.000 3/31752 20.0 165.967 117.580 194.372 0.000 5.640 -0.000 3/31752 30.0 67.498 48.851 86.606 0.000 0.314 -0.000 3/31752 40.0 38.618 28.161 51.702 0.000 -0.375 -0.000 3/31752 50.0 26.173 19.304 35.999 0.000 -0.493 -0.000 3/31752 60.0 19.573 14.603 27.431 0.000 -0.509 -0.000 3/31752 70.0 15.586 11.743 22.141 0.000 -0.499 -0.000 3/31752 80.0 12.948 9.832 18.581 0.000 -0.481 -0.000 3/31752 90.0 11.082 8.467 16.029 0.000 -0.460 -0.000 3/31752 100.0 9.694 7.441 14.112 0.000 -0.439 -0.000 3/31752 110.0 8.621 6.643 12.617 0.000 -0.418 -0.000 3/31752 120.0 7.765 6.002 11.418 0.000 -0.399 -0.000 3/31752 130.0 7.068 5.476 10.435 0.000 -0.382 -0.000 3/31752 140.0 6.488 5.038 9.614 0.000 -0.366 -0.000 3/31752 150.0 5.998 4.666 8.919 0.000 -0.352 -0.000 3/31752 160.0 5.579 4.347 8.321 0.000 -0.338 -0.000 3/31752 170.0 5.216 4.070 7.803 0.000 -0.326 -0.000 3/31752 180.0 4.899 3.827 7.348 0.000 -0.315 -0.000 3/31752 190.0 4.620 3.614 6.947 0.000 -0.305 -0.000 3/31752 200.0 4.372 3.424 6.589 0.000 -0.296 -0.000 3/31752 210.0 4.150 3.253 6.269 0.000 -0.287 -0.000 3/31752 220.0 3.950 3.100 5.980 0.000 -0.278 -0.000 3/31752 230.0 3.770 2.962 5.718 0.000 -0.271 -0.000 3/31752 240.0 3.606 2.835 5.479 0.000 -0.263 -0.000 3/31752 250.0 3.456 2.720 5.260 0.000 -0.256 -0.000 3/31752 260.0 3.318 2.614 5.059 0.000 -0.250 -0.000 3/31752 270.0 3.192 2.517 4.873 0.000 -0.244 -0.000 3/31752 280.0 3.075 2.427 4.701 0.000 -0.238 -0.000 3/31752 290.0 2.967 2.343 4.542 0.000 -0.232 -0.000 3/31752 300.0 2.866 2.265 4.393 0.000 -0.227 -0.000 3/31752 310.0 2.772 2.193 4.254 0.000 -0.221 -0.000 3/31752 320.0 2.684 2.125 4.124 0.000 -0.216 -0.000 3/31752 330.0 2.602 2.061 4.002 0.000 -0.212 -0.000 3/31752 340.0 2.525 2.002 3.887 0.000 -0.207 -0.000 3/31752 350.0 2.453 1.945 3.778 0.000 -0.203 -0.000 3/31752 360.0 2.384 1.892 3.676 0.000 -0.198 -0.000 3/31752 370.0 2.319 1.842 3.579 0.000 -0.194 -0.000 3/31752 380.0 2.258 1.794 3.487 0.000 -0.190 -0.000 3/31752 390.0 2.200 1.749 3.400 0.000 -0.186 -0.000 3/31752 400.0 2.145 1.706 3.317 0.000 -0.183 -0.000 3/31752 410.0 2.093 1.666 3.239 0.000 -0.179 -0.000 3/31752 420.0 2.043 1.627 3.163 0.000 -0.176 -0.000 3/31752 430.0 1.996 1.590 3.092 0.000 -0.172 -0.000 3/31752 440.0 1.951 1.554 3.023 0.000 -0.169 -0.000 3/31752 450.0 1.908 1.521 2.958 0.000 -0.166 -0.000 3/31752 460.0 1.866 1.488 2.895 0.000 -0.163 -0.000 3/31752 470.0 1.827 1.457 2.835 0.000 -0.160 -0.000 3/31752 480.0 1.789 1.428 2.778 0.000 -0.158 -0.000 3/31752 490.0 1.753 1.399 2.722 0.000 -0.155 -0.000 3/31752 500.0 1.718 1.372 2.669 0.000 -0.152 -0.000 3/31752 510.0 1.684 1.345 2.618 0.000 -0.150 -0.000 3/31752 520.0 1.652 1.320 2.569 0.000 -0.147 -0.000 3/31752 530.0 1.621 1.296 2.521 0.000 -0.145 -0.000 3/31752 540.0 1.591 1.272 2.476 0.000 -0.142 -0.000 3/31752 550.0 1.563 1.250 2.432 0.000 -0.140 -0.000 3/31752 560.0 1.535 1.228 2.389 0.000 -0.138 -0.000 3/31752 570.0 1.508 1.207 2.348 0.000 -0.136 -0.000 3/31752 580.0 1.482 1.186 2.309 0.000 -0.134 -0.000 3/31752 590.0 1.457 1.166 2.270 0.000 -0.132 -0.000 3/31752 600.0 1.433 1.147 2.233 0.000 -0.130 -0.000 3/31752 610.0 1.410 1.129 2.197 0.000 -0.128 -0.000 3/31752 620.0 1.387 1.111 2.163 0.000 -0.126 -0.000 3/31752 630.0 1.366 1.094 2.129 0.000 -0.124 -0.000 3/31752 640.0 1.344 1.077 2.096 0.000 -0.123 -0.000 3/31752 650.0 1.324 1.061 2.065 0.000 -0.121 -0.000 3/31752 660.0 1.304 1.045 2.034 0.000 -0.119 -0.000 3/31752 670.0 1.285 1.030 2.004 0.000 -0.118 -0.000 3/31752 680.0 1.266 1.015 1.975 0.000 -0.116 -0.000 3/31752 690.0 1.248 1.000 1.947 0.000 -0.115 -0.000 3/31752 700.0 1.230 0.986 1.920 0.000 -0.113 -0.000 3/31752 710.0 1.213 0.973 1.893 0.000 -0.112 -0.000 3/31752 720.0 1.196 0.959 1.867 0.000 -0.110 -0.000 3/31752 730.0 1.180 0.946 1.842 0.000 -0.109 -0.000 3/31752 740.0 1.164 0.934 1.818 0.000 -0.107 -0.000 3/31752 750.0 1.148 0.922 1.794 0.000 -0.106 -0.000 3/31752 760.0 1.133 0.910 1.771 0.000 -0.105 -0.000 3/31752 770.0 1.119 0.898 1.748 0.000 -0.104 -0.000 3/31752 780.0 1.105 0.887 1.726 0.000 -0.102 -0.000 3/31752 790.0 1.091 0.876 1.704 0.000 -0.101 -0.000 3/31752 800.0 1.077 0.865 1.683 0.000 -0.100 -0.000 3/31752 810.0 1.064 0.854 1.663 0.000 -0.099 -0.000 3/31752 820.0 1.051 0.844 1.643 0.000 -0.098 -0.000 3/31752 830.0 1.038 0.834 1.623 0.000 -0.097 -0.000 3/31752 840.0 1.026 0.824 1.604 0.000 -0.096 -0.000 3/31752 850.0 1.014 0.815 1.586 0.000 -0.094 -0.000 3/31752 860.0 1.002 0.805 1.567 0.000 -0.093 -0.000 3/31752 870.0 0.991 0.796 1.550 0.000 -0.092 -0.000 3/31752 880.0 0.980 0.787 1.532 0.000 -0.091 -0.000 3/31752 890.0 0.969 0.778 1.515 0.000 -0.090 -0.000 3/31752 900.0 0.958 0.770 1.499 0.000 -0.090 -0.000 3/31752 910.0 0.948 0.762 1.482 0.000 -0.089 -0.000 3/31752 920.0 0.937 0.753 1.466 0.000 -0.088 -0.000 3/31752 930.0 0.927 0.745 1.451 0.000 -0.087 -0.000 3/31752 940.0 0.918 0.737 1.436 0.000 -0.086 -0.000 3/31752 950.0 0.908 0.730 1.421 0.000 -0.085 -0.000 3/31752 960.0 0.899 0.722 1.406 0.000 -0.084 -0.000 3/31752 970.0 0.889 0.715 1.392 0.000 -0.083 -0.000 3/31752 980.0 0.880 0.708 1.378 0.000 -0.083 -0.000 3/31752 990.0 0.871 0.701 1.364 0.000 -0.082 -0.000 3/31752 1000.0 0.863 0.694 1.350 0.000 -0.081 -0.000 3/31752 Thermal conductivity related properties were written into "kappa-m779.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 04:22:37]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|