----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 02:39:19]------------------------- 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 2 1] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.094551350304767 -3.283393610000000 0.000000000000000 b 7.094551350304767 3.283393610000000 0.000000000000000 c -5.378037427200898 0.000000000000000 8.539465279853262 Atomic positions (fractional): *1 O 0.38433230922387 0.57976445471542 0.10182245114201 15.999 2 O 0.42023554528458 0.61566769077613 0.39817754885799 15.999 3 O 0.61566769077613 0.42023554528458 0.89817754885799 15.999 4 O 0.57976445471542 0.38433230922387 0.60182245114201 15.999 *5 O 0.13063120762157 0.27460729249088 0.94120500829108 15.999 6 O 0.72539270750912 0.86936879237843 0.55879499170892 15.999 7 O 0.86936879237843 0.72539270750912 0.05879499170892 15.999 8 O 0.27460729249088 0.13063120762157 0.44120500829108 15.999 *9 O 0.45077345391415 0.14953832475035 0.82429013287416 15.999 10 O 0.85046167524965 0.54922654608585 0.67570986712584 15.999 11 O 0.54922654608585 0.85046167524965 0.17570986712584 15.999 12 O 0.14953832475035 0.45077345391415 0.32429013287416 15.999 *13 O 0.08247472323951 0.09254337761219 0.13585146250667 15.999 14 O 0.90745662238781 0.91752527676049 0.36414853749333 15.999 15 O 0.91752527676049 0.90745662238781 0.86414853749333 15.999 16 O 0.09254337761219 0.08247472323951 0.63585146250667 15.999 *17 O 0.82571109630785 0.41171446591204 0.32304526602961 15.999 18 O 0.58828553408796 0.17428890369215 0.17695473397039 15.999 19 O 0.17428890369215 0.58828553408796 0.67695473397039 15.999 20 O 0.41171446591204 0.82571109630785 0.82304526602961 15.999 *21 Si 0.27578654073052 0.09029163145798 0.80767958826504 28.085 22 Si 0.90970836854202 0.72421345926948 0.69232041173496 28.085 23 Si 0.72421345926948 0.90970836854202 0.19232041173496 28.085 24 Si 0.09029163145798 0.27578654073052 0.30767958826504 28.085 *25 Lu 0.23512493277714 0.48615124037489 0.16396514248517 174.967 26 Lu 0.51384875962511 0.76487506722286 0.33603485751483 174.967 27 Lu 0.76487506722286 0.51384875962511 0.83603485751483 174.967 28 Lu 0.48615124037489 0.23512493277714 0.66396514248517 174.967 *29 Lu 0.22117273534662 0.70667140167434 0.53436038850879 174.967 30 Lu 0.29332859832565 0.77882726465338 0.96563961149121 174.967 31 Lu 0.77882726465338 0.29332859832565 0.46563961149121 174.967 32 Lu 0.70667140167435 0.22117273534662 0.03436038850879 174.967 -------------------------------- unit cell --------------------------------- Lattice vectors: a 14.189102700609535 0.000000000000000 0.000000000000000 b 0.000000000000000 6.566787220000000 0.000000000000000 c -5.378037427200898 0.000000000000000 8.539465279853262 Atomic positions (fractional): *1 O 0.98204838196964 0.59771607274577 0.10182245114201 15.999 > 1 2 O 0.01795161803036 0.59771607274577 0.39817754885799 15.999 > 2 3 O 0.01795161803036 0.40228392725423 0.89817754885799 15.999 > 3 4 O 0.98204838196964 0.40228392725423 0.60182245114201 15.999 > 4 *5 O 0.20261925005622 0.07198804243466 0.94120500829108 15.999 > 5 6 O 0.79738074994378 0.07198804243466 0.55879499170892 15.999 > 6 7 O 0.79738074994378 0.92801195756534 0.05879499170892 15.999 > 7 8 O 0.20261925005622 0.92801195756534 0.44120500829108 15.999 > 8 *9 O 0.30015588933225 0.84938243541810 0.82429013287416 15.999 > 9 10 O 0.19984411066775 0.34938243541810 0.67570986712584 15.999 > 10 11 O 0.69984411066775 0.15061756458190 0.17570986712584 15.999 > 11 12 O 0.80015588933225 0.65061756458190 0.32429013287416 15.999 > 12 *13 O 0.58750905042585 0.50503432718634 0.13585146250667 15.999 > 13 14 O 0.91249094957415 0.00503432718634 0.36414853749333 15.999 > 14 15 O 0.41249094957415 0.49496567281366 0.86414853749333 15.999 > 15 16 O 0.08750905042585 0.99496567281366 0.63585146250667 15.999 > 16 *17 O 0.11871278110995 0.29300168480210 0.32304526602961 15.999 > 17 18 O 0.88128721889006 0.29300168480210 0.17695473397039 15.999 > 18 19 O 0.88128721889006 0.70699831519790 0.67695473397039 15.999 > 19 20 O 0.11871278110995 0.70699831519790 0.82304526602961 15.999 > 20 21 O 0.48204838196964 0.09771607274577 0.10182245114201 15.999 > 1 22 O 0.51795161803036 0.09771607274577 0.39817754885799 15.999 > 2 23 O 0.51795161803036 0.90228392725423 0.89817754885799 15.999 > 3 24 O 0.48204838196964 0.90228392725423 0.60182245114201 15.999 > 4 25 O 0.70261925005622 0.57198804243466 0.94120500829108 15.999 > 5 26 O 0.29738074994378 0.57198804243466 0.55879499170892 15.999 > 6 27 O 0.29738074994378 0.42801195756534 0.05879499170892 15.999 > 7 28 O 0.70261925005622 0.42801195756534 0.44120500829108 15.999 > 8 29 O 0.80015588933225 0.34938243541810 0.82429013287416 15.999 > 9 30 O 0.69984411066775 0.84938243541810 0.67570986712584 15.999 > 10 31 O 0.19984411066775 0.65061756458190 0.17570986712584 15.999 > 11 32 O 0.30015588933225 0.15061756458190 0.32429013287416 15.999 > 12 33 O 0.08750905042585 0.00503432718634 0.13585146250667 15.999 > 13 34 O 0.41249094957415 0.50503432718634 0.36414853749333 15.999 > 14 35 O 0.91249094957415 0.99496567281366 0.86414853749333 15.999 > 15 36 O 0.58750905042585 0.49496567281366 0.63585146250667 15.999 > 16 37 O 0.61871278110994 0.79300168480210 0.32304526602961 15.999 > 17 38 O 0.38128721889006 0.79300168480210 0.17695473397039 15.999 > 18 39 O 0.38128721889006 0.20699831519790 0.67695473397039 15.999 > 19 40 O 0.61871278110994 0.20699831519790 0.82304526602961 15.999 > 20 *41 Si 0.18303908609425 0.90725254536373 0.80767958826504 28.085 > 21 42 Si 0.31696091390575 0.40725254536373 0.69232041173496 28.085 > 22 43 Si 0.81696091390575 0.09274745463627 0.19232041173496 28.085 > 23 44 Si 0.68303908609425 0.59274745463627 0.30767958826504 28.085 > 24 45 Si 0.68303908609425 0.40725254536373 0.80767958826504 28.085 > 21 46 Si 0.81696091390575 0.90725254536373 0.69232041173496 28.085 > 22 47 Si 0.31696091390575 0.59274745463627 0.19232041173496 28.085 > 23 48 Si 0.18303908609425 0.09274745463627 0.30767958826504 28.085 > 24 *49 Lu 0.86063808657602 0.62551315379888 0.16396514248517 174.967 > 25 50 Lu 0.13936191342398 0.62551315379888 0.33603485751483 174.967 > 26 51 Lu 0.13936191342398 0.37448684620112 0.83603485751483 174.967 > 27 52 Lu 0.86063808657602 0.37448684620112 0.66396514248517 174.967 > 28 *53 Lu 0.96392206851048 0.74274933316386 0.53436038850879 174.967 > 29 54 Lu 0.03607793148952 0.74274933316386 0.96563961149121 174.967 > 30 55 Lu 0.03607793148952 0.25725066683614 0.46563961149121 174.967 > 31 56 Lu 0.96392206851048 0.25725066683614 0.03436038850879 174.967 > 32 57 Lu 0.36063808657602 0.12551315379888 0.16396514248517 174.967 > 25 58 Lu 0.63936191342398 0.12551315379888 0.33603485751483 174.967 > 26 59 Lu 0.63936191342398 0.87448684620112 0.83603485751483 174.967 > 27 60 Lu 0.36063808657602 0.87448684620112 0.66396514248517 174.967 > 28 61 Lu 0.46392206851048 0.24274933316386 0.53436038850879 174.967 > 29 62 Lu 0.53607793148952 0.24274933316386 0.96563961149121 174.967 > 30 63 Lu 0.53607793148952 0.75725066683614 0.46563961149121 174.967 > 31 64 Lu 0.46392206851048 0.75725066683614 0.03436038850879 174.967 > 32 -------------------------------- super cell -------------------------------- Lattice vectors: a 14.189102700609535 0.000000000000000 0.000000000000000 b 0.000000000000000 13.133574440000000 0.000000000000000 c -5.378037427200898 0.000000000000000 8.539465279853262 Atomic positions (fractional): *1 O 0.98204838196964 0.29885803637289 0.10182245114201 15.999 > 1 2 O 0.98204838196964 0.79885803637289 0.10182245114201 15.999 > 1 3 O 0.01795161803036 0.29885803637289 0.39817754885799 15.999 > 2 4 O 0.01795161803036 0.79885803637289 0.39817754885799 15.999 > 2 5 O 0.01795161803036 0.20114196362711 0.89817754885799 15.999 > 3 6 O 0.01795161803036 0.70114196362711 0.89817754885799 15.999 > 3 7 O 0.98204838196964 0.20114196362711 0.60182245114201 15.999 > 4 8 O 0.98204838196964 0.70114196362711 0.60182245114201 15.999 > 4 *9 O 0.20261925005622 0.03599402121733 0.94120500829108 15.999 > 5 10 O 0.20261925005622 0.53599402121733 0.94120500829108 15.999 > 5 11 O 0.79738074994378 0.03599402121733 0.55879499170892 15.999 > 6 12 O 0.79738074994378 0.53599402121733 0.55879499170892 15.999 > 6 13 O 0.79738074994378 0.46400597878267 0.05879499170892 15.999 > 7 14 O 0.79738074994378 0.96400597878267 0.05879499170892 15.999 > 7 15 O 0.20261925005622 0.46400597878267 0.44120500829108 15.999 > 8 16 O 0.20261925005622 0.96400597878267 0.44120500829108 15.999 > 8 *17 O 0.30015588933225 0.42469121770905 0.82429013287416 15.999 > 9 18 O 0.30015588933225 0.92469121770905 0.82429013287416 15.999 > 9 19 O 0.19984411066775 0.17469121770905 0.67570986712584 15.999 > 10 20 O 0.19984411066775 0.67469121770905 0.67570986712584 15.999 > 10 21 O 0.69984411066775 0.07530878229095 0.17570986712584 15.999 > 11 22 O 0.69984411066775 0.57530878229095 0.17570986712584 15.999 > 11 23 O 0.80015588933225 0.32530878229095 0.32429013287416 15.999 > 12 24 O 0.80015588933225 0.82530878229095 0.32429013287416 15.999 > 12 *25 O 0.58750905042585 0.25251716359317 0.13585146250667 15.999 > 13 26 O 0.58750905042585 0.75251716359317 0.13585146250667 15.999 > 13 27 O 0.91249094957415 0.00251716359317 0.36414853749333 15.999 > 14 28 O 0.91249094957415 0.50251716359317 0.36414853749333 15.999 > 14 29 O 0.41249094957415 0.24748283640683 0.86414853749333 15.999 > 15 30 O 0.41249094957415 0.74748283640683 0.86414853749333 15.999 > 15 31 O 0.08750905042585 0.49748283640683 0.63585146250667 15.999 > 16 32 O 0.08750905042585 0.99748283640683 0.63585146250667 15.999 > 16 *33 O 0.11871278110995 0.14650084240105 0.32304526602961 15.999 > 17 34 O 0.11871278110995 0.64650084240105 0.32304526602961 15.999 > 17 35 O 0.88128721889006 0.14650084240105 0.17695473397039 15.999 > 18 36 O 0.88128721889006 0.64650084240105 0.17695473397039 15.999 > 18 37 O 0.88128721889006 0.35349915759895 0.67695473397039 15.999 > 19 38 O 0.88128721889006 0.85349915759895 0.67695473397039 15.999 > 19 39 O 0.11871278110995 0.35349915759895 0.82304526602961 15.999 > 20 40 O 0.11871278110995 0.85349915759895 0.82304526602961 15.999 > 20 41 O 0.48204838196964 0.04885803637289 0.10182245114201 15.999 > 1 42 O 0.48204838196964 0.54885803637289 0.10182245114201 15.999 > 1 43 O 0.51795161803036 0.04885803637289 0.39817754885799 15.999 > 2 44 O 0.51795161803036 0.54885803637289 0.39817754885799 15.999 > 2 45 O 0.51795161803036 0.45114196362711 0.89817754885799 15.999 > 3 46 O 0.51795161803036 0.95114196362711 0.89817754885799 15.999 > 3 47 O 0.48204838196964 0.45114196362711 0.60182245114201 15.999 > 4 48 O 0.48204838196964 0.95114196362711 0.60182245114201 15.999 > 4 49 O 0.70261925005622 0.28599402121733 0.94120500829108 15.999 > 5 50 O 0.70261925005622 0.78599402121733 0.94120500829108 15.999 > 5 51 O 0.29738074994378 0.28599402121733 0.55879499170892 15.999 > 6 52 O 0.29738074994378 0.78599402121733 0.55879499170892 15.999 > 6 53 O 0.29738074994378 0.21400597878267 0.05879499170892 15.999 > 7 54 O 0.29738074994378 0.71400597878267 0.05879499170892 15.999 > 7 55 O 0.70261925005622 0.21400597878267 0.44120500829108 15.999 > 8 56 O 0.70261925005622 0.71400597878267 0.44120500829108 15.999 > 8 57 O 0.80015588933225 0.17469121770905 0.82429013287416 15.999 > 9 58 O 0.80015588933225 0.67469121770905 0.82429013287416 15.999 > 9 59 O 0.69984411066775 0.42469121770905 0.67570986712584 15.999 > 10 60 O 0.69984411066775 0.92469121770905 0.67570986712584 15.999 > 10 61 O 0.19984411066775 0.32530878229095 0.17570986712584 15.999 > 11 62 O 0.19984411066775 0.82530878229095 0.17570986712584 15.999 > 11 63 O 0.30015588933225 0.07530878229095 0.32429013287416 15.999 > 12 64 O 0.30015588933225 0.57530878229095 0.32429013287416 15.999 > 12 65 O 0.08750905042585 0.00251716359317 0.13585146250667 15.999 > 13 66 O 0.08750905042585 0.50251716359317 0.13585146250667 15.999 > 13 67 O 0.41249094957415 0.25251716359317 0.36414853749333 15.999 > 14 68 O 0.41249094957415 0.75251716359317 0.36414853749333 15.999 > 14 69 O 0.91249094957415 0.49748283640683 0.86414853749333 15.999 > 15 70 O 0.91249094957415 0.99748283640683 0.86414853749333 15.999 > 15 71 O 0.58750905042585 0.24748283640683 0.63585146250667 15.999 > 16 72 O 0.58750905042585 0.74748283640683 0.63585146250667 15.999 > 16 73 O 0.61871278110994 0.39650084240105 0.32304526602961 15.999 > 17 74 O 0.61871278110994 0.89650084240105 0.32304526602961 15.999 > 17 75 O 0.38128721889006 0.39650084240105 0.17695473397039 15.999 > 18 76 O 0.38128721889006 0.89650084240105 0.17695473397039 15.999 > 18 77 O 0.38128721889006 0.10349915759895 0.67695473397039 15.999 > 19 78 O 0.38128721889006 0.60349915759895 0.67695473397039 15.999 > 19 79 O 0.61871278110994 0.10349915759895 0.82304526602961 15.999 > 20 80 O 0.61871278110994 0.60349915759895 0.82304526602961 15.999 > 20 *81 Si 0.18303908609425 0.45362627268187 0.80767958826504 28.085 > 21 82 Si 0.18303908609425 0.95362627268186 0.80767958826504 28.085 > 21 83 Si 0.31696091390575 0.20362627268187 0.69232041173496 28.085 > 22 84 Si 0.31696091390575 0.70362627268186 0.69232041173496 28.085 > 22 85 Si 0.81696091390575 0.04637372731814 0.19232041173496 28.085 > 23 86 Si 0.81696091390575 0.54637372731814 0.19232041173496 28.085 > 23 87 Si 0.68303908609425 0.29637372731813 0.30767958826504 28.085 > 24 88 Si 0.68303908609425 0.79637372731814 0.30767958826504 28.085 > 24 89 Si 0.68303908609425 0.20362627268187 0.80767958826504 28.085 > 21 90 Si 0.68303908609425 0.70362627268186 0.80767958826504 28.085 > 21 91 Si 0.81696091390575 0.45362627268187 0.69232041173496 28.085 > 22 92 Si 0.81696091390575 0.95362627268186 0.69232041173496 28.085 > 22 93 Si 0.31696091390575 0.29637372731813 0.19232041173496 28.085 > 23 94 Si 0.31696091390575 0.79637372731814 0.19232041173496 28.085 > 23 95 Si 0.18303908609425 0.04637372731814 0.30767958826504 28.085 > 24 96 Si 0.18303908609425 0.54637372731814 0.30767958826504 28.085 > 24 *97 Lu 0.86063808657602 0.31275657689944 0.16396514248517 174.967 > 25 98 Lu 0.86063808657602 0.81275657689944 0.16396514248517 174.967 > 25 99 Lu 0.13936191342398 0.31275657689944 0.33603485751483 174.967 > 26 100 Lu 0.13936191342398 0.81275657689944 0.33603485751483 174.967 > 26 101 Lu 0.13936191342398 0.18724342310056 0.83603485751483 174.967 > 27 102 Lu 0.13936191342398 0.68724342310056 0.83603485751483 174.967 > 27 103 Lu 0.86063808657602 0.18724342310056 0.66396514248517 174.967 > 28 104 Lu 0.86063808657602 0.68724342310056 0.66396514248517 174.967 > 28 *105 Lu 0.96392206851048 0.37137466658193 0.53436038850879 174.967 > 29 106 Lu 0.96392206851048 0.87137466658193 0.53436038850879 174.967 > 29 107 Lu 0.03607793148952 0.37137466658193 0.96563961149121 174.967 > 30 108 Lu 0.03607793148952 0.87137466658193 0.96563961149121 174.967 > 30 109 Lu 0.03607793148952 0.12862533341807 0.46563961149121 174.967 > 31 110 Lu 0.03607793148952 0.62862533341807 0.46563961149121 174.967 > 31 111 Lu 0.96392206851048 0.12862533341807 0.03436038850879 174.967 > 32 112 Lu 0.96392206851048 0.62862533341807 0.03436038850879 174.967 > 32 113 Lu 0.36063808657602 0.06275657689944 0.16396514248517 174.967 > 25 114 Lu 0.36063808657602 0.56275657689944 0.16396514248517 174.967 > 25 115 Lu 0.63936191342398 0.06275657689944 0.33603485751483 174.967 > 26 116 Lu 0.63936191342398 0.56275657689944 0.33603485751483 174.967 > 26 117 Lu 0.63936191342398 0.43724342310056 0.83603485751483 174.967 > 27 118 Lu 0.63936191342398 0.93724342310056 0.83603485751483 174.967 > 27 119 Lu 0.36063808657602 0.43724342310056 0.66396514248517 174.967 > 28 120 Lu 0.36063808657602 0.93724342310056 0.66396514248517 174.967 > 28 121 Lu 0.46392206851048 0.12137466658193 0.53436038850879 174.967 > 29 122 Lu 0.46392206851048 0.62137466658193 0.53436038850879 174.967 > 29 123 Lu 0.53607793148952 0.12137466658193 0.96563961149121 174.967 > 30 124 Lu 0.53607793148952 0.62137466658193 0.96563961149121 174.967 > 30 125 Lu 0.53607793148952 0.37862533341807 0.46563961149121 174.967 > 31 126 Lu 0.53607793148952 0.87862533341807 0.46563961149121 174.967 > 31 127 Lu 0.46392206851048 0.37862533341807 0.03436038850879 174.967 > 32 128 Lu 0.46392206851048 0.87862533341807 0.03436038850879 174.967 > 32 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.4915382 0.0000000 -0.0227203 0.0000000 3.4727093 0.0000000 -0.0227158 0.0000000 3.5536219 -------------------------- Born effective charges -------------------------- 1 O -2.7173806 -0.1846342 0.4247700 -0.2478916 -1.9854874 -0.0034031 0.4275738 -0.0784272 -2.2849547 2 O -2.7173806 0.1846342 0.4247700 0.2478916 -1.9854874 0.0034031 0.4275738 0.0784272 -2.2849547 3 O -2.7173806 -0.1846342 0.4247700 -0.2478916 -1.9854874 -0.0034031 0.4275738 -0.0784272 -2.2849547 4 O -2.7173806 0.1846342 0.4247700 0.2478916 -1.9854874 0.0034031 0.4275738 0.0784272 -2.2849547 5 O -1.4805035 0.2080606 -0.3014404 0.2038587 -2.2986471 -0.2211319 -0.2608851 -0.2477089 -2.3471269 6 O -1.4805035 -0.2080606 -0.3014404 -0.2038587 -2.2986471 0.2211319 -0.2608851 0.2477089 -2.3471269 7 O -1.4805035 0.2080606 -0.3014404 0.2038587 -2.2986471 -0.2211319 -0.2608851 -0.2477089 -2.3471269 8 O -1.4805035 -0.2080606 -0.3014404 -0.2038587 -2.2986471 0.2211319 -0.2608851 0.2477089 -2.3471269 9 O -2.8868552 0.2541250 0.0007165 0.2980701 -1.3576979 0.1822820 -0.0428456 0.1664130 -1.9183524 10 O -2.8868552 -0.2541250 0.0007165 -0.2980701 -1.3576979 -0.1822820 -0.0428456 -0.1664130 -1.9183524 11 O -2.8868552 0.2541250 0.0007165 0.2980701 -1.3576979 0.1822820 -0.0428456 0.1664130 -1.9183524 12 O -2.8868552 -0.2541250 0.0007165 -0.2980701 -1.3576979 -0.1822820 -0.0428456 -0.1664130 -1.9183524 13 O -1.4262180 0.2839163 -0.3610875 0.2644756 -2.2915490 -0.3566398 -0.3742643 -0.2519652 -2.2995478 14 O -1.4262180 -0.2839163 -0.3610875 -0.2644756 -2.2915490 0.3566398 -0.3742643 0.2519652 -2.2995478 15 O -1.4262180 0.2839163 -0.3610875 0.2644756 -2.2915490 -0.3566398 -0.3742643 -0.2519652 -2.2995478 16 O -1.4262180 -0.2839163 -0.3610875 -0.2644756 -2.2915490 0.3566398 -0.3742643 0.2519652 -2.2995478 17 O -2.0024311 0.3768998 0.1787972 0.4126600 -2.4736919 -0.1138318 0.2076578 -0.1408161 -1.8151233 18 O -2.0024311 -0.3768998 0.1787972 -0.4126600 -2.4736919 0.1138318 0.2076578 0.1408161 -1.8151233 19 O -2.0024311 0.3768998 0.1787972 0.4126600 -2.4736919 -0.1138318 0.2076578 -0.1408161 -1.8151233 20 O -2.0024311 -0.3768998 0.1787972 -0.4126600 -2.4736919 0.1138318 0.2076578 0.1408161 -1.8151233 21 Si 3.4008135 0.1167332 0.2719280 0.0651926 3.1202833 0.0859004 0.1394925 0.0147311 3.0610805 22 Si 3.4008135 -0.1167332 0.2719280 -0.0651926 3.1202833 -0.0859004 0.1394925 -0.0147311 3.0610805 23 Si 3.4008135 0.1167332 0.2719280 0.0651926 3.1202833 0.0859004 0.1394925 0.0147311 3.0610805 24 Si 3.4008135 -0.1167332 0.2719280 -0.0651926 3.1202833 -0.0859004 0.1394925 -0.0147311 3.0610805 25 Lu 3.7713510 -0.4588919 -0.0256342 -0.4238348 3.5787913 -0.1198467 0.1234299 -0.1179725 3.7418404 26 Lu 3.7713510 0.4588919 -0.0256342 0.4238348 3.5787913 0.1198467 0.1234299 0.1179725 3.7418404 27 Lu 3.7713510 -0.4588919 -0.0256342 -0.4238348 3.5787913 -0.1198467 0.1234299 -0.1179725 3.7418404 28 Lu 3.7713510 0.4588919 -0.0256342 0.4238348 3.5787913 0.1198467 0.1234299 0.1179725 3.7418404 29 Lu 3.3412237 0.1190133 -0.1880497 0.1315302 3.7079987 0.0170639 -0.2201590 0.0107275 3.8621842 30 Lu 3.3412237 -0.1190133 -0.1880497 -0.1315302 3.7079987 -0.0170639 -0.2201590 -0.0107275 3.8621842 31 Lu 3.3412237 0.1190133 -0.1880497 0.1315302 3.7079987 0.0170639 -0.2201590 0.0107275 3.8621842 32 Lu 3.3412237 -0.1190133 -0.1880497 -0.1315302 3.7079987 -0.0170639 -0.2201590 -0.0107275 3.8621842 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 384/384 Permutation basis: 22848/22848 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 4752 Number of blocks in projector: 4752 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 238 eigenvectors found. (2) Block: 524 / 524 (2) 258 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 508 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 16 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 238 eigenvectors found. (2) Block: 524 / 524 (2) 258 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 508 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 16 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 239 eigenvectors found. (2) Block: 524 / 524 (2) 265 eigenvectors found. (2) Complementary block size: 20 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 513 eigenvectors found. (1) Complementary block size: 26 (1) Compute compressed projector. (1) Use standard solver. (1) 11 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. Tree of FC basis block matrices: - (4752, 4681), data: False |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (1024, 1009), data: False |-- (1024, 11), data: (1024, 26) @ (26, 11) |-- (524, 513), data: False |-- (524, 9), data: (524, 20) @ (20, 9) |-- (274, 265), data: True |-- (250, 239), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (1024, 1008), data: False |-- (1024, 16), data: (1024, 32) @ (32, 16) |-- (524, 508), data: False |-- (524, 12), data: (524, 28) @ (28, 12) |-- (274, 258), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (1024, 1008), data: False |-- (1024, 16), data: (1024, 32) @ (32, 16) |-- (524, 508), data: False |-- (524, 12), data: (524, 28) @ (28, 12) |-- (274, 258), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True ----- Solver_atoms: 1 -- 128 / 128 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 960 - Time: 1.935 Solver_block: 200 / 960 - Time: 1.695 Solver_block: 300 / 960 - Time: 1.793 Solver_block: 400 / 960 - Time: 1.566 Solver_block: 500 / 960 - Time: 1.666 Solver_block: 600 / 960 - Time: 2.178 Solver_block: 700 / 960 - Time: 1.809 Solver_block: 800 / 960 - Time: 1.820 Solver_block: 900 / 960 - Time: 1.577 Solver_block: 960 / 960 - Time: 1.218 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 17.855 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 384/384 Permutation basis: 22848/22848 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 4752 Number of blocks in projector: 4752 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 238 eigenvectors found. (2) Block: 524 / 524 (2) 258 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 508 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 16 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 238 eigenvectors found. (2) Block: 524 / 524 (2) 258 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 508 eigenvectors found. (1) Complementary block size: 32 (1) Compute compressed projector. (1) Use standard solver. (1) 16 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1024 Use submatrix version of eigh solver. (1) Block: 500 / 1024 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 237 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 13 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 1024 / 1024 (2) Block: 250 / 524 (2) 239 eigenvectors found. (2) Block: 524 / 524 (2) 265 eigenvectors found. (2) Complementary block size: 20 (2) Compute compressed projector. (2) Use standard solver. (2) 9 eigenvectors found. (1) 513 eigenvectors found. (1) Complementary block size: 26 (1) Compute compressed projector. (1) Use standard solver. (1) 11 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 242 eigenvectors found. (2) Block: 500 / 560 (2) 242 eigenvectors found. (2) Block: 560 / 560 (2) 54 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 552 eigenvectors found. (1) Complementary block size: 7 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. Tree of FC basis block matrices: - (4752, 4681), data: False |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (560, 552), data: False |-- (560, 552), data: False |-- (560, 14), data: (560, 22) @ (22, 14) |-- (60, 54), data: True |-- (250, 242), data: True |-- (250, 242), data: True |-- (1024, 1009), data: False |-- (1024, 11), data: (1024, 26) @ (26, 11) |-- (524, 513), data: False |-- (524, 9), data: (524, 20) @ (20, 9) |-- (274, 265), data: True |-- (250, 239), data: True |-- (500, 485), data: False |-- (500, 13), data: (500, 28) @ (28, 13) |-- (250, 237), data: True |-- (250, 235), data: True |-- (1024, 1008), data: False |-- (1024, 16), data: (1024, 32) @ (32, 16) |-- (524, 508), data: False |-- (524, 12), data: (524, 28) @ (28, 12) |-- (274, 258), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (1024, 1008), data: False |-- (1024, 16), data: (1024, 32) @ (32, 16) |-- (524, 508), data: False |-- (524, 12), data: (524, 28) @ (28, 12) |-- (274, 258), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True Max drift after symmetrization by symfc projector: 0.00000000 (xx) 0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 02:40:40]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 02:40:41]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 2 1] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.094551350304767 -3.283393610000000 0.000000000000000 b 7.094551350304767 3.283393610000000 0.000000000000000 c -5.378037427200898 0.000000000000000 8.539465279853262 Atomic positions (fractional): 1 O 0.38433230922387 0.57976445471542 0.10182245114201 15.999 2 O 0.42023554528458 0.61566769077613 0.39817754885799 15.999 3 O 0.61566769077613 0.42023554528458 0.89817754885799 15.999 4 O 0.57976445471542 0.38433230922387 0.60182245114201 15.999 5 O 0.13063120762157 0.27460729249088 0.94120500829108 15.999 6 O 0.72539270750912 0.86936879237843 0.55879499170892 15.999 7 O 0.86936879237843 0.72539270750912 0.05879499170892 15.999 8 O 0.27460729249088 0.13063120762157 0.44120500829108 15.999 9 O 0.45077345391415 0.14953832475035 0.82429013287416 15.999 10 O 0.85046167524965 0.54922654608585 0.67570986712584 15.999 11 O 0.54922654608585 0.85046167524965 0.17570986712584 15.999 12 O 0.14953832475035 0.45077345391415 0.32429013287416 15.999 13 O 0.08247472323951 0.09254337761219 0.13585146250667 15.999 14 O 0.90745662238781 0.91752527676049 0.36414853749333 15.999 15 O 0.91752527676049 0.90745662238781 0.86414853749333 15.999 16 O 0.09254337761219 0.08247472323951 0.63585146250667 15.999 17 O 0.82571109630785 0.41171446591204 0.32304526602961 15.999 18 O 0.58828553408796 0.17428890369215 0.17695473397039 15.999 19 O 0.17428890369215 0.58828553408796 0.67695473397039 15.999 20 O 0.41171446591204 0.82571109630785 0.82304526602961 15.999 21 Si 0.27578654073052 0.09029163145798 0.80767958826504 28.085 22 Si 0.90970836854202 0.72421345926948 0.69232041173496 28.085 23 Si 0.72421345926948 0.90970836854202 0.19232041173496 28.085 24 Si 0.09029163145798 0.27578654073052 0.30767958826504 28.085 25 Lu 0.23512493277714 0.48615124037489 0.16396514248517 174.967 26 Lu 0.51384875962511 0.76487506722286 0.33603485751483 174.967 27 Lu 0.76487506722286 0.51384875962511 0.83603485751483 174.967 28 Lu 0.48615124037489 0.23512493277714 0.66396514248517 174.967 29 Lu 0.22117273534662 0.70667140167434 0.53436038850879 174.967 30 Lu 0.29332859832565 0.77882726465338 0.96563961149121 174.967 31 Lu 0.77882726465338 0.29332859832565 0.46563961149121 174.967 32 Lu 0.70667140167435 0.22117273534662 0.03436038850879 174.967 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.189102700609535 0.000000000000000 0.000000000000000 b 0.000000000000000 13.133574440000000 0.000000000000000 c -5.378037427200898 0.000000000000000 8.539465279853262 Atomic positions (fractional): 1 O 0.98204838196964 0.29885803637289 0.10182245114201 15.999 > 1 2 O 0.98204838196964 0.79885803637289 0.10182245114201 15.999 > 1 3 O 0.01795161803036 0.29885803637289 0.39817754885799 15.999 > 3 4 O 0.01795161803036 0.79885803637289 0.39817754885799 15.999 > 3 5 O 0.01795161803036 0.20114196362711 0.89817754885799 15.999 > 5 6 O 0.01795161803036 0.70114196362711 0.89817754885799 15.999 > 5 7 O 0.98204838196964 0.20114196362711 0.60182245114201 15.999 > 7 8 O 0.98204838196964 0.70114196362711 0.60182245114201 15.999 > 7 9 O 0.20261925005622 0.03599402121733 0.94120500829108 15.999 > 9 10 O 0.20261925005622 0.53599402121733 0.94120500829108 15.999 > 9 11 O 0.79738074994378 0.03599402121733 0.55879499170892 15.999 > 11 12 O 0.79738074994378 0.53599402121733 0.55879499170892 15.999 > 11 13 O 0.79738074994378 0.46400597878267 0.05879499170892 15.999 > 13 14 O 0.79738074994378 0.96400597878267 0.05879499170892 15.999 > 13 15 O 0.20261925005622 0.46400597878267 0.44120500829108 15.999 > 15 16 O 0.20261925005622 0.96400597878267 0.44120500829108 15.999 > 15 17 O 0.30015588933225 0.42469121770905 0.82429013287416 15.999 > 17 18 O 0.30015588933225 0.92469121770905 0.82429013287416 15.999 > 17 19 O 0.19984411066775 0.17469121770905 0.67570986712584 15.999 > 19 20 O 0.19984411066775 0.67469121770905 0.67570986712584 15.999 > 19 21 O 0.69984411066775 0.07530878229095 0.17570986712584 15.999 > 21 22 O 0.69984411066775 0.57530878229095 0.17570986712584 15.999 > 21 23 O 0.80015588933225 0.32530878229095 0.32429013287416 15.999 > 23 24 O 0.80015588933225 0.82530878229095 0.32429013287416 15.999 > 23 25 O 0.58750905042585 0.25251716359317 0.13585146250667 15.999 > 25 26 O 0.58750905042585 0.75251716359317 0.13585146250667 15.999 > 25 27 O 0.91249094957415 0.00251716359317 0.36414853749333 15.999 > 27 28 O 0.91249094957415 0.50251716359317 0.36414853749333 15.999 > 27 29 O 0.41249094957415 0.24748283640683 0.86414853749333 15.999 > 29 30 O 0.41249094957415 0.74748283640683 0.86414853749333 15.999 > 29 31 O 0.08750905042585 0.49748283640683 0.63585146250667 15.999 > 31 32 O 0.08750905042585 0.99748283640683 0.63585146250667 15.999 > 31 33 O 0.11871278110995 0.14650084240105 0.32304526602961 15.999 > 33 34 O 0.11871278110995 0.64650084240105 0.32304526602961 15.999 > 33 35 O 0.88128721889006 0.14650084240105 0.17695473397039 15.999 > 35 36 O 0.88128721889006 0.64650084240105 0.17695473397039 15.999 > 35 37 O 0.88128721889006 0.35349915759895 0.67695473397039 15.999 > 37 38 O 0.88128721889006 0.85349915759895 0.67695473397039 15.999 > 37 39 O 0.11871278110995 0.35349915759895 0.82304526602961 15.999 > 39 40 O 0.11871278110995 0.85349915759895 0.82304526602961 15.999 > 39 41 O 0.48204838196964 0.04885803637289 0.10182245114201 15.999 > 1 42 O 0.48204838196964 0.54885803637289 0.10182245114201 15.999 > 1 43 O 0.51795161803036 0.04885803637289 0.39817754885799 15.999 > 3 44 O 0.51795161803036 0.54885803637289 0.39817754885799 15.999 > 3 45 O 0.51795161803036 0.45114196362711 0.89817754885799 15.999 > 5 46 O 0.51795161803036 0.95114196362711 0.89817754885799 15.999 > 5 47 O 0.48204838196964 0.45114196362711 0.60182245114201 15.999 > 7 48 O 0.48204838196964 0.95114196362711 0.60182245114201 15.999 > 7 49 O 0.70261925005622 0.28599402121733 0.94120500829108 15.999 > 9 50 O 0.70261925005622 0.78599402121733 0.94120500829108 15.999 > 9 51 O 0.29738074994378 0.28599402121733 0.55879499170892 15.999 > 11 52 O 0.29738074994378 0.78599402121733 0.55879499170892 15.999 > 11 53 O 0.29738074994378 0.21400597878267 0.05879499170892 15.999 > 13 54 O 0.29738074994378 0.71400597878267 0.05879499170892 15.999 > 13 55 O 0.70261925005622 0.21400597878267 0.44120500829108 15.999 > 15 56 O 0.70261925005622 0.71400597878267 0.44120500829108 15.999 > 15 57 O 0.80015588933225 0.17469121770905 0.82429013287416 15.999 > 17 58 O 0.80015588933225 0.67469121770905 0.82429013287416 15.999 > 17 59 O 0.69984411066775 0.42469121770905 0.67570986712584 15.999 > 19 60 O 0.69984411066775 0.92469121770905 0.67570986712584 15.999 > 19 61 O 0.19984411066775 0.32530878229095 0.17570986712584 15.999 > 21 62 O 0.19984411066775 0.82530878229095 0.17570986712584 15.999 > 21 63 O 0.30015588933225 0.07530878229095 0.32429013287416 15.999 > 23 64 O 0.30015588933225 0.57530878229095 0.32429013287416 15.999 > 23 65 O 0.08750905042585 0.00251716359317 0.13585146250667 15.999 > 25 66 O 0.08750905042585 0.50251716359317 0.13585146250667 15.999 > 25 67 O 0.41249094957415 0.25251716359317 0.36414853749333 15.999 > 27 68 O 0.41249094957415 0.75251716359317 0.36414853749333 15.999 > 27 69 O 0.91249094957415 0.49748283640683 0.86414853749333 15.999 > 29 70 O 0.91249094957415 0.99748283640683 0.86414853749333 15.999 > 29 71 O 0.58750905042585 0.24748283640683 0.63585146250667 15.999 > 31 72 O 0.58750905042585 0.74748283640683 0.63585146250667 15.999 > 31 73 O 0.61871278110994 0.39650084240105 0.32304526602961 15.999 > 33 74 O 0.61871278110994 0.89650084240105 0.32304526602961 15.999 > 33 75 O 0.38128721889006 0.39650084240105 0.17695473397039 15.999 > 35 76 O 0.38128721889006 0.89650084240105 0.17695473397039 15.999 > 35 77 O 0.38128721889006 0.10349915759895 0.67695473397039 15.999 > 37 78 O 0.38128721889006 0.60349915759895 0.67695473397039 15.999 > 37 79 O 0.61871278110994 0.10349915759895 0.82304526602961 15.999 > 39 80 O 0.61871278110994 0.60349915759895 0.82304526602961 15.999 > 39 81 Si 0.18303908609425 0.45362627268187 0.80767958826504 28.085 > 81 82 Si 0.18303908609425 0.95362627268186 0.80767958826504 28.085 > 81 83 Si 0.31696091390575 0.20362627268187 0.69232041173496 28.085 > 83 84 Si 0.31696091390575 0.70362627268186 0.69232041173496 28.085 > 83 85 Si 0.81696091390575 0.04637372731814 0.19232041173496 28.085 > 85 86 Si 0.81696091390575 0.54637372731814 0.19232041173496 28.085 > 85 87 Si 0.68303908609425 0.29637372731813 0.30767958826504 28.085 > 87 88 Si 0.68303908609425 0.79637372731814 0.30767958826504 28.085 > 87 89 Si 0.68303908609425 0.20362627268187 0.80767958826504 28.085 > 81 90 Si 0.68303908609425 0.70362627268186 0.80767958826504 28.085 > 81 91 Si 0.81696091390575 0.45362627268187 0.69232041173496 28.085 > 83 92 Si 0.81696091390575 0.95362627268186 0.69232041173496 28.085 > 83 93 Si 0.31696091390575 0.29637372731813 0.19232041173496 28.085 > 85 94 Si 0.31696091390575 0.79637372731814 0.19232041173496 28.085 > 85 95 Si 0.18303908609425 0.04637372731814 0.30767958826504 28.085 > 87 96 Si 0.18303908609425 0.54637372731814 0.30767958826504 28.085 > 87 97 Lu 0.86063808657602 0.31275657689944 0.16396514248517 174.967 > 97 98 Lu 0.86063808657602 0.81275657689944 0.16396514248517 174.967 > 97 99 Lu 0.13936191342398 0.31275657689944 0.33603485751483 174.967 > 99 100 Lu 0.13936191342398 0.81275657689944 0.33603485751483 174.967 > 99 101 Lu 0.13936191342398 0.18724342310056 0.83603485751483 174.967 > 101 102 Lu 0.13936191342398 0.68724342310056 0.83603485751483 174.967 > 101 103 Lu 0.86063808657602 0.18724342310056 0.66396514248517 174.967 > 103 104 Lu 0.86063808657602 0.68724342310056 0.66396514248517 174.967 > 103 105 Lu 0.96392206851048 0.37137466658193 0.53436038850879 174.967 > 105 106 Lu 0.96392206851048 0.87137466658193 0.53436038850879 174.967 > 105 107 Lu 0.03607793148952 0.37137466658193 0.96563961149121 174.967 > 107 108 Lu 0.03607793148952 0.87137466658193 0.96563961149121 174.967 > 107 109 Lu 0.03607793148952 0.12862533341807 0.46563961149121 174.967 > 109 110 Lu 0.03607793148952 0.62862533341807 0.46563961149121 174.967 > 109 111 Lu 0.96392206851048 0.12862533341807 0.03436038850879 174.967 > 111 112 Lu 0.96392206851048 0.62862533341807 0.03436038850879 174.967 > 111 113 Lu 0.36063808657602 0.06275657689944 0.16396514248517 174.967 > 97 114 Lu 0.36063808657602 0.56275657689944 0.16396514248517 174.967 > 97 115 Lu 0.63936191342398 0.06275657689944 0.33603485751483 174.967 > 99 116 Lu 0.63936191342398 0.56275657689944 0.33603485751483 174.967 > 99 117 Lu 0.63936191342398 0.43724342310056 0.83603485751483 174.967 > 101 118 Lu 0.63936191342398 0.93724342310056 0.83603485751483 174.967 > 101 119 Lu 0.36063808657602 0.43724342310056 0.66396514248517 174.967 > 103 120 Lu 0.36063808657602 0.93724342310056 0.66396514248517 174.967 > 103 121 Lu 0.46392206851048 0.12137466658193 0.53436038850879 174.967 > 105 122 Lu 0.46392206851048 0.62137466658193 0.53436038850879 174.967 > 105 123 Lu 0.53607793148952 0.12137466658193 0.96563961149121 174.967 > 107 124 Lu 0.53607793148952 0.62137466658193 0.96563961149121 174.967 > 107 125 Lu 0.53607793148952 0.37862533341807 0.46563961149121 174.967 > 109 126 Lu 0.53607793148952 0.87862533341807 0.46563961149121 174.967 > 109 127 Lu 0.46392206851048 0.37862533341807 0.03436038850879 174.967 > 111 128 Lu 0.46392206851048 0.87862533341807 0.03436038850879 174.967 > 111 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.4915382 0.0000000 -0.0227203 0.0000000 3.4727093 0.0000000 -0.0227158 0.0000000 3.5536219 -------------------------- Born effective charges -------------------------- 1 O -2.7173806 -0.1846342 0.4247700 -0.2478916 -1.9854874 -0.0034031 0.4275738 -0.0784272 -2.2849547 2 O -2.7173806 0.1846342 0.4247700 0.2478916 -1.9854874 0.0034031 0.4275738 0.0784272 -2.2849547 3 O -2.7173806 -0.1846342 0.4247700 -0.2478916 -1.9854874 -0.0034031 0.4275738 -0.0784272 -2.2849547 4 O -2.7173806 0.1846342 0.4247700 0.2478916 -1.9854874 0.0034031 0.4275738 0.0784272 -2.2849547 5 O -1.4805035 0.2080606 -0.3014404 0.2038587 -2.2986471 -0.2211319 -0.2608851 -0.2477089 -2.3471269 6 O -1.4805035 -0.2080606 -0.3014404 -0.2038587 -2.2986471 0.2211319 -0.2608851 0.2477089 -2.3471269 7 O -1.4805035 0.2080606 -0.3014404 0.2038587 -2.2986471 -0.2211319 -0.2608851 -0.2477089 -2.3471269 8 O -1.4805035 -0.2080606 -0.3014404 -0.2038587 -2.2986471 0.2211319 -0.2608851 0.2477089 -2.3471269 9 O -2.8868552 0.2541250 0.0007165 0.2980701 -1.3576979 0.1822820 -0.0428456 0.1664130 -1.9183524 10 O -2.8868552 -0.2541250 0.0007165 -0.2980701 -1.3576979 -0.1822820 -0.0428456 -0.1664130 -1.9183524 11 O -2.8868552 0.2541250 0.0007165 0.2980701 -1.3576979 0.1822820 -0.0428456 0.1664130 -1.9183524 12 O -2.8868552 -0.2541250 0.0007165 -0.2980701 -1.3576979 -0.1822820 -0.0428456 -0.1664130 -1.9183524 13 O -1.4262180 0.2839163 -0.3610875 0.2644756 -2.2915490 -0.3566398 -0.3742643 -0.2519652 -2.2995478 14 O -1.4262180 -0.2839163 -0.3610875 -0.2644756 -2.2915490 0.3566398 -0.3742643 0.2519652 -2.2995478 15 O -1.4262180 0.2839163 -0.3610875 0.2644756 -2.2915490 -0.3566398 -0.3742643 -0.2519652 -2.2995478 16 O -1.4262180 -0.2839163 -0.3610875 -0.2644756 -2.2915490 0.3566398 -0.3742643 0.2519652 -2.2995478 17 O -2.0024311 0.3768998 0.1787972 0.4126600 -2.4736919 -0.1138318 0.2076578 -0.1408161 -1.8151233 18 O -2.0024311 -0.3768998 0.1787972 -0.4126600 -2.4736919 0.1138318 0.2076578 0.1408161 -1.8151233 19 O -2.0024311 0.3768998 0.1787972 0.4126600 -2.4736919 -0.1138318 0.2076578 -0.1408161 -1.8151233 20 O -2.0024311 -0.3768998 0.1787972 -0.4126600 -2.4736919 0.1138318 0.2076578 0.1408161 -1.8151233 21 Si 3.4008135 0.1167332 0.2719280 0.0651926 3.1202833 0.0859004 0.1394925 0.0147311 3.0610805 22 Si 3.4008135 -0.1167332 0.2719280 -0.0651926 3.1202833 -0.0859004 0.1394925 -0.0147311 3.0610805 23 Si 3.4008135 0.1167332 0.2719280 0.0651926 3.1202833 0.0859004 0.1394925 0.0147311 3.0610805 24 Si 3.4008135 -0.1167332 0.2719280 -0.0651926 3.1202833 -0.0859004 0.1394925 -0.0147311 3.0610805 25 Lu 3.7713510 -0.4588919 -0.0256342 -0.4238348 3.5787913 -0.1198467 0.1234299 -0.1179725 3.7418404 26 Lu 3.7713510 0.4588919 -0.0256342 0.4238348 3.5787913 0.1198467 0.1234299 0.1179725 3.7418404 27 Lu 3.7713510 -0.4588919 -0.0256342 -0.4238348 3.5787913 -0.1198467 0.1234299 -0.1179725 3.7418404 28 Lu 3.7713510 0.4588919 -0.0256342 0.4238348 3.5787913 0.1198467 0.1234299 0.1179725 3.7418404 29 Lu 3.3412237 0.1190133 -0.1880497 0.1315302 3.7079987 0.0170639 -0.2201590 0.0107275 3.8621842 30 Lu 3.3412237 -0.1190133 -0.1880497 -0.1315302 3.7079987 -0.0170639 -0.2201590 -0.0107275 3.8621842 31 Lu 3.3412237 0.1190133 -0.1880497 0.1315302 3.7079987 0.0170639 -0.2201590 0.0107275 3.8621842 32 Lu 3.3412237 -0.1190133 -0.1880497 -0.1315302 3.7079987 -0.0170639 -0.2201590 -0.0107275 3.8621842 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 9, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] 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] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 81, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 97, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Computing fc3[ 105, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0053 0.0000 0.0085] [ 0.0053 0.0000 -0.0085] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (zzz) -0.00000000 (zzz) -0.00000000 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (yx) 0.00000000 (yx) 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 02:41:29]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 02:41:30]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 2 1] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 7.094551350304767 -3.283393610000000 0.000000000000000 b 7.094551350304767 3.283393610000000 0.000000000000000 c -5.378037427200898 0.000000000000000 8.539465279853262 Atomic positions (fractional): 1 O 0.38433230922387 0.57976445471542 0.10182245114201 15.999 2 O 0.42023554528458 0.61566769077613 0.39817754885799 15.999 3 O 0.61566769077613 0.42023554528458 0.89817754885799 15.999 4 O 0.57976445471542 0.38433230922387 0.60182245114201 15.999 5 O 0.13063120762157 0.27460729249088 0.94120500829108 15.999 6 O 0.72539270750912 0.86936879237843 0.55879499170892 15.999 7 O 0.86936879237843 0.72539270750912 0.05879499170892 15.999 8 O 0.27460729249088 0.13063120762157 0.44120500829108 15.999 9 O 0.45077345391415 0.14953832475035 0.82429013287416 15.999 10 O 0.85046167524965 0.54922654608585 0.67570986712584 15.999 11 O 0.54922654608585 0.85046167524965 0.17570986712584 15.999 12 O 0.14953832475035 0.45077345391415 0.32429013287416 15.999 13 O 0.08247472323951 0.09254337761219 0.13585146250667 15.999 14 O 0.90745662238781 0.91752527676049 0.36414853749333 15.999 15 O 0.91752527676049 0.90745662238781 0.86414853749333 15.999 16 O 0.09254337761219 0.08247472323951 0.63585146250667 15.999 17 O 0.82571109630785 0.41171446591204 0.32304526602961 15.999 18 O 0.58828553408796 0.17428890369215 0.17695473397039 15.999 19 O 0.17428890369215 0.58828553408796 0.67695473397039 15.999 20 O 0.41171446591204 0.82571109630785 0.82304526602961 15.999 21 Si 0.27578654073052 0.09029163145798 0.80767958826504 28.085 22 Si 0.90970836854202 0.72421345926948 0.69232041173496 28.085 23 Si 0.72421345926948 0.90970836854202 0.19232041173496 28.085 24 Si 0.09029163145798 0.27578654073052 0.30767958826504 28.085 25 Lu 0.23512493277714 0.48615124037489 0.16396514248517 174.967 26 Lu 0.51384875962511 0.76487506722286 0.33603485751483 174.967 27 Lu 0.76487506722286 0.51384875962511 0.83603485751483 174.967 28 Lu 0.48615124037489 0.23512493277714 0.66396514248517 174.967 29 Lu 0.22117273534662 0.70667140167434 0.53436038850879 174.967 30 Lu 0.29332859832565 0.77882726465338 0.96563961149121 174.967 31 Lu 0.77882726465338 0.29332859832565 0.46563961149121 174.967 32 Lu 0.70667140167435 0.22117273534662 0.03436038850879 174.967 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.189102700609535 0.000000000000000 0.000000000000000 b 0.000000000000000 13.133574440000000 0.000000000000000 c -5.378037427200898 0.000000000000000 8.539465279853262 Atomic positions (fractional): 1 O 0.98204838196964 0.29885803637289 0.10182245114201 15.999 > 1 2 O 0.98204838196964 0.79885803637289 0.10182245114201 15.999 > 1 3 O 0.01795161803036 0.29885803637289 0.39817754885799 15.999 > 3 4 O 0.01795161803036 0.79885803637289 0.39817754885799 15.999 > 3 5 O 0.01795161803036 0.20114196362711 0.89817754885799 15.999 > 5 6 O 0.01795161803036 0.70114196362711 0.89817754885799 15.999 > 5 7 O 0.98204838196964 0.20114196362711 0.60182245114201 15.999 > 7 8 O 0.98204838196964 0.70114196362711 0.60182245114201 15.999 > 7 9 O 0.20261925005622 0.03599402121733 0.94120500829108 15.999 > 9 10 O 0.20261925005622 0.53599402121733 0.94120500829108 15.999 > 9 11 O 0.79738074994378 0.03599402121733 0.55879499170892 15.999 > 11 12 O 0.79738074994378 0.53599402121733 0.55879499170892 15.999 > 11 13 O 0.79738074994378 0.46400597878267 0.05879499170892 15.999 > 13 14 O 0.79738074994378 0.96400597878267 0.05879499170892 15.999 > 13 15 O 0.20261925005622 0.46400597878267 0.44120500829108 15.999 > 15 16 O 0.20261925005622 0.96400597878267 0.44120500829108 15.999 > 15 17 O 0.30015588933225 0.42469121770905 0.82429013287416 15.999 > 17 18 O 0.30015588933225 0.92469121770905 0.82429013287416 15.999 > 17 19 O 0.19984411066775 0.17469121770905 0.67570986712584 15.999 > 19 20 O 0.19984411066775 0.67469121770905 0.67570986712584 15.999 > 19 21 O 0.69984411066775 0.07530878229095 0.17570986712584 15.999 > 21 22 O 0.69984411066775 0.57530878229095 0.17570986712584 15.999 > 21 23 O 0.80015588933225 0.32530878229095 0.32429013287416 15.999 > 23 24 O 0.80015588933225 0.82530878229095 0.32429013287416 15.999 > 23 25 O 0.58750905042585 0.25251716359317 0.13585146250667 15.999 > 25 26 O 0.58750905042585 0.75251716359317 0.13585146250667 15.999 > 25 27 O 0.91249094957415 0.00251716359317 0.36414853749333 15.999 > 27 28 O 0.91249094957415 0.50251716359317 0.36414853749333 15.999 > 27 29 O 0.41249094957415 0.24748283640683 0.86414853749333 15.999 > 29 30 O 0.41249094957415 0.74748283640683 0.86414853749333 15.999 > 29 31 O 0.08750905042585 0.49748283640683 0.63585146250667 15.999 > 31 32 O 0.08750905042585 0.99748283640683 0.63585146250667 15.999 > 31 33 O 0.11871278110995 0.14650084240105 0.32304526602961 15.999 > 33 34 O 0.11871278110995 0.64650084240105 0.32304526602961 15.999 > 33 35 O 0.88128721889006 0.14650084240105 0.17695473397039 15.999 > 35 36 O 0.88128721889006 0.64650084240105 0.17695473397039 15.999 > 35 37 O 0.88128721889006 0.35349915759895 0.67695473397039 15.999 > 37 38 O 0.88128721889006 0.85349915759895 0.67695473397039 15.999 > 37 39 O 0.11871278110995 0.35349915759895 0.82304526602961 15.999 > 39 40 O 0.11871278110995 0.85349915759895 0.82304526602961 15.999 > 39 41 O 0.48204838196964 0.04885803637289 0.10182245114201 15.999 > 1 42 O 0.48204838196964 0.54885803637289 0.10182245114201 15.999 > 1 43 O 0.51795161803036 0.04885803637289 0.39817754885799 15.999 > 3 44 O 0.51795161803036 0.54885803637289 0.39817754885799 15.999 > 3 45 O 0.51795161803036 0.45114196362711 0.89817754885799 15.999 > 5 46 O 0.51795161803036 0.95114196362711 0.89817754885799 15.999 > 5 47 O 0.48204838196964 0.45114196362711 0.60182245114201 15.999 > 7 48 O 0.48204838196964 0.95114196362711 0.60182245114201 15.999 > 7 49 O 0.70261925005622 0.28599402121733 0.94120500829108 15.999 > 9 50 O 0.70261925005622 0.78599402121733 0.94120500829108 15.999 > 9 51 O 0.29738074994378 0.28599402121733 0.55879499170892 15.999 > 11 52 O 0.29738074994378 0.78599402121733 0.55879499170892 15.999 > 11 53 O 0.29738074994378 0.21400597878267 0.05879499170892 15.999 > 13 54 O 0.29738074994378 0.71400597878267 0.05879499170892 15.999 > 13 55 O 0.70261925005622 0.21400597878267 0.44120500829108 15.999 > 15 56 O 0.70261925005622 0.71400597878267 0.44120500829108 15.999 > 15 57 O 0.80015588933225 0.17469121770905 0.82429013287416 15.999 > 17 58 O 0.80015588933225 0.67469121770905 0.82429013287416 15.999 > 17 59 O 0.69984411066775 0.42469121770905 0.67570986712584 15.999 > 19 60 O 0.69984411066775 0.92469121770905 0.67570986712584 15.999 > 19 61 O 0.19984411066775 0.32530878229095 0.17570986712584 15.999 > 21 62 O 0.19984411066775 0.82530878229095 0.17570986712584 15.999 > 21 63 O 0.30015588933225 0.07530878229095 0.32429013287416 15.999 > 23 64 O 0.30015588933225 0.57530878229095 0.32429013287416 15.999 > 23 65 O 0.08750905042585 0.00251716359317 0.13585146250667 15.999 > 25 66 O 0.08750905042585 0.50251716359317 0.13585146250667 15.999 > 25 67 O 0.41249094957415 0.25251716359317 0.36414853749333 15.999 > 27 68 O 0.41249094957415 0.75251716359317 0.36414853749333 15.999 > 27 69 O 0.91249094957415 0.49748283640683 0.86414853749333 15.999 > 29 70 O 0.91249094957415 0.99748283640683 0.86414853749333 15.999 > 29 71 O 0.58750905042585 0.24748283640683 0.63585146250667 15.999 > 31 72 O 0.58750905042585 0.74748283640683 0.63585146250667 15.999 > 31 73 O 0.61871278110994 0.39650084240105 0.32304526602961 15.999 > 33 74 O 0.61871278110994 0.89650084240105 0.32304526602961 15.999 > 33 75 O 0.38128721889006 0.39650084240105 0.17695473397039 15.999 > 35 76 O 0.38128721889006 0.89650084240105 0.17695473397039 15.999 > 35 77 O 0.38128721889006 0.10349915759895 0.67695473397039 15.999 > 37 78 O 0.38128721889006 0.60349915759895 0.67695473397039 15.999 > 37 79 O 0.61871278110994 0.10349915759895 0.82304526602961 15.999 > 39 80 O 0.61871278110994 0.60349915759895 0.82304526602961 15.999 > 39 81 Si 0.18303908609425 0.45362627268187 0.80767958826504 28.085 > 81 82 Si 0.18303908609425 0.95362627268186 0.80767958826504 28.085 > 81 83 Si 0.31696091390575 0.20362627268187 0.69232041173496 28.085 > 83 84 Si 0.31696091390575 0.70362627268186 0.69232041173496 28.085 > 83 85 Si 0.81696091390575 0.04637372731814 0.19232041173496 28.085 > 85 86 Si 0.81696091390575 0.54637372731814 0.19232041173496 28.085 > 85 87 Si 0.68303908609425 0.29637372731813 0.30767958826504 28.085 > 87 88 Si 0.68303908609425 0.79637372731814 0.30767958826504 28.085 > 87 89 Si 0.68303908609425 0.20362627268187 0.80767958826504 28.085 > 81 90 Si 0.68303908609425 0.70362627268186 0.80767958826504 28.085 > 81 91 Si 0.81696091390575 0.45362627268187 0.69232041173496 28.085 > 83 92 Si 0.81696091390575 0.95362627268186 0.69232041173496 28.085 > 83 93 Si 0.31696091390575 0.29637372731813 0.19232041173496 28.085 > 85 94 Si 0.31696091390575 0.79637372731814 0.19232041173496 28.085 > 85 95 Si 0.18303908609425 0.04637372731814 0.30767958826504 28.085 > 87 96 Si 0.18303908609425 0.54637372731814 0.30767958826504 28.085 > 87 97 Lu 0.86063808657602 0.31275657689944 0.16396514248517 174.967 > 97 98 Lu 0.86063808657602 0.81275657689944 0.16396514248517 174.967 > 97 99 Lu 0.13936191342398 0.31275657689944 0.33603485751483 174.967 > 99 100 Lu 0.13936191342398 0.81275657689944 0.33603485751483 174.967 > 99 101 Lu 0.13936191342398 0.18724342310056 0.83603485751483 174.967 > 101 102 Lu 0.13936191342398 0.68724342310056 0.83603485751483 174.967 > 101 103 Lu 0.86063808657602 0.18724342310056 0.66396514248517 174.967 > 103 104 Lu 0.86063808657602 0.68724342310056 0.66396514248517 174.967 > 103 105 Lu 0.96392206851048 0.37137466658193 0.53436038850879 174.967 > 105 106 Lu 0.96392206851048 0.87137466658193 0.53436038850879 174.967 > 105 107 Lu 0.03607793148952 0.37137466658193 0.96563961149121 174.967 > 107 108 Lu 0.03607793148952 0.87137466658193 0.96563961149121 174.967 > 107 109 Lu 0.03607793148952 0.12862533341807 0.46563961149121 174.967 > 109 110 Lu 0.03607793148952 0.62862533341807 0.46563961149121 174.967 > 109 111 Lu 0.96392206851048 0.12862533341807 0.03436038850879 174.967 > 111 112 Lu 0.96392206851048 0.62862533341807 0.03436038850879 174.967 > 111 113 Lu 0.36063808657602 0.06275657689944 0.16396514248517 174.967 > 97 114 Lu 0.36063808657602 0.56275657689944 0.16396514248517 174.967 > 97 115 Lu 0.63936191342398 0.06275657689944 0.33603485751483 174.967 > 99 116 Lu 0.63936191342398 0.56275657689944 0.33603485751483 174.967 > 99 117 Lu 0.63936191342398 0.43724342310056 0.83603485751483 174.967 > 101 118 Lu 0.63936191342398 0.93724342310056 0.83603485751483 174.967 > 101 119 Lu 0.36063808657602 0.43724342310056 0.66396514248517 174.967 > 103 120 Lu 0.36063808657602 0.93724342310056 0.66396514248517 174.967 > 103 121 Lu 0.46392206851048 0.12137466658193 0.53436038850879 174.967 > 105 122 Lu 0.46392206851048 0.62137466658193 0.53436038850879 174.967 > 105 123 Lu 0.53607793148952 0.12137466658193 0.96563961149121 174.967 > 107 124 Lu 0.53607793148952 0.62137466658193 0.96563961149121 174.967 > 107 125 Lu 0.53607793148952 0.37862533341807 0.46563961149121 174.967 > 109 126 Lu 0.53607793148952 0.87862533341807 0.46563961149121 174.967 > 109 127 Lu 0.46392206851048 0.37862533341807 0.03436038850879 174.967 > 111 128 Lu 0.46392206851048 0.87862533341807 0.03436038850879 174.967 > 111 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.4915382 0.0000000 -0.0227203 0.0000000 3.4727093 0.0000000 -0.0227158 0.0000000 3.5536219 -------------------------- Born effective charges -------------------------- 1 O -2.7173806 -0.1846342 0.4247700 -0.2478916 -1.9854874 -0.0034031 0.4275738 -0.0784272 -2.2849547 2 O -2.7173806 0.1846342 0.4247700 0.2478916 -1.9854874 0.0034031 0.4275738 0.0784272 -2.2849547 3 O -2.7173806 -0.1846342 0.4247700 -0.2478916 -1.9854874 -0.0034031 0.4275738 -0.0784272 -2.2849547 4 O -2.7173806 0.1846342 0.4247700 0.2478916 -1.9854874 0.0034031 0.4275738 0.0784272 -2.2849547 5 O -1.4805035 0.2080606 -0.3014404 0.2038587 -2.2986471 -0.2211319 -0.2608851 -0.2477089 -2.3471269 6 O -1.4805035 -0.2080606 -0.3014404 -0.2038587 -2.2986471 0.2211319 -0.2608851 0.2477089 -2.3471269 7 O -1.4805035 0.2080606 -0.3014404 0.2038587 -2.2986471 -0.2211319 -0.2608851 -0.2477089 -2.3471269 8 O -1.4805035 -0.2080606 -0.3014404 -0.2038587 -2.2986471 0.2211319 -0.2608851 0.2477089 -2.3471269 9 O -2.8868552 0.2541250 0.0007165 0.2980701 -1.3576979 0.1822820 -0.0428456 0.1664130 -1.9183524 10 O -2.8868552 -0.2541250 0.0007165 -0.2980701 -1.3576979 -0.1822820 -0.0428456 -0.1664130 -1.9183524 11 O -2.8868552 0.2541250 0.0007165 0.2980701 -1.3576979 0.1822820 -0.0428456 0.1664130 -1.9183524 12 O -2.8868552 -0.2541250 0.0007165 -0.2980701 -1.3576979 -0.1822820 -0.0428456 -0.1664130 -1.9183524 13 O -1.4262180 0.2839163 -0.3610875 0.2644756 -2.2915490 -0.3566398 -0.3742643 -0.2519652 -2.2995478 14 O -1.4262180 -0.2839163 -0.3610875 -0.2644756 -2.2915490 0.3566398 -0.3742643 0.2519652 -2.2995478 15 O -1.4262180 0.2839163 -0.3610875 0.2644756 -2.2915490 -0.3566398 -0.3742643 -0.2519652 -2.2995478 16 O -1.4262180 -0.2839163 -0.3610875 -0.2644756 -2.2915490 0.3566398 -0.3742643 0.2519652 -2.2995478 17 O -2.0024311 0.3768998 0.1787972 0.4126600 -2.4736919 -0.1138318 0.2076578 -0.1408161 -1.8151233 18 O -2.0024311 -0.3768998 0.1787972 -0.4126600 -2.4736919 0.1138318 0.2076578 0.1408161 -1.8151233 19 O -2.0024311 0.3768998 0.1787972 0.4126600 -2.4736919 -0.1138318 0.2076578 -0.1408161 -1.8151233 20 O -2.0024311 -0.3768998 0.1787972 -0.4126600 -2.4736919 0.1138318 0.2076578 0.1408161 -1.8151233 21 Si 3.4008135 0.1167332 0.2719280 0.0651926 3.1202833 0.0859004 0.1394925 0.0147311 3.0610805 22 Si 3.4008135 -0.1167332 0.2719280 -0.0651926 3.1202833 -0.0859004 0.1394925 -0.0147311 3.0610805 23 Si 3.4008135 0.1167332 0.2719280 0.0651926 3.1202833 0.0859004 0.1394925 0.0147311 3.0610805 24 Si 3.4008135 -0.1167332 0.2719280 -0.0651926 3.1202833 -0.0859004 0.1394925 -0.0147311 3.0610805 25 Lu 3.7713510 -0.4588919 -0.0256342 -0.4238348 3.5787913 -0.1198467 0.1234299 -0.1179725 3.7418404 26 Lu 3.7713510 0.4588919 -0.0256342 0.4238348 3.5787913 0.1198467 0.1234299 0.1179725 3.7418404 27 Lu 3.7713510 -0.4588919 -0.0256342 -0.4238348 3.5787913 -0.1198467 0.1234299 -0.1179725 3.7418404 28 Lu 3.7713510 0.4588919 -0.0256342 0.4238348 3.5787913 0.1198467 0.1234299 0.1179725 3.7418404 29 Lu 3.3412237 0.1190133 -0.1880497 0.1315302 3.7079987 0.0170639 -0.2201590 0.0107275 3.8621842 30 Lu 3.3412237 -0.1190133 -0.1880497 -0.1315302 3.7079987 -0.0170639 -0.2201590 -0.0107275 3.8621842 31 Lu 3.3412237 0.1190133 -0.1880497 0.1315302 3.7079987 0.0170639 -0.2201590 0.0107275 3.8621842 32 Lu 3.3412237 -0.1190133 -0.1880497 -0.1315302 3.7079987 -0.0170639 -0.2201590 -0.0107275 3.8621842 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (zzz) -0.00000000 (zzz) -0.00000000 (zzz) Max drift of fc2: 0.00000000 (xx) 0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 9 9 6 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.56, Number of G-points: 307, Lambda: 0.11 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/140) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 1.621 ( 0.000 0.000 0.000) 0.000 2.159 ( 0.000 0.000 0.000) 0.000 2.288 ( 0.000 0.000 0.000) 0.000 2.489 ( 0.000 0.000 0.000) 0.000 2.616 ( 0.000 0.000 0.000) 0.000 2.694 ( 0.000 0.000 0.000) 0.000 2.778 ( 0.000 0.000 0.000) 0.000 2.814 ( 0.000 0.000 0.000) 0.000 3.430 ( 0.000 0.000 0.000) 0.000 3.479 ( 0.000 0.000 0.000) 0.000 3.502 ( 0.000 0.000 0.000) 0.000 3.585 ( 0.000 0.000 0.000) 0.000 3.788 ( 0.000 0.000 0.000) 0.000 4.101 ( 0.000 0.000 0.000) 0.000 4.275 ( 0.000 0.000 0.000) 0.000 4.416 ( 0.000 0.000 0.000) 0.000 4.563 ( 0.000 0.000 0.000) 0.000 4.662 ( 0.000 0.000 0.000) 0.000 4.682 ( 0.000 0.000 0.000) 0.000 4.704 ( 0.000 0.000 0.000) 0.000 5.122 ( 0.000 0.000 0.000) 0.000 5.146 ( 0.000 0.000 0.000) 0.000 5.209 ( 0.000 0.000 0.000) 0.000 5.694 ( 0.000 0.000 0.000) 0.000 5.790 ( 0.000 0.000 0.000) 0.000 6.086 ( 0.000 0.000 0.000) 0.000 6.235 ( 0.000 0.000 0.000) 0.000 6.319 ( 0.000 0.000 0.000) 0.000 6.421 ( 0.000 0.000 0.000) 0.000 6.517 ( 0.000 0.000 0.000) 0.000 6.522 ( 0.000 0.000 0.000) 0.000 6.873 ( 0.000 0.000 0.000) 0.000 6.890 ( 0.000 0.000 0.000) 0.000 7.480 ( 0.000 0.000 0.000) 0.000 7.506 ( 0.000 0.000 0.000) 0.000 7.963 ( 0.000 0.000 0.000) 0.000 7.970 ( 0.000 0.000 0.000) 0.000 8.518 ( 0.000 0.000 0.000) 0.000 9.047 ( 0.000 0.000 0.000) 0.000 9.198 ( 0.000 0.000 0.000) 0.000 9.268 ( 0.000 0.000 0.000) 0.000 9.475 ( 0.000 0.000 0.000) 0.000 9.614 ( 0.000 0.000 0.000) 0.000 9.848 ( 0.000 0.000 0.000) 0.000 10.357 ( 0.000 0.000 0.000) 0.000 10.381 ( 0.000 0.000 0.000) 0.000 10.482 ( 0.000 0.000 0.000) 0.000 10.784 ( 0.000 0.000 0.000) 0.000 11.120 ( 0.000 0.000 0.000) 0.000 11.217 ( 0.000 0.000 0.000) 0.000 11.381 ( 0.000 0.000 0.000) 0.000 11.428 ( 0.000 0.000 0.000) 0.000 11.924 ( 0.000 0.000 0.000) 0.000 12.066 ( 0.000 0.000 0.000) 0.000 12.151 ( 0.000 0.000 0.000) 0.000 12.194 ( 0.000 0.000 0.000) 0.000 12.657 ( 0.000 0.000 0.000) 0.000 12.778 ( 0.000 0.000 0.000) 0.000 12.938 ( 0.000 0.000 0.000) 0.000 12.994 ( 0.000 0.000 0.000) 0.000 13.798 ( 0.000 0.000 0.000) 0.000 15.071 ( 0.000 0.000 0.000) 0.000 15.122 ( 0.000 0.000 0.000) 0.000 15.300 ( 0.000 0.000 0.000) 0.000 15.347 ( 0.000 0.000 0.000) 0.000 15.379 ( 0.000 0.000 0.000) 0.000 15.825 ( 0.000 0.000 0.000) 0.000 15.966 ( 0.000 0.000 0.000) 0.000 16.047 ( 0.000 0.000 0.000) 0.000 16.146 ( 0.000 0.000 0.000) 0.000 16.333 ( 0.000 0.000 0.000) 0.000 16.633 ( 0.000 0.000 0.000) 0.000 16.770 ( 0.000 0.000 0.000) 0.000 17.223 ( 0.000 0.000 0.000) 0.000 17.755 ( 0.000 0.000 0.000) 0.000 18.294 ( 0.000 0.000 0.000) 0.000 18.768 ( 0.000 0.000 0.000) 0.000 25.804 ( 0.000 0.000 0.000) 0.000 25.854 ( 0.000 0.000 0.000) 0.000 25.988 ( 0.000 0.000 0.000) 0.000 26.075 ( 0.000 0.000 0.000) 0.000 26.144 ( 0.000 0.000 0.000) 0.000 26.452 ( 0.000 0.000 0.000) 0.000 26.922 ( 0.000 0.000 0.000) 0.000 26.959 ( 0.000 0.000 0.000) 0.000 27.102 ( 0.000 0.000 0.000) 0.000 27.426 ( 0.000 0.000 0.000) 0.000 28.343 ( 0.000 0.000 0.000) 0.000 28.574 ( 0.000 0.000 0.000) 0.000 28.745 ( 0.000 0.000 0.000) 0.000 28.883 ( 0.000 0.000 0.000) 0.000 29.092 ( 0.000 0.000 0.000) 0.000 29.771 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/140) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.490 ( 23.132 -18.512 -2.012) 29.696 0.644 ( 12.323 -26.842 15.756) 33.475 0.964 ( 20.019 -39.565 14.912) 46.782 1.728 ( -0.366 -11.946 3.172) 12.365 2.316 ( -3.013 -14.756 -1.432) 15.128 2.347 ( -5.967 -8.190 0.209) 10.135 2.479 ( 2.966 0.151 -2.397) 3.816 2.624 ( -5.285 -5.497 -0.633) 7.652 2.743 ( -6.032 -6.925 5.135) 10.522 2.820 ( 4.116 -2.176 -1.289) 4.831 2.870 ( 4.916 -5.030 -2.979) 7.638 3.325 ( 1.448 11.055 -0.237) 11.152 3.419 ( -0.709 0.623 -0.985) 1.365 3.536 ( -0.257 0.016 -1.235) 1.261 3.611 ( 2.119 -1.409 1.804) 3.119 3.885 ( -1.471 -8.637 -1.397) 8.872 4.060 ( 0.238 4.882 0.255) 4.894 4.207 ( -3.579 6.002 -1.503) 7.148 4.403 ( -3.011 1.977 0.115) 3.604 4.542 ( -2.262 -2.164 0.703) 3.208 4.565 ( -0.377 4.122 1.506) 4.404 4.688 ( -1.580 2.071 -1.420) 2.967 4.882 ( -2.329 -8.792 -3.462) 9.732 5.084 ( -1.099 2.635 1.392) 3.177 5.247 ( 9.444 -3.986 0.179) 10.252 5.289 ( 0.229 -7.537 0.825) 7.585 5.667 ( -1.648 6.302 -3.569) 7.428 5.873 ( -4.218 -5.153 -4.514) 8.045 6.022 ( -0.021 7.145 1.500) 7.301 6.224 ( 0.987 6.521 3.706) 7.566 6.359 ( -1.854 5.542 1.882) 6.139 6.436 ( 1.715 5.160 7.403) 9.185 6.556 ( -5.426 -4.945 5.514) 9.182 6.675 ( 14.462 -1.312 -0.374) 14.527 6.824 ( 0.590 3.381 -2.473) 4.230 7.351 ( -3.797 -4.808 4.628) 7.678 7.477 ( 4.048 1.517 -2.910) 5.211 7.841 ( -7.879 8.998 -1.279) 12.029 7.936 ( -3.364 3.286 3.130) 5.649 7.990 ( -13.328 -7.495 -11.456) 19.106 8.635 ( 5.026 -8.970 -1.038) 10.335 9.177 ( -0.682 -4.071 -10.606) 11.381 9.224 ( -10.017 -7.449 3.065) 12.854 9.474 ( -2.613 -0.410 3.475) 4.368 9.561 ( 11.211 3.042 1.495) 11.712 9.653 ( -0.023 -4.330 1.359) 4.539 9.841 ( 2.574 4.116 8.905) 10.143 10.254 ( -3.597 8.685 0.878) 9.441 10.484 ( -2.516 -4.624 -0.056) 5.264 10.809 ( 2.939 -1.152 2.069) 3.775 11.078 ( -0.642 -2.219 -8.304) 8.619 11.161 ( 0.648 2.766 0.640) 2.912 11.310 ( -4.637 -13.474 -8.249) 16.465 11.458 ( 0.304 -7.391 -0.796) 7.440 11.787 ( 8.408 10.600 20.503) 24.565 11.935 ( -3.230 -1.589 4.297) 5.605 12.056 ( -1.321 1.407 -1.521) 2.457 12.113 ( 1.988 1.606 0.903) 2.711 12.228 ( 0.187 0.196 4.085) 4.094 12.737 ( -4.435 0.979 -4.613) 6.474 12.843 ( -4.504 0.458 -5.934) 7.464 12.976 ( 0.289 0.158 9.930) 9.935 13.457 ( -35.877 -14.774 -10.862) 40.292 13.776 ( -11.692 2.823 16.274) 20.237 14.918 ( 4.501 10.623 -4.544) 12.400 15.203 ( 0.453 8.193 0.154) 8.207 15.306 ( 4.451 -5.392 -0.267) 6.997 15.352 ( -1.847 -3.152 -2.566) 4.464 15.611 ( 12.567 7.504 10.287) 17.890 15.774 ( -5.868 1.733 -0.715) 6.161 16.024 ( -8.137 -0.254 9.526) 12.530 16.033 ( 5.065 2.235 -3.344) 6.468 16.162 ( 6.128 -0.225 -5.670) 8.352 16.348 ( -2.198 -1.661 3.535) 4.481 16.747 ( -11.046 -3.035 3.551) 11.993 16.887 ( -9.536 -9.559 -4.258) 14.158 17.460 ( 48.026 24.889 -10.505) 55.103 17.807 ( 8.285 -1.764 -1.412) 8.588 18.771 ( 1.580 0.144 -1.769) 2.376 18.874 ( 3.582 0.138 -18.057) 18.410 25.816 ( 0.699 -0.740 0.384) 1.088 25.871 ( 0.911 -1.762 0.266) 2.001 25.995 ( -1.103 -0.846 1.625) 2.139 26.077 ( -0.201 -0.131 0.741) 0.779 26.173 ( 0.234 -2.553 0.676) 2.651 26.807 ( -3.442 -2.216 -17.909) 18.371 26.940 ( -3.633 -0.472 -1.480) 3.952 26.987 ( -3.385 -2.213 8.767) 9.655 27.166 ( -1.834 -2.031 5.126) 5.811 27.958 ( -47.726 -14.653 -9.543) 50.829 28.363 ( -2.026 -1.450 0.517) 2.545 28.650 ( -8.428 -8.990 -0.326) 12.328 28.848 ( -3.352 -12.664 -1.143) 13.150 29.106 ( 1.355 -0.603 1.517) 2.122 29.711 ( -1.210 5.103 -4.201) 6.720 30.050 ( 75.875 43.791 19.301) 89.706 ======================= Grid point 2 (3/140) ======================= q-point: ( 0.22 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.958 ( 20.985 -16.450 -0.322) 26.665 1.240 ( 11.047 -23.812 13.365) 29.456 1.724 ( 10.222 -26.231 11.018) 30.232 2.017 ( -0.505 -17.217 4.910) 17.910 2.324 ( -5.393 -3.817 -3.984) 7.715 2.472 ( -2.977 -2.473 -2.341) 4.523 2.618 ( -2.921 -13.510 1.102) 13.866 2.769 ( -1.035 -12.259 0.578) 12.316 2.887 ( 1.274 -3.445 0.961) 3.797 2.910 ( -4.915 -15.099 4.207) 16.427 2.999 ( 5.315 -4.772 -4.476) 8.430 3.207 ( 5.270 2.591 2.065) 6.225 3.382 ( -0.853 2.419 -2.785) 3.786 3.500 ( 0.676 3.298 -1.692) 3.768 3.676 ( 3.493 -1.589 2.960) 4.847 3.928 ( -1.016 2.396 -2.121) 3.357 3.988 ( -5.306 -1.150 -1.153) 5.550 4.043 ( -5.690 4.942 -7.225) 10.441 4.363 ( -3.228 0.042 3.325) 4.634 4.478 ( 1.473 5.661 0.874) 5.914 4.611 ( -2.332 0.689 -0.678) 2.525 4.688 ( 2.286 -6.363 6.667) 9.495 4.954 ( -5.155 -4.029 -0.474) 6.559 5.048 ( 1.675 2.182 -2.279) 3.572 5.371 ( 2.025 -5.588 -0.326) 5.953 5.423 ( 4.378 -2.833 -3.813) 6.460 5.568 ( 2.783 1.434 -1.085) 3.313 5.843 ( -2.562 3.162 -4.154) 5.815 5.919 ( 0.433 5.122 4.170) 6.619 6.131 ( 0.009 5.332 -0.670) 5.374 6.232 ( -1.163 8.039 4.486) 9.279 6.442 ( 0.698 -1.455 -0.641) 1.736 6.594 ( -6.029 -1.104 4.872) 7.830 6.771 ( 3.919 0.925 -1.174) 4.194 6.833 ( 8.388 -4.597 -1.921) 9.756 7.390 ( -4.799 0.120 3.490) 5.935 7.443 ( 4.816 5.237 -5.313) 8.879 7.607 ( -7.321 6.889 -3.129) 10.529 7.837 ( -7.361 4.034 0.551) 8.412 7.946 ( -6.493 -1.419 -5.278) 8.487 8.842 ( 3.167 -9.179 1.374) 9.807 9.177 ( -0.596 -1.334 3.400) 3.701 9.323 ( -7.597 -10.141 -3.997) 13.286 9.477 ( -3.236 -2.239 -5.421) 6.699 9.568 ( -3.322 -3.154 -6.758) 8.164 9.779 ( -1.803 -6.629 -0.091) 6.871 9.866 ( 7.441 1.544 12.343) 14.495 10.095 ( -1.845 6.712 4.464) 8.269 10.539 ( -2.425 -3.915 -0.182) 4.609 10.896 ( 6.071 -3.360 3.734) 7.879 11.072 ( -0.406 1.892 -0.455) 1.988 11.137 ( 6.560 1.584 -0.708) 6.785 11.418 ( 0.402 -2.548 2.566) 3.638 11.609 ( 2.355 -8.728 -0.638) 9.062 11.793 ( 8.117 2.960 -2.411) 8.970 11.977 ( -1.299 -2.980 6.590) 7.348 12.021 ( 0.413 -0.368 -4.128) 4.165 12.124 ( -0.056 0.841 3.685) 3.781 12.216 ( 2.347 3.400 2.996) 5.103 12.641 ( -6.725 1.191 -8.074) 10.575 12.769 ( -3.377 1.013 -4.285) 5.549 13.006 ( -1.818 1.821 9.351) 9.698 13.320 ( -11.897 3.414 -7.269) 14.354 13.681 ( -11.307 6.723 14.410) 19.512 14.807 ( 3.962 3.523 -3.070) 6.126 15.069 ( 2.094 6.752 0.616) 7.096 15.320 ( -4.095 -1.137 -4.056) 5.875 15.482 ( 1.861 -7.785 1.333) 8.115 15.610 ( 2.594 4.081 3.929) 6.230 15.706 ( -5.889 -0.158 -0.577) 5.919 15.970 ( -0.892 4.690 3.440) 5.884 16.021 ( -5.089 0.547 2.942) 5.904 16.173 ( 8.489 1.794 -8.822) 12.374 16.384 ( -1.620 -2.341 3.183) 4.271 16.742 ( -6.383 -1.958 2.459) 7.115 16.951 ( -4.325 -7.544 -5.843) 10.477 17.349 ( 22.149 15.974 -3.891) 27.584 17.903 ( 7.699 -2.120 -0.098) 7.986 18.733 ( 2.323 4.616 -7.112) 8.791 18.828 ( -0.610 -0.331 -1.315) 1.487 25.839 ( 1.176 -1.047 -0.170) 1.584 25.931 ( 1.826 -3.325 1.099) 3.950 26.012 ( -1.084 -1.243 0.944) 1.900 26.088 ( -0.188 -0.576 2.095) 2.181 26.219 ( -0.284 -2.100 0.517) 2.181 26.746 ( -0.168 -0.230 -9.115) 9.120 26.899 ( -4.653 0.269 -2.039) 5.087 27.023 ( -2.173 1.564 13.676) 13.936 27.214 ( -1.081 -4.836 -7.411) 8.915 27.797 ( -16.373 -0.350 -1.709) 16.466 28.360 ( -0.384 0.270 -0.154) 0.494 28.766 ( -3.543 -9.141 2.445) 10.104 29.056 ( -3.899 -14.695 -1.663) 15.294 29.147 ( 1.816 -1.527 3.129) 3.927 29.556 ( -1.846 7.728 -7.185) 10.712 29.971 ( 32.971 23.960 8.201) 41.574 ======================= Grid point 3 (4/140) ======================= q-point: ( 0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.347 ( 15.883 -11.511 0.682) 19.627 1.733 ( 7.943 -18.290 9.020) 21.885 2.077 ( -2.850 -9.478 6.225) 11.691 2.237 ( -2.137 -10.165 -3.931) 11.106 2.433 ( 2.088 -6.319 -0.708) 6.692 2.506 ( -1.237 -5.851 2.285) 6.401 2.753 ( -4.880 -7.185 1.323) 8.786 2.900 ( 2.935 -0.085 2.467) 3.835 2.986 ( -2.147 -0.260 4.446) 4.944 3.027 ( 3.227 -7.622 -1.264) 8.373 3.151 ( -3.006 -10.645 2.815) 11.414 3.301 ( -0.644 3.335 -2.190) 4.041 3.319 ( 1.991 -2.523 -6.135) 6.925 3.494 ( 6.705 -3.747 1.731) 7.873 3.703 ( 1.706 2.598 4.263) 5.276 3.838 ( -9.167 5.159 -5.579) 11.907 3.950 ( 3.982 -3.882 -2.715) 6.189 4.021 ( -1.705 -7.665 -3.904) 8.770 4.353 ( -0.359 3.642 2.683) 4.538 4.357 ( -3.901 4.727 0.924) 6.198 4.670 ( 2.137 -4.602 5.872) 7.760 4.821 ( 0.370 -3.314 2.508) 4.172 4.946 ( -4.667 -0.450 -0.378) 4.704 4.991 ( 0.492 4.110 -1.684) 4.469 5.398 ( -1.742 -2.530 -8.555) 9.090 5.476 ( 2.404 -2.159 1.275) 3.474 5.639 ( 5.192 -2.378 -1.585) 5.926 5.754 ( -0.732 2.358 -2.607) 3.590 5.871 ( 0.492 4.663 7.133) 8.536 6.051 ( 0.036 2.522 -3.603) 4.398 6.156 ( 1.497 2.633 3.951) 4.978 6.456 ( -0.826 -0.692 -2.903) 3.097 6.543 ( -6.641 2.958 2.474) 7.680 6.802 ( 2.214 -2.795 -2.603) 4.414 6.968 ( 6.689 -3.834 0.515) 7.727 7.245 ( -5.358 8.438 -0.078) 9.996 7.357 ( 0.101 5.108 -3.624) 6.263 7.541 ( 3.659 0.460 -1.380) 3.938 7.709 ( -9.587 1.945 -1.949) 9.974 7.892 ( -4.467 0.955 -0.561) 4.602 8.935 ( 0.705 0.901 3.214) 3.411 9.290 ( -0.915 -9.025 2.964) 9.543 9.377 ( -5.623 -4.387 -3.562) 7.972 9.438 ( -3.921 -1.025 -7.172) 8.238 9.576 ( -0.352 -1.145 1.203) 1.698 9.795 ( -2.844 -0.679 -3.206) 4.339 9.973 ( 6.308 -2.353 2.515) 7.187 10.136 ( -0.111 -5.874 9.033) 10.776 10.559 ( -1.847 -0.707 -0.928) 2.184 10.990 ( 2.854 3.797 5.427) 7.212 11.076 ( 2.333 -6.449 0.382) 6.869 11.186 ( 6.465 -0.469 -0.491) 6.500 11.462 ( 1.747 -1.148 4.658) 5.106 11.737 ( 6.391 2.086 -0.574) 6.748 11.792 ( -1.221 -7.591 -6.722) 10.213 11.961 ( 0.339 6.104 -2.136) 6.476 12.069 ( -1.202 0.302 3.516) 3.728 12.122 ( 1.098 -2.194 5.642) 6.152 12.234 ( 5.026 -0.757 -2.114) 5.505 12.529 ( -5.732 0.924 -8.154) 10.010 12.728 ( -0.837 -0.569 -3.061) 3.224 12.965 ( -1.963 5.218 4.427) 7.119 13.124 ( -7.373 6.229 -1.491) 9.767 13.525 ( -8.654 9.140 11.039) 16.742 14.831 ( 4.085 -3.244 -1.215) 5.356 15.039 ( 1.860 -0.429 1.236) 2.275 15.265 ( -5.715 0.791 -3.401) 6.697 15.538 ( 1.383 6.356 1.055) 6.590 15.634 ( 1.797 -6.123 2.199) 6.750 15.694 ( -4.241 -3.371 -0.216) 5.422 15.902 ( -4.269 2.758 3.334) 6.079 15.967 ( -0.857 3.630 0.696) 3.795 16.150 ( 5.258 2.522 -6.831) 8.982 16.426 ( -0.289 -1.947 1.252) 2.333 16.718 ( -2.813 1.371 0.610) 3.189 17.021 ( -6.070 -8.203 -3.842) 10.904 17.242 ( 14.435 11.640 -1.800) 18.631 17.987 ( 4.975 -1.422 0.831) 5.241 18.620 ( 0.447 5.494 -4.528) 7.133 18.838 ( -0.010 -0.802 0.245) 0.838 25.869 ( 1.444 -1.433 -0.235) 2.048 26.006 ( 1.344 -2.220 -0.190) 2.602 26.028 ( -0.480 -1.699 1.510) 2.323 26.112 ( 0.027 -0.843 2.588) 2.721 26.236 ( -0.905 -0.201 0.131) 0.936 26.721 ( 0.952 -0.196 -4.542) 4.645 26.847 ( -4.537 0.272 -1.747) 4.869 27.041 ( -1.284 2.136 11.615) 11.879 27.225 ( -1.729 -3.184 -10.384) 10.997 27.711 ( -5.002 0.993 2.117) 5.521 28.358 ( 0.547 -0.110 -0.051) 0.560 28.909 ( -2.773 -8.616 2.672) 9.437 29.173 ( 0.496 -0.074 3.221) 3.259 29.275 ( -5.570 -13.908 -2.641) 15.213 29.386 ( 1.400 6.285 -5.989) 8.794 29.839 ( 17.505 18.306 3.631) 25.588 ======================= Grid point 4 (5/140) ======================= q-point: ( 0.44 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( 5.820 -3.854 0.362) 6.990 2.048 ( 2.678 -10.951 2.216) 11.489 2.199 ( -0.644 0.232 6.186) 6.223 2.308 ( 0.989 -5.509 -4.881) 7.426 2.444 ( -3.403 1.950 -1.038) 4.057 2.642 ( 1.301 -5.240 1.953) 5.741 2.813 ( -2.783 -3.443 -0.144) 4.429 2.890 ( 1.928 3.484 0.367) 3.999 2.986 ( -0.377 0.860 2.550) 2.717 3.162 ( 1.545 -4.117 -3.037) 5.344 3.203 ( 0.725 2.930 2.124) 3.691 3.247 ( -2.426 -2.889 1.417) 4.030 3.371 ( -0.116 -3.290 -0.886) 3.409 3.584 ( 5.877 1.648 0.538) 6.127 3.652 ( -10.221 1.638 -3.650) 10.976 3.723 ( 2.309 0.025 1.581) 2.799 4.050 ( 1.430 -7.033 -4.317) 8.375 4.167 ( 4.545 2.597 -0.565) 5.265 4.245 ( 3.732 -1.836 1.367) 4.378 4.343 ( -6.553 -0.221 4.015) 7.688 4.790 ( 0.901 -0.078 4.228) 4.323 4.804 ( -1.431 -1.067 -0.701) 1.918 4.880 ( -1.116 2.501 -3.690) 4.595 4.972 ( -0.919 -0.421 1.737) 2.010 5.423 ( 1.843 -4.009 -5.430) 6.997 5.485 ( -1.418 2.268 1.241) 2.949 5.656 ( -0.079 0.213 -1.965) 1.978 5.745 ( 0.918 -0.342 0.373) 1.048 5.850 ( 0.897 2.028 4.547) 5.059 6.014 ( -0.114 0.221 -2.359) 2.372 6.211 ( 5.639 -2.782 2.959) 6.949 6.391 ( -6.951 3.185 -3.240) 8.305 6.469 ( -0.927 1.499 0.716) 1.902 6.849 ( 1.059 -1.737 -1.708) 2.656 7.059 ( 1.791 -2.128 1.707) 3.263 7.120 ( -1.377 2.614 -0.973) 3.110 7.258 ( -0.167 3.670 -1.450) 3.949 7.543 ( 2.783 2.647 0.081) 3.841 7.649 ( -3.990 -2.466 -1.845) 5.040 7.843 ( -2.279 1.270 0.715) 2.705 8.918 ( -0.077 1.464 1.581) 2.156 9.326 ( -3.057 0.564 -2.247) 3.836 9.399 ( -1.657 -2.179 -1.471) 3.108 9.461 ( -0.239 -3.801 0.797) 3.891 9.607 ( 1.066 -0.387 3.157) 3.355 9.763 ( -0.033 0.738 -3.048) 3.137 10.097 ( 3.295 -6.196 -1.567) 7.190 10.217 ( -2.165 0.766 4.370) 4.937 10.550 ( -0.313 -0.244 0.043) 0.399 10.966 ( 0.779 1.650 1.556) 2.398 11.194 ( -0.407 -3.753 1.723) 4.150 11.227 ( 4.007 0.622 -0.179) 4.059 11.567 ( 3.410 -6.508 3.149) 7.993 11.706 ( 1.261 3.246 -1.374) 3.744 11.779 ( -2.860 6.232 -2.615) 7.339 11.936 ( 1.296 -5.484 -4.622) 7.288 12.056 ( -0.973 1.660 6.969) 7.230 12.179 ( 1.019 0.706 0.623) 1.387 12.244 ( 0.546 -0.151 -3.441) 3.487 12.458 ( -0.856 0.897 -2.706) 2.976 12.746 ( 1.671 -1.983 -2.427) 3.551 12.885 ( -0.915 2.815 1.088) 3.154 13.011 ( -3.821 2.053 1.076) 4.469 13.384 ( -3.758 4.931 4.722) 7.793 14.943 ( 4.128 -5.463 0.539) 6.868 15.059 ( -1.855 1.478 -0.848) 2.519 15.211 ( -2.053 -0.970 -0.017) 2.270 15.432 ( 0.031 5.337 -0.531) 5.364 15.732 ( -1.053 -3.389 -1.135) 3.726 15.750 ( 2.756 -3.005 3.059) 5.098 15.837 ( -6.144 1.436 1.180) 6.419 15.913 ( 2.075 2.817 -0.390) 3.521 16.116 ( 1.573 1.350 -2.775) 3.464 16.452 ( 0.040 -0.679 0.224) 0.716 16.675 ( -0.725 1.412 -0.099) 1.591 17.088 ( -7.064 -6.980 -1.409) 10.030 17.167 ( 9.518 7.637 -0.382) 12.209 18.033 ( 1.670 -0.492 0.535) 1.822 18.535 ( -0.019 2.372 -1.546) 2.831 18.849 ( 0.050 -0.306 0.108) 0.328 25.901 ( 0.901 -0.922 -0.063) 1.290 26.008 ( -0.673 0.173 -0.334) 0.771 26.083 ( 1.071 -1.694 0.833) 2.170 26.136 ( 0.072 -0.561 1.164) 1.294 26.221 ( -0.763 0.672 -0.113) 1.023 26.717 ( 0.701 -0.080 -1.171) 1.367 26.810 ( -2.047 0.054 -0.827) 2.209 27.045 ( -0.581 1.120 4.705) 4.871 27.211 ( -0.715 -1.153 -4.865) 5.050 27.689 ( -0.892 0.378 1.358) 1.668 28.368 ( 0.518 -0.273 0.158) 0.607 29.022 ( -2.126 -5.648 0.953) 6.110 29.130 ( -0.707 4.433 0.384) 4.506 29.324 ( 1.133 -0.694 -3.104) 3.377 29.469 ( -4.517 -12.420 0.451) 13.224 29.669 ( 9.132 14.921 1.069) 17.526 ======================= Grid point 10 (6/140) ======================= q-point: ( 0.11 0.11 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.562 ( 22.700 0.000 19.549) 29.958 0.606 ( 35.906 0.000 3.336) 36.060 1.038 ( 42.128 0.000 32.900) 53.452 1.630 ( -2.004 -0.000 2.983) 3.594 2.139 ( -1.958 -0.000 -1.567) 2.508 2.232 ( -8.159 -0.000 2.839) 8.639 2.493 ( 1.596 0.000 -4.943) 5.195 2.500 ( -11.320 -0.000 -0.137) 11.321 2.647 ( -6.647 -0.000 3.548) 7.534 2.841 ( 0.899 0.000 3.338) 3.457 2.864 ( 10.053 0.000 -4.547) 11.033 3.387 ( -0.789 -0.000 -7.337) 7.379 3.479 ( -1.947 -0.000 -1.700) 2.584 3.485 ( 1.408 0.000 -1.932) 2.391 3.637 ( 4.288 0.000 3.096) 5.288 3.793 ( -2.367 -0.000 4.385) 4.983 4.111 ( 1.991 0.000 -1.892) 2.747 4.246 ( -4.069 -0.000 1.260) 4.259 4.357 ( -10.531 -0.000 -4.208) 11.340 4.475 ( -5.420 -0.000 5.802) 7.940 4.634 ( -3.557 -0.000 1.061) 3.712 4.690 ( 3.991 0.000 -4.526) 6.035 4.713 ( 1.370 0.000 -1.613) 2.116 5.177 ( 1.583 0.000 4.032) 4.331 5.179 ( -1.175 -0.000 -0.701) 1.368 5.310 ( 13.334 0.000 2.028) 13.487 5.700 ( 2.269 0.000 -1.704) 2.837 5.741 ( -3.451 -0.000 -4.038) 5.312 6.083 ( -1.523 -0.000 1.449) 2.102 6.303 ( -2.693 -0.000 1.783) 3.229 6.425 ( 1.006 0.000 -0.878) 1.336 6.449 ( -8.158 -0.000 10.025) 12.925 6.585 ( 3.048 0.000 5.957) 6.692 6.841 ( 1.327 0.000 -5.969) 6.114 6.904 ( 3.020 0.000 -2.084) 3.669 7.308 ( -22.794 -0.000 26.095) 34.649 7.493 ( 0.368 0.000 -3.188) 3.209 7.635 ( 16.707 0.000 -14.569) 22.167 7.916 ( -6.716 -0.000 2.126) 7.045 7.917 ( -6.931 -0.000 0.278) 6.937 8.592 ( 4.671 0.000 -0.136) 4.673 9.020 ( -1.760 -0.000 -3.370) 3.802 9.129 ( -4.186 -0.000 -7.682) 8.749 9.385 ( -6.453 -0.000 -6.679) 9.287 9.585 ( -5.653 -0.000 1.072) 5.753 9.825 ( 0.303 0.000 -4.058) 4.069 10.160 ( -3.018 -0.000 11.273) 11.670 10.359 ( -2.292 -0.000 4.265) 4.842 10.386 ( -2.283 -0.000 4.471) 5.020 10.505 ( -1.741 -0.000 8.931) 9.099 10.862 ( 6.197 0.000 3.745) 7.240 11.172 ( 4.585 0.000 3.199) 5.590 11.230 ( 2.594 0.000 -1.457) 2.975 11.426 ( 4.358 0.000 1.123) 4.501 11.891 ( -2.432 -0.000 -1.336) 2.774 12.017 ( -7.770 -0.000 4.180) 8.823 12.124 ( -1.508 -0.000 -1.741) 2.304 12.195 ( -18.459 -0.000 39.263) 43.386 12.241 ( 0.963 0.000 4.462) 4.565 12.662 ( 2.474 0.000 -3.316) 4.137 12.714 ( -4.111 -0.000 -5.781) 7.094 12.844 ( -10.939 -0.000 8.781) 14.028 13.134 ( 10.831 0.000 -0.810) 10.861 13.781 ( -6.852 -0.000 7.027) 9.814 15.064 ( -1.628 -0.000 -4.050) 4.365 15.151 ( 2.666 0.000 1.338) 2.983 15.273 ( -1.946 -0.000 -1.889) 2.712 15.463 ( 9.324 0.000 3.479) 9.952 15.720 ( -10.256 -0.000 -0.154) 10.258 15.925 ( -3.914 -0.000 -0.603) 3.960 15.946 ( -6.901 -0.000 7.217) 9.986 16.139 ( 6.420 0.000 1.881) 6.690 16.151 ( 2.163 0.000 -3.524) 4.135 16.344 ( 0.173 0.000 1.628) 1.638 16.580 ( -7.393 -0.000 2.790) 7.902 16.724 ( -2.616 -0.000 -5.830) 6.390 17.802 ( 2.778 0.000 5.065) 5.777 18.341 ( 6.357 0.000 -1.714) 6.584 18.603 ( 44.186 0.000 -77.682) 89.369 18.777 ( 2.406 0.000 -2.430) 3.420 25.824 ( 1.270 0.000 1.472) 1.944 25.863 ( 0.940 0.000 0.390) 1.017 25.984 ( -2.747 -0.000 2.855) 3.962 26.075 ( -0.736 -0.000 1.009) 1.249 26.168 ( 0.169 0.000 4.520) 4.523 26.485 ( 1.327 0.000 4.098) 4.308 26.867 ( -2.633 -0.000 -5.580) 6.170 26.950 ( 0.228 0.000 -2.081) 2.093 27.255 ( -15.235 -0.000 27.107) 31.095 27.495 ( 4.198 0.000 6.146) 7.443 28.337 ( 0.210 0.000 -1.652) 1.665 28.573 ( 0.084 0.000 -0.192) 0.210 28.691 ( -2.346 -0.000 -6.757) 7.153 29.126 ( 2.376 0.000 2.316) 3.318 29.698 ( -4.187 -0.000 -7.540) 8.625 31.160 ( 14.666 0.000 -20.159) 24.930 ======================= Grid point 11 (7/140) ======================= q-point: ( 0.22 0.11 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.935 ( 28.504 -10.463 3.231) 30.535 1.060 ( 19.668 -17.455 14.183) 29.878 1.583 ( 18.711 -12.930 20.681) 30.741 1.803 ( 6.850 -13.055 11.767) 18.863 2.181 ( -6.532 -5.130 -3.179) 8.894 2.273 ( -4.614 -13.204 -0.921) 14.018 2.444 ( -5.431 -1.928 -1.964) 6.088 2.548 ( -1.660 -10.200 1.732) 10.478 2.684 ( -5.426 -8.196 2.251) 10.084 2.877 ( 1.284 -1.313 3.933) 4.340 2.953 ( 9.128 -3.781 -3.900) 10.622 3.327 ( 1.569 3.356 -7.710) 8.554 3.381 ( -2.788 3.185 0.064) 4.233 3.510 ( -0.833 -1.264 -2.306) 2.759 3.701 ( 5.344 -0.707 3.484) 6.418 3.826 ( -3.168 -3.080 -1.237) 4.588 4.032 ( -2.731 6.658 -5.193) 8.875 4.114 ( -7.259 8.777 1.754) 11.524 4.301 ( -6.115 -4.329 -1.537) 7.648 4.551 ( -2.840 -5.887 6.347) 9.111 4.577 ( 0.245 3.580 0.032) 3.589 4.664 ( 0.951 -0.222 0.634) 1.165 4.815 ( -1.572 -6.595 -2.662) 7.284 5.112 ( 2.914 3.660 -0.085) 4.679 5.274 ( -0.037 -4.252 -0.307) 4.264 5.442 ( 8.292 -1.606 0.717) 8.476 5.623 ( 2.048 3.499 -3.890) 5.619 5.785 ( -0.364 -3.526 -4.551) 5.769 6.037 ( -0.394 4.236 1.417) 4.484 6.231 ( -2.420 6.413 2.734) 7.379 6.346 ( -3.588 4.727 3.047) 6.671 6.468 ( -6.469 0.652 4.315) 7.803 6.588 ( 3.932 3.669 4.077) 6.749 6.811 ( 3.597 1.592 -3.801) 5.470 6.871 ( 8.123 1.416 -0.647) 8.271 7.311 ( -8.199 -5.147 6.155) 11.471 7.524 ( 1.113 -1.019 -2.037) 2.535 7.656 ( -8.161 6.522 -9.739) 14.283 7.733 ( -1.748 3.754 0.015) 4.142 7.932 ( -5.057 -1.046 1.838) 5.481 8.707 ( 2.704 -8.107 3.075) 9.083 9.068 ( -4.416 -9.381 -5.916) 11.938 9.090 ( -5.910 -3.894 -5.301) 8.843 9.351 ( -7.300 -6.267 -6.754) 11.755 9.518 ( -5.593 2.418 -0.822) 6.149 9.727 ( 2.029 3.498 -2.222) 4.614 10.059 ( 5.132 6.298 15.085) 17.134 10.235 ( -0.874 9.103 4.153) 10.044 10.456 ( -1.121 -5.148 1.996) 5.634 10.872 ( -0.775 -10.531 0.929) 10.600 10.999 ( 1.437 -9.325 1.845) 9.614 11.217 ( 5.154 1.425 0.269) 5.354 11.322 ( 4.387 -8.772 4.096) 10.629 11.500 ( 4.143 -4.571 -1.601) 6.373 11.843 ( -1.714 2.718 -3.057) 4.435 11.938 ( -4.465 0.861 2.074) 4.998 12.133 ( 0.556 -1.271 0.203) 1.402 12.184 ( 4.688 7.100 14.056) 16.430 12.266 ( -3.652 -0.215 6.950) 7.854 12.563 ( -6.187 2.425 -8.144) 10.511 12.739 ( -0.876 0.033 -5.937) 6.001 12.917 ( -19.003 -10.483 13.711) 25.671 13.217 ( 5.481 -1.278 -3.955) 6.879 13.733 ( -7.770 3.415 8.060) 11.705 14.917 ( 0.871 8.358 -1.522) 8.540 15.195 ( -1.658 2.195 -1.322) 3.052 15.342 ( 1.481 -9.378 0.249) 9.497 15.429 ( 8.685 12.772 0.853) 15.469 15.628 ( -9.986 0.629 -0.067) 10.006 15.767 ( 2.359 7.571 2.927) 8.453 15.951 ( -7.341 -1.710 3.895) 8.484 16.098 ( 2.834 4.901 -0.753) 5.711 16.213 ( 9.320 -0.115 -8.894) 12.884 16.363 ( -0.562 -1.219 3.477) 3.727 16.615 ( -9.125 -6.117 2.497) 11.266 16.737 ( -6.095 -7.803 -6.402) 11.791 17.799 ( 9.049 11.319 2.742) 14.748 18.052 ( 23.878 15.516 -12.258) 31.003 18.725 ( 5.232 -4.088 -22.104) 23.080 18.789 ( -0.043 -1.412 1.043) 1.756 25.840 ( 1.755 -0.046 0.221) 1.769 25.902 ( 1.931 -2.606 1.060) 3.412 25.987 ( -1.831 -1.124 1.756) 2.775 26.081 ( -0.896 -0.789 1.606) 2.001 26.202 ( 0.667 -0.862 4.088) 4.231 26.642 ( -2.575 -8.129 -1.914) 8.739 26.826 ( -4.527 -1.275 -5.401) 7.161 26.972 ( -0.478 -4.067 -3.167) 5.177 27.232 ( -3.947 3.478 15.177) 16.063 27.645 ( -3.513 -6.128 6.477) 9.584 28.348 ( -0.175 -1.268 -1.407) 1.902 28.617 ( -0.631 -6.055 0.695) 6.127 28.731 ( -4.631 -11.429 -9.111) 15.333 29.162 ( 1.626 -0.659 2.903) 3.392 29.585 ( -4.068 3.649 -10.214) 11.584 30.815 ( 22.230 34.491 0.929) 41.045 ======================= Grid point 12 (8/140) ======================= q-point: ( 0.33 0.11 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.340 ( 25.083 -9.520 1.690) 26.882 1.547 ( 10.430 -17.332 10.368) 22.731 1.961 ( 1.863 -8.595 12.677) 15.429 2.013 ( -2.326 -12.407 1.799) 12.751 2.349 ( 7.491 -9.652 4.150) 12.904 2.356 ( -6.976 -5.724 -3.526) 9.688 2.550 ( -7.399 -11.805 2.332) 14.126 2.795 ( 0.161 -14.638 3.715) 15.103 2.855 ( -2.901 -13.555 -0.994) 13.898 2.945 ( 3.098 -2.072 4.453) 5.807 3.075 ( 5.071 -2.627 1.826) 5.996 3.274 ( 1.246 0.728 -1.634) 2.180 3.314 ( -0.697 0.137 -7.223) 7.258 3.530 ( 4.908 -0.633 0.628) 4.988 3.735 ( -0.980 -1.273 -1.814) 2.423 3.823 ( -8.732 7.092 -7.447) 13.491 3.869 ( -1.361 -2.820 -0.462) 3.165 3.977 ( 1.929 1.293 1.878) 2.986 4.333 ( -3.657 -2.169 1.750) 4.598 4.476 ( 0.782 6.189 -2.489) 6.716 4.649 ( -0.015 -3.183 7.635) 8.272 4.770 ( -0.050 -6.282 6.824) 9.275 4.863 ( -4.027 -2.948 -0.785) 5.052 5.075 ( 3.964 4.166 -3.120) 6.542 5.287 ( -4.637 -1.461 -5.834) 7.594 5.457 ( 1.737 -0.419 -2.745) 3.275 5.647 ( 1.656 -1.352 -0.494) 2.194 5.787 ( 5.509 1.613 -3.742) 6.852 5.994 ( 3.686 2.918 2.907) 5.528 6.095 ( -3.360 6.554 -2.017) 7.636 6.251 ( -3.267 5.229 7.013) 9.337 6.425 ( -2.872 0.299 -1.953) 3.486 6.570 ( 0.650 3.121 1.772) 3.647 6.794 ( 3.927 1.109 -2.270) 4.669 6.955 ( 4.873 -3.303 -0.110) 5.888 7.331 ( -7.168 4.756 2.561) 8.975 7.387 ( -4.000 4.566 -7.240) 9.448 7.534 ( -6.844 -3.050 -2.032) 7.763 7.665 ( 2.829 4.550 -0.983) 5.447 7.910 ( -2.885 1.014 2.677) 4.064 8.867 ( -2.690 -6.990 0.579) 7.512 9.127 ( -3.501 -7.859 -2.325) 8.913 9.168 ( -7.160 -10.355 -5.103) 13.584 9.389 ( -4.436 -4.442 -3.101) 7.001 9.481 ( 1.141 -3.822 -3.615) 5.383 9.714 ( -2.708 -1.951 -2.696) 4.290 10.099 ( 5.429 6.418 6.988) 10.931 10.134 ( 0.363 0.757 10.002) 10.037 10.524 ( -0.530 -2.196 1.822) 2.902 11.006 ( 0.921 -5.183 0.941) 5.348 11.080 ( 3.119 0.395 3.687) 4.845 11.247 ( 7.459 0.698 0.203) 7.495 11.498 ( 5.123 -2.552 4.446) 7.248 11.622 ( 0.717 -7.249 -4.019) 8.320 11.792 ( 1.164 0.195 -4.030) 4.199 11.949 ( -1.715 -4.830 -1.993) 5.499 12.121 ( 1.641 5.009 -0.206) 5.275 12.186 ( 2.814 2.637 7.752) 8.658 12.270 ( -1.824 0.741 7.403) 7.660 12.454 ( -2.864 0.249 -7.429) 7.965 12.696 ( -0.522 0.652 -4.200) 4.282 12.956 ( -16.286 -3.908 10.416) 19.723 13.177 ( 0.837 5.818 -6.531) 8.787 13.622 ( -9.802 6.636 9.422) 15.129 14.836 ( 2.381 1.876 0.308) 3.046 15.113 ( -0.214 4.319 -1.272) 4.508 15.285 ( 3.846 7.992 -0.669) 8.895 15.522 ( 1.489 -8.781 0.340) 8.913 15.566 ( -7.590 -1.536 1.381) 7.866 15.711 ( 3.018 5.078 3.131) 6.686 15.915 ( -5.779 1.400 1.727) 6.192 16.044 ( 3.342 3.813 -0.645) 5.111 16.203 ( 6.056 2.890 -8.208) 10.602 16.400 ( 0.842 -1.619 0.413) 1.871 16.646 ( -8.525 -4.109 0.896) 9.506 16.801 ( -6.868 -8.855 -3.624) 11.777 17.628 ( 17.201 17.711 -3.018) 24.873 18.045 ( 9.786 1.835 -0.979) 10.005 18.659 ( -0.879 2.925 -9.728) 10.196 18.820 ( -0.242 -1.457 0.821) 1.690 25.861 ( 1.867 -0.856 -0.225) 2.067 25.974 ( 1.598 -2.879 -0.058) 3.294 26.009 ( -0.504 -1.594 2.801) 3.262 26.102 ( -1.080 -1.351 2.082) 2.707 26.233 ( 0.093 -0.061 3.059) 3.061 26.697 ( -0.393 -1.966 -0.281) 2.025 26.786 ( -3.953 -1.184 -4.436) 6.058 27.010 ( -2.013 -3.498 -6.526) 7.673 27.235 ( -0.356 2.437 12.665) 12.902 27.700 ( -1.125 -0.464 4.534) 4.695 28.352 ( 0.100 -0.465 -1.400) 1.478 28.740 ( -2.353 -8.129 0.478) 8.476 28.887 ( -7.878 -17.190 -9.586) 21.200 29.186 ( -2.854 -0.743 0.938) 3.095 29.451 ( 1.294 3.809 -7.707) 8.694 30.458 ( 19.155 29.514 6.217) 35.731 ======================= Grid point 13 (9/140) ======================= q-point: ( 0.44 0.11 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.602 ( 12.612 -1.532 2.051) 12.869 1.882 ( 3.934 -12.781 4.131) 13.996 2.137 ( 2.896 -11.311 0.028) 11.676 2.237 ( 3.099 -4.063 6.554) 8.311 2.389 ( -5.242 -4.992 1.789) 7.457 2.558 ( 2.437 -7.561 4.750) 9.256 2.683 ( -5.191 -8.687 0.875) 10.158 2.943 ( -5.787 -3.806 -2.744) 7.450 2.985 ( 1.409 2.979 3.797) 5.027 3.028 ( 0.351 -10.178 -4.506) 11.136 3.151 ( -3.364 -2.869 5.111) 6.758 3.226 ( -1.163 -1.362 -0.600) 1.889 3.334 ( 4.608 -0.960 -5.807) 7.475 3.581 ( -11.766 4.241 -5.474) 13.653 3.622 ( 6.413 -2.328 0.272) 6.828 3.786 ( 1.234 1.452 2.503) 3.145 3.898 ( -0.611 -8.223 -3.454) 8.940 4.155 ( 12.362 -8.545 2.610) 15.253 4.305 ( -2.196 3.202 2.761) 4.764 4.390 ( 1.679 4.987 2.529) 5.838 4.734 ( -4.713 -4.240 4.461) 7.751 4.833 ( 0.248 1.705 3.064) 3.515 4.893 ( -0.157 -2.736 -0.317) 2.758 4.976 ( -0.784 5.313 -2.373) 5.871 5.301 ( -0.011 -6.282 -6.120) 8.770 5.454 ( -5.058 -1.346 -1.876) 5.560 5.654 ( -1.608 -0.954 1.660) 2.500 5.795 ( 8.600 2.860 -3.962) 9.892 5.941 ( -1.167 5.885 -4.172) 7.308 6.028 ( 2.549 0.787 4.409) 5.153 6.218 ( -1.687 -0.072 5.766) 6.008 6.371 ( -2.391 1.621 -4.467) 5.320 6.519 ( 1.104 3.768 0.682) 3.985 6.823 ( 4.080 -1.717 -2.241) 4.962 7.024 ( -1.232 -2.615 1.255) 3.151 7.152 ( -4.780 4.975 -1.916) 7.161 7.293 ( -1.622 3.818 -6.546) 7.750 7.503 ( -11.194 -2.346 -0.157) 11.438 7.681 ( 10.440 1.040 3.802) 11.159 7.879 ( -1.028 2.357 2.914) 3.886 8.884 ( -6.691 -1.759 -2.691) 7.423 9.226 ( -4.560 -7.890 -5.529) 10.659 9.283 ( -1.470 -7.972 0.545) 8.124 9.405 ( -0.571 -2.393 0.801) 2.588 9.592 ( 2.431 -4.773 -0.290) 5.364 9.721 ( -2.360 -4.445 -4.135) 6.514 10.037 ( -0.111 2.120 -0.644) 2.218 10.241 ( 2.962 -1.294 9.815) 10.334 10.537 ( -1.360 -0.043 0.343) 1.404 11.011 ( -1.334 1.643 1.012) 2.346 11.188 ( 6.244 -2.869 3.908) 7.905 11.295 ( 6.235 1.239 2.193) 6.724 11.557 ( 4.312 0.586 3.326) 5.477 11.666 ( -2.047 -3.617 -9.555) 10.419 11.816 ( 2.428 -0.513 0.918) 2.646 11.937 ( -0.391 5.896 -3.417) 6.826 12.079 ( -1.990 -1.781 3.689) 4.554 12.210 ( -0.314 -2.299 -2.481) 3.397 12.268 ( 2.187 3.698 7.788) 8.894 12.459 ( 4.885 -0.818 -1.908) 5.308 12.686 ( -0.132 -2.463 -3.890) 4.606 12.910 ( -11.536 0.716 5.549) 12.822 13.030 ( -0.650 5.563 -4.602) 7.249 13.457 ( -10.405 7.507 6.582) 14.420 14.889 ( 3.192 -4.196 2.133) 5.688 15.059 ( -1.650 1.143 -1.716) 2.641 15.217 ( 2.363 2.568 0.704) 3.560 15.516 ( -4.155 3.128 0.485) 5.224 15.649 ( -1.255 -2.450 -1.451) 3.112 15.707 ( 2.090 -3.981 4.994) 6.720 15.862 ( -0.344 2.075 0.552) 2.175 16.001 ( 3.619 4.234 -0.737) 5.619 16.146 ( 2.310 3.128 -5.636) 6.847 16.430 ( 0.796 -1.532 -1.764) 2.468 16.625 ( -9.058 -2.026 -0.579) 9.300 16.888 ( -5.845 -8.040 -0.761) 9.969 17.473 ( 15.656 14.366 -1.876) 21.331 18.074 ( 4.432 1.792 1.270) 4.946 18.551 ( -2.842 2.787 -5.354) 6.671 18.841 ( -0.103 -0.791 0.536) 0.961 25.893 ( 1.576 -1.135 0.127) 1.946 25.996 ( -0.514 -0.650 -0.886) 1.213 26.072 ( 1.755 -2.161 2.699) 3.878 26.126 ( -1.109 -1.305 1.667) 2.390 26.232 ( -0.467 1.286 1.739) 2.212 26.715 ( -2.231 -0.648 2.552) 3.451 26.776 ( 0.845 -1.582 -3.011) 3.505 26.995 ( -1.624 -1.735 -10.004) 10.283 27.268 ( 1.540 1.912 13.704) 13.922 27.705 ( 0.448 1.347 1.850) 2.332 28.357 ( -0.143 -0.814 -1.525) 1.735 28.843 ( -5.422 -8.527 -3.937) 10.845 29.058 ( -8.433 -14.768 -7.226) 18.478 29.140 ( -5.133 0.248 -3.810) 6.397 29.441 ( 5.970 -0.132 1.234) 6.098 30.158 ( 14.051 25.359 6.345) 29.678 ======================= Grid point 14 (10/140) ======================= q-point: ( 0.56 0.11 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.629 ( 0.359 4.853 2.055) 5.283 2.096 ( 3.501 -4.364 -1.587) 5.816 2.224 ( 1.141 1.585 -1.456) 2.436 2.310 ( -2.440 -2.977 1.329) 4.073 2.467 ( 3.882 -1.662 9.155) 10.082 2.671 ( 0.073 -0.865 -0.547) 1.025 2.785 ( -1.917 -6.285 3.915) 7.649 2.900 ( -0.938 2.263 -1.397) 2.821 2.931 ( -3.715 0.132 -3.915) 5.399 3.116 ( -1.464 -3.603 -2.448) 4.595 3.170 ( -0.840 -3.930 -7.088) 8.148 3.248 ( -3.374 2.092 2.261) 4.569 3.390 ( 2.381 -3.443 -0.804) 4.262 3.487 ( -6.421 -3.399 0.700) 7.299 3.704 ( 6.783 -2.230 0.556) 7.162 3.752 ( 0.786 3.392 -0.258) 3.491 4.031 ( -1.730 -7.904 -0.141) 8.092 4.181 ( -1.023 6.939 5.644) 9.003 4.311 ( -0.046 6.099 1.226) 6.221 4.405 ( 9.779 -0.425 -0.505) 9.801 4.748 ( -3.240 -2.467 -2.881) 4.988 4.811 ( -1.790 0.176 0.631) 1.906 4.911 ( 2.658 1.722 8.003) 8.607 4.953 ( 1.820 -1.729 -4.727) 5.352 5.373 ( -3.541 -5.393 -3.822) 7.499 5.450 ( -2.894 -2.749 2.568) 4.746 5.675 ( -0.121 -0.377 3.896) 3.916 5.778 ( 4.389 2.997 -3.313) 6.263 5.832 ( 0.349 2.345 -8.213) 8.548 6.045 ( -0.004 1.809 7.127) 7.353 6.187 ( -7.096 1.931 -2.188) 7.673 6.394 ( 7.057 -3.978 1.108) 8.176 6.480 ( 1.473 1.896 0.034) 2.401 6.869 ( 3.409 -0.590 -1.632) 3.825 7.058 ( -4.688 2.264 -1.391) 5.389 7.063 ( -4.383 -4.281 2.919) 6.787 7.205 ( 0.153 0.293 -6.947) 6.954 7.477 ( -5.352 -2.147 2.281) 6.201 7.748 ( 4.515 2.674 4.488) 6.905 7.875 ( 5.743 0.267 2.518) 6.276 8.842 ( -5.942 -2.016 -4.622) 7.793 9.296 ( -0.916 -6.426 -3.155) 7.217 9.378 ( 2.199 -3.278 1.953) 4.404 9.469 ( -1.022 -3.239 1.141) 3.583 9.606 ( 0.340 1.913 -3.404) 3.920 9.785 ( 1.383 -1.016 3.763) 4.136 10.043 ( -4.712 -6.617 -5.972) 10.082 10.261 ( 1.833 5.265 4.110) 6.927 10.536 ( -1.331 -1.298 -0.197) 1.869 10.978 ( 0.746 2.305 -0.586) 2.493 11.233 ( 1.519 3.015 3.293) 4.716 11.305 ( 3.837 4.658 2.285) 6.453 11.609 ( -1.926 -4.086 -1.188) 4.671 11.641 ( -0.982 4.215 -5.238) 6.795 11.750 ( 1.383 1.333 -0.035) 1.921 11.925 ( -0.096 -3.878 -3.308) 5.098 12.101 ( -0.964 2.477 5.329) 5.955 12.205 ( 1.944 1.356 1.150) 2.635 12.282 ( 3.210 1.930 5.539) 6.687 12.480 ( 3.705 1.261 0.293) 3.924 12.724 ( -1.050 -2.842 -2.273) 3.788 12.847 ( -5.793 -0.652 1.446) 6.007 12.988 ( 2.711 -1.720 -3.120) 4.477 13.316 ( -7.619 1.005 0.187) 7.687 14.982 ( -3.283 2.400 0.060) 4.068 15.030 ( 2.929 -4.485 1.397) 5.535 15.243 ( 3.110 -0.887 2.054) 3.831 15.407 ( -2.151 4.099 -0.367) 4.644 15.672 ( -4.178 -3.580 -1.879) 5.814 15.817 ( 2.468 -1.916 2.636) 4.088 15.846 ( 4.396 1.024 0.793) 4.583 15.949 ( 4.202 4.702 -2.200) 6.679 16.100 ( -1.025 0.396 -0.952) 1.454 16.445 ( 0.711 -0.895 -2.743) 2.972 16.592 ( -9.152 -3.481 0.055) 9.791 16.964 ( -5.459 -6.089 0.557) 8.197 17.362 ( 12.327 11.459 -0.055) 16.830 18.061 ( 0.871 2.889 0.940) 3.161 18.492 ( -2.746 -1.079 -2.327) 3.758 18.850 ( -0.150 -0.139 0.252) 0.325 25.910 ( -0.043 0.417 0.472) 0.631 26.004 ( 0.841 -0.904 -0.536) 1.347 26.099 ( -0.782 0.529 0.500) 1.068 26.145 ( 0.145 0.463 1.673) 1.742 26.216 ( -0.028 0.028 0.116) 0.122 26.719 ( -2.400 -0.429 3.872) 4.576 26.814 ( 3.429 -1.546 -0.798) 3.845 26.962 ( -0.664 -1.941 -11.253) 11.438 27.325 ( 3.129 2.295 15.406) 15.887 27.687 ( 0.964 0.712 -2.227) 2.529 28.356 ( -1.032 -0.511 -1.728) 2.076 28.903 ( -8.494 -8.417 -9.103) 15.029 29.106 ( -0.729 -0.931 -1.567) 1.963 29.179 ( -6.312 -9.992 -3.593) 12.353 29.507 ( 2.419 -0.797 3.463) 4.299 29.886 ( 9.845 20.740 5.737) 23.664 ======================= Grid point 15 (11/140) ======================= q-point: (-0.33 0.11 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( -6.374 12.150 0.589) 13.734 1.940 ( -3.836 15.291 -5.890) 16.829 2.217 ( 4.780 4.138 -1.133) 6.423 2.370 ( 1.237 -0.952 5.067) 5.302 2.514 ( 1.081 3.427 5.039) 6.190 2.582 ( -2.924 6.867 -3.862) 8.403 2.856 ( -1.315 -0.639 3.431) 3.730 2.871 ( 3.539 1.638 -2.068) 4.414 2.921 ( -1.090 -3.313 -5.339) 6.377 3.118 ( -4.394 3.489 -0.442) 5.628 3.187 ( -3.427 -2.387 2.196) 4.718 3.228 ( 2.216 -6.007 -6.258) 8.953 3.404 ( 1.361 3.728 0.986) 4.090 3.506 ( -3.269 -0.303 -0.187) 3.288 3.676 ( -0.915 4.407 -1.401) 4.714 3.837 ( 7.165 -5.151 2.038) 9.056 4.040 ( -3.790 7.747 4.683) 9.814 4.186 ( 3.527 -2.899 5.395) 7.068 4.190 ( -2.148 1.729 -0.779) 2.866 4.411 ( 5.473 3.037 -3.674) 7.258 4.674 ( -6.379 2.638 -7.024) 9.848 4.871 ( 1.264 -0.131 5.378) 5.526 4.926 ( -0.545 -0.180 4.999) 5.032 4.988 ( 6.634 -1.551 -6.026) 9.095 5.409 ( -4.789 -3.166 2.580) 6.294 5.479 ( -0.601 -0.384 0.300) 0.774 5.681 ( -0.875 3.175 0.927) 3.421 5.740 ( -1.721 0.012 1.913) 2.573 5.806 ( 5.718 -1.098 -6.947) 9.064 6.046 ( -1.363 0.459 4.329) 4.562 6.104 ( -3.562 0.387 -2.072) 4.138 6.482 ( 1.669 -0.197 1.730) 2.412 6.527 ( 5.283 -3.769 -0.660) 6.523 6.855 ( 0.084 3.446 -0.891) 3.560 6.970 ( -5.915 2.282 -0.274) 6.346 7.143 ( 0.176 -6.493 0.951) 6.565 7.253 ( 0.369 -7.308 -1.454) 7.461 7.509 ( -0.995 -2.757 2.599) 3.917 7.729 ( 0.790 1.665 0.357) 1.877 7.966 ( 9.236 -0.530 5.406) 10.714 8.826 ( -5.032 -4.276 -5.990) 8.915 9.393 ( -0.398 -2.571 -0.847) 2.736 9.437 ( 2.899 1.869 0.554) 3.494 9.497 ( 2.493 -2.333 4.306) 5.495 9.556 ( 3.583 1.102 -4.673) 5.991 9.807 ( -1.986 -0.493 4.914) 5.323 10.041 ( -2.906 3.852 -0.399) 4.842 10.168 ( -1.946 4.681 -6.364) 8.136 10.563 ( 0.906 -2.380 1.190) 2.811 10.936 ( 0.544 2.113 -3.001) 3.711 11.181 ( -2.274 3.494 1.257) 4.354 11.204 ( -0.583 9.183 1.029) 9.258 11.489 ( -1.707 5.777 -3.541) 6.987 11.634 ( -4.732 -2.757 -0.815) 5.537 11.858 ( 3.281 -6.876 1.955) 7.866 11.971 ( 0.288 -2.025 -1.550) 2.566 12.015 ( -0.151 6.106 0.377) 6.120 12.186 ( 2.388 4.898 0.119) 5.451 12.267 ( -3.222 4.234 5.936) 7.971 12.556 ( 4.916 -4.724 4.975) 8.440 12.732 ( -0.932 -1.173 0.782) 1.690 12.858 ( -2.990 -4.167 -1.289) 5.288 13.077 ( 5.892 -5.502 -0.682) 8.090 13.338 ( -1.343 -9.411 -7.810) 12.303 14.877 ( -3.631 5.118 0.062) 6.276 15.087 ( 1.256 3.188 1.458) 3.724 15.295 ( 5.334 -2.682 1.899) 6.265 15.418 ( -1.977 -5.334 0.488) 5.710 15.664 ( -2.798 0.485 -1.922) 3.429 15.804 ( 3.650 4.608 1.673) 6.112 15.887 ( -0.017 0.689 -1.676) 1.812 15.940 ( 9.174 -2.038 -3.936) 10.188 16.103 ( -4.677 -1.714 4.338) 6.605 16.444 ( 1.289 0.368 -2.784) 3.089 16.617 ( -7.847 -7.049 0.968) 10.592 17.012 ( -5.986 -4.231 1.707) 7.526 17.269 ( 8.330 9.361 0.715) 12.552 18.003 ( -1.506 3.674 -0.125) 3.973 18.527 ( -1.814 -5.446 0.447) 5.758 18.847 ( -0.164 0.416 0.035) 0.449 25.888 ( -0.876 1.623 0.297) 1.868 26.025 ( 0.805 0.067 0.458) 0.929 26.063 ( -0.582 2.385 -0.353) 2.480 26.116 ( -0.791 1.832 -1.079) 2.268 26.237 ( 0.801 -1.101 0.266) 1.387 26.737 ( -1.367 -0.550 6.184) 6.357 26.865 ( 3.857 -1.514 -1.372) 4.364 26.942 ( -0.313 -2.294 -10.192) 10.452 27.373 ( 2.754 4.000 13.740) 14.573 27.706 ( 4.506 -2.913 -2.394) 5.876 28.348 ( -0.721 -0.440 -1.135) 1.414 28.891 ( -9.713 -4.983 -12.012) 16.231 29.126 ( 0.152 -1.216 -0.899) 1.520 29.291 ( -0.655 -7.545 1.972) 7.826 29.463 ( -3.467 7.738 0.037) 8.480 29.722 ( 5.135 8.040 6.015) 11.278 ======================= Grid point 16 (12/140) ======================= q-point: (-0.22 0.11 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.149 ( -7.332 18.077 0.025) 19.507 1.543 ( -4.119 23.573 -5.738) 24.609 2.063 ( -0.081 18.927 -1.533) 18.989 2.292 ( 0.739 14.846 -0.665) 14.879 2.431 ( 1.853 2.845 3.914) 5.181 2.499 ( -0.934 0.753 -2.048) 2.374 2.797 ( 1.679 6.677 -0.782) 6.929 2.881 ( 0.641 1.641 0.888) 1.973 2.970 ( -0.363 -4.527 -0.415) 4.560 2.984 ( -1.377 6.744 -1.462) 7.037 3.165 ( 1.637 11.507 -1.817) 11.764 3.255 ( -4.257 2.133 1.168) 4.902 3.369 ( 0.596 5.790 0.508) 5.843 3.434 ( -0.531 -3.827 0.762) 3.938 3.647 ( -1.053 -1.551 -1.490) 2.395 3.865 ( -1.294 1.390 -1.232) 2.264 4.018 ( 3.944 -3.367 2.343) 5.691 4.145 ( 1.686 3.901 5.468) 6.925 4.368 ( 3.576 -8.622 3.607) 10.007 4.385 ( 2.948 2.187 -3.041) 4.767 4.546 ( -7.170 0.021 -6.558) 9.717 4.800 ( 0.627 7.916 -0.056) 7.941 4.991 ( -1.009 -2.460 3.987) 4.793 5.036 ( 4.752 -1.283 -3.086) 5.809 5.389 ( -4.536 2.107 -0.385) 5.016 5.494 ( 1.472 -0.253 4.207) 4.464 5.580 ( -2.104 5.853 -1.286) 6.352 5.761 ( -0.889 -3.513 -0.048) 3.624 5.873 ( 3.181 -3.308 -0.806) 4.660 6.065 ( -1.086 -2.460 1.633) 3.146 6.110 ( -0.585 -4.123 -1.804) 4.538 6.501 ( 2.207 2.294 2.514) 4.057 6.585 ( 0.302 -2.464 -2.903) 3.820 6.777 ( -0.686 3.658 -2.238) 4.343 6.880 ( -3.738 4.426 2.410) 6.275 7.293 ( 0.660 -8.989 0.253) 9.017 7.383 ( 0.618 -5.694 0.960) 5.807 7.589 ( 3.942 -4.591 4.332) 7.442 7.728 ( -1.967 -3.316 -4.376) 5.832 8.069 ( 7.376 -0.076 5.818) 9.395 8.842 ( -3.637 -3.841 -3.975) 6.617 9.248 ( -0.459 10.468 -2.417) 10.753 9.487 ( 1.869 1.418 4.270) 4.872 9.557 ( 1.118 -5.045 -2.890) 5.921 9.622 ( 6.782 2.344 5.596) 9.100 9.858 ( -1.843 -0.733 3.029) 3.620 9.882 ( 0.207 8.003 -0.707) 8.036 10.008 ( -3.538 4.392 -8.854) 10.498 10.617 ( 2.339 0.526 2.176) 3.238 10.881 ( -2.360 2.112 -4.376) 5.402 11.061 ( -1.007 4.006 0.644) 4.180 11.109 ( -3.672 2.271 0.847) 4.400 11.416 ( 0.115 0.819 -2.480) 2.614 11.626 ( -5.047 -0.954 -0.450) 5.156 11.838 ( -0.069 10.094 1.775) 10.249 12.011 ( 0.925 -2.728 4.889) 5.675 12.046 ( 2.254 -5.620 -5.397) 8.111 12.100 ( 1.710 4.596 -2.798) 5.646 12.169 ( -5.625 4.536 3.410) 7.990 12.678 ( 2.475 -2.595 4.419) 5.691 12.790 ( 3.590 -2.503 3.932) 5.883 12.905 ( -2.893 -4.606 -5.116) 7.467 13.274 ( 6.335 -11.067 5.044) 13.713 13.491 ( 1.238 -12.783 -10.568) 16.632 14.780 ( -2.785 2.709 0.762) 3.959 15.043 ( 1.458 1.752 0.702) 2.385 15.401 ( 5.794 -1.268 3.085) 6.686 15.484 ( -3.421 -4.135 -0.308) 5.376 15.594 ( -0.625 4.957 -2.068) 5.407 15.767 ( 2.722 2.721 0.679) 3.908 15.887 ( -0.519 -2.286 -1.598) 2.838 16.034 ( 9.875 -2.601 -6.604) 12.161 16.113 ( -8.601 -1.965 7.744) 11.739 16.425 ( 1.742 1.905 -2.206) 3.396 16.703 ( -3.394 -7.356 0.243) 8.105 17.026 ( -6.317 -1.509 3.248) 7.261 17.188 ( 3.216 5.490 0.016) 6.363 17.920 ( -2.246 4.033 -0.360) 4.631 18.635 ( -1.048 -7.350 1.775) 7.633 18.837 ( -0.021 0.496 0.009) 0.497 25.855 ( -0.583 1.552 0.154) 1.664 25.978 ( -0.928 3.867 -0.360) 3.993 26.043 ( 0.895 1.697 0.533) 1.991 26.084 ( -0.494 0.146 -1.787) 1.860 26.249 ( 0.466 0.671 0.173) 0.835 26.779 ( -0.604 -1.060 8.555) 8.641 26.904 ( 2.798 -2.460 -7.841) 8.681 26.934 ( -0.164 -1.206 -3.246) 3.467 27.353 ( 0.570 5.474 6.083) 8.203 27.856 ( 10.169 -7.501 3.430) 13.093 28.353 ( 0.305 -0.786 -0.413) 0.939 28.827 ( -5.583 -1.812 -8.720) 10.512 29.123 ( 0.191 1.252 -0.490) 1.358 29.228 ( -5.330 10.595 -3.333) 12.320 29.468 ( 0.917 -8.259 4.390) 9.398 29.669 ( -3.429 3.679 2.041) 5.428 ======================= Grid point 17 (13/140) ======================= q-point: (-0.11 0.11 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.774 ( -0.000 21.654 0.000) 21.654 1.056 ( -0.000 29.067 0.000) 29.067 1.566 ( -0.000 36.646 0.000) 36.646 1.992 ( -0.000 18.527 0.000) 18.527 2.451 ( 0.000 -0.070 -0.000) 0.070 2.472 ( -0.000 1.549 0.000) 1.549 2.626 ( -0.000 14.886 0.000) 14.886 2.782 ( -0.000 9.934 0.000) 9.934 2.879 ( -0.000 4.839 0.000) 4.839 2.915 ( -0.000 11.964 0.000) 11.964 3.005 ( -0.000 13.715 0.000) 13.715 3.131 ( 0.000 -9.385 -0.000) 9.385 3.399 ( 0.000 -2.503 -0.000) 2.503 3.511 ( 0.000 -3.361 -0.000) 3.361 3.627 ( -0.000 1.902 0.000) 1.902 3.938 ( 0.000 -8.275 -0.000) 8.275 4.062 ( -0.000 8.892 0.000) 8.892 4.120 ( 0.000 -5.888 -0.000) 5.888 4.370 ( 0.000 -1.617 -0.000) 1.617 4.483 ( 0.000 -2.840 -0.000) 2.840 4.574 ( 0.000 -4.551 -0.000) 4.551 4.678 ( -0.000 4.207 0.000) 4.207 4.995 ( -0.000 2.975 0.000) 2.975 5.067 ( 0.000 -0.872 -0.000) 0.872 5.298 ( -0.000 5.518 0.000) 5.518 5.429 ( -0.000 8.695 0.000) 8.695 5.569 ( 0.000 -5.244 -0.000) 5.244 5.866 ( 0.000 -8.945 -0.000) 8.945 5.924 ( 0.000 -1.070 -0.000) 1.070 6.124 ( 0.000 -4.323 -0.000) 4.323 6.213 ( 0.000 -8.402 -0.000) 8.402 6.449 ( -0.000 4.219 0.000) 4.219 6.614 ( 0.000 -0.704 -0.000) 0.704 6.695 ( -0.000 5.027 0.000) 5.027 6.808 ( -0.000 2.045 0.000) 2.045 7.417 ( 0.000 -4.992 -0.000) 4.992 7.421 ( -0.000 1.515 0.000) 1.515 7.755 ( 0.000 -6.358 -0.000) 6.358 7.788 ( 0.000 -9.620 -0.000) 9.620 8.117 ( -0.000 0.437 0.000) 0.437 8.791 ( -0.000 8.530 0.000) 8.530 9.144 ( 0.000 -1.328 -0.000) 1.328 9.465 ( -0.000 4.192 0.000) 4.192 9.512 ( -0.000 11.818 0.000) 11.818 9.624 ( -0.000 6.546 0.000) 6.546 9.719 ( 0.000 -4.042 -0.000) 4.042 9.788 ( -0.000 9.002 0.000) 9.002 10.099 ( 0.000 -11.265 -0.000) 11.265 10.572 ( -0.000 5.098 0.000) 5.098 10.815 ( -0.000 1.911 0.000) 1.911 11.077 ( 0.000 -0.235 -0.000) 0.235 11.080 ( 0.000 -4.278 -0.000) 4.278 11.414 ( 0.000 -0.142 -0.000) 0.142 11.582 ( -0.000 3.471 0.000) 3.471 11.684 ( -0.000 6.854 0.000) 6.854 11.989 ( -0.000 3.959 0.000) 3.959 12.074 ( -0.000 1.627 0.000) 1.627 12.079 ( 0.000 -0.640 -0.000) 0.640 12.172 ( 0.000 -5.037 -0.000) 5.037 12.737 ( 0.000 -2.022 -0.000) 2.022 12.878 ( 0.000 -2.644 -0.000) 2.644 12.905 ( 0.000 -0.704 -0.000) 0.704 13.544 ( 0.000 -12.621 -0.000) 12.621 13.658 ( 0.000 -9.450 -0.000) 9.450 14.776 ( 0.000 -3.958 -0.000) 3.958 15.078 ( 0.000 -4.775 -0.000) 4.775 15.430 ( -0.000 2.039 0.000) 2.039 15.458 ( -0.000 8.740 0.000) 8.740 15.508 ( 0.000 -0.221 -0.000) 0.221 15.769 ( 0.000 -1.103 -0.000) 1.103 15.938 ( 0.000 -4.228 -0.000) 4.228 16.082 ( -0.000 1.287 0.000) 1.287 16.126 ( 0.000 -2.620 -0.000) 2.620 16.387 ( -0.000 2.558 0.000) 2.558 16.789 ( 0.000 -2.605 -0.000) 2.605 17.014 ( -0.000 0.194 0.000) 0.194 17.141 ( 0.000 -0.058 -0.000) 0.058 17.839 ( -0.000 3.912 0.000) 3.912 18.744 ( 0.000 -4.126 -0.000) 4.126 18.845 ( 0.000 -2.256 -0.000) 2.256 25.830 ( -0.000 1.190 0.000) 1.190 25.910 ( -0.000 3.310 0.000) 3.310 26.016 ( -0.000 1.577 0.000) 1.577 26.078 ( -0.000 0.136 0.000) 0.136 26.221 ( -0.000 2.707 0.000) 2.707 26.835 ( 0.000 -2.259 -0.000) 2.259 26.925 ( 0.000 -2.628 -0.000) 2.628 26.947 ( 0.000 -0.718 -0.000) 0.718 27.269 ( -0.000 6.239 0.000) 6.239 28.097 ( 0.000 -11.190 -0.000) 11.190 28.372 ( 0.000 -1.206 -0.000) 1.206 28.830 ( 0.000 -2.901 -0.000) 2.901 28.979 ( -0.000 11.056 0.000) 11.056 29.114 ( -0.000 1.061 0.000) 1.061 29.534 ( -0.000 7.865 0.000) 7.865 29.631 ( 0.000 -7.660 -0.000) 7.660 ======================= Grid point 20 (14/140) ======================= q-point: ( 0.22 0.22 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.079 ( 18.859 0.000 18.139) 26.167 1.180 ( 32.947 0.000 3.229) 33.105 1.568 ( -3.969 -0.000 9.272) 10.086 1.945 ( 17.430 0.000 17.317) 24.570 2.042 ( -5.992 -0.000 -5.771) 8.319 2.166 ( 6.712 0.000 6.378) 9.260 2.339 ( -10.269 -0.000 3.994) 11.019 2.502 ( 5.169 0.000 -0.909) 5.249 2.569 ( -6.287 -0.000 2.024) 6.605 2.894 ( -0.057 -0.000 6.628) 6.629 2.978 ( 9.028 0.000 -2.617) 9.399 3.265 ( -2.040 -0.000 -12.525) 12.691 3.400 ( -4.944 -0.000 -4.052) 6.392 3.469 ( 0.134 0.000 -4.008) 4.010 3.769 ( 7.366 0.000 4.734) 8.757 3.793 ( -4.129 -0.000 5.870) 7.177 4.094 ( 1.080 0.000 -8.064) 8.136 4.114 ( -11.610 -0.000 -4.446) 12.433 4.205 ( -4.319 -0.000 4.990) 6.599 4.444 ( -7.481 -0.000 3.176) 8.128 4.590 ( -1.194 -0.000 -1.464) 1.889 4.701 ( -2.284 -0.000 0.593) 2.360 4.748 ( 7.094 0.000 0.277) 7.099 5.165 ( 0.863 0.000 -0.860) 1.218 5.263 ( 2.497 0.000 5.161) 5.733 5.493 ( 5.372 0.000 0.408) 5.387 5.620 ( -3.571 -0.000 -7.792) 8.571 5.767 ( 10.597 0.000 -3.514) 11.164 6.061 ( -2.296 -0.000 0.874) 2.457 6.302 ( -1.326 -0.000 5.648) 5.802 6.350 ( -13.149 -0.000 2.997) 13.486 6.427 ( 1.399 0.000 -2.385) 2.765 6.704 ( 4.500 0.000 5.079) 6.786 6.840 ( 3.430 0.000 -2.942) 4.519 6.940 ( 4.391 0.000 -2.674) 5.141 7.189 ( -12.221 -0.000 8.097) 14.660 7.453 ( -0.871 -0.000 -4.375) 4.461 7.740 ( 5.182 0.000 -6.869) 8.605 7.762 ( -12.219 -0.000 -0.987) 12.258 7.854 ( -0.742 -0.000 4.810) 4.867 8.682 ( 1.951 0.000 5.852) 6.169 8.911 ( -5.935 -0.000 -6.424) 8.746 8.991 ( -2.925 -0.000 -6.047) 6.717 9.180 ( -8.993 -0.000 -8.101) 12.104 9.464 ( -7.117 -0.000 -2.750) 7.630 9.807 ( 2.679 0.000 -3.160) 4.142 10.232 ( -0.310 -0.000 5.584) 5.592 10.383 ( -0.704 -0.000 5.595) 5.639 10.396 ( -2.853 -0.000 6.616) 7.205 10.602 ( -0.348 -0.000 13.110) 13.114 11.013 ( 7.348 0.000 3.957) 8.346 11.269 ( 4.855 0.000 -2.645) 5.528 11.322 ( 7.595 0.000 7.757) 10.856 11.489 ( 3.878 0.000 -5.231) 6.511 11.843 ( -1.259 -0.000 -1.777) 2.178 11.926 ( -7.248 -0.000 1.733) 7.452 12.125 ( 2.450 0.000 4.134) 4.805 12.253 ( -6.354 -0.000 10.216) 12.031 12.324 ( 3.286 0.000 4.543) 5.607 12.555 ( -7.187 -0.000 -6.942) 9.992 12.653 ( -2.216 -0.000 -0.644) 2.308 12.782 ( -6.989 -0.000 7.486) 10.241 13.257 ( 6.172 0.000 -3.150) 6.930 13.755 ( -3.953 -0.000 5.926) 7.124 15.019 ( -0.600 -0.000 -1.360) 1.486 15.189 ( -1.963 -0.000 -1.057) 2.230 15.245 ( 3.194 0.000 0.522) 3.237 15.536 ( -10.642 -0.000 -0.329) 10.647 15.652 ( 8.361 0.000 1.716) 8.535 15.860 ( -2.818 -0.000 -1.036) 3.003 15.910 ( -3.786 -0.000 4.290) 5.722 16.134 ( 1.104 0.000 -4.842) 4.967 16.256 ( 10.516 0.000 -6.419) 12.321 16.363 ( -0.942 -0.000 3.613) 3.734 16.482 ( -8.374 -0.000 1.916) 8.590 16.591 ( -5.360 -0.000 -5.792) 7.892 17.932 ( 6.768 0.000 5.166) 8.514 18.428 ( 5.602 0.000 -1.333) 5.758 18.508 ( 14.460 0.000 -34.026) 36.971 18.790 ( 1.185 0.000 -0.664) 1.358 25.863 ( 2.080 0.000 0.169) 2.086 25.890 ( 1.798 0.000 0.676) 1.921 25.972 ( -1.444 -0.000 1.893) 2.381 26.071 ( -1.339 -0.000 1.394) 1.933 26.234 ( 0.701 0.000 7.135) 7.169 26.557 ( 0.040 0.000 6.520) 6.520 26.769 ( -0.389 -0.000 -6.927) 6.938 26.927 ( 0.419 0.000 -3.509) 3.534 27.297 ( -6.460 -0.000 15.767) 17.039 27.658 ( 6.052 0.000 9.917) 11.618 28.313 ( 0.281 0.000 -4.596) 4.604 28.556 ( -3.883 -0.000 -9.307) 10.084 28.575 ( 0.451 0.000 -0.042) 0.453 29.169 ( -2.059 -0.000 1.420) 2.501 29.530 ( -2.225 -0.000 -11.954) 12.159 31.200 ( 6.159 0.000 -5.281) 8.113 ======================= Grid point 21 (15/140) ======================= q-point: ( 0.33 0.22 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.366 ( 14.679 -9.727 11.940) 21.276 1.507 ( 24.971 -6.098 4.568) 26.108 1.773 ( -0.065 -17.586 9.570) 20.021 1.936 ( -4.441 -0.257 0.880) 4.535 2.114 ( -6.628 -11.308 -1.595) 13.204 2.332 ( -4.776 -4.163 1.115) 6.433 2.378 ( 8.411 -2.994 8.978) 12.662 2.580 ( -2.406 -8.441 2.501) 9.127 2.672 ( 5.007 -8.876 0.761) 10.219 2.967 ( 3.234 -2.078 11.721) 12.335 3.070 ( 8.308 -3.863 0.900) 9.206 3.216 ( -1.242 -3.012 -13.061) 13.462 3.309 ( -5.429 2.779 -3.393) 6.979 3.480 ( 1.014 -4.846 -1.959) 5.324 3.744 ( -2.265 4.798 0.422) 5.322 3.867 ( 4.113 -0.513 3.628) 5.509 3.899 ( -3.921 9.477 -5.079) 11.445 4.019 ( -4.348 3.676 0.634) 5.729 4.231 ( -1.246 -5.567 -3.646) 6.770 4.522 ( -6.477 -8.460 2.348) 10.910 4.559 ( -0.505 0.727 -0.810) 1.200 4.703 ( -3.723 -3.101 4.764) 6.795 4.838 ( 7.111 -1.723 2.740) 7.813 5.149 ( 1.415 2.530 -0.638) 2.968 5.264 ( -2.950 3.350 2.139) 4.950 5.474 ( 1.932 2.659 -5.105) 6.071 5.595 ( -2.127 -2.557 -4.490) 5.587 5.848 ( 11.574 -0.433 -4.785) 12.531 6.040 ( 0.386 1.165 0.682) 1.404 6.180 ( -8.465 6.678 -0.239) 10.785 6.321 ( -3.479 1.992 8.192) 9.120 6.413 ( 0.802 1.435 -2.912) 3.344 6.694 ( 4.103 6.365 2.586) 8.002 6.855 ( 2.426 0.436 1.574) 2.925 6.936 ( 3.073 0.060 -3.071) 4.344 7.233 ( -7.087 -7.310 4.180) 11.006 7.412 ( -6.510 3.029 -4.202) 8.319 7.487 ( -7.051 8.807 -4.521) 12.154 7.833 ( 9.402 6.149 1.257) 11.305 7.843 ( -7.130 -5.728 0.683) 9.171 8.747 ( -2.611 -4.084 1.831) 5.182 8.908 ( -7.362 -8.770 -6.524) 13.179 8.993 ( -0.791 -4.422 0.022) 4.492 9.161 ( -6.873 -9.034 -7.500) 13.605 9.421 ( -3.288 -2.341 -4.297) 5.895 9.745 ( 2.574 5.546 -0.245) 6.119 10.224 ( 0.954 1.683 8.391) 8.611 10.290 ( 0.499 8.707 5.505) 10.314 10.489 ( 0.975 -4.211 4.133) 5.981 10.853 ( -3.663 -14.091 7.177) 16.232 11.106 ( 5.364 -2.111 3.615) 6.805 11.302 ( 6.564 -0.533 -2.480) 7.037 11.478 ( 7.092 -3.409 -4.671) 9.151 11.496 ( 1.890 -6.298 2.932) 7.199 11.796 ( -1.160 3.845 -1.066) 4.155 11.891 ( -3.821 -1.945 1.082) 4.422 12.172 ( 2.124 1.690 3.920) 4.768 12.242 ( -4.279 1.342 2.018) 4.918 12.351 ( 2.871 1.812 6.291) 7.149 12.426 ( -3.041 1.765 -2.104) 4.098 12.681 ( -2.980 -2.960 -4.321) 6.025 12.783 ( -10.710 -2.843 9.419) 14.544 13.241 ( 1.740 3.487 -6.203) 7.326 13.716 ( -3.398 5.220 6.380) 8.916 14.931 ( 1.479 6.331 0.453) 6.517 15.137 ( -3.052 2.465 -2.007) 4.407 15.381 ( 2.699 -8.666 -0.041) 9.076 15.459 ( -8.274 -0.600 -0.236) 8.299 15.566 ( 5.085 13.171 -0.149) 14.120 15.827 ( 1.610 2.212 2.261) 3.549 15.891 ( -3.507 1.063 3.349) 4.964 16.115 ( 2.485 1.808 -2.828) 4.177 16.261 ( 7.180 2.839 -8.524) 11.501 16.389 ( 0.324 -1.005 1.261) 1.645 16.484 ( -9.767 -5.634 0.459) 11.284 16.598 ( -4.039 -7.390 -2.765) 8.864 17.965 ( 9.209 7.529 2.463) 12.147 18.223 ( 12.124 11.915 -9.186) 19.322 18.593 ( -0.770 -3.646 -11.387) 11.982 18.802 ( 0.306 -0.907 0.764) 1.225 25.869 ( 1.930 0.175 -0.465) 1.993 25.936 ( 1.202 -2.433 -0.191) 2.721 25.991 ( -0.093 -1.828 2.943) 3.466 26.076 ( -1.601 -1.103 1.378) 2.383 26.270 ( 0.875 0.743 6.641) 6.739 26.622 ( -4.117 -4.341 2.971) 6.680 26.749 ( 2.748 -0.021 -4.120) 4.953 26.927 ( 0.211 -1.675 -5.120) 5.391 27.320 ( -3.213 0.845 13.907) 14.298 27.752 ( 5.118 0.951 9.357) 10.708 28.321 ( -0.236 -2.417 -4.159) 4.816 28.544 ( -5.226 -8.593 -10.454) 14.507 28.623 ( -0.110 -4.875 0.564) 4.909 29.127 ( -8.197 -0.475 -4.104) 9.179 29.470 ( 3.526 1.049 -7.350) 8.219 31.035 ( 8.168 20.374 0.655) 21.960 ======================= Grid point 22 (16/140) ======================= q-point: ( 0.44 0.22 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.712 ( 4.175 -3.220 3.052) 6.092 1.733 ( 16.763 -10.287 6.404) 20.684 1.970 ( 2.487 -9.285 -1.215) 9.689 2.171 ( 3.789 -11.014 4.308) 12.419 2.245 ( -3.263 -10.787 8.682) 14.226 2.442 ( -6.076 -13.066 -0.237) 14.411 2.504 ( 2.390 -4.341 8.740) 10.047 2.737 ( -5.189 -11.092 -2.955) 12.598 2.819 ( -1.086 -9.326 -4.983) 10.629 3.053 ( 2.360 0.999 4.135) 4.865 3.163 ( 0.378 -0.118 0.168) 0.430 3.199 ( -4.676 3.016 -3.084) 6.362 3.259 ( 0.361 -7.293 -0.925) 7.360 3.610 ( -7.516 9.903 -4.215) 13.128 3.654 ( 1.821 3.740 -5.142) 6.614 3.686 ( 6.553 -11.226 2.101) 13.167 3.863 ( -2.312 1.884 2.366) 3.806 4.134 ( 12.684 -7.598 3.756) 15.255 4.288 ( -0.823 -4.284 -2.302) 4.933 4.500 ( 1.494 3.725 2.374) 4.663 4.629 ( -6.299 -5.442 0.642) 8.349 4.782 ( -4.496 -6.637 2.893) 8.522 4.915 ( 4.425 3.153 4.201) 6.868 5.076 ( -0.185 4.550 2.245) 5.077 5.206 ( 0.340 -0.818 -2.935) 3.066 5.401 ( -4.130 2.705 -5.017) 7.039 5.603 ( -2.506 -3.212 -1.831) 4.466 5.881 ( 7.120 1.838 -8.450) 11.201 5.971 ( -5.893 5.502 -3.438) 8.765 6.099 ( 6.046 0.024 1.989) 6.365 6.273 ( -4.778 5.107 9.898) 12.120 6.382 ( 3.060 1.874 -2.815) 4.561 6.618 ( 2.476 5.906 0.378) 6.415 6.863 ( 4.648 2.420 1.575) 5.472 6.961 ( -3.329 -3.133 -1.168) 4.719 7.198 ( -6.223 6.919 -2.929) 9.756 7.286 ( -3.965 -0.405 -1.089) 4.132 7.379 ( -6.608 -1.278 -3.122) 7.420 7.808 ( 6.094 2.753 2.783) 7.243 7.895 ( 0.017 -1.472 2.354) 2.776 8.767 ( -6.148 -2.999 -3.249) 7.573 8.994 ( -6.091 -10.494 -5.371) 13.269 9.131 ( 0.193 -9.617 4.727) 10.717 9.265 ( -4.449 -10.677 -5.655) 12.876 9.466 ( 0.348 -7.804 -5.205) 9.387 9.689 ( 1.073 3.418 0.828) 3.677 10.151 ( -0.100 8.867 2.982) 9.355 10.296 ( 3.108 -1.442 7.781) 8.502 10.543 ( -0.106 0.421 2.385) 2.425 11.011 ( -1.679 -2.956 6.480) 7.318 11.191 ( 4.895 -2.805 2.227) 6.065 11.365 ( 7.396 -0.784 -0.551) 7.458 11.511 ( 0.464 -6.768 -13.812) 15.388 11.669 ( 4.631 4.460 5.262) 8.308 11.769 ( -0.587 -7.993 0.443) 8.027 11.926 ( -1.133 -3.525 0.650) 3.759 12.090 ( -5.759 6.182 -0.048) 8.449 12.186 ( 0.071 1.152 0.315) 1.197 12.372 ( 2.239 1.891 6.148) 6.810 12.475 ( 5.965 -2.911 3.662) 7.581 12.663 ( 0.148 0.390 -4.531) 4.550 12.785 ( -14.337 -3.695 7.437) 16.568 13.110 ( -1.841 6.712 -7.985) 10.592 13.577 ( -5.339 10.602 5.692) 13.164 14.892 ( 2.566 0.631 2.435) 3.593 15.057 ( -2.775 2.228 -2.414) 4.300 15.357 ( 3.725 9.684 0.059) 10.376 15.448 ( -4.906 -3.805 -0.761) 6.255 15.567 ( -0.066 -6.256 1.604) 6.459 15.790 ( 2.246 6.142 4.256) 7.803 15.871 ( -0.248 -1.045 -0.466) 1.171 16.091 ( 3.747 3.095 -0.862) 4.936 16.204 ( 3.523 4.290 -6.524) 8.566 16.403 ( 0.360 -1.103 -3.075) 3.287 16.488 ( -10.544 -3.811 0.500) 11.223 16.712 ( -2.317 -8.782 -0.417) 9.092 17.838 ( 13.059 15.377 -1.976) 20.270 18.165 ( 6.057 3.466 -0.216) 6.982 18.530 ( -4.705 1.724 -6.740) 8.399 18.827 ( -0.091 -1.156 0.807) 1.413 25.889 ( 1.787 -0.896 -0.143) 2.004 25.969 ( -0.258 -1.545 -0.930) 1.822 26.058 ( 1.505 -2.850 3.068) 4.450 26.092 ( -1.785 -1.661 0.896) 2.598 26.280 ( 0.513 2.154 4.956) 5.428 26.653 ( -4.825 -3.323 0.294) 5.866 26.774 ( 3.971 -0.648 0.100) 4.024 26.919 ( 0.101 -0.865 -7.864) 7.912 27.364 ( -0.485 0.175 13.509) 13.519 27.786 ( 4.371 4.149 6.095) 8.571 28.325 ( -1.017 -1.059 -3.461) 3.760 28.610 ( -7.690 -9.837 -10.563) 16.355 28.754 ( -1.646 -11.068 -0.413) 11.197 29.047 ( -7.975 -2.052 -6.650) 10.585 29.483 ( 5.615 -0.355 -1.080) 5.729 30.720 ( 8.876 25.225 3.849) 27.016 ======================= Grid point 23 (17/140) ======================= q-point: ( 0.56 0.22 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.740 ( 3.560 3.720 2.598) 5.767 2.039 ( 9.677 -8.190 3.890) 13.261 2.109 ( -2.721 -7.949 -2.894) 8.886 2.272 ( -2.271 -4.002 1.069) 4.724 2.499 ( 7.154 -6.583 10.011) 13.955 2.597 ( -3.095 -6.962 -2.263) 7.948 2.674 ( 0.603 -8.515 10.218) 13.315 2.789 ( -6.120 -4.426 -4.374) 8.728 2.960 ( -2.015 -11.014 -6.944) 13.175 3.002 ( -1.631 5.902 0.711) 6.164 3.101 ( -0.651 1.488 -4.610) 4.888 3.218 ( -3.361 -4.809 -1.266) 6.002 3.361 ( 2.745 -1.473 -0.280) 3.128 3.397 ( -6.946 1.409 0.878) 7.142 3.669 ( 1.873 -4.565 -2.407) 5.490 3.806 ( 0.379 1.532 0.175) 1.588 3.908 ( 1.459 -5.882 0.490) 6.080 4.283 ( 3.810 0.100 3.169) 4.957 4.439 ( 5.872 1.160 4.520) 7.500 4.463 ( 6.472 -0.341 2.269) 6.867 4.627 ( -7.707 -2.507 -4.070) 9.069 4.823 ( -0.723 1.751 1.594) 2.475 4.895 ( 1.691 -3.953 -1.459) 4.540 5.050 ( 3.920 5.483 7.951) 10.423 5.231 ( -4.531 -3.421 -6.269) 8.458 5.358 ( -3.125 -5.258 1.791) 6.374 5.645 ( -2.162 -4.051 0.308) 4.602 5.816 ( -1.753 2.206 -8.485) 8.941 5.856 ( 2.821 3.769 -4.869) 6.773 6.142 ( 3.945 2.714 1.949) 5.170 6.183 ( -5.159 5.060 5.970) 9.373 6.395 ( 5.468 -1.401 -0.263) 5.651 6.546 ( 1.458 4.228 -0.498) 4.500 6.878 ( 4.340 -0.070 -1.235) 4.513 6.964 ( -7.069 -2.694 1.342) 7.683 7.075 ( -2.988 3.649 0.001) 4.716 7.200 ( -1.183 2.976 -6.659) 7.389 7.394 ( -4.223 -4.457 1.824) 6.405 7.831 ( 1.257 1.637 2.934) 3.587 7.939 ( 6.037 -0.492 3.351) 6.922 8.738 ( -5.700 -1.682 -4.358) 7.370 9.110 ( -3.356 -10.135 -3.293) 11.173 9.319 ( 1.479 -8.138 3.510) 8.985 9.363 ( -2.256 -6.948 -2.405) 7.691 9.636 ( -2.910 -8.134 -4.192) 9.602 9.653 ( 3.968 -3.371 1.059) 5.313 10.003 ( -2.291 7.850 -0.757) 8.212 10.378 ( 3.323 0.842 6.021) 6.929 10.508 ( -2.154 1.535 -0.758) 2.752 11.025 ( 0.393 2.260 3.809) 4.446 11.299 ( 3.375 -2.317 2.849) 4.987 11.403 ( 4.723 2.149 0.321) 5.199 11.550 ( -1.841 -1.737 -3.139) 4.032 11.636 ( 5.158 -0.509 -7.270) 8.929 11.831 ( -1.321 3.256 1.644) 3.879 11.875 ( -3.891 4.051 -2.125) 6.006 12.089 ( -0.214 -5.926 3.641) 6.958 12.218 ( 4.136 -2.007 1.890) 4.971 12.378 ( 0.029 2.014 5.924) 6.258 12.567 ( 6.694 2.737 2.042) 7.514 12.655 ( 0.792 -2.533 -2.411) 3.586 12.758 ( -10.719 -2.645 2.004) 11.221 12.978 ( -0.225 1.173 -6.178) 6.292 13.352 ( -8.049 11.041 3.081) 14.006 14.963 ( 1.427 -3.850 3.572) 5.442 15.004 ( -0.933 0.539 -2.317) 2.555 15.277 ( 2.462 2.637 1.119) 3.777 15.471 ( -2.410 0.978 2.207) 3.411 15.576 ( -3.324 -0.324 -4.145) 5.323 15.810 ( 3.731 -2.553 4.913) 6.677 15.896 ( 2.521 -0.204 0.101) 2.531 16.054 ( 3.821 4.359 -0.460) 5.815 16.120 ( 1.020 3.890 -4.396) 5.958 16.406 ( -0.587 -1.931 -5.294) 5.665 16.463 ( -9.610 -2.279 2.267) 10.133 16.833 ( -1.543 -7.027 0.151) 7.196 17.673 ( 10.810 14.343 -0.693) 17.974 18.142 ( 2.290 4.043 1.631) 4.925 18.439 ( -4.573 0.392 -4.275) 6.272 18.844 ( -0.150 -0.624 0.434) 0.775 25.916 ( 0.723 -0.451 0.417) 0.949 25.986 ( 0.578 -1.371 -0.989) 1.787 26.090 ( -1.799 -0.441 0.656) 1.965 26.142 ( 1.285 -2.811 1.858) 3.606 26.252 ( -0.012 3.510 2.442) 4.276 26.681 ( -3.096 -3.139 1.645) 4.705 26.821 ( 3.020 -1.078 1.303) 3.461 26.888 ( 0.545 -0.320 -8.730) 8.753 27.442 ( 1.906 -0.657 14.247) 14.389 27.738 ( 2.416 5.873 -0.681) 6.387 28.317 ( -1.671 -1.419 -3.066) 3.769 28.647 ( -8.247 -7.868 -9.320) 14.723 28.937 ( -2.523 -12.325 -0.992) 12.619 29.031 ( -3.226 -4.156 -3.287) 6.203 29.539 ( 3.948 -0.934 1.496) 4.324 30.372 ( 6.743 25.007 3.838) 26.184 ======================= Grid point 24 (18/140) ======================= q-point: (-0.33 0.22 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.642 ( -0.512 10.562 1.382) 10.664 2.105 ( 0.616 7.144 -1.963) 7.435 2.206 ( -0.724 -6.470 -1.896) 6.781 2.349 ( 2.418 -4.365 5.291) 7.272 2.603 ( -2.426 0.663 -3.358) 4.195 2.634 ( 2.324 2.715 6.582) 7.490 2.806 ( -0.772 -5.077 -1.783) 5.436 2.830 ( -1.082 -2.983 1.710) 3.605 2.924 ( 1.586 0.967 1.654) 2.487 3.055 ( -2.321 -6.630 -6.128) 9.322 3.098 ( 0.665 -1.820 -3.383) 3.898 3.174 ( -4.710 0.670 0.401) 4.774 3.411 ( 2.248 -3.558 -1.296) 4.403 3.446 ( -2.994 -3.727 2.383) 5.342 3.757 ( 1.138 3.565 -1.009) 3.876 3.784 ( 2.307 -5.843 0.083) 6.282 3.998 ( -1.908 -6.319 0.412) 6.614 4.264 ( 0.877 10.516 5.415) 11.861 4.358 ( 5.098 6.479 2.415) 8.591 4.483 ( 2.689 3.076 -1.295) 4.286 4.590 ( -7.976 -1.544 -6.326) 10.296 4.860 ( 0.666 -3.068 4.504) 5.490 4.966 ( 4.462 -2.040 -4.205) 6.461 5.021 ( 1.976 4.799 4.670) 6.982 5.283 ( -3.858 -8.673 0.185) 9.495 5.432 ( -0.910 -3.322 -0.737) 3.522 5.707 ( -0.109 -2.703 2.786) 3.883 5.738 ( -1.534 2.266 -3.129) 4.156 5.816 ( 2.854 0.669 -4.460) 5.337 6.096 ( -0.426 2.545 -2.297) 3.455 6.101 ( -1.931 4.509 5.393) 7.290 6.492 ( 3.570 -3.990 0.101) 5.355 6.504 ( 0.874 1.237 0.339) 1.552 6.899 ( 1.790 1.592 -2.599) 3.534 6.947 ( -4.570 -0.590 0.879) 4.691 7.049 ( -1.519 -3.350 1.717) 4.059 7.153 ( -0.067 -2.013 -3.312) 3.876 7.457 ( -0.764 -3.919 1.476) 4.257 7.792 ( -0.134 3.994 1.162) 4.162 8.030 ( 5.586 -1.896 3.393) 6.806 8.707 ( -3.864 -1.999 -3.807) 5.781 9.252 ( -0.912 -9.607 -1.194) 9.724 9.432 ( -0.517 -5.486 -0.456) 5.529 9.465 ( 1.700 -3.239 1.068) 3.811 9.620 ( 3.567 1.260 0.215) 3.789 9.826 ( -3.090 2.754 4.192) 5.891 9.901 ( -2.170 -9.863 -6.488) 12.003 10.305 ( 0.214 9.967 1.164) 10.037 10.520 ( -0.327 -3.073 -0.083) 3.091 10.993 ( 0.770 3.468 0.572) 3.599 11.279 ( 1.342 6.655 0.786) 6.835 11.360 ( 0.431 7.118 1.251) 7.240 11.562 ( -2.002 -0.840 2.354) 3.202 11.588 ( 0.526 5.319 -5.415) 7.608 11.791 ( 3.809 -2.571 -1.449) 4.819 11.859 ( -4.003 -4.743 -1.332) 6.348 12.143 ( 0.679 3.233 2.769) 4.311 12.279 ( 4.530 1.647 1.119) 4.948 12.362 ( -2.383 3.325 5.358) 6.741 12.541 ( 2.926 0.332 0.121) 2.947 12.701 ( 0.389 -1.993 0.737) 2.161 12.760 ( -3.893 -3.676 -2.025) 5.724 13.029 ( 5.552 -5.789 -2.210) 8.320 13.175 ( -8.272 0.760 -0.804) 8.346 14.934 ( -1.544 3.675 -0.397) 4.006 15.098 ( 1.781 -5.015 1.950) 5.668 15.307 ( 1.864 -2.325 1.597) 3.381 15.372 ( -1.371 4.921 -0.563) 5.140 15.600 ( -1.883 -4.175 -1.583) 4.845 15.893 ( 1.900 -0.270 2.428) 3.095 15.900 ( 1.688 1.818 0.205) 2.489 16.004 ( 6.442 3.282 -3.726) 8.134 16.069 ( -3.326 0.590 1.317) 3.626 16.422 ( 1.849 -3.458 -6.654) 7.724 16.453 ( -8.516 -3.081 5.068) 10.378 16.923 ( -1.063 -4.691 0.284) 4.818 17.511 ( 5.408 12.313 0.247) 13.451 18.077 ( 0.186 5.171 0.622) 5.212 18.427 ( -2.086 -3.793 -1.343) 4.533 18.850 ( -0.108 -0.013 0.136) 0.174 25.910 ( -0.269 1.256 0.242) 1.307 26.021 ( 1.458 -1.845 -0.180) 2.359 26.074 ( -1.689 0.794 -0.197) 1.876 26.174 ( 0.537 3.867 1.780) 4.291 26.214 ( -0.023 -1.494 -0.450) 1.561 26.726 ( -1.555 -2.707 3.623) 4.783 26.854 ( 2.460 0.058 -5.815) 6.314 26.874 ( -0.016 -2.286 -0.639) 2.374 27.530 ( 2.059 3.398 14.841) 15.363 27.664 ( 1.673 -1.000 -7.655) 7.899 28.320 ( -0.690 -1.379 -1.420) 2.097 28.662 ( -6.963 -6.109 -6.955) 11.583 29.075 ( -1.231 -4.376 -0.736) 4.605 29.127 ( -0.255 -10.796 0.084) 10.800 29.560 ( 1.068 2.817 1.204) 3.244 30.036 ( 3.519 20.386 2.424) 20.829 ======================= Grid point 25 (19/140) ======================= q-point: (-0.22 0.22 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.414 ( -0.000 15.518 0.000) 15.518 1.873 ( -0.000 17.847 0.000) 17.847 2.259 ( -0.000 2.507 0.000) 2.507 2.429 ( 0.000 -1.758 -0.000) 1.758 2.493 ( -0.000 8.437 0.000) 8.437 2.568 ( -0.000 6.353 0.000) 6.353 2.857 ( 0.000 -0.471 -0.000) 0.471 2.876 ( 0.000 -3.066 -0.000) 3.066 2.927 ( -0.000 0.843 0.000) 0.843 3.058 ( -0.000 3.663 0.000) 3.663 3.148 ( 0.000 -7.640 -0.000) 7.640 3.228 ( 0.000 -4.445 -0.000) 4.445 3.419 ( -0.000 2.841 0.000) 2.841 3.478 ( -0.000 0.154 0.000) 0.154 3.665 ( -0.000 5.648 0.000) 5.648 3.892 ( 0.000 -3.011 -0.000) 3.011 4.065 ( -0.000 10.007 0.000) 10.007 4.129 ( 0.000 -8.091 -0.000) 8.091 4.308 ( -0.000 1.908 0.000) 1.908 4.482 ( -0.000 3.248 0.000) 3.248 4.489 ( -0.000 2.074 0.000) 2.074 4.934 ( -0.000 6.734 0.000) 6.734 4.939 ( 0.000 -4.043 -0.000) 4.043 5.014 ( 0.000 -2.100 -0.000) 2.100 5.374 ( 0.000 -2.465 -0.000) 2.465 5.476 ( 0.000 -2.861 -0.000) 2.861 5.658 ( -0.000 4.371 0.000) 4.371 5.745 ( -0.000 0.240 0.000) 0.240 5.833 ( 0.000 -2.291 -0.000) 2.291 6.053 ( -0.000 1.277 0.000) 1.277 6.068 ( 0.000 -0.253 -0.000) 0.253 6.517 ( 0.000 -2.236 -0.000) 2.236 6.552 ( 0.000 -0.667 -0.000) 0.667 6.834 ( -0.000 3.991 0.000) 3.991 6.930 ( -0.000 2.133 0.000) 2.133 7.148 ( 0.000 -7.950 -0.000) 7.950 7.249 ( 0.000 -8.943 -0.000) 8.943 7.526 ( 0.000 -4.320 -0.000) 4.320 7.727 ( -0.000 3.273 0.000) 3.273 8.097 ( 0.000 -1.677 -0.000) 1.677 8.731 ( 0.000 -4.404 -0.000) 4.404 9.380 ( 0.000 -2.224 -0.000) 2.224 9.451 ( -0.000 1.574 0.000) 1.574 9.500 ( 0.000 -2.314 -0.000) 2.314 9.709 ( 0.000 -7.561 -0.000) 7.561 9.730 ( -0.000 3.116 0.000) 3.116 10.021 ( 0.000 -2.237 -0.000) 2.237 10.105 ( -0.000 13.329 0.000) 13.329 10.581 ( 0.000 -4.361 -0.000) 4.361 10.928 ( -0.000 4.403 0.000) 4.403 11.168 ( -0.000 5.991 0.000) 5.991 11.199 ( -0.000 10.820 0.000) 10.820 11.457 ( -0.000 5.050 0.000) 5.050 11.594 ( 0.000 -0.827 -0.000) 0.827 11.898 ( 0.000 -8.039 -0.000) 8.039 11.946 ( 0.000 -6.164 -0.000) 6.164 12.027 ( -0.000 10.134 0.000) 10.134 12.240 ( -0.000 9.211 0.000) 9.211 12.244 ( -0.000 4.613 0.000) 4.613 12.631 ( 0.000 -5.611 -0.000) 5.611 12.767 ( 0.000 -5.186 -0.000) 5.186 12.784 ( 0.000 -2.900 -0.000) 2.900 13.161 ( 0.000 -6.098 -0.000) 6.098 13.240 ( 0.000 -12.357 -0.000) 12.357 14.846 ( -0.000 5.295 0.000) 5.295 15.111 ( -0.000 4.172 0.000) 4.172 15.361 ( 0.000 -5.348 -0.000) 5.348 15.395 ( 0.000 -4.295 -0.000) 4.295 15.631 ( 0.000 -0.248 -0.000) 0.248 15.843 ( -0.000 4.660 0.000) 4.660 15.881 ( -0.000 1.412 0.000) 1.412 16.034 ( 0.000 -0.653 -0.000) 0.653 16.053 ( 0.000 -2.322 -0.000) 2.322 16.444 ( -0.000 0.174 0.000) 0.174 16.534 ( 0.000 -8.848 -0.000) 8.848 16.979 ( 0.000 -2.569 -0.000) 2.569 17.344 ( -0.000 9.881 0.000) 9.881 17.990 ( -0.000 5.029 0.000) 5.029 18.510 ( 0.000 -6.775 -0.000) 6.775 18.845 ( -0.000 0.451 0.000) 0.451 25.882 ( -0.000 1.787 0.000) 1.787 26.033 ( -0.000 2.779 0.000) 2.779 26.060 ( 0.000 -1.484 -0.000) 1.484 26.101 ( -0.000 4.006 0.000) 4.006 26.245 ( 0.000 -1.273 -0.000) 1.273 26.775 ( 0.000 -2.113 -0.000) 2.113 26.850 ( 0.000 -1.086 -0.000) 1.086 26.912 ( 0.000 -1.740 -0.000) 1.740 27.468 ( -0.000 6.189 0.000) 6.189 27.760 ( 0.000 -8.055 -0.000) 8.055 28.336 ( 0.000 -1.085 -0.000) 1.085 28.700 ( 0.000 -4.644 -0.000) 4.644 29.120 ( 0.000 -1.641 -0.000) 1.641 29.311 ( 0.000 -10.576 -0.000) 10.576 29.432 ( -0.000 12.654 0.000) 12.654 29.799 ( -0.000 10.070 0.000) 10.070 ======================= Grid point 30 (20/140) ======================= q-point: ( 0.33 0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.477 ( 9.782 0.000 14.510) 17.499 1.571 ( -1.737 -0.000 6.537) 6.764 1.702 ( 24.594 0.000 5.572) 25.217 1.896 ( -4.328 -0.000 -3.334) 5.463 1.941 ( -4.582 -0.000 -1.944) 4.977 2.251 ( -5.652 -0.000 2.704) 6.266 2.481 ( 6.369 0.000 6.371) 9.008 2.502 ( -4.239 -0.000 1.126) 4.386 2.640 ( 2.491 0.000 -0.591) 2.560 3.085 ( 2.182 0.000 -6.671) 7.019 3.095 ( 10.471 0.000 21.030) 23.493 3.104 ( 2.576 0.000 -6.616) 7.099 3.250 ( -7.457 -0.000 -4.703) 8.816 3.439 ( 3.904 0.000 -3.819) 5.462 3.785 ( -3.483 -0.000 4.910) 6.020 3.942 ( -5.267 -0.000 -3.750) 6.466 3.946 ( 8.197 0.000 4.565) 9.383 4.002 ( -0.558 -0.000 -9.828) 9.844 4.189 ( -2.227 -0.000 1.840) 2.889 4.302 ( -10.083 -0.000 -1.669) 10.220 4.577 ( 0.132 0.000 0.225) 0.261 4.661 ( -3.656 -0.000 1.313) 3.884 4.909 ( 7.938 0.000 7.018) 10.595 5.176 ( -0.612 -0.000 1.399) 1.527 5.299 ( -4.781 -0.000 3.540) 5.949 5.493 ( -0.236 -0.000 -6.400) 6.405 5.524 ( 2.017 0.000 -7.462) 7.730 5.900 ( 9.196 0.000 -5.936) 10.946 6.071 ( 1.935 0.000 4.224) 4.647 6.136 ( -12.197 -0.000 -2.765) 12.507 6.378 ( 1.896 0.000 7.926) 8.149 6.440 ( 3.498 0.000 -1.761) 3.917 6.791 ( -0.056 -0.000 -0.272) 0.277 6.837 ( -0.913 -0.000 2.042) 2.237 6.980 ( 3.510 0.000 -2.240) 4.163 7.146 ( -1.635 -0.000 5.610) 5.844 7.379 ( -2.967 -0.000 -4.310) 5.232 7.527 ( -14.252 -0.000 -3.100) 14.585 7.676 ( -4.500 -0.000 -0.851) 4.580 7.966 ( 7.206 0.000 0.787) 7.249 8.700 ( -3.589 -0.000 0.153) 3.592 8.735 ( -7.334 -0.000 -5.923) 9.427 8.981 ( -6.711 -0.000 -5.910) 8.943 8.984 ( 2.487 0.000 4.597) 5.226 9.354 ( -0.973 -0.000 -5.491) 5.576 9.843 ( 3.814 0.000 -0.957) 3.932 10.219 ( -5.612 -0.000 2.278) 6.057 10.439 ( 0.910 0.000 4.473) 4.565 10.447 ( 0.020 0.000 6.964) 6.964 10.738 ( 0.602 0.000 13.634) 13.647 11.146 ( 5.366 0.000 1.650) 5.614 11.320 ( 4.967 0.000 -3.422) 6.032 11.417 ( -0.383 -0.000 -12.659) 12.665 11.563 ( 11.428 0.000 10.489) 15.512 11.820 ( -1.265 -0.000 -1.958) 2.331 11.843 ( -3.144 -0.000 2.009) 3.731 12.211 ( -5.185 -0.000 0.520) 5.211 12.286 ( 5.345 0.000 9.607) 10.994 12.329 ( -3.622 -0.000 -8.468) 9.210 12.452 ( -1.411 -0.000 5.875) 6.042 12.564 ( -8.529 -0.000 4.128) 9.475 12.784 ( -0.338 -0.000 3.392) 3.409 13.241 ( -1.006 -0.000 -8.510) 8.569 13.779 ( -0.265 -0.000 5.039) 5.045 15.014 ( 0.838 0.000 -0.225) 0.868 15.128 ( -2.571 -0.000 -1.732) 3.100 15.326 ( 4.548 0.000 1.277) 4.724 15.368 ( -8.962 -0.000 -1.157) 9.036 15.737 ( 2.631 0.000 -2.598) 3.698 15.816 ( -2.275 -0.000 -0.535) 2.337 15.948 ( 1.122 0.000 7.125) 7.213 16.106 ( 1.447 0.000 -4.046) 4.297 16.315 ( 6.683 0.000 -9.292) 11.446 16.342 ( -8.698 -0.000 -0.991) 8.754 16.403 ( 0.656 0.000 5.089) 5.131 16.493 ( -2.296 -0.000 -2.196) 3.178 18.100 ( 9.026 0.000 3.264) 9.598 18.400 ( 4.486 0.000 -17.240) 17.815 18.468 ( 0.287 0.000 -0.456) 0.539 18.800 ( 0.360 0.000 0.282) 0.458 25.879 ( 0.844 0.000 -1.415) 1.648 25.929 ( 2.176 0.000 0.587) 2.254 25.984 ( 0.034 0.000 2.455) 2.455 26.060 ( -1.590 -0.000 1.231) 2.011 26.321 ( 0.971 0.000 7.285) 7.350 26.564 ( -3.582 -0.000 1.066) 3.737 26.767 ( 4.215 0.000 -0.535) 4.249 26.897 ( 0.449 0.000 -3.725) 3.752 27.361 ( -2.820 -0.000 11.606) 11.944 27.875 ( 7.244 0.000 12.736) 14.652 28.235 ( -0.906 -0.000 -10.471) 10.510 28.429 ( -2.781 -0.000 -3.825) 4.729 28.585 ( 0.613 0.000 0.107) 0.622 29.004 ( -11.844 -0.000 -9.958) 15.474 29.482 ( 5.065 0.000 -4.334) 6.667 31.242 ( 2.867 0.000 -0.847) 2.990 ======================= Grid point 31 (21/140) ======================= q-point: ( 0.44 0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( -0.060 -7.898 14.006) 16.079 1.743 ( 3.011 -6.475 -9.036) 11.518 1.945 ( 15.613 -6.318 5.385) 17.683 1.982 ( 0.736 -15.653 7.163) 17.230 2.022 ( 0.716 -8.941 0.661) 8.994 2.265 ( -2.002 -4.319 0.905) 4.845 2.526 ( -0.717 -3.400 1.771) 3.900 2.537 ( -2.448 -3.182 4.603) 6.107 2.661 ( -2.779 -4.869 -4.123) 6.959 3.060 ( -2.086 -4.430 -11.258) 12.277 3.119 ( 2.810 1.854 0.103) 3.368 3.164 ( -4.378 1.194 0.818) 4.611 3.251 ( 0.754 -0.420 7.595) 7.644 3.567 ( 8.341 -5.924 3.559) 10.832 3.734 ( 1.299 4.117 -1.330) 4.517 3.779 ( -1.516 11.516 -3.366) 12.094 3.889 ( -4.325 3.867 2.298) 6.241 4.102 ( 5.949 -9.289 -0.308) 11.035 4.175 ( 2.590 -3.810 -2.728) 5.354 4.418 ( -5.627 -12.100 -0.548) 13.355 4.568 ( 0.380 1.420 0.992) 1.773 4.666 ( -4.516 -3.574 2.768) 6.390 5.020 ( 8.084 -0.123 5.170) 9.596 5.141 ( -2.909 3.160 5.210) 6.752 5.226 ( -3.518 3.407 -0.325) 4.908 5.445 ( 0.447 5.016 -4.153) 6.527 5.493 ( -2.744 -2.805 -8.937) 9.760 5.912 ( 3.358 1.947 -5.466) 6.704 5.989 ( -6.994 4.163 -3.297) 8.782 6.150 ( 6.606 -1.776 4.283) 8.070 6.380 ( 0.440 4.348 3.182) 5.406 6.452 ( 4.308 2.706 2.858) 5.835 6.728 ( -2.260 4.706 -0.540) 5.248 6.864 ( -2.266 -2.350 2.373) 4.036 6.966 ( 4.009 3.026 -1.668) 5.292 7.201 ( -1.312 -2.517 2.486) 3.773 7.294 ( -5.979 7.308 -0.105) 9.443 7.322 ( -5.949 1.885 -6.708) 9.162 7.746 ( -4.862 -7.760 0.117) 9.159 7.977 ( 6.321 3.787 1.127) 7.454 8.680 ( -3.654 -1.310 -1.754) 4.259 8.747 ( -5.474 -9.472 -4.058) 11.668 8.993 ( -4.225 -8.724 -1.723) 9.846 9.068 ( 1.494 -4.850 3.453) 6.138 9.349 ( 0.574 -2.623 -5.659) 6.264 9.789 ( 2.055 5.748 0.819) 6.159 10.267 ( -1.527 -5.175 2.092) 5.787 10.335 ( -0.045 8.860 3.549) 9.544 10.551 ( 1.056 -2.511 3.935) 4.786 10.925 ( -0.217 -10.928 12.826) 16.852 11.200 ( 2.693 -1.806 1.626) 3.628 11.337 ( 0.500 -1.015 -15.214) 15.256 11.367 ( 2.933 -2.693 -3.671) 5.415 11.719 ( 7.570 -1.368 7.115) 10.478 11.801 ( 1.480 4.424 2.970) 5.531 11.846 ( -0.174 -4.854 0.037) 4.857 12.135 ( -5.199 4.181 -1.430) 6.823 12.208 ( -1.991 2.042 -2.336) 3.687 12.395 ( -4.674 -3.409 1.528) 5.983 12.498 ( 1.932 -3.603 4.432) 6.030 12.573 ( -0.448 -0.947 6.401) 6.486 12.778 ( -0.688 2.365 4.166) 4.840 13.133 ( -4.456 4.413 -10.664) 12.371 13.743 ( -0.299 7.164 3.883) 8.154 14.966 ( 1.841 4.424 0.859) 4.868 15.073 ( -2.653 3.083 -1.374) 4.293 15.332 ( -4.789 -3.650 -1.325) 6.165 15.438 ( 2.733 -6.161 0.628) 6.769 15.605 ( 0.299 11.405 -0.511) 11.421 15.824 ( -0.957 -2.718 -0.594) 2.943 15.936 ( 1.347 5.963 4.444) 7.558 16.136 ( 3.692 -1.282 -2.784) 4.798 16.259 ( -0.348 2.250 -3.465) 4.146 16.323 ( -4.200 -1.732 -2.396) 5.136 16.424 ( -0.132 0.204 0.218) 0.327 16.554 ( -0.662 -7.888 0.062) 7.916 18.130 ( 9.436 7.937 0.415) 12.337 18.274 ( 4.218 5.605 -4.772) 8.484 18.476 ( -4.668 -0.259 -3.921) 6.101 18.812 ( 0.068 -0.884 0.549) 1.043 25.885 ( 0.839 -0.823 -0.836) 1.442 25.947 ( 0.786 -0.388 -0.013) 0.877 26.028 ( 0.987 -3.040 1.928) 3.733 26.062 ( -1.551 -0.848 0.904) 1.985 26.347 ( 0.786 1.624 5.543) 5.829 26.565 ( -3.033 -2.764 -0.619) 4.150 26.799 ( 2.930 0.015 0.834) 3.046 26.887 ( 0.810 -0.320 -3.746) 3.846 27.403 ( -1.249 -0.835 9.445) 9.564 27.956 ( 7.093 4.415 10.929) 13.756 28.240 ( -1.969 -5.522 -7.777) 9.740 28.396 ( -3.493 -1.662 -5.068) 6.375 28.629 ( 0.138 -4.451 0.354) 4.468 28.887 ( -9.674 -3.487 -9.960) 14.316 29.508 ( 4.334 -0.412 -1.474) 4.597 31.127 ( 3.090 14.857 0.831) 15.198 ======================= Grid point 32 (22/140) ======================= q-point: ( 0.56 0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.763 ( 1.851 -5.128 0.876) 5.522 1.891 ( -1.470 -11.171 1.699) 11.395 2.110 ( 10.336 0.816 1.649) 10.498 2.159 ( 0.025 -8.468 2.330) 8.782 2.347 ( -3.451 -13.834 -2.628) 14.498 2.418 ( 4.423 -15.320 6.323) 17.154 2.589 ( -3.946 -7.241 7.120) 10.895 2.645 ( -1.584 -7.963 -2.456) 8.483 2.739 ( -0.412 -6.857 -3.346) 7.641 3.060 ( -2.115 -2.772 -8.171) 8.884 3.090 ( 0.147 2.488 0.160) 2.497 3.116 ( -2.014 0.430 -0.969) 2.276 3.317 ( -0.986 -3.720 6.644) 7.678 3.497 ( -2.259 11.926 -2.757) 12.447 3.614 ( 0.274 0.153 -2.140) 2.162 3.813 ( 2.871 -1.850 2.014) 3.965 3.860 ( 0.236 -1.470 -0.532) 1.581 4.275 ( 3.478 -6.591 0.438) 7.465 4.350 ( 2.786 -10.666 1.541) 11.131 4.533 ( 0.949 -2.683 0.920) 2.991 4.555 ( 0.254 -0.215 -1.406) 1.445 4.743 ( -3.241 -7.832 1.816) 8.669 4.974 ( 4.062 7.325 2.810) 8.835 5.120 ( -6.506 2.553 -2.941) 7.583 5.236 ( 4.994 0.411 8.510) 9.876 5.301 ( -1.486 3.751 -1.378) 4.263 5.503 ( -4.064 -6.183 -8.223) 11.061 5.833 ( -1.062 4.095 -1.866) 4.624 5.888 ( -0.944 2.625 -4.239) 5.075 6.230 ( 5.870 3.048 2.346) 7.018 6.297 ( -1.035 5.404 2.682) 6.121 6.437 ( 2.845 2.327 0.859) 3.774 6.624 ( -1.449 4.715 -0.511) 4.959 6.875 ( -3.594 -1.731 -0.530) 4.024 6.939 ( 2.210 3.117 1.333) 4.047 7.136 ( -0.791 5.294 0.084) 5.353 7.214 ( -1.700 2.824 -3.742) 4.986 7.289 ( -2.733 -4.934 0.317) 5.649 7.824 ( -1.438 -3.833 0.624) 4.141 7.986 ( 3.715 0.514 1.617) 4.084 8.667 ( -2.485 -1.065 -1.901) 3.305 8.889 ( -2.383 -11.558 -1.876) 11.949 9.155 ( -2.416 -12.390 0.003) 12.624 9.205 ( 1.172 -8.520 1.734) 8.773 9.407 ( -0.502 -7.959 -4.315) 9.068 9.728 ( 1.328 3.877 1.024) 4.224 10.167 ( -0.345 11.189 1.099) 11.248 10.363 ( 0.368 -4.811 1.547) 5.068 10.563 ( 0.006 3.266 1.343) 3.532 11.099 ( 0.981 1.185 9.894) 10.013 11.260 ( 1.909 -3.797 0.943) 4.353 11.355 ( -1.695 -9.644 -11.403) 15.030 11.462 ( 4.901 -6.781 -2.288) 8.673 11.665 ( -2.364 5.952 -0.649) 6.437 11.839 ( 0.509 -0.911 2.617) 2.818 11.943 ( 1.468 1.113 0.010) 1.843 12.021 ( -0.597 0.540 1.593) 1.785 12.220 ( 4.118 -2.728 0.287) 4.948 12.386 ( -7.225 -1.077 1.626) 7.484 12.577 ( -2.453 -5.186 -1.282) 5.878 12.652 ( 6.272 -0.291 4.840) 7.928 12.747 ( 1.407 4.312 6.933) 8.285 12.947 ( -6.839 4.020 -10.520) 13.176 13.565 ( -1.409 14.340 2.000) 14.548 14.949 ( 1.433 -0.349 1.948) 2.443 15.002 ( -1.415 1.871 -1.712) 2.904 15.378 ( -0.918 -0.878 0.035) 1.271 15.412 ( 0.536 4.356 0.030) 4.389 15.557 ( -1.020 -2.196 -0.305) 2.440 15.860 ( 1.633 3.497 2.434) 4.563 15.876 ( 0.496 -2.593 -0.234) 2.650 16.146 ( 3.476 2.918 0.245) 4.545 16.188 ( 0.911 4.434 -3.884) 5.965 16.313 ( -5.321 -2.713 -0.953) 6.049 16.417 ( -1.007 -0.092 -0.009) 1.011 16.695 ( -0.267 -8.416 0.057) 8.420 17.987 ( 6.639 14.347 -0.916) 15.835 18.234 ( 2.468 3.492 1.061) 4.406 18.398 ( -4.639 1.385 -3.144) 5.772 18.831 ( -0.060 -0.993 0.325) 1.047 25.909 ( 0.669 -1.232 -0.039) 1.402 25.961 ( 0.164 -1.167 -0.456) 1.264 26.069 ( -1.186 -0.803 0.474) 1.509 26.101 ( 0.807 -3.575 0.959) 3.788 26.330 ( 0.364 3.387 2.704) 4.349 26.601 ( -1.609 -3.894 -0.216) 4.219 26.816 ( 0.308 -0.629 -0.482) 0.850 26.882 ( 1.710 0.574 -1.995) 2.690 27.466 ( 0.145 -2.550 6.342) 6.837 27.921 ( 4.087 10.210 4.669) 11.948 28.252 ( -2.372 -2.366 -3.790) 5.059 28.425 ( -3.862 -7.884 -5.495) 10.356 28.740 ( -0.378 -8.825 -0.029) 8.833 28.895 ( -3.352 -6.661 -3.504) 8.239 29.547 ( 2.321 -1.282 0.084) 2.653 30.833 ( 2.593 22.420 1.350) 22.610 ======================= Grid point 33 (23/140) ======================= q-point: ( 0.67 0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.789 ( -0.000 4.799 0.000) 4.799 2.051 ( 0.000 -9.403 -0.000) 9.403 2.157 ( 0.000 -0.740 -0.000) 0.740 2.283 ( 0.000 -5.590 -0.000) 5.590 2.498 ( 0.000 -8.827 -0.000) 8.827 2.669 ( 0.000 -8.932 -0.000) 8.932 2.704 ( 0.000 -0.777 -0.000) 0.777 2.796 ( 0.000 -3.387 -0.000) 3.387 2.838 ( 0.000 -14.872 -0.000) 14.872 2.987 ( -0.000 6.359 0.000) 6.359 3.073 ( 0.000 -2.072 -0.000) 2.072 3.158 ( 0.000 -1.365 -0.000) 1.365 3.355 ( -0.000 0.142 0.000) 0.142 3.389 ( 0.000 -2.755 -0.000) 2.755 3.669 ( 0.000 -6.381 -0.000) 6.381 3.814 ( -0.000 1.835 0.000) 1.835 3.913 ( 0.000 -3.598 -0.000) 3.598 4.411 ( 0.000 -2.055 -0.000) 2.055 4.444 ( 0.000 -2.642 -0.000) 2.642 4.495 ( -0.000 4.303 0.000) 4.303 4.555 ( -0.000 2.946 0.000) 2.946 4.835 ( 0.000 -1.959 -0.000) 1.959 4.982 ( -0.000 2.515 0.000) 2.515 5.070 ( 0.000 -10.743 -0.000) 10.743 5.137 ( -0.000 6.566 0.000) 6.566 5.376 ( 0.000 -3.283 -0.000) 3.283 5.595 ( 0.000 -8.784 -0.000) 8.784 5.772 ( -0.000 2.658 0.000) 2.658 5.833 ( -0.000 1.834 0.000) 1.834 6.156 ( -0.000 5.456 0.000) 5.456 6.212 ( -0.000 6.442 0.000) 6.442 6.453 ( 0.000 -2.028 -0.000) 2.028 6.549 ( -0.000 3.502 0.000) 3.502 6.895 ( 0.000 -2.249 -0.000) 2.249 6.915 ( -0.000 0.400 0.000) 0.400 7.055 ( -0.000 3.580 0.000) 3.580 7.152 ( -0.000 2.245 0.000) 2.245 7.376 ( 0.000 -5.554 -0.000) 5.554 7.844 ( -0.000 1.269 0.000) 1.269 8.023 ( 0.000 -2.039 -0.000) 2.039 8.664 ( 0.000 -0.646 -0.000) 0.646 9.067 ( 0.000 -11.031 -0.000) 11.031 9.317 ( 0.000 -7.674 -0.000) 7.674 9.371 ( 0.000 -8.658 -0.000) 8.658 9.578 ( 0.000 -11.172 -0.000) 11.172 9.700 ( 0.000 -1.831 -0.000) 1.831 9.975 ( -0.000 10.823 0.000) 10.823 10.451 ( 0.000 -4.573 -0.000) 4.573 10.466 ( -0.000 7.856 0.000) 7.856 11.062 ( -0.000 3.975 0.000) 3.975 11.342 ( 0.000 -2.097 -0.000) 2.097 11.424 ( 0.000 -0.897 -0.000) 0.897 11.551 ( -0.000 3.414 0.000) 3.414 11.613 ( 0.000 -5.466 -0.000) 5.466 11.821 ( -0.000 6.685 0.000) 6.685 11.828 ( -0.000 2.299 0.000) 2.299 12.124 ( 0.000 -5.953 -0.000) 5.953 12.324 ( 0.000 -4.468 -0.000) 4.468 12.344 ( -0.000 1.753 0.000) 1.753 12.644 ( -0.000 7.301 0.000) 7.301 12.655 ( 0.000 -5.232 -0.000) 5.232 12.692 ( -0.000 0.930 0.000) 0.930 12.920 ( 0.000 -6.225 -0.000) 6.225 13.299 ( -0.000 14.716 0.000) 14.716 14.967 ( -0.000 1.360 0.000) 1.360 15.012 ( 0.000 -5.134 -0.000) 5.134 15.301 ( -0.000 2.286 0.000) 2.286 15.494 ( 0.000 -6.385 -0.000) 6.385 15.495 ( -0.000 7.261 0.000) 7.261 15.878 ( 0.000 -2.820 -0.000) 2.820 15.913 ( 0.000 -0.804 -0.000) 0.804 16.092 ( -0.000 5.148 0.000) 5.148 16.103 ( -0.000 3.830 0.000) 3.830 16.335 ( 0.000 -3.151 -0.000) 3.151 16.419 ( 0.000 -0.799 -0.000) 0.799 16.824 ( 0.000 -6.751 -0.000) 6.751 17.763 ( -0.000 14.544 0.000) 14.544 18.172 ( -0.000 5.201 0.000) 5.201 18.369 ( 0.000 -1.234 -0.000) 1.234 18.845 ( 0.000 -0.549 -0.000) 0.549 25.923 ( -0.000 0.063 0.000) 0.063 25.989 ( 0.000 -2.135 -0.000) 2.135 26.073 ( 0.000 -0.071 -0.000) 0.071 26.165 ( 0.000 -3.156 -0.000) 3.156 26.267 ( -0.000 4.821 0.000) 4.821 26.665 ( 0.000 -4.168 -0.000) 4.168 26.832 ( 0.000 -1.533 -0.000) 1.533 26.870 ( -0.000 0.957 0.000) 0.957 27.548 ( 0.000 -4.654 -0.000) 4.654 27.752 ( -0.000 11.013 0.000) 11.013 28.279 ( 0.000 -2.541 -0.000) 2.541 28.517 ( 0.000 -6.456 -0.000) 6.456 28.916 ( 0.000 -11.599 -0.000) 11.599 28.989 ( 0.000 -6.360 -0.000) 6.360 29.579 ( 0.000 -0.925 -0.000) 0.925 30.444 ( -0.000 24.423 0.000) 24.423 ======================= Grid point 41 (24/140) ======================= q-point: ( 0.44 0.44 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.594 ( -1.945 -0.000 4.631) 5.022 1.641 ( 0.707 0.000 4.518) 4.573 1.838 ( -0.555 -0.000 -3.521) 3.564 1.866 ( -0.694 -0.000 1.884) 2.007 2.146 ( 20.120 0.000 4.733) 20.669 2.225 ( 0.594 0.000 -0.046) 0.595 2.455 ( -2.250 -0.000 0.028) 2.251 2.487 ( -12.796 -0.000 -1.832) 12.926 2.622 ( 2.496 0.000 1.825) 3.092 2.966 ( -0.953 -0.000 -5.585) 5.666 3.099 ( -3.614 -0.000 -2.496) 4.392 3.206 ( 3.093 0.000 0.957) 3.237 3.272 ( -1.053 -0.000 2.833) 3.022 3.645 ( 10.381 0.000 10.074) 14.465 3.780 ( -1.117 -0.000 1.158) 1.609 3.866 ( -1.372 -0.000 -1.154) 1.793 3.905 ( 2.022 0.000 -10.738) 10.926 4.017 ( -3.755 -0.000 1.347) 3.990 4.153 ( -5.214 -0.000 -1.365) 5.390 4.240 ( 5.665 0.000 2.286) 6.109 4.579 ( -1.335 -0.000 1.079) 1.716 4.626 ( -1.620 -0.000 0.639) 1.742 5.102 ( 7.348 0.000 5.214) 9.010 5.168 ( -3.582 -0.000 4.365) 5.646 5.231 ( -3.246 -0.000 -0.525) 3.288 5.386 ( -2.029 -0.000 -9.049) 9.273 5.495 ( -0.256 -0.000 -2.610) 2.622 5.932 ( 1.913 0.000 -2.706) 3.314 5.979 ( -3.884 -0.000 -1.643) 4.217 6.185 ( 4.250 0.000 4.125) 5.922 6.424 ( 0.363 0.000 -1.525) 1.567 6.546 ( 4.733 0.000 4.758) 6.711 6.725 ( -3.193 -0.000 -0.538) 3.238 6.872 ( 0.783 0.000 1.045) 1.306 6.997 ( 0.499 0.000 -1.000) 1.118 7.193 ( 0.853 0.000 2.286) 2.440 7.260 ( -5.670 -0.000 -4.406) 7.181 7.342 ( -4.266 -0.000 -0.636) 4.313 7.619 ( -1.866 -0.000 -0.134) 1.871 8.052 ( 2.806 0.000 0.184) 2.812 8.604 ( -3.308 -0.000 -2.321) 4.041 8.642 ( -1.829 -0.000 -0.918) 2.047 8.870 ( -2.287 -0.000 -2.080) 3.091 9.069 ( 0.623 0.000 4.662) 4.703 9.323 ( 1.898 0.000 -3.583) 4.055 9.886 ( 1.702 0.000 -0.093) 1.705 10.152 ( -3.114 -0.000 0.350) 3.133 10.484 ( 0.619 0.000 1.661) 1.772 10.503 ( 0.090 0.000 3.320) 3.321 10.874 ( 0.847 0.000 9.334) 9.372 11.184 ( 0.342 0.000 -3.971) 3.985 11.306 ( 0.335 0.000 -5.322) 5.332 11.345 ( 1.800 0.000 -2.127) 2.787 11.774 ( -1.476 -0.000 -0.033) 1.477 11.858 ( 12.808 0.000 7.375) 14.780 11.865 ( 1.414 0.000 1.126) 1.808 12.131 ( -3.323 -0.000 -1.072) 3.492 12.201 ( -2.708 -0.000 -3.685) 4.573 12.238 ( -12.263 -0.000 -1.453) 12.349 12.494 ( 0.338 0.000 2.142) 2.168 12.664 ( 7.710 0.000 7.811) 10.975 12.818 ( -0.684 -0.000 5.228) 5.273 13.081 ( -4.855 -0.000 -10.865) 11.900 13.822 ( 0.533 0.000 2.035) 2.103 15.032 ( 1.011 0.000 0.132) 1.019 15.087 ( -0.968 -0.000 -0.628) 1.154 15.252 ( -3.977 -0.000 -0.658) 4.031 15.396 ( 2.665 0.000 0.376) 2.691 15.732 ( 0.312 0.000 -1.386) 1.421 15.772 ( -2.234 -0.000 -0.209) 2.244 16.027 ( 0.888 0.000 3.484) 3.595 16.102 ( 1.288 0.000 -1.670) 2.109 16.236 ( -3.322 -0.000 -0.303) 3.335 16.311 ( 1.864 0.000 -3.734) 4.173 16.454 ( 1.014 0.000 1.463) 1.780 16.456 ( -0.715 -0.000 -0.694) 0.997 18.260 ( 7.404 0.000 1.337) 7.524 18.325 ( 0.811 0.000 -5.474) 5.534 18.429 ( -4.073 -0.000 -0.297) 4.084 18.806 ( 0.068 0.000 0.216) 0.226 25.874 ( 0.102 0.000 -0.650) 0.658 25.962 ( 1.233 0.000 0.156) 1.243 26.006 ( 0.263 0.000 0.941) 0.977 26.048 ( -0.945 -0.000 0.580) 1.109 26.390 ( 0.470 0.000 3.335) 3.368 26.520 ( -1.452 -0.000 -0.486) 1.531 26.826 ( 1.888 0.000 0.825) 2.061 26.873 ( 0.203 0.000 -1.786) 1.797 27.423 ( -0.661 -0.000 5.270) 5.311 28.110 ( 5.954 0.000 10.104) 11.728 28.121 ( -1.003 -0.000 -6.354) 6.432 28.387 ( -0.699 -0.000 -0.496) 0.857 28.592 ( 0.168 0.000 -0.116) 0.204 28.716 ( -8.237 -0.000 -9.914) 12.890 29.525 ( 2.366 0.000 -0.789) 2.494 31.268 ( 0.852 0.000 0.055) 0.854 ======================= Grid point 42 (25/140) ======================= q-point: ( 0.56 0.44 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.674 ( 0.000 -4.068 -0.000) 4.068 1.708 ( 0.000 -10.399 -0.000) 10.399 1.976 ( 0.000 -13.544 -0.000) 13.544 2.003 ( 0.000 -14.366 -0.000) 14.366 2.252 ( 0.000 -4.071 -0.000) 4.071 2.271 ( -0.000 0.603 0.000) 0.603 2.447 ( 0.000 -6.076 -0.000) 6.076 2.498 ( 0.000 -6.253 -0.000) 6.253 2.665 ( 0.000 -3.172 -0.000) 3.172 2.973 ( 0.000 -2.782 -0.000) 2.782 3.075 ( -0.000 0.137 0.000) 0.137 3.188 ( -0.000 3.708 0.000) 3.708 3.283 ( 0.000 -1.427 -0.000) 1.427 3.668 ( -0.000 6.464 0.000) 6.464 3.682 ( -0.000 7.826 0.000) 7.826 3.835 ( -0.000 0.170 0.000) 0.170 3.853 ( -0.000 5.352 0.000) 5.352 4.086 ( 0.000 -14.158 -0.000) 14.158 4.235 ( 0.000 -6.478 -0.000) 6.478 4.395 ( 0.000 -11.197 -0.000) 11.197 4.574 ( -0.000 0.624 0.000) 0.624 4.634 ( 0.000 -2.705 -0.000) 2.705 5.126 ( -0.000 4.525 0.000) 4.525 5.126 ( -0.000 3.534 0.000) 3.534 5.239 ( 0.000 -3.300 -0.000) 3.300 5.369 ( 0.000 -2.685 -0.000) 2.685 5.424 ( -0.000 6.945 0.000) 6.945 5.904 ( -0.000 4.991 0.000) 4.991 5.914 ( -0.000 2.024 0.000) 2.024 6.271 ( 0.000 -4.360 -0.000) 4.360 6.373 ( -0.000 5.142 0.000) 5.142 6.526 ( -0.000 5.293 0.000) 5.293 6.679 ( -0.000 3.285 0.000) 3.285 6.865 ( -0.000 1.121 0.000) 1.121 6.992 ( -0.000 1.020 0.000) 1.020 7.213 ( 0.000 -2.032 -0.000) 2.032 7.223 ( -0.000 0.581 0.000) 0.581 7.242 ( -0.000 6.904 0.000) 6.904 7.708 ( 0.000 -8.114 -0.000) 8.114 8.034 ( -0.000 2.675 0.000) 2.675 8.639 ( 0.000 -0.692 -0.000) 0.692 8.681 ( 0.000 -10.107 -0.000) 10.107 8.943 ( 0.000 -9.647 -0.000) 9.647 9.112 ( 0.000 -3.683 -0.000) 3.683 9.325 ( 0.000 -1.218 -0.000) 1.218 9.811 ( -0.000 5.497 0.000) 5.497 10.258 ( 0.000 -8.287 -0.000) 8.287 10.355 ( -0.000 10.077 0.000) 10.077 10.581 ( 0.000 -2.036 -0.000) 2.036 11.037 ( 0.000 -14.907 -0.000) 14.907 11.176 ( 0.000 -0.256 -0.000) 0.256 11.259 ( -0.000 2.915 0.000) 2.915 11.379 ( 0.000 -3.818 -0.000) 3.818 11.779 ( -0.000 5.370 0.000) 5.370 11.813 ( 0.000 -0.789 -0.000) 0.789 11.950 ( 0.000 -0.726 -0.000) 0.726 12.081 ( -0.000 3.783 0.000) 3.783 12.199 ( 0.000 -2.112 -0.000) 2.112 12.252 ( 0.000 -7.296 -0.000) 7.296 12.514 ( 0.000 -1.703 -0.000) 1.703 12.709 ( -0.000 1.316 0.000) 1.316 12.833 ( -0.000 0.085 0.000) 0.085 12.966 ( -0.000 6.424 0.000) 6.424 13.763 ( -0.000 7.980 0.000) 7.980 14.992 ( -0.000 3.627 0.000) 3.627 15.039 ( -0.000 3.603 0.000) 3.603 15.286 ( 0.000 -4.874 -0.000) 4.874 15.471 ( 0.000 -5.965 -0.000) 5.965 15.594 ( -0.000 11.365 0.000) 11.365 15.813 ( 0.000 -3.578 -0.000) 3.578 15.972 ( -0.000 6.360 0.000) 6.360 16.158 ( 0.000 -4.204 -0.000) 4.204 16.218 ( -0.000 1.271 0.000) 1.271 16.289 ( -0.000 1.916 0.000) 1.916 16.422 ( -0.000 1.055 0.000) 1.055 16.554 ( 0.000 -7.626 -0.000) 7.626 18.220 ( -0.000 9.337 0.000) 9.337 18.296 ( -0.000 1.838 0.000) 1.838 18.392 ( -0.000 1.410 0.000) 1.410 18.815 ( 0.000 -0.865 -0.000) 0.865 25.886 ( 0.000 -1.404 -0.000) 1.404 25.955 ( -0.000 0.479 0.000) 0.479 26.047 ( 0.000 -3.350 -0.000) 3.350 26.052 ( 0.000 -0.700 -0.000) 0.700 26.384 ( -0.000 1.832 0.000) 1.832 26.536 ( 0.000 -2.628 -0.000) 2.628 26.820 ( -0.000 1.037 0.000) 1.037 26.883 ( 0.000 -0.804 -0.000) 0.804 27.446 ( 0.000 -1.403 -0.000) 1.403 28.102 ( -0.000 3.179 0.000) 3.179 28.184 ( 0.000 -2.144 -0.000) 2.144 28.318 ( -0.000 1.582 0.000) 1.582 28.632 ( 0.000 -4.072 -0.000) 4.072 28.739 ( 0.000 -7.861 -0.000) 7.861 29.538 ( 0.000 -0.692 -0.000) 0.692 31.154 ( -0.000 13.379 0.000) 13.379 ======================= Grid point 85 (26/140) ======================= q-point: ( 0.00 0.00 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.550 ( 7.712 0.000 27.640) 28.695 0.620 ( -22.269 -0.000 31.204) 38.335 0.954 ( 19.604 0.000 47.257) 51.162 1.674 ( 1.884 0.000 5.038) 5.379 2.149 ( -0.897 -0.000 -1.642) 1.871 2.348 ( 2.616 0.000 0.680) 2.703 2.460 ( -8.318 -0.000 -2.215) 8.608 2.585 ( 13.544 0.000 -9.261) 16.408 2.672 ( -5.796 -0.000 4.610) 7.405 2.771 ( -5.886 -0.000 -0.791) 5.939 2.873 ( 0.627 0.000 6.115) 6.147 3.290 ( -0.253 -0.000 -10.466) 10.469 3.436 ( 1.442 0.000 -5.487) 5.673 3.481 ( -0.550 -0.000 -3.334) 3.379 3.668 ( -1.441 -0.000 7.906) 8.036 3.894 ( -2.425 -0.000 6.820) 7.238 4.060 ( 0.628 0.000 -4.666) 4.708 4.281 ( 1.110 0.000 1.155) 1.602 4.409 ( -0.649 -0.000 -1.784) 1.899 4.507 ( 7.592 0.000 -4.091) 8.624 4.660 ( -7.348 -0.000 -2.539) 7.774 4.678 ( 4.731 0.000 2.044) 5.153 4.810 ( -11.301 -0.000 2.111) 11.497 5.139 ( 7.771 0.000 1.108) 7.850 5.237 ( -5.835 -0.000 0.495) 5.855 5.243 ( -5.077 -0.000 2.252) 5.554 5.553 ( 5.904 0.000 -12.500) 13.824 5.726 ( -0.659 -0.000 -6.234) 6.269 6.108 ( 1.002 0.000 2.323) 2.530 6.362 ( -1.549 -0.000 3.947) 4.240 6.502 ( 14.184 0.000 -1.310) 14.244 6.516 ( -5.928 -0.000 7.428) 9.504 6.539 ( -0.553 -0.000 1.214) 1.334 6.763 ( -1.502 -0.000 -7.022) 7.180 6.911 ( -4.245 -0.000 2.257) 4.808 7.068 ( 28.861 0.000 4.184) 29.163 7.480 ( -1.930 -0.000 -2.137) 2.880 7.743 ( -11.789 -0.000 -5.455) 12.990 7.987 ( -0.433 -0.000 1.490) 1.552 7.995 ( 5.389 0.000 2.381) 5.891 8.569 ( -2.386 -0.000 2.808) 3.685 9.005 ( -1.306 -0.000 -4.236) 4.432 9.137 ( -2.701 -0.000 -5.764) 6.365 9.401 ( -4.018 -0.000 -7.047) 8.112 9.651 ( 0.582 0.000 2.827) 2.886 9.787 ( -0.696 -0.000 -4.471) 4.525 10.399 ( -4.962 -0.000 1.636) 5.225 10.424 ( -0.141 -0.000 5.439) 5.441 10.459 ( -8.477 -0.000 3.120) 9.033 10.483 ( 10.839 0.000 0.283) 10.842 10.828 ( 1.792 0.000 4.089) 4.465 11.191 ( -0.773 -0.000 -2.490) 2.608 11.197 ( -0.518 -0.000 7.172) 7.191 11.441 ( -2.031 -0.000 5.730) 6.079 11.787 ( 23.730 0.000 -10.803) 26.073 11.950 ( 3.228 0.000 -0.531) 3.271 12.123 ( -1.004 -0.000 3.143) 3.299 12.134 ( -2.018 -0.000 -1.383) 2.447 12.456 ( 8.503 0.000 -12.185) 14.858 12.668 ( -1.191 -0.000 -4.353) 4.513 12.762 ( 8.332 0.000 2.795) 8.788 12.993 ( 7.455 0.000 1.322) 7.571 13.218 ( -13.801 -0.000 18.829) 23.345 14.403 ( -4.646 -0.000 -6.070) 7.644 15.106 ( -19.163 -0.000 -1.023) 19.190 15.121 ( 1.848 0.000 -0.131) 1.852 15.303 ( -2.793 -0.000 0.346) 2.815 15.334 ( 5.810 0.000 -0.966) 5.890 15.627 ( 26.138 0.000 3.282) 26.343 15.878 ( -3.353 -0.000 4.957) 5.985 15.912 ( 2.051 0.000 -4.832) 5.250 16.151 ( -3.819 -0.000 -0.002) 3.819 16.272 ( -3.101 -0.000 -5.355) 6.188 16.534 ( 6.620 0.000 -8.043) 10.417 16.717 ( 41.937 0.000 1.696) 41.972 16.809 ( -7.892 -0.000 2.151) 8.180 17.442 ( -84.940 -0.000 3.827) 85.026 17.737 ( 9.257 0.000 -1.794) 9.429 18.333 ( -5.045 -0.000 3.811) 6.322 18.739 ( 3.047 0.000 -2.882) 4.194 25.833 ( 0.456 0.000 1.842) 1.897 25.856 ( 0.381 0.000 0.205) 0.433 26.093 ( 0.055 0.000 1.429) 1.430 26.109 ( -4.745 -0.000 -2.174) 5.219 26.296 ( -5.806 -0.000 4.620) 7.420 26.473 ( 3.680 0.000 2.154) 4.264 26.878 ( -4.576 -0.000 -4.170) 6.192 26.934 ( -0.750 -0.000 -2.539) 2.648 27.475 ( 5.031 0.000 4.801) 6.954 28.209 ( -30.808 -0.000 -7.981) 31.825 28.529 ( -49.763 -0.000 8.258) 50.444 28.552 ( 1.097 0.000 -2.001) 2.282 28.664 ( -6.613 -0.000 -6.635) 9.367 29.066 ( 4.952 0.000 -2.632) 5.608 29.686 ( 109.811 0.000 4.893) 109.920 29.791 ( -10.945 -0.000 1.745) 11.083 ======================= Grid point 86 (27/140) ======================= q-point: ( 0.11 0.00 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.762 ( -3.164 -12.160 23.593) 26.730 1.015 ( 8.982 -21.794 19.830) 30.804 1.512 ( 20.813 -16.855 33.223) 42.674 1.845 ( 3.617 -13.628 9.459) 16.979 2.245 ( -5.483 -10.368 -6.638) 13.477 2.337 ( -2.057 0.137 -6.644) 6.957 2.459 ( -2.924 -8.560 6.248) 10.994 2.680 ( -7.583 -5.968 5.412) 11.064 2.685 ( 13.099 -4.799 -10.640) 17.545 2.803 ( -4.219 -7.603 1.679) 8.856 2.925 ( -0.075 -1.693 7.442) 7.633 3.210 ( 0.946 2.499 -10.260) 10.602 3.394 ( 0.378 1.975 -3.058) 3.660 3.468 ( 0.058 -0.594 -5.330) 5.363 3.706 ( 0.121 -0.294 7.374) 7.380 3.889 ( -4.232 0.736 0.462) 4.320 4.015 ( -1.333 2.207 -4.506) 5.191 4.208 ( -1.456 8.537 1.227) 8.747 4.380 ( -5.648 -0.897 -3.163) 6.535 4.565 ( 6.179 -0.669 2.309) 6.630 4.636 ( 1.007 -4.904 3.184) 5.934 4.686 ( -9.060 3.714 -0.068) 9.792 4.784 ( 2.756 -4.517 -1.726) 5.566 5.132 ( -4.860 2.689 1.402) 5.729 5.256 ( 3.132 -4.454 1.171) 5.569 5.312 ( 5.979 -2.995 1.073) 6.772 5.489 ( 4.258 3.870 -12.812) 14.044 5.737 ( -2.057 -4.818 -8.534) 10.014 6.062 ( 0.315 6.336 2.513) 6.823 6.300 ( -0.525 8.511 4.588) 9.683 6.401 ( -2.693 5.120 1.842) 6.071 6.553 ( 3.790 8.044 1.347) 8.994 6.639 ( 6.903 -3.710 2.957) 8.376 6.693 ( -4.432 -4.036 0.161) 5.997 6.789 ( 1.470 6.022 2.111) 6.548 7.315 ( 10.867 -2.338 -4.740) 12.084 7.448 ( -1.643 0.556 -0.920) 1.963 7.704 ( -9.290 -3.545 -9.438) 13.709 7.881 ( -8.266 5.827 1.918) 10.294 8.008 ( -0.401 2.673 2.593) 3.745 8.676 ( 3.015 -8.883 4.048) 10.217 9.044 ( -0.950 -8.056 -5.775) 9.957 9.142 ( -5.281 -6.410 -6.597) 10.607 9.379 ( -4.640 -5.970 -8.184) 11.143 9.658 ( -4.061 8.924 2.841) 10.208 9.707 ( -1.025 -4.793 2.562) 5.531 10.170 ( -1.290 10.865 16.321) 19.649 10.305 ( -3.125 6.728 4.131) 8.491 10.490 ( -1.408 -3.817 0.944) 4.176 10.852 ( 3.786 -8.869 -3.232) 10.170 10.896 ( 6.935 -6.173 -0.483) 9.297 11.170 ( 0.419 1.218 -1.263) 1.804 11.283 ( 3.648 -5.054 3.421) 7.110 11.495 ( -1.807 -4.934 4.270) 6.771 11.772 ( 7.690 6.307 -8.328) 12.972 11.981 ( 8.151 1.055 -1.875) 8.430 12.039 ( -3.331 4.213 0.479) 5.392 12.180 ( 1.492 -1.013 1.833) 2.572 12.391 ( 4.546 5.932 2.236) 7.801 12.581 ( -6.549 1.367 -9.311) 11.465 12.748 ( -2.913 2.559 -0.958) 3.994 13.078 ( 7.740 0.600 -1.207) 7.856 13.297 ( -11.435 -7.195 8.997) 16.232 14.156 ( -20.802 7.619 6.424) 23.066 14.938 ( -6.626 6.021 4.397) 9.974 15.215 ( -1.325 4.438 0.877) 4.714 15.277 ( 8.099 1.332 -1.954) 8.437 15.327 ( 0.615 -3.403 -0.424) 3.484 15.742 ( 6.888 3.553 3.975) 8.711 15.785 ( -6.223 4.250 0.288) 7.541 15.934 ( 5.414 0.142 -4.299) 6.915 16.055 ( 0.888 5.960 -3.204) 6.825 16.164 ( -7.172 -0.377 0.265) 7.187 16.463 ( 0.494 3.270 2.825) 4.349 16.766 ( -2.398 -3.405 0.635) 4.213 16.862 ( -21.450 -5.835 1.219) 22.263 17.292 ( 24.203 6.435 -2.696) 25.189 17.843 ( 6.859 -2.529 2.121) 7.611 18.475 ( 1.195 -10.023 -10.420) 14.508 18.764 ( 2.718 -1.532 -2.679) 4.112 25.843 ( -0.229 -0.002 1.612) 1.628 25.885 ( 1.283 -2.320 0.733) 2.751 26.063 ( -4.263 -0.205 1.718) 4.601 26.110 ( -0.521 -1.201 1.844) 2.261 26.246 ( 0.894 2.315 7.510) 7.909 26.593 ( 2.866 -3.883 -3.995) 6.265 26.855 ( -5.024 -2.712 -6.098) 8.354 26.943 ( -1.579 -4.434 -5.028) 6.887 27.435 ( 2.522 8.780 13.541) 16.334 27.933 ( -25.144 -0.351 -0.185) 25.147 28.400 ( -5.827 0.434 3.302) 6.712 28.650 ( -3.358 -8.473 -0.375) 9.122 28.731 ( -9.523 -17.191 -8.091) 21.253 29.111 ( 5.813 -1.341 -0.801) 6.019 29.651 ( -11.300 5.085 -2.211) 12.587 30.103 ( 59.150 21.878 -2.887) 63.133 ======================= Grid point 87 (28/140) ======================= q-point: ( 0.22 0.00 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.120 ( 7.859 -14.437 15.227) 22.407 1.517 ( 7.744 -19.194 13.627) 24.781 1.997 ( 6.589 -13.773 6.576) 16.624 2.118 ( -5.275 -4.708 7.184) 10.080 2.287 ( 6.030 -9.783 4.476) 12.333 2.438 ( -4.428 -9.609 -0.401) 10.588 2.647 ( 0.977 -9.639 1.018) 9.741 2.791 ( -0.183 -7.304 -0.647) 7.335 2.873 ( 0.409 -12.760 -1.468) 12.851 2.962 ( 6.630 -9.221 3.632) 11.924 3.013 ( -4.732 -6.737 5.487) 9.894 3.153 ( 4.015 -0.323 -6.947) 8.031 3.339 ( -3.102 2.066 -2.893) 4.718 3.453 ( 3.502 0.722 -2.878) 4.591 3.722 ( -0.985 -0.086 0.175) 1.004 3.887 ( -2.881 -0.260 -1.841) 3.429 3.911 ( -5.332 -0.554 0.207) 5.364 4.021 ( -2.926 9.966 0.471) 10.397 4.391 ( -3.808 -4.489 -2.385) 6.352 4.502 ( -4.210 6.847 2.730) 8.488 4.686 ( 4.744 -1.754 6.588) 8.305 4.789 ( 4.428 -6.641 -2.933) 8.504 4.837 ( 2.875 0.156 -0.858) 3.004 5.064 ( -6.282 0.490 1.128) 6.402 5.262 ( -0.782 3.006 -10.026) 10.497 5.406 ( 2.490 -5.332 1.221) 6.010 5.496 ( 10.613 -1.694 -4.104) 11.505 5.733 ( -3.388 -1.715 -6.714) 7.713 5.976 ( 1.547 4.398 1.723) 4.970 6.137 ( -1.881 10.148 0.180) 10.322 6.322 ( -0.313 4.423 3.894) 5.902 6.455 ( 1.122 4.892 1.007) 5.119 6.662 ( -6.734 0.684 3.334) 7.546 6.739 ( -1.361 -1.056 -0.879) 1.934 6.851 ( 9.999 -4.962 2.778) 11.503 7.314 ( 3.831 5.105 -7.646) 9.960 7.424 ( -2.043 1.856 0.152) 2.765 7.558 ( -4.634 5.765 -2.516) 7.813 7.769 ( -11.512 -0.574 -1.652) 11.644 7.959 ( -0.033 3.647 2.200) 4.259 8.887 ( 2.022 -9.490 2.890) 10.125 9.182 ( -5.343 -8.821 -1.577) 10.433 9.192 ( -2.328 -10.668 -7.690) 13.356 9.438 ( -3.526 -8.794 -6.711) 11.611 9.511 ( -5.556 5.935 6.165) 10.203 9.772 ( -6.148 -3.651 -0.921) 7.210 10.101 ( 3.166 8.055 10.635) 13.711 10.235 ( -1.843 0.901 8.879) 9.113 10.538 ( -0.263 -1.822 0.164) 1.849 10.966 ( 5.055 -4.649 2.835) 7.430 11.055 ( 6.700 -3.794 -0.738) 7.735 11.133 ( 2.755 3.168 -1.084) 4.336 11.405 ( 4.805 -4.744 -3.348) 7.537 11.619 ( -0.543 -7.189 1.989) 7.479 11.686 ( 4.721 3.676 -6.770) 9.035 11.953 ( 3.259 4.695 -1.653) 5.949 12.045 ( 2.121 -2.510 1.455) 3.594 12.190 ( 2.229 2.374 1.691) 3.670 12.355 ( 2.700 4.064 5.453) 7.317 12.456 ( -6.030 1.572 -8.200) 10.299 12.680 ( -2.461 1.413 -2.992) 4.124 13.051 ( 4.310 6.478 -4.353) 8.916 13.307 ( -12.272 -0.439 7.669) 14.478 13.918 ( -12.404 9.764 5.623) 16.757 14.857 ( -3.232 2.016 7.234) 8.176 15.097 ( 3.072 7.160 2.402) 8.153 15.253 ( -2.403 0.336 -3.047) 3.895 15.486 ( 4.018 -8.438 -0.196) 9.347 15.669 ( -2.164 5.010 0.823) 5.519 15.732 ( -3.248 1.120 3.696) 5.046 15.935 ( 5.881 2.733 -4.795) 8.065 15.997 ( 2.959 0.661 -6.475) 7.150 16.110 ( -9.163 1.038 1.556) 9.352 16.438 ( -1.433 0.250 1.401) 2.020 16.778 ( -7.803 -1.691 0.870) 8.031 16.884 ( -5.021 -7.948 0.568) 9.418 17.290 ( 16.572 10.344 -1.408) 19.586 17.948 ( 6.788 -1.783 3.212) 7.718 18.526 ( 2.660 -1.167 -9.900) 10.317 18.794 ( 2.541 -1.109 -2.674) 3.852 25.855 ( -0.123 -0.933 1.458) 1.735 25.947 ( 1.729 -2.837 0.089) 3.324 26.063 ( -2.276 -0.991 3.420) 4.226 26.140 ( -0.922 -1.592 2.245) 2.903 26.262 ( 1.053 1.193 4.894) 5.147 26.632 ( 3.920 -0.731 -2.997) 4.988 26.824 ( -4.373 -1.440 -4.579) 6.494 26.963 ( -2.903 -3.618 -10.033) 11.053 27.400 ( 0.881 6.065 16.731) 17.818 27.794 ( -8.733 1.419 -0.791) 8.883 28.375 ( -2.653 -0.051 1.981) 3.311 28.766 ( -2.281 -8.832 -3.976) 9.951 28.941 ( -9.766 -18.990 -6.350) 22.278 29.193 ( 4.657 -2.858 1.856) 5.771 29.447 ( -9.496 6.107 -4.779) 12.260 30.063 ( 34.174 23.121 2.105) 41.314 ======================= Grid point 88 (29/140) ======================= q-point: ( 0.33 0.00 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.469 ( 8.948 -10.118 10.827) 17.311 1.888 ( 2.942 -12.494 6.480) 14.379 2.113 ( -1.345 -7.305 -5.096) 9.008 2.270 ( 0.522 -5.484 8.373) 10.023 2.481 ( -0.055 -5.727 4.436) 7.245 2.577 ( 0.503 -6.236 4.734) 7.845 2.768 ( -1.793 -5.224 0.431) 5.540 2.874 ( 3.795 -0.995 -6.100) 7.253 2.996 ( 0.981 0.088 -1.078) 1.460 3.026 ( -2.458 -5.167 -0.655) 5.759 3.196 ( -4.682 0.825 -6.580) 8.118 3.218 ( 2.315 -9.219 4.130) 10.364 3.289 ( -0.701 -3.373 0.372) 3.465 3.540 ( 5.233 -4.897 3.005) 7.772 3.733 ( -7.373 0.546 -1.350) 7.515 3.756 ( 1.149 1.740 -0.783) 2.227 3.893 ( -1.516 -0.332 -0.405) 1.604 4.049 ( 4.202 -7.603 4.385) 9.731 4.333 ( -3.239 3.958 0.229) 5.119 4.473 ( -2.328 -0.529 5.093) 5.625 4.750 ( 2.812 1.348 -5.238) 6.095 4.834 ( 5.239 2.110 3.639) 6.719 4.845 ( 2.985 0.837 -3.351) 4.565 5.005 ( -8.173 0.262 -3.268) 8.805 5.228 ( 2.121 -4.883 -5.049) 7.338 5.505 ( -2.308 -4.148 1.361) 4.938 5.565 ( 9.497 0.796 -4.655) 10.606 5.714 ( -2.436 -2.378 -1.508) 3.723 5.946 ( -0.516 6.709 -0.576) 6.753 5.991 ( 1.802 -0.904 -1.753) 2.672 6.290 ( 1.143 3.251 7.885) 8.605 6.398 ( -1.633 2.085 -2.536) 3.667 6.584 ( -7.402 3.229 2.786) 8.543 6.765 ( -0.037 -3.203 -0.923) 3.333 7.007 ( 5.187 -4.311 2.052) 7.049 7.174 ( -0.551 6.139 -5.211) 8.071 7.312 ( -6.211 4.861 -1.482) 8.026 7.543 ( 8.406 -0.039 1.415) 8.524 7.677 ( -9.612 0.817 -0.187) 9.648 7.905 ( 0.125 3.946 0.594) 3.993 8.990 ( -5.703 -2.521 1.645) 6.448 9.256 ( -3.037 -5.433 -2.480) 6.700 9.323 ( -4.556 -8.596 -1.989) 9.930 9.461 ( -2.204 -1.023 5.594) 6.099 9.561 ( -0.445 -8.569 -2.050) 8.823 9.727 ( -3.005 0.740 -3.580) 4.733 10.053 ( -0.057 2.966 5.905) 6.609 10.297 ( -0.486 -1.495 6.478) 6.666 10.544 ( 0.093 0.284 -0.682) 0.745 11.031 ( -2.370 2.253 -0.223) 3.278 11.138 ( 6.251 -5.128 4.069) 9.051 11.187 ( 9.876 -0.292 0.058) 9.880 11.483 ( 3.110 -3.312 -4.583) 6.453 11.621 ( -0.921 -1.170 -7.197) 7.350 11.761 ( 4.301 -3.843 0.742) 5.816 11.890 ( 3.358 5.184 -1.518) 6.360 12.085 ( 0.291 -0.247 0.997) 1.067 12.178 ( 1.499 0.367 -1.603) 2.225 12.354 ( 1.860 4.742 10.206) 11.407 12.379 ( -0.365 -1.682 -6.080) 6.319 12.639 ( -0.129 -0.273 -4.981) 4.990 12.920 ( 2.772 7.253 -5.247) 9.372 13.212 ( -12.766 3.860 6.616) 14.887 13.673 ( -8.451 11.819 3.041) 14.844 14.890 ( 0.342 -2.899 6.266) 6.912 15.067 ( 1.383 0.666 1.727) 2.310 15.216 ( -2.853 -0.196 -1.573) 3.263 15.545 ( 2.139 8.323 -0.519) 8.609 15.645 ( -0.405 -6.164 0.750) 6.223 15.738 ( -0.468 -2.138 3.090) 3.787 15.902 ( -1.209 0.903 -2.818) 3.197 15.956 ( -2.104 3.644 -3.854) 5.706 16.043 ( 0.500 -0.068 -2.019) 2.081 16.443 ( -1.611 -1.337 0.417) 2.135 16.737 ( -4.863 0.868 1.042) 5.049 16.998 ( -5.246 -8.906 2.112) 10.550 17.225 ( 11.315 9.176 0.193) 14.569 18.027 ( 5.349 0.019 2.154) 5.766 18.495 ( 1.091 0.869 -6.291) 6.444 18.815 ( 2.350 -0.559 -2.553) 3.515 25.888 ( 0.366 -1.733 1.712) 2.464 25.992 ( 0.303 -1.448 -1.006) 1.789 26.090 ( -0.316 -1.167 3.911) 4.094 26.164 ( -1.392 -0.936 1.876) 2.517 26.256 ( 0.165 2.415 2.856) 3.744 26.661 ( 5.241 0.047 -2.682) 5.887 26.799 ( -3.437 -1.399 -2.021) 4.226 26.931 ( -3.069 -2.131 -10.464) 11.111 27.400 ( 1.166 4.418 16.049) 16.687 27.720 ( -2.424 2.134 -1.838) 3.716 28.380 ( -2.326 -1.271 2.532) 3.665 28.860 ( -3.510 -8.216 -8.144) 12.090 29.123 ( -8.255 -13.001 -5.944) 16.507 29.209 ( -7.365 1.028 -1.442) 7.575 29.376 ( 4.496 -3.739 2.103) 6.214 29.915 ( 21.891 21.341 3.372) 30.758 ======================= Grid point 89 (30/140) ======================= q-point: ( 0.44 0.00 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.671 ( 1.669 -2.334 8.953) 9.401 2.053 ( -0.292 -4.656 -0.451) 4.687 2.190 ( 1.123 -0.507 -2.237) 2.554 2.363 ( -1.716 -2.524 4.519) 5.453 2.532 ( 1.050 1.012 7.021) 7.171 2.683 ( -0.606 -1.656 1.669) 2.428 2.829 ( 1.300 -1.961 1.563) 2.824 2.838 ( 2.279 1.802 -5.426) 6.155 2.931 ( -2.207 3.038 -4.362) 5.756 3.076 ( -1.390 -1.578 -8.587) 8.841 3.159 ( -2.405 -5.820 -0.703) 6.337 3.278 ( 0.398 2.451 -0.659) 2.569 3.391 ( -0.928 -4.916 2.048) 5.406 3.587 ( -2.891 1.588 -3.331) 4.688 3.639 ( 0.253 -0.839 4.953) 5.030 3.778 ( -2.690 0.370 3.535) 4.457 4.024 ( 5.250 -8.239 1.712) 9.919 4.181 ( 5.652 1.164 2.226) 6.185 4.312 ( 0.598 -0.904 5.443) 5.550 4.429 ( -7.905 4.792 3.899) 10.033 4.690 ( 2.186 0.549 -8.152) 8.457 4.799 ( 3.152 3.161 -3.427) 5.628 4.871 ( 4.489 1.686 -0.091) 4.796 4.948 ( -3.226 -1.304 -3.391) 4.859 5.352 ( 1.124 -8.491 -0.854) 8.607 5.514 ( -3.089 -0.199 -2.016) 3.694 5.593 ( 8.495 1.550 -1.940) 8.850 5.737 ( -2.792 -1.771 0.256) 3.316 5.836 ( -2.794 2.441 -1.467) 3.990 6.069 ( 3.762 -2.210 2.081) 4.834 6.299 ( -3.092 3.087 3.903) 5.859 6.325 ( -0.519 -0.720 -0.547) 1.042 6.496 ( -3.883 2.205 1.838) 4.829 6.831 ( 0.627 -4.236 0.080) 4.283 7.048 ( 3.771 1.685 -4.924) 6.427 7.158 ( -1.769 -2.667 6.608) 7.342 7.186 ( -6.039 0.652 -3.944) 7.242 7.601 ( -6.325 0.852 1.852) 6.645 7.650 ( 12.162 -0.362 3.989) 12.805 7.831 ( 0.487 4.298 -1.981) 4.757 8.949 ( -8.458 0.024 1.595) 8.607 9.286 ( -0.561 -2.617 -0.727) 2.773 9.414 ( -2.562 -4.783 1.210) 5.560 9.502 ( -0.860 -0.431 3.037) 3.185 9.568 ( -2.509 1.129 -5.598) 6.237 9.793 ( 2.601 -4.693 4.696) 7.130 10.069 ( -2.465 -4.157 -0.214) 4.838 10.275 ( -0.656 5.854 1.476) 6.073 10.538 ( -0.143 -0.013 -1.726) 1.732 10.974 ( -2.055 1.844 -0.544) 2.815 11.208 ( 8.229 4.141 -1.843) 9.395 11.258 ( 1.274 -0.132 3.096) 3.351 11.553 ( 1.610 -5.724 -6.550) 8.847 11.632 ( -0.996 -4.097 -3.086) 5.225 11.743 ( -1.144 4.655 -1.062) 4.909 11.909 ( 4.212 -1.278 4.195) 6.081 12.100 ( 1.509 -1.587 -3.163) 3.847 12.173 ( 1.808 1.229 -1.258) 2.522 12.305 ( 1.022 4.924 7.929) 9.390 12.430 ( 2.517 -2.238 0.442) 3.397 12.652 ( 2.867 -3.476 -6.103) 7.586 12.867 ( 5.112 -0.531 -2.907) 5.904 13.052 ( -11.724 5.936 2.465) 13.370 13.438 ( -5.852 9.496 0.681) 11.175 15.002 ( 2.424 -4.974 3.123) 6.354 15.053 ( -3.180 1.641 1.944) 4.072 15.221 ( 1.698 -0.043 1.097) 2.022 15.417 ( 0.531 5.138 -0.875) 5.239 15.723 ( -1.616 -4.148 -0.084) 4.453 15.788 ( 2.749 2.249 -0.079) 3.553 15.816 ( -3.876 2.374 -2.076) 4.997 15.894 ( 0.493 0.716 -1.580) 1.803 16.082 ( 1.366 -3.545 -0.333) 3.813 16.453 ( -2.388 -1.435 -0.100) 2.788 16.699 ( -2.879 0.498 2.099) 3.598 17.111 ( -10.132 -9.772 3.014) 14.396 17.170 ( 11.575 8.234 1.490) 14.282 18.051 ( 2.369 1.263 0.383) 2.712 18.478 ( 0.171 -1.530 -2.963) 3.339 18.824 ( 2.045 0.030 -2.617) 3.321 25.928 ( -0.135 -1.190 2.365) 2.651 25.997 ( -0.622 -0.539 -0.680) 1.067 26.117 ( -0.220 0.458 2.006) 2.070 26.169 ( -0.911 0.408 1.944) 2.185 26.217 ( -0.258 2.229 0.072) 2.245 26.681 ( 6.770 0.911 -4.296) 8.069 26.801 ( -2.584 -1.887 0.471) 3.234 26.903 ( -1.977 -2.010 -6.093) 6.713 27.429 ( 2.989 3.463 15.587) 16.245 27.654 ( -1.160 1.812 -5.042) 5.482 28.391 ( -3.438 -0.963 1.970) 4.078 28.903 ( -4.021 -5.840 -11.678) 13.662 29.108 ( -2.383 0.347 -1.290) 2.731 29.263 ( -7.761 -9.909 -2.396) 12.812 29.511 ( 1.749 -5.036 2.556) 5.913 29.740 ( 14.425 17.105 4.594) 22.842 ======================= Grid point 90 (31/140) ======================= q-point: (-0.44 0.00 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.657 ( -9.956 5.019 8.205) 13.843 1.964 ( -5.328 11.764 -4.078) 13.543 2.154 ( 3.585 5.181 2.611) 6.820 2.380 ( 0.746 2.172 1.963) 3.021 2.546 ( 2.021 3.481 3.816) 5.547 2.601 ( -3.085 6.815 -2.957) 8.044 2.803 ( 0.445 5.530 -3.956) 6.814 2.840 ( 2.692 -1.959 -4.638) 5.709 2.887 ( 0.346 -0.158 0.678) 0.777 3.109 ( 0.915 -3.691 -8.509) 9.320 3.192 ( -0.595 3.408 0.070) 3.461 3.231 ( 0.535 -2.629 2.686) 3.796 3.435 ( -1.675 0.217 3.990) 4.333 3.544 ( -2.403 -1.340 -2.983) 4.059 3.714 ( -6.528 3.452 2.155) 7.693 3.749 ( 6.493 -4.289 2.849) 8.286 4.168 ( 4.698 1.775 6.685) 8.362 4.191 ( -0.535 4.470 0.742) 4.563 4.240 ( -1.050 6.244 0.548) 6.355 4.335 ( -5.650 -2.757 5.176) 8.144 4.678 ( -0.700 1.220 -4.944) 5.141 4.776 ( 9.288 1.584 -4.681) 10.521 4.874 ( 0.505 1.920 -6.163) 6.475 4.957 ( 1.629 -3.740 2.242) 4.655 5.456 ( -2.059 -3.326 -2.465) 4.623 5.477 ( -1.047 0.232 -3.288) 3.458 5.655 ( 7.410 -2.620 -1.278) 7.963 5.723 ( -1.725 1.387 1.365) 2.601 5.791 ( -2.205 0.793 1.265) 2.663 6.095 ( -1.006 0.953 0.889) 1.647 6.202 ( -6.917 2.015 3.383) 7.959 6.404 ( 5.169 -2.855 -1.014) 5.991 6.479 ( 0.124 -0.842 0.707) 1.107 6.895 ( -2.184 -1.319 2.724) 3.732 7.054 ( 3.399 0.002 -0.371) 3.419 7.083 ( -4.036 -0.805 -3.345) 5.304 7.300 ( -2.469 -8.954 4.797) 10.454 7.570 ( -3.625 -0.979 0.863) 3.852 7.706 ( 3.217 4.358 1.903) 5.741 7.827 ( 11.661 -0.764 0.980) 11.727 8.906 ( -7.814 -2.186 1.123) 8.192 9.360 ( 5.490 -2.917 1.717) 6.450 9.393 ( 1.860 6.681 -2.294) 7.304 9.497 ( -3.570 -2.924 -3.928) 6.060 9.549 ( -2.082 -1.336 4.709) 5.319 9.864 ( 1.061 1.379 7.101) 7.312 10.100 ( -4.662 -1.143 -2.817) 5.565 10.131 ( 0.118 10.024 -2.131) 10.249 10.534 ( 2.267 -0.717 -2.003) 3.109 10.926 ( -2.611 1.026 -1.937) 3.409 11.158 ( 5.840 6.143 -2.709) 8.898 11.243 ( -3.636 0.321 0.119) 3.652 11.493 ( -4.385 6.831 -3.000) 8.653 11.695 ( -3.806 -5.758 -1.859) 7.148 11.786 ( 4.260 -7.250 -2.222) 8.697 11.949 ( 2.428 1.033 2.537) 3.660 12.042 ( -0.802 6.945 0.639) 7.020 12.178 ( -0.199 1.028 -0.751) 1.289 12.331 ( 4.682 -0.269 5.696) 7.379 12.500 ( 2.095 -4.078 0.284) 4.594 12.723 ( 2.210 -4.172 -3.279) 5.748 12.870 ( -5.690 5.198 -0.374) 7.716 12.992 ( 7.320 -7.952 -1.756) 10.950 13.301 ( -1.329 2.092 -1.912) 3.130 14.971 ( -5.247 2.867 1.721) 6.221 15.084 ( 1.100 3.354 2.615) 4.393 15.231 ( 4.705 -1.846 2.259) 5.536 15.436 ( 0.917 -4.811 -0.078) 4.898 15.677 ( -1.059 5.333 -4.032) 6.769 15.765 ( -0.103 -0.384 1.309) 1.368 15.788 ( 3.916 2.742 -2.516) 5.402 15.907 ( -1.672 -3.126 -0.977) 3.677 16.161 ( 0.558 -4.163 1.135) 4.351 16.449 ( -3.798 -0.828 0.229) 3.894 16.700 ( -0.426 -0.601 1.827) 1.970 17.134 ( 8.892 6.036 1.812) 10.898 17.206 ( -12.441 -9.299 4.655) 16.215 18.036 ( -1.947 0.587 0.250) 2.049 18.526 ( 0.652 -5.008 -1.783) 5.355 18.820 ( 1.825 0.677 -2.860) 3.460 25.928 ( -2.428 1.022 2.065) 3.347 26.015 ( 0.914 -1.136 0.704) 1.619 26.082 ( -1.677 2.930 0.219) 3.383 26.125 ( -1.261 3.273 0.151) 3.511 26.219 ( 1.435 -0.870 -0.221) 1.693 26.704 ( 7.775 -0.016 -6.385) 10.061 26.818 ( -1.989 -1.367 2.592) 3.542 26.910 ( -0.323 -1.636 -0.789) 1.845 27.457 ( 1.969 4.848 10.956) 12.142 27.621 ( 2.901 -1.204 -2.809) 4.213 28.380 ( -3.726 -0.510 0.878) 3.862 28.872 ( -3.086 -0.851 -11.961) 12.382 29.110 ( -0.349 -1.265 -1.619) 2.084 29.347 ( -3.564 -4.470 0.100) 5.718 29.485 ( 1.121 6.756 0.957) 6.915 29.718 ( 1.842 -2.687 4.583) 5.623 ======================= Grid point 91 (32/140) ======================= q-point: (-0.33 0.00 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.449 ( -19.336 10.380 10.337) 24.259 1.601 ( -7.822 21.573 -2.021) 23.036 2.064 ( 1.934 13.883 4.685) 14.779 2.246 ( 2.362 15.594 -2.232) 15.929 2.444 ( -1.418 6.154 0.007) 6.315 2.498 ( -1.229 1.808 -2.316) 3.185 2.690 ( 4.754 6.700 -4.667) 9.449 2.871 ( 4.340 3.971 -1.186) 6.001 2.914 ( 2.496 -4.262 -1.589) 5.188 3.018 ( -2.237 6.747 -1.422) 7.249 3.121 ( 1.735 10.247 1.006) 10.442 3.329 ( -0.828 -6.750 -0.341) 6.809 3.414 ( -2.981 6.463 3.076) 7.753 3.498 ( -6.030 2.395 2.307) 6.886 3.634 ( -1.651 -2.630 -1.399) 3.406 3.862 ( 1.573 -0.105 -1.350) 2.076 4.019 ( -2.899 1.230 3.971) 5.068 4.193 ( 6.235 4.559 11.069) 13.497 4.253 ( 6.728 -0.001 -2.990) 7.362 4.423 ( -4.952 -5.920 2.919) 8.252 4.612 ( -4.882 -0.323 0.410) 4.910 4.733 ( 4.294 8.693 -5.573) 11.183 4.835 ( 7.767 -0.349 -8.735) 11.694 5.070 ( 0.052 -5.008 3.016) 5.846 5.431 ( -4.047 1.140 -3.431) 5.427 5.464 ( 2.193 -0.963 -4.164) 4.803 5.633 ( -3.192 5.619 0.794) 6.511 5.755 ( -0.860 -4.790 -3.482) 5.984 5.821 ( 5.600 -1.028 3.673) 6.776 6.074 ( -0.598 -0.569 -1.396) 1.622 6.177 ( -4.822 -2.169 5.050) 7.312 6.468 ( 5.119 -1.645 -4.640) 7.102 6.499 ( 0.651 0.287 1.423) 1.591 6.843 ( -7.328 2.088 0.670) 7.650 6.995 ( -4.927 3.360 2.852) 6.611 7.212 ( 6.035 -8.096 -1.826) 10.262 7.449 ( -3.066 -7.180 5.127) 9.340 7.578 ( 1.892 -0.287 2.294) 2.987 7.689 ( 1.322 -2.558 -3.655) 4.653 7.948 ( 12.331 0.219 2.907) 12.671 8.907 ( -5.871 -2.464 1.385) 6.516 9.238 ( 0.963 9.677 -0.811) 9.759 9.429 ( 4.849 3.503 -0.588) 6.010 9.519 ( 2.376 -3.582 -1.427) 4.529 9.632 ( 0.739 -4.093 7.662) 8.718 9.855 ( 2.239 4.102 3.921) 6.100 9.917 ( -3.436 10.237 -3.877) 11.473 10.025 ( -3.970 2.774 0.235) 4.849 10.565 ( 5.119 1.449 -0.710) 5.367 10.889 ( -4.053 -1.315 -3.599) 5.577 11.086 ( 2.403 4.495 0.371) 5.110 11.198 ( -7.215 -0.133 -1.207) 7.316 11.347 ( -0.453 4.333 -5.014) 6.643 11.712 ( -6.682 -1.000 -3.651) 7.680 11.872 ( -1.787 3.967 0.923) 4.448 11.910 ( 4.856 1.725 -4.674) 6.957 12.005 ( 2.399 -2.088 2.725) 4.188 12.140 ( -3.387 -0.436 0.871) 3.525 12.327 ( -5.164 4.903 7.146) 10.088 12.597 ( 10.152 -2.372 -5.170) 11.637 12.739 ( 0.133 -0.123 -1.846) 1.855 12.839 ( 2.516 -2.187 -2.614) 4.237 13.239 ( 6.674 -10.210 7.664) 14.406 13.336 ( 5.780 -7.300 -5.793) 10.967 14.910 ( -6.727 0.004 4.854) 8.295 15.029 ( 1.025 2.188 1.171) 2.685 15.346 ( 5.507 -2.552 4.432) 7.515 15.509 ( 1.461 -0.981 -2.111) 2.748 15.570 ( -0.793 3.447 -2.535) 4.351 15.732 ( 2.517 3.331 1.874) 4.577 15.805 ( 2.084 -2.214 -4.905) 5.771 15.949 ( -0.933 -3.474 -1.361) 3.846 16.235 ( 0.798 -3.453 0.146) 3.547 16.419 ( -6.151 0.402 1.822) 6.428 16.707 ( 2.959 1.652 -0.965) 3.523 17.111 ( 8.530 6.954 4.820) 12.015 17.295 ( -17.770 -13.188 3.253) 22.367 18.007 ( -7.628 -0.886 2.419) 8.051 18.630 ( 0.822 -7.572 -3.223) 8.270 18.804 ( 2.031 1.059 -3.257) 3.982 25.895 ( -2.733 1.389 1.805) 3.557 25.999 ( -2.022 3.511 -0.325) 4.065 26.044 ( 0.620 1.223 2.526) 2.874 26.076 ( -0.287 0.875 -0.787) 1.212 26.235 ( 1.347 0.587 -0.134) 1.475 26.728 ( 5.840 -0.875 -10.718) 12.237 26.857 ( 1.541 -1.111 7.535) 7.770 26.936 ( 0.086 -0.942 2.187) 2.382 27.392 ( -1.711 5.037 -0.291) 5.327 27.732 ( 12.018 -2.571 8.612) 15.007 28.367 ( -2.741 -0.737 0.175) 2.843 28.783 ( -0.632 2.989 -8.820) 9.334 29.100 ( -0.193 0.444 -3.981) 4.011 29.227 ( 0.083 11.210 -4.613) 12.122 29.553 ( -3.614 -8.859 7.986) 12.463 29.785 ( -8.625 -6.406 -2.096) 10.946 ======================= Grid point 92 (33/140) ======================= q-point: (-0.22 0.00 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.130 ( -12.699 21.496 11.384) 27.440 1.144 ( -17.641 18.231 10.738) 27.548 1.655 ( -10.238 31.546 3.463) 33.346 1.954 ( 3.980 18.616 -0.540) 19.045 2.405 ( 4.859 2.651 1.505) 5.736 2.468 ( 2.270 1.514 -2.872) 3.961 2.576 ( 1.477 8.086 -2.361) 8.552 2.761 ( 6.417 13.246 -6.784) 16.207 2.820 ( -1.286 10.710 3.725) 11.412 2.937 ( -3.021 8.002 3.181) 9.125 3.049 ( 2.196 -1.916 0.668) 2.990 3.187 ( -7.284 5.968 1.424) 9.524 3.401 ( -0.602 -1.871 -1.036) 2.222 3.500 ( 0.692 -2.080 -2.200) 3.106 3.660 ( -2.668 -0.085 2.360) 3.564 3.902 ( 1.239 -6.909 -1.717) 7.226 4.056 ( 1.251 0.709 1.644) 2.184 4.187 ( -1.002 4.055 6.694) 7.890 4.332 ( 3.763 -4.546 0.725) 5.945 4.445 ( 3.098 -1.234 -2.020) 3.899 4.583 ( 2.270 5.974 -3.041) 7.078 4.694 ( -2.151 -5.658 6.137) 8.620 4.844 ( 6.326 1.161 -8.658) 10.785 5.126 ( -1.310 -0.576 3.147) 3.457 5.353 ( -5.379 1.757 -2.642) 6.245 5.468 ( -3.341 5.685 -3.941) 7.682 5.503 ( 2.232 0.007 -2.231) 3.156 5.839 ( 1.770 -5.237 -3.732) 6.670 5.884 ( 4.044 -1.946 0.324) 4.500 6.107 ( 1.057 -3.844 -1.151) 4.149 6.251 ( -1.350 -6.110 4.836) 7.908 6.478 ( -0.795 0.690 -1.422) 1.770 6.499 ( 4.021 2.116 0.256) 4.551 6.773 ( -8.161 -1.628 -0.395) 8.331 6.900 ( -5.068 4.844 3.784) 7.966 7.308 ( 3.692 0.904 -4.221) 5.680 7.522 ( -4.731 -2.717 2.334) 5.934 7.680 ( 10.052 -5.055 3.813) 11.880 7.777 ( 0.565 -7.638 -2.716) 8.126 8.012 ( 8.453 2.717 -2.432) 9.206 8.837 ( -3.497 7.925 0.983) 8.718 9.152 ( 0.867 1.222 1.250) 1.951 9.385 ( 6.421 7.393 2.129) 10.021 9.495 ( -0.040 4.359 -5.700) 7.175 9.684 ( -3.044 3.658 -5.016) 6.914 9.781 ( -3.502 -4.445 11.358) 12.689 9.814 ( 2.364 8.047 6.527) 10.628 10.079 ( 2.967 -8.750 3.813) 9.996 10.539 ( 3.967 4.824 -0.122) 6.247 10.847 ( -4.539 0.785 -0.778) 4.671 11.086 ( 3.104 -0.853 -2.073) 3.829 11.135 ( -7.778 -1.423 -1.510) 8.050 11.281 ( 6.853 3.936 -7.732) 11.056 11.592 ( -3.832 5.419 -3.962) 7.729 11.717 ( -5.805 8.340 -2.866) 10.558 11.927 ( 1.253 -1.087 -0.171) 1.667 12.076 ( 1.275 -1.928 2.029) 3.076 12.173 ( 0.515 -2.947 1.476) 3.336 12.221 ( -6.690 3.716 6.660) 10.146 12.669 ( 11.952 0.386 -8.454) 14.645 12.759 ( 2.831 -1.730 -5.111) 6.094 12.879 ( 3.602 -0.351 1.137) 3.794 13.364 ( 2.221 -0.745 1.592) 2.832 13.645 ( 14.082 -14.447 7.108) 21.390 14.934 ( -7.059 -5.955 7.607) 11.965 15.072 ( 0.768 -5.544 1.132) 5.710 15.415 ( 1.878 1.306 0.250) 2.301 15.423 ( 4.466 7.924 1.016) 9.153 15.549 ( -5.124 -0.860 -1.831) 5.509 15.744 ( 3.463 -0.861 2.296) 4.244 15.836 ( 3.500 -2.326 -6.133) 7.435 15.995 ( 0.218 -3.138 -1.687) 3.570 16.283 ( 3.436 -0.780 -3.805) 5.186 16.364 ( -9.875 0.430 6.262) 11.701 16.681 ( 6.642 4.068 -3.752) 8.645 17.067 ( 4.128 7.508 5.306) 10.078 17.410 ( -18.425 -15.444 1.855) 24.113 17.971 ( -15.588 -3.217 5.721) 16.914 18.724 ( -1.249 -4.682 -6.532) 8.133 18.801 ( 1.865 -2.231 -5.603) 6.313 25.859 ( -1.990 1.511 1.327) 2.830 25.926 ( -1.532 3.104 0.160) 3.466 26.040 ( -0.872 -0.296 4.187) 4.287 26.078 ( 0.767 0.207 1.254) 1.484 26.214 ( 0.658 2.538 -0.273) 2.636 26.714 ( 3.609 -0.015 -12.613) 13.119 26.931 ( 2.518 -0.714 1.565) 3.049 26.983 ( 2.378 -1.343 10.558) 10.906 27.280 ( -3.037 4.092 -3.308) 6.075 27.976 ( 22.330 -3.578 16.096) 27.758 28.361 ( -1.418 -0.550 -0.812) 1.724 28.696 ( 5.968 5.278 -3.564) 8.728 29.000 ( -2.336 10.845 -5.185) 12.245 29.067 ( 1.217 1.199 -4.873) 5.164 29.705 ( -9.087 -8.692 1.491) 12.663 29.750 ( -19.797 -6.134 -7.030) 21.886 ======================= Grid point 93 (34/140) ======================= q-point: (-0.11 0.00 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.740 ( -0.971 23.100 21.960) 31.887 0.803 ( -18.808 17.459 21.866) 33.714 1.011 ( -12.907 32.789 21.079) 41.062 1.728 ( 4.342 11.537 3.374) 12.781 2.311 ( 1.386 14.871 -2.498) 15.143 2.389 ( 3.905 4.860 -0.686) 6.272 2.495 ( -6.818 0.139 2.459) 7.249 2.582 ( 11.144 6.604 -9.494) 16.061 2.698 ( -1.656 3.912 5.539) 6.980 2.856 ( -2.419 2.725 2.522) 4.432 2.913 ( -4.684 7.769 1.184) 9.149 3.263 ( 0.964 -8.123 -5.103) 9.641 3.413 ( 0.332 -1.682 -2.350) 2.909 3.511 ( 0.555 0.185 -3.719) 3.765 3.652 ( -2.347 0.606 6.221) 6.676 3.935 ( -2.425 4.495 2.143) 5.539 4.049 ( 0.358 -2.181 -1.336) 2.582 4.211 ( 1.009 -4.695 -0.065) 4.802 4.413 ( 2.007 -0.486 0.045) 2.065 4.484 ( 6.316 0.297 -2.830) 6.928 4.573 ( 3.166 -2.653 1.518) 4.401 4.763 ( 1.163 1.250 -1.314) 2.154 4.825 ( -4.623 -2.566 -0.078) 5.288 5.129 ( 1.283 0.954 0.306) 1.628 5.249 ( -8.612 2.347 2.080) 9.166 5.323 ( -2.721 4.604 2.113) 5.750 5.557 ( 4.615 -4.194 -12.996) 14.415 5.814 ( 3.004 5.258 -7.121) 9.348 6.021 ( 1.669 -7.313 1.445) 7.639 6.229 ( 4.389 -8.291 5.374) 10.811 6.378 ( 4.750 -3.833 3.391) 6.982 6.467 ( -2.213 -1.201 4.541) 5.193 6.500 ( 3.443 -0.586 1.044) 3.645 6.736 ( -7.996 1.543 5.957) 10.090 6.827 ( -3.165 -0.973 -1.528) 3.647 7.219 ( 6.892 11.690 -5.156) 14.517 7.507 ( -4.303 -0.182 -0.446) 4.330 7.871 ( 2.145 -6.084 -2.719) 7.001 7.897 ( 8.007 -3.587 1.436) 8.891 7.951 ( 2.691 5.645 -5.978) 8.651 8.666 ( -3.875 7.804 1.258) 8.803 9.100 ( 0.610 5.673 -4.843) 7.484 9.253 ( -0.113 7.761 -5.943) 9.776 9.469 ( 1.061 1.467 -2.352) 2.968 9.645 ( -3.997 -4.742 3.826) 7.287 9.723 ( -2.224 0.402 1.680) 2.816 9.976 ( 0.862 -10.589 21.318) 23.819 10.288 ( 2.821 -8.080 4.999) 9.911 10.490 ( 1.994 3.854 0.676) 4.391 10.812 ( -0.562 1.048 2.400) 2.679 10.968 ( 1.839 12.800 -21.714) 25.273 11.176 ( -0.764 -3.014 2.655) 4.089 11.213 ( 4.072 5.436 -1.209) 6.899 11.509 ( -5.343 5.941 1.319) 8.098 11.563 ( 15.298 0.896 0.981) 15.355 11.945 ( -1.233 -0.700 0.466) 1.492 12.100 ( -2.632 -1.208 1.611) 3.314 12.169 ( -1.332 0.660 0.441) 1.550 12.285 ( 2.781 -6.176 8.073) 10.538 12.684 ( 12.300 3.998 -8.815) 15.651 12.760 ( 0.821 -0.060 -6.332) 6.385 12.935 ( 7.832 0.298 2.369) 8.188 13.331 ( -2.583 6.965 6.078) 9.598 14.076 ( 23.121 -14.796 10.458) 29.375 15.068 ( -5.735 -10.029 6.167) 13.096 15.204 ( -0.670 -7.685 -0.198) 7.716 15.283 ( -1.730 5.528 -2.013) 6.132 15.406 ( -10.121 1.583 -3.388) 10.790 15.478 ( 8.583 6.248 5.413) 11.916 15.816 ( 2.376 -3.044 1.825) 4.271 15.898 ( 3.484 -3.328 -1.597) 5.076 16.056 ( 0.617 -6.651 -0.870) 6.736 16.260 ( -3.308 0.156 -2.543) 4.175 16.355 ( -0.066 -0.746 6.963) 7.003 16.653 ( 11.701 4.958 -5.198) 13.730 16.964 ( 1.146 9.630 2.837) 10.104 17.541 ( -20.710 -17.473 -0.019) 27.096 17.921 ( -32.091 -8.377 5.288) 33.586 18.690 ( -9.139 2.220 -17.254) 19.651 18.766 ( -0.941 3.496 -9.066) 9.762 25.832 ( -0.617 0.995 1.412) 1.834 25.875 ( -0.472 2.068 0.031) 2.121 26.085 ( 0.291 -0.045 1.380) 1.411 26.109 ( -4.300 -6.184 7.761) 10.815 26.173 ( 1.242 1.775 1.686) 2.745 26.644 ( 3.058 5.439 -13.217) 14.616 26.940 ( -0.391 -0.107 -2.271) 2.307 27.007 ( -0.058 6.603 -0.328) 6.612 27.289 ( 0.700 -8.305 8.523) 11.921 28.305 ( -4.612 -7.064 -0.641) 8.461 28.402 ( 17.392 -4.018 10.228) 20.573 28.719 ( 26.465 8.595 1.834) 27.886 28.828 ( 19.858 6.043 10.160) 23.110 29.041 ( 0.067 0.151 -5.258) 5.260 29.395 ( -47.722 6.353 -26.685) 55.044 29.810 ( -7.770 -4.403 5.672) 10.580 ======================= Grid point 95 (35/140) ======================= q-point: ( 0.11 0.11 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.837 ( 13.850 0.000 20.083) 24.396 1.006 ( 15.254 0.000 23.902) 28.354 1.652 ( 5.189 0.000 10.947) 12.115 1.856 ( 19.923 0.000 30.752) 36.642 2.077 ( -4.530 -0.000 -4.545) 6.417 2.278 ( -9.136 -0.000 -3.482) 9.777 2.416 ( 3.750 0.000 3.834) 5.363 2.546 ( -10.508 -0.000 -0.446) 10.518 2.671 ( -0.818 -0.000 -0.473) 0.945 2.759 ( 9.077 0.000 -2.102) 9.317 2.967 ( 1.174 0.000 9.828) 9.898 3.147 ( -1.277 -0.000 -15.257) 15.311 3.406 ( 1.578 0.000 -6.441) 6.631 3.415 ( -2.751 -0.000 -4.979) 5.688 3.753 ( 1.890 0.000 8.118) 8.335 3.895 ( -3.266 -0.000 2.511) 4.120 4.007 ( 0.181 0.000 -7.550) 7.552 4.276 ( -11.238 -0.000 -3.160) 11.674 4.302 ( -1.725 -0.000 3.555) 3.951 4.524 ( -0.175 -0.000 -8.491) 8.493 4.651 ( -8.852 -0.000 0.427) 8.862 4.657 ( 5.153 0.000 9.411) 10.730 4.758 ( 0.186 0.000 4.595) 4.599 5.140 ( -2.297 -0.000 -2.735) 3.572 5.242 ( 3.682 0.000 2.695) 4.563 5.375 ( 10.506 0.000 2.760) 10.863 5.522 ( 8.576 0.000 -13.017) 15.588 5.610 ( -4.378 -0.000 -8.710) 9.748 6.127 ( -2.201 -0.000 3.025) 3.741 6.381 ( -0.916 -0.000 4.491) 4.583 6.481 ( -6.265 -0.000 5.459) 8.310 6.526 ( -6.839 -0.000 -1.141) 6.933 6.660 ( 1.875 0.000 -4.470) 4.847 6.702 ( 11.469 0.000 0.789) 11.497 6.887 ( -0.260 -0.000 0.400) 0.477 7.417 ( 13.490 0.000 -6.419) 14.939 7.441 ( -1.018 -0.000 -1.359) 1.699 7.500 ( -8.426 -0.000 1.027) 8.488 7.929 ( -8.520 -0.000 0.731) 8.552 7.984 ( -6.926 -0.000 2.085) 7.233 8.660 ( 6.221 0.000 5.589) 8.363 8.917 ( -3.272 -0.000 -6.801) 7.547 9.021 ( -5.053 -0.000 -3.811) 6.329 9.233 ( -6.877 -0.000 -8.271) 10.756 9.632 ( -9.551 -0.000 2.397) 9.847 9.743 ( 0.763 0.000 -3.326) 3.412 10.266 ( -3.747 -0.000 2.084) 4.288 10.443 ( -1.446 -0.000 3.899) 4.159 10.491 ( -0.515 -0.000 5.463) 5.487 10.675 ( 6.684 0.000 7.693) 10.191 10.928 ( 5.864 0.000 3.227) 6.693 11.172 ( 2.329 0.000 -4.046) 4.668 11.298 ( 3.506 0.000 5.477) 6.503 11.466 ( -1.501 -0.000 4.481) 4.725 11.804 ( 1.080 0.000 -8.051) 8.123 12.005 ( 0.030 0.000 -3.072) 3.072 12.121 ( 1.873 0.000 2.638) 3.236 12.187 ( 7.278 0.000 -1.594) 7.451 12.495 ( -7.380 -0.000 -7.856) 10.779 12.497 ( 9.093 0.000 -8.237) 12.269 12.727 ( -13.235 -0.000 6.162) 14.599 13.081 ( -2.481 -0.000 5.792) 6.301 13.206 ( -7.355 -0.000 11.927) 14.012 14.042 ( -23.184 -0.000 9.925) 25.219 15.013 ( -0.821 -0.000 -1.372) 1.599 15.176 ( 3.831 0.000 1.130) 3.994 15.248 ( -3.313 -0.000 -0.565) 3.360 15.489 ( 11.931 0.000 -0.436) 11.939 15.736 ( -9.875 -0.000 2.047) 10.085 15.866 ( -0.962 -0.000 -5.169) 5.258 15.931 ( 8.861 0.000 -1.311) 8.957 16.094 ( -2.176 -0.000 -1.945) 2.919 16.140 ( -6.736 -0.000 -2.617) 7.227 16.516 ( 1.324 0.000 -8.658) 8.759 16.587 ( -21.276 -0.000 15.053) 26.063 16.667 ( -9.411 -0.000 -0.204) 9.413 17.666 ( 45.407 0.000 -21.378) 50.188 17.904 ( 8.010 0.000 5.205) 9.552 18.337 ( 2.552 0.000 1.383) 2.903 18.760 ( 2.617 0.000 -1.894) 3.231 25.857 ( 0.237 0.000 1.286) 1.308 25.872 ( 1.218 0.000 0.541) 1.333 26.028 ( -3.365 -0.000 1.203) 3.574 26.101 ( -0.705 -0.000 1.306) 1.484 26.318 ( -1.175 -0.000 8.098) 8.182 26.578 ( 4.881 0.000 4.870) 6.895 26.745 ( -5.177 -0.000 -6.180) 8.062 26.892 ( -0.375 -0.000 -3.701) 3.720 27.642 ( 7.299 0.000 8.894) 11.505 27.713 ( -24.451 -0.000 13.337) 27.852 28.331 ( -7.482 -0.000 2.016) 7.749 28.536 ( -3.342 -0.000 -6.631) 7.425 28.554 ( 1.367 0.000 -1.431) 1.979 29.147 ( 6.206 0.000 0.026) 6.206 29.563 ( -14.088 -0.000 -6.686) 15.594 30.685 ( 43.328 0.000 -17.825) 46.852 ======================= Grid point 96 (36/140) ======================= q-point: ( 0.22 0.11 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.111 ( 19.082 -7.200 14.642) 25.107 1.382 ( 12.396 -13.895 17.832) 25.782 1.812 ( 0.037 -13.009 -0.981) 13.046 2.049 ( -6.844 -3.365 -0.606) 7.650 2.234 ( -0.181 -8.309 13.324) 15.703 2.269 ( 8.744 -5.601 8.032) 13.128 2.491 ( -2.461 -5.947 3.463) 7.308 2.597 ( -1.728 -11.928 1.095) 12.102 2.697 ( -3.927 -5.052 1.399) 6.550 2.877 ( 11.362 -5.078 -2.337) 12.662 3.041 ( 3.798 -0.848 9.953) 10.687 3.095 ( 0.367 -3.188 -10.699) 11.170 3.334 ( -3.050 2.267 -5.510) 6.693 3.422 ( 1.313 -3.638 -6.057) 7.186 3.749 ( -1.594 5.873 -0.878) 6.148 3.878 ( 1.472 -1.740 6.211) 6.616 3.929 ( -4.145 5.816 -2.820) 7.678 4.151 ( -8.158 7.498 -0.147) 11.082 4.244 ( -4.803 -3.767 -3.669) 7.122 4.565 ( -3.788 3.086 0.558) 4.918 4.622 ( -0.895 -10.824 -4.545) 11.774 4.753 ( 5.756 -0.210 7.745) 9.652 4.810 ( -2.152 -3.959 6.125) 7.604 5.086 ( 1.320 3.595 -3.119) 4.939 5.288 ( 2.258 2.162 0.348) 3.146 5.375 ( 2.493 1.939 -7.751) 8.370 5.557 ( 7.115 -2.561 -1.054) 7.635 5.607 ( 3.481 -3.321 -10.479) 11.530 6.073 ( -1.645 4.814 2.584) 5.706 6.296 ( -5.863 10.298 -0.203) 11.852 6.383 ( -0.382 2.173 2.858) 3.610 6.525 ( -9.927 -1.720 1.463) 10.180 6.624 ( 4.668 4.688 -0.731) 6.656 6.811 ( 5.472 1.187 4.757) 7.347 6.861 ( 4.833 -0.805 -0.402) 4.917 7.348 ( -3.011 1.206 -2.431) 4.053 7.480 ( -3.581 0.460 -5.152) 6.291 7.512 ( 2.409 0.809 0.555) 2.601 7.767 ( -6.020 7.316 1.870) 9.657 7.963 ( -6.438 -1.561 0.561) 6.648 8.781 ( 2.573 -5.422 3.552) 6.974 8.942 ( -4.486 -9.975 -6.429) 12.687 9.021 ( -3.105 -4.992 -0.186) 5.882 9.208 ( -6.692 -7.681 -6.929) 12.321 9.549 ( -12.787 0.661 2.118) 12.978 9.703 ( 1.168 1.935 -0.427) 2.300 10.267 ( 1.121 0.319 5.331) 5.457 10.345 ( -0.494 10.790 5.842) 12.280 10.507 ( 0.985 -2.513 3.396) 4.338 10.908 ( 2.490 -9.351 3.226) 10.200 11.031 ( 8.270 -4.876 1.707) 9.751 11.171 ( 3.772 0.683 -4.879) 6.204 11.344 ( 2.077 -2.232 -6.227) 6.933 11.531 ( 0.921 -4.922 8.637) 9.984 11.744 ( 2.033 3.665 -7.237) 8.363 11.983 ( -4.009 -1.041 1.688) 4.473 12.116 ( 7.644 4.544 0.013) 8.893 12.248 ( 3.799 -0.087 1.039) 3.940 12.383 ( -4.882 1.790 -8.560) 10.015 12.489 ( 4.528 3.492 1.990) 6.054 12.657 ( -7.527 0.477 1.882) 7.773 13.118 ( -2.985 -2.013 -0.695) 3.666 13.190 ( -11.879 -0.358 8.714) 14.737 13.923 ( -14.610 2.639 7.436) 16.605 14.932 ( -0.408 5.299 2.633) 5.931 15.175 ( -3.167 2.242 -0.498) 3.912 15.344 ( 2.693 -9.018 -0.112) 9.412 15.436 ( 8.837 12.793 0.652) 15.562 15.646 ( -10.757 0.948 1.798) 10.948 15.815 ( 1.679 2.367 0.595) 2.962 15.987 ( -0.476 0.690 -1.110) 1.391 16.016 ( 5.278 4.816 -7.172) 10.124 16.076 ( -2.068 0.063 -1.867) 2.787 16.439 ( -3.047 1.709 -0.028) 3.494 16.631 ( -9.560 -7.141 0.500) 11.943 16.676 ( -7.873 -8.210 2.060) 11.560 17.691 ( 26.540 15.666 -9.658) 32.296 18.006 ( 7.683 -1.156 5.785) 9.686 18.450 ( 4.918 -5.334 -6.579) 9.794 18.782 ( 2.308 -1.138 -1.725) 3.098 25.856 ( 0.281 0.138 0.903) 0.956 25.914 ( 1.420 -2.487 0.045) 2.864 26.033 ( -1.824 -1.727 2.419) 3.488 26.113 ( -1.145 -1.298 1.283) 2.155 26.333 ( 0.253 1.921 7.778) 8.016 26.652 ( 5.330 -0.379 0.115) 5.345 26.708 ( -5.608 -3.644 -3.653) 7.621 26.879 ( -0.327 -0.809 -4.997) 5.072 27.567 ( -7.401 4.891 14.463) 16.967 27.762 ( 1.351 -0.364 5.106) 5.295 28.341 ( -5.255 -3.236 1.271) 6.301 28.537 ( -5.245 -9.454 -8.182) 13.558 28.629 ( -0.513 -7.411 0.469) 7.443 29.194 ( 0.305 -1.048 0.266) 1.123 29.403 ( -7.960 2.001 -8.521) 11.831 30.699 ( 29.084 19.421 -8.821) 36.068 ======================= Grid point 97 (37/140) ======================= q-point: ( 0.33 0.11 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.470 ( 17.795 -8.516 10.905) 22.541 1.752 ( 5.224 -11.656 9.998) 16.221 1.938 ( -1.993 -8.603 -6.226) 10.805 2.170 ( -0.505 -10.250 2.425) 10.545 2.390 ( -1.638 -7.850 7.925) 11.274 2.485 ( 0.364 -9.535 6.078) 11.313 2.616 ( -3.408 -8.488 3.111) 9.661 2.770 ( -1.218 -6.691 -3.839) 7.810 2.811 ( -5.011 -12.265 0.223) 13.251 3.004 ( 3.989 -2.071 -4.223) 6.167 3.090 ( 1.896 -4.252 -5.163) 6.952 3.220 ( -1.338 2.970 -2.520) 4.119 3.265 ( 5.043 -4.304 5.885) 8.865 3.532 ( 8.571 -5.552 1.211) 10.283 3.654 ( -3.241 -3.445 -3.156) 5.686 3.738 ( -8.778 8.072 0.908) 11.959 3.967 ( -4.745 6.234 3.408) 8.544 4.014 ( 6.796 -4.686 5.019) 9.661 4.283 ( -3.156 -5.245 -4.691) 7.712 4.510 ( 0.548 2.242 3.137) 3.895 4.740 ( -6.417 -7.751 -3.498) 10.654 4.777 ( 2.855 1.963 -4.186) 5.434 4.918 ( 0.440 -1.674 6.675) 6.895 5.023 ( 5.540 4.952 -1.088) 7.510 5.190 ( 0.020 3.095 -2.390) 3.910 5.404 ( -0.779 -3.613 -2.208) 4.305 5.602 ( -3.469 -5.558 -7.675) 10.091 5.667 ( 11.654 1.761 -2.342) 12.017 6.010 ( -0.360 3.522 -0.669) 3.603 6.069 ( -2.414 8.260 -1.136) 8.680 6.359 ( -0.877 1.964 1.060) 2.397 6.453 ( -4.911 4.421 5.821) 8.806 6.577 ( -0.025 2.634 -0.642) 2.711 6.798 ( 4.070 3.184 2.406) 5.700 6.978 ( 3.129 -4.516 2.234) 5.931 7.234 ( -3.380 6.255 -7.514) 10.345 7.346 ( -6.808 5.764 0.140) 8.922 7.536 ( -7.386 -4.173 1.897) 8.693 7.684 ( 7.116 3.701 1.941) 8.252 7.945 ( -2.953 0.155 0.520) 3.002 8.862 ( -6.353 -4.668 -0.623) 7.908 9.072 ( -7.482 -11.748 -2.915) 14.230 9.144 ( 2.266 -8.329 2.787) 9.070 9.308 ( -5.816 -12.137 -4.026) 14.048 9.479 ( -5.119 -1.563 1.751) 5.631 9.687 ( -1.528 0.671 -0.388) 1.714 10.189 ( -0.776 9.700 4.159) 10.583 10.318 ( 1.705 -1.370 5.725) 6.128 10.550 ( 0.902 0.115 0.594) 1.086 11.047 ( 1.892 -1.664 3.343) 4.186 11.129 ( 4.203 -1.355 0.202) 4.420 11.231 ( 9.801 -4.588 -1.610) 10.941 11.369 ( 0.257 -5.571 -12.346) 13.548 11.640 ( 2.708 4.404 -1.238) 5.316 11.710 ( 4.519 -5.956 -0.071) 7.476 11.984 ( -2.805 0.788 3.835) 4.816 12.100 ( 4.259 2.435 -2.211) 5.381 12.199 ( -3.107 2.839 -2.482) 4.886 12.359 ( 5.273 -0.272 0.658) 5.321 12.488 ( 3.481 2.964 6.550) 7.987 12.609 ( -2.815 0.277 -1.797) 3.351 13.033 ( 1.043 7.211 -7.968) 10.797 13.138 ( -18.780 -2.058 7.806) 20.442 13.766 ( -11.343 7.721 3.908) 14.267 14.899 ( 0.161 0.584 5.185) 5.220 15.099 ( -3.774 2.604 0.069) 4.585 15.287 ( 5.771 8.579 0.922) 10.380 15.519 ( -2.370 -7.333 0.848) 7.753 15.602 ( -3.057 -2.221 0.963) 3.899 15.792 ( 2.940 5.198 4.966) 7.767 15.883 ( -3.490 1.921 -4.616) 6.097 16.004 ( 5.645 2.552 -6.054) 8.662 16.048 ( 1.894 1.108 -4.148) 4.693 16.413 ( -2.096 -0.416 0.298) 2.158 16.657 ( -8.417 -3.914 0.754) 9.313 16.789 ( -7.021 -9.712 2.331) 12.208 17.569 ( 18.423 15.010 -2.044) 23.851 18.097 ( 6.065 0.449 5.167) 7.980 18.478 ( 1.518 0.153 -7.270) 7.429 18.809 ( 2.042 -0.905 -1.953) 2.967 25.874 ( 0.756 -1.198 1.115) 1.803 25.960 ( 0.412 -2.012 -0.954) 2.265 26.075 ( -0.193 -2.429 3.098) 3.942 26.132 ( -1.867 -1.532 0.949) 2.595 26.328 ( -0.023 2.950 5.576) 6.308 26.669 ( 1.014 -1.830 -6.248) 6.589 26.742 ( 0.413 -1.688 3.449) 3.862 26.855 ( -0.553 -0.247 -6.116) 6.146 27.527 ( -4.037 2.160 11.259) 12.154 27.774 ( 3.778 4.402 4.782) 7.517 28.345 ( -3.451 -1.307 0.867) 3.791 28.627 ( -6.502 -10.125 -9.814) 15.528 28.796 ( -4.206 -13.465 0.203) 14.108 29.127 ( -11.202 -0.293 -6.649) 13.030 29.389 ( 6.729 -1.796 0.845) 7.015 30.491 ( 20.865 23.801 -2.223) 31.730 ======================= Grid point 98 (38/140) ======================= q-point: ( 0.44 0.11 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.718 ( 7.496 -1.973 8.859) 11.771 1.961 ( 3.199 -8.125 3.408) 9.374 2.093 ( 1.420 -8.704 -1.949) 9.032 2.311 ( -0.862 -5.943 1.604) 6.216 2.535 ( -0.733 -6.629 4.644) 8.127 2.613 ( -1.631 -4.198 -0.678) 4.555 2.750 ( -0.076 -5.940 5.337) 7.986 2.811 ( -2.326 -2.545 -5.529) 6.516 2.972 ( -5.209 -10.845 -1.108) 12.082 2.997 ( 1.494 3.888 -2.900) 5.076 3.048 ( -0.952 3.292 -6.796) 7.611 3.249 ( -0.890 -9.882 0.688) 9.946 3.307 ( 0.146 2.207 -3.157) 3.855 3.587 ( -9.223 2.425 4.921) 10.732 3.613 ( 1.511 -2.304 0.848) 2.883 3.805 ( 1.219 -1.024 0.608) 1.704 3.925 ( 2.070 -6.303 5.349) 8.522 4.210 ( 8.326 -4.751 3.592) 10.237 4.340 ( 4.940 -3.398 2.484) 6.489 4.494 ( -1.370 3.846 4.149) 5.822 4.680 ( -3.808 2.356 -7.586) 8.809 4.798 ( -0.377 -3.846 -5.263) 6.529 4.865 ( -1.742 3.761 -3.593) 5.485 5.015 ( 7.373 4.247 2.736) 8.938 5.221 ( -0.038 -5.036 0.432) 5.055 5.438 ( -4.327 -3.573 -1.673) 5.855 5.650 ( 0.569 -4.802 -4.987) 6.946 5.693 ( 5.609 1.497 0.142) 5.807 5.858 ( -4.332 4.685 -2.673) 6.918 6.085 ( 6.189 -0.958 0.961) 6.336 6.294 ( -4.945 2.186 -2.853) 6.114 6.385 ( -0.807 3.948 7.450) 8.470 6.526 ( -0.676 3.076 0.541) 3.195 6.808 ( 3.010 -0.207 0.779) 3.116 7.058 ( 2.347 -2.266 -1.561) 3.616 7.105 ( -3.983 1.800 -0.613) 4.413 7.199 ( -6.483 5.073 0.449) 8.244 7.531 ( -8.966 -2.646 1.493) 9.467 7.764 ( 12.018 -0.650 4.282) 12.775 7.901 ( -0.264 3.463 -0.691) 3.541 8.850 ( -9.883 -2.206 0.072) 10.126 9.175 ( -6.416 -8.435 -0.207) 10.600 9.313 ( 2.571 -6.686 2.015) 7.441 9.405 ( -5.296 -6.422 -0.602) 8.346 9.603 ( 3.579 -6.094 1.578) 7.241 9.648 ( -2.855 -4.051 -3.106) 5.848 10.053 ( -3.845 5.835 2.198) 7.326 10.373 ( 2.967 1.176 3.412) 4.672 10.523 ( -1.448 1.473 -2.062) 2.919 11.013 ( 1.186 3.541 -1.479) 4.017 11.257 ( 4.235 -3.110 1.807) 5.556 11.345 ( 7.244 -0.091 3.005) 7.843 11.429 ( 4.452 -6.729 -11.293) 13.879 11.568 ( -0.342 1.774 -3.003) 3.505 11.814 ( 3.374 1.559 -1.345) 3.953 11.941 ( -1.736 1.248 3.541) 4.137 12.067 ( -1.176 -0.304 -3.502) 3.707 12.186 ( 2.732 -1.244 1.173) 3.223 12.419 ( 5.483 1.549 4.124) 7.034 12.497 ( 4.388 3.493 6.008) 8.219 12.594 ( 1.252 -1.679 -4.504) 4.967 12.895 ( 1.247 3.515 -6.284) 7.307 13.024 ( -16.797 1.984 3.249) 17.223 13.534 ( -10.778 9.888 1.103) 14.669 14.958 ( 1.819 -3.504 2.894) 4.895 15.046 ( -4.061 0.488 1.624) 4.400 15.250 ( 3.650 1.389 2.566) 4.673 15.527 ( -2.580 5.514 0.654) 6.123 15.610 ( -5.139 -3.785 -2.534) 6.867 15.804 ( 3.051 -1.431 4.691) 5.776 15.845 ( 2.485 1.455 -1.941) 3.473 15.955 ( 4.029 3.993 -4.916) 7.507 16.044 ( 2.629 -1.129 -3.037) 4.172 16.407 ( -2.669 -0.960 -0.446) 2.871 16.647 ( -8.367 -2.214 2.554) 9.024 16.900 ( -6.728 -8.325 1.920) 10.875 17.468 ( 15.163 12.308 1.531) 19.590 18.124 ( 3.454 3.281 2.754) 5.503 18.439 ( -1.294 -0.107 -4.560) 4.742 18.824 ( 1.770 -0.380 -2.241) 2.881 25.915 ( 0.772 -1.784 1.680) 2.569 25.977 ( -0.451 -0.884 -0.911) 1.348 26.124 ( -0.594 -0.491 2.088) 2.225 26.146 ( -0.800 -2.260 0.408) 2.432 26.282 ( -0.844 4.336 2.393) 5.024 26.682 ( 1.092 -2.588 -7.744) 8.238 26.785 ( 2.454 0.474 4.928) 5.525 26.841 ( -0.515 -1.777 -2.253) 2.916 27.543 ( -0.455 -0.665 7.586) 7.629 27.711 ( 2.094 7.804 3.020) 8.626 28.344 ( -4.070 -1.632 -0.117) 4.387 28.676 ( -6.917 -7.972 -9.881) 14.457 28.988 ( -4.721 -12.951 -0.426) 13.792 29.055 ( -5.413 -2.852 -4.763) 7.753 29.497 ( 5.063 -2.918 3.899) 7.025 30.221 ( 14.425 23.244 -0.073) 27.356 ======================= Grid point 99 (39/140) ======================= q-point: (-0.44 0.11 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.737 ( -4.171 5.742 7.742) 10.503 2.066 ( 2.350 2.749 -0.109) 3.618 2.199 ( 0.663 -4.424 0.258) 4.481 2.380 ( 0.491 -2.072 4.417) 4.904 2.600 ( -5.074 -1.373 -8.046) 9.611 2.650 ( 3.603 2.150 3.971) 5.777 2.785 ( -3.281 -0.712 -5.677) 6.595 2.820 ( 0.250 -1.788 -3.826) 4.230 2.909 ( 3.102 0.386 3.258) 4.515 3.007 ( 1.011 -1.847 -4.454) 4.927 3.123 ( -3.050 -5.655 1.509) 6.599 3.247 ( -2.948 0.542 -0.205) 3.005 3.402 ( -0.868 -6.876 2.098) 7.242 3.513 ( -2.984 1.924 -0.813) 3.642 3.696 ( 2.603 -4.079 1.188) 4.983 3.774 ( -0.327 2.513 0.975) 2.715 4.099 ( -2.447 -8.659 6.369) 11.024 4.304 ( 5.112 1.946 7.004) 8.887 4.335 ( -3.034 9.067 -1.318) 9.652 4.430 ( 2.956 5.785 4.604) 7.963 4.624 ( -2.216 -2.364 -6.582) 7.336 4.804 ( 2.417 -0.612 -9.249) 9.579 4.855 ( 4.682 -2.564 0.452) 5.357 4.997 ( 3.304 3.176 -0.677) 4.633 5.322 ( -2.453 -6.687 -0.680) 7.156 5.429 ( -1.656 -1.333 -5.492) 5.889 5.700 ( 4.647 0.080 -1.039) 4.762 5.713 ( 0.098 -0.395 -0.265) 0.486 5.811 ( -1.451 -0.803 5.293) 5.547 6.098 ( -1.736 1.341 -1.662) 2.752 6.215 ( -4.101 2.964 2.797) 5.781 6.406 ( 4.196 -1.637 1.172) 4.654 6.485 ( 1.177 1.154 -0.226) 1.664 6.857 ( 0.952 -2.779 0.308) 2.954 7.035 ( -5.929 1.885 -4.091) 7.446 7.078 ( 2.660 0.400 -0.372) 2.715 7.169 ( -4.293 -5.082 6.633) 9.395 7.522 ( -4.993 -2.108 1.322) 5.579 7.800 ( -0.371 5.028 -0.249) 5.047 7.918 ( 11.740 -1.524 2.286) 12.057 8.805 ( -9.277 -1.611 1.722) 9.572 9.281 ( -1.812 -8.157 0.980) 8.413 9.413 ( 1.883 -2.807 0.584) 3.430 9.473 ( -2.790 -4.754 -0.757) 5.564 9.551 ( 4.284 5.627 -0.991) 7.141 9.870 ( 1.234 -11.887 2.522) 12.215 9.956 ( -8.400 0.760 -0.056) 8.434 10.306 ( 1.044 9.525 0.561) 9.598 10.507 ( -0.002 -1.960 -2.682) 3.322 10.960 ( 1.453 3.095 -1.951) 3.936 11.251 ( -0.056 3.359 -2.488) 4.180 11.337 ( 6.919 8.111 -1.011) 10.709 11.523 ( 0.569 -1.441 -3.392) 3.729 11.593 ( -0.130 -3.867 0.663) 3.926 11.736 ( 0.616 1.545 0.134) 1.669 11.943 ( -4.445 -1.238 3.239) 5.637 12.092 ( 3.373 -1.180 -5.298) 6.391 12.241 ( 3.478 1.161 2.369) 4.365 12.424 ( 5.369 2.041 4.898) 7.549 12.478 ( 0.615 2.891 1.021) 3.127 12.653 ( 3.844 -3.813 -3.421) 6.405 12.856 ( -10.374 2.958 -3.930) 11.481 12.927 ( 4.076 -5.458 0.059) 6.812 13.320 ( -8.893 5.241 0.446) 10.332 14.976 ( -3.117 1.685 -0.646) 3.602 15.097 ( 0.912 -4.899 4.415) 6.658 15.296 ( 3.176 0.498 3.224) 4.552 15.389 ( -2.249 3.609 -1.614) 4.549 15.636 ( -4.680 -3.842 -1.455) 6.227 15.826 ( 7.433 3.764 -2.009) 8.571 15.864 ( 3.194 -0.017 0.886) 3.314 15.893 ( 1.544 3.387 -2.438) 4.450 16.099 ( 0.831 -3.814 0.601) 3.950 16.397 ( -3.520 -1.230 -1.433) 3.995 16.646 ( -7.250 -3.328 4.385) 9.103 16.980 ( -6.837 -6.555 1.010) 9.526 17.396 ( 11.098 10.176 3.496) 15.458 18.076 ( 0.603 4.382 -0.376) 4.439 18.440 ( -1.589 -3.330 -1.589) 4.017 18.827 ( 1.560 0.194 -2.579) 3.021 25.935 ( -1.540 0.498 1.498) 2.205 26.000 ( 1.317 -1.959 0.434) 2.400 26.103 ( -2.163 1.338 -0.114) 2.546 26.186 ( 0.216 1.946 1.712) 2.601 26.207 ( -0.327 0.857 -1.103) 1.435 26.690 ( 2.337 -1.684 -8.945) 9.397 26.828 ( 2.060 -0.220 7.482) 7.764 26.877 ( 0.037 -2.373 0.955) 2.558 27.567 ( -0.991 2.606 -9.813) 10.201 27.641 ( 3.529 1.705 15.356) 15.849 28.335 ( -3.267 -1.314 -1.020) 3.666 28.695 ( -6.403 -5.924 -8.784) 12.379 29.069 ( -0.651 -2.993 -2.506) 3.958 29.165 ( -3.487 -11.550 1.296) 12.135 29.564 ( 1.113 1.224 2.386) 2.903 29.953 ( 8.559 18.054 0.736) 19.993 ======================= Grid point 100 (40/140) ======================= q-point: (-0.33 0.11 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.564 ( -11.320 11.297 8.811) 18.260 1.896 ( -1.319 16.169 2.250) 16.378 2.263 ( 2.984 1.931 5.547) 6.588 2.428 ( 2.664 1.342 1.734) 3.450 2.468 ( -4.442 6.502 -7.831) 11.106 2.553 ( -0.381 5.942 -5.061) 7.814 2.770 ( 3.256 1.741 -5.078) 6.279 2.878 ( 1.813 -2.871 2.046) 3.964 2.936 ( 2.177 1.786 2.870) 4.021 3.032 ( 0.193 -2.403 -7.169) 7.564 3.149 ( -2.841 -2.630 -0.519) 3.906 3.291 ( -0.412 -2.848 6.738) 7.326 3.439 ( -1.223 2.119 1.885) 3.088 3.495 ( -1.429 -1.847 -0.533) 2.396 3.663 ( -1.923 6.076 1.585) 6.567 3.847 ( 4.253 -4.732 -1.127) 6.461 4.104 ( -4.814 10.382 0.742) 11.468 4.253 ( -6.902 -9.096 7.088) 13.439 4.300 ( 1.095 4.673 0.718) 4.853 4.397 ( 9.190 3.589 6.574) 11.855 4.573 ( -7.079 1.462 -2.526) 7.657 4.823 ( 6.227 -2.028 -9.963) 11.923 4.868 ( 4.282 5.310 -6.384) 9.343 5.020 ( 2.359 -3.346 4.085) 5.783 5.367 ( -3.036 -2.513 -4.520) 5.997 5.429 ( 1.662 -1.712 -5.542) 6.033 5.683 ( -1.100 1.898 0.270) 2.210 5.729 ( 1.658 0.953 0.321) 1.940 5.866 ( 1.896 -0.864 7.511) 7.795 6.053 ( -2.445 0.328 -1.574) 2.926 6.150 ( -5.371 1.382 3.619) 6.622 6.465 ( 5.535 -1.709 -2.969) 6.510 6.510 ( 2.701 -0.960 -0.531) 2.916 6.838 ( -5.031 3.398 -1.042) 6.159 7.003 ( -3.440 -1.086 2.803) 4.569 7.119 ( 3.215 -4.688 -1.465) 5.871 7.299 ( -3.207 -9.383 4.986) 11.099 7.543 ( -1.689 -3.251 0.559) 3.706 7.711 ( 0.783 4.040 -1.947) 4.552 8.030 ( 7.592 -1.142 -0.473) 7.692 8.803 ( -5.835 -3.868 4.647) 8.403 9.400 ( -1.616 -1.560 0.202) 2.255 9.408 ( 2.991 2.990 -3.463) 5.466 9.509 ( 3.867 -2.011 2.015) 4.802 9.584 ( 4.710 -4.857 2.341) 7.159 9.875 ( -9.459 0.189 0.814) 9.496 10.021 ( 0.174 -0.750 0.419) 0.877 10.116 ( -0.095 11.032 1.851) 11.187 10.554 ( 2.095 -3.740 -1.962) 4.715 10.908 ( 1.602 3.586 -0.546) 3.965 11.161 ( -2.672 3.899 -3.075) 5.639 11.224 ( 2.291 8.589 -0.303) 8.894 11.417 ( -1.146 6.503 -2.423) 7.034 11.630 ( -3.113 -1.594 0.280) 3.509 11.834 ( 4.396 -6.157 -1.100) 7.645 11.985 ( -1.139 -4.636 2.838) 5.554 12.020 ( -0.480 7.784 -2.436) 8.170 12.186 ( 1.017 6.701 0.334) 6.786 12.387 ( -7.151 4.608 4.457) 9.604 12.561 ( 8.286 -6.389 -5.132) 11.654 12.702 ( -0.182 -1.141 -4.698) 4.838 12.769 ( -1.485 -3.707 -3.293) 5.176 13.146 ( 9.437 -11.876 4.522) 15.828 13.250 ( -3.965 -2.412 1.148) 4.781 14.903 ( -4.460 3.149 1.859) 5.768 15.123 ( -0.617 4.422 2.189) 4.972 15.324 ( 3.547 -4.162 0.538) 5.494 15.426 ( -2.068 -5.405 0.407) 5.801 15.638 ( -0.473 0.892 -0.201) 1.029 15.802 ( 5.209 3.217 -5.136) 7.991 15.832 ( 3.844 3.999 1.089) 5.653 15.904 ( 2.469 -1.361 -0.829) 2.939 16.175 ( -0.575 -4.272 2.207) 4.843 16.378 ( -3.484 -0.691 -2.248) 4.203 16.688 ( -4.800 -4.114 4.400) 7.702 17.030 ( -8.374 -6.161 0.607) 10.414 17.322 ( 5.866 8.699 4.351) 11.359 17.999 ( -1.879 3.364 -1.024) 3.987 18.503 ( -0.648 -5.724 -1.858) 6.053 18.818 ( 1.634 0.707 -2.975) 3.467 25.908 ( -2.095 1.430 1.485) 2.939 26.034 ( 0.047 1.326 0.142) 1.335 26.065 ( -0.298 -0.134 0.773) 0.839 26.109 ( -0.827 3.909 0.288) 4.006 26.237 ( 0.910 -1.225 -0.245) 1.545 26.688 ( 2.290 -1.099 -8.844) 9.202 26.895 ( 2.246 -0.983 5.718) 6.222 26.926 ( 0.090 -2.141 5.415) 5.823 27.437 ( -1.906 4.570 -8.850) 10.142 27.776 ( 4.523 -5.035 9.943) 12.028 28.334 ( -0.724 -0.976 -0.639) 1.373 28.700 ( -2.747 -3.536 -5.168) 6.838 29.094 ( 1.137 -0.913 -2.482) 2.879 29.330 ( -0.968 -6.671 1.716) 6.956 29.458 ( -2.899 8.144 -0.499) 8.659 29.792 ( 1.121 6.891 0.984) 7.051 ======================= Grid point 101 (41/140) ======================= q-point: (-0.22 0.11 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.293 ( -14.520 14.644 13.423) 24.606 1.582 ( 0.458 22.581 9.378) 24.455 2.099 ( -1.720 20.447 3.970) 20.900 2.269 ( 3.543 13.796 -0.254) 14.246 2.412 ( -2.376 1.289 -7.480) 7.954 2.497 ( 3.618 -0.845 3.397) 5.034 2.707 ( 4.425 6.527 -6.030) 9.927 2.897 ( 2.812 3.646 -4.577) 6.492 2.945 ( -0.936 1.495 1.915) 2.603 3.005 ( 1.055 -0.316 2.645) 2.865 3.133 ( -0.060 8.189 -0.818) 8.230 3.299 ( -2.212 2.419 2.164) 3.928 3.406 ( -2.537 8.938 3.484) 9.922 3.452 ( -2.979 -1.801 0.578) 3.528 3.625 ( 1.272 -3.253 0.157) 3.497 3.859 ( 0.428 1.591 0.493) 1.720 4.028 ( -0.359 -1.908 -1.264) 2.317 4.205 ( -7.803 1.424 -0.886) 7.981 4.375 ( 3.545 0.768 3.957) 5.368 4.482 ( -8.521 -2.965 0.496) 9.036 4.504 ( 8.143 -2.301 8.315) 11.863 4.760 ( 2.805 6.087 -3.982) 7.796 4.849 ( 5.878 -1.027 -11.112) 12.613 5.111 ( 0.830 -2.623 3.566) 4.504 5.336 ( -1.345 0.871 -3.835) 4.157 5.429 ( 1.531 -0.241 -8.488) 8.628 5.610 ( -2.478 7.020 2.697) 7.918 5.738 ( 0.772 -3.547 -1.329) 3.866 5.916 ( 1.281 0.277 2.929) 3.209 6.045 ( -0.780 -2.574 -1.450) 3.055 6.161 ( -2.507 -4.492 4.402) 6.770 6.490 ( 1.291 1.373 -4.338) 4.730 6.559 ( 5.177 -1.938 2.179) 5.942 6.732 ( -2.275 3.705 -1.514) 4.604 6.957 ( -5.783 3.923 4.354) 8.234 7.246 ( 1.981 -6.947 -3.960) 8.238 7.436 ( -3.250 -5.996 2.662) 7.321 7.614 ( -3.328 -6.524 -3.253) 8.014 7.703 ( 5.911 -2.441 3.424) 7.254 8.053 ( 1.174 0.423 -6.600) 6.717 8.871 ( -1.226 -2.017 5.827) 6.286 9.273 ( 1.350 9.201 3.924) 10.094 9.434 ( 2.088 -1.491 -4.355) 5.054 9.565 ( 0.605 2.400 -3.969) 4.678 9.708 ( -0.089 -4.056 4.532) 6.082 9.792 ( -4.104 7.689 -5.675) 10.400 9.922 ( 0.425 -1.807 6.097) 6.373 10.064 ( 1.697 4.623 10.711) 11.789 10.604 ( 0.687 -0.433 -2.744) 2.862 10.868 ( 3.015 3.516 1.843) 4.985 11.067 ( -3.189 1.665 -3.988) 5.371 11.107 ( -2.546 3.921 2.829) 5.465 11.350 ( 6.093 2.255 -3.567) 7.411 11.604 ( -2.453 1.374 -1.739) 3.306 11.838 ( -1.979 9.199 -1.891) 9.597 11.928 ( 2.762 -0.758 -4.591) 5.412 12.076 ( 3.081 -2.092 1.943) 4.200 12.116 ( -2.239 -0.579 2.839) 3.662 12.257 ( -8.174 3.937 3.984) 9.909 12.650 ( 0.750 -3.001 -6.531) 7.227 12.707 ( 4.391 -2.458 -9.927) 11.130 12.865 ( 2.926 -5.616 0.391) 6.345 13.312 ( -1.714 -5.443 2.710) 6.317 13.509 ( 10.772 -16.775 7.830) 21.419 14.845 ( -5.651 0.101 4.775) 7.399 15.063 ( -1.125 1.657 1.384) 2.435 15.425 ( 3.356 -2.876 -1.001) 4.532 15.468 ( -5.718 -2.230 -1.839) 6.407 15.598 ( 2.664 4.731 3.275) 6.341 15.768 ( 2.180 1.204 -1.496) 2.905 15.831 ( 5.724 0.785 -2.256) 6.203 15.946 ( 2.899 -2.128 -2.551) 4.409 16.259 ( -2.981 -4.670 5.536) 7.832 16.339 ( 0.404 1.661 -4.242) 4.573 16.733 ( 0.248 -1.457 1.162) 1.880 17.060 ( -13.255 -6.183 1.251) 14.680 17.246 ( 0.732 5.555 5.184) 7.634 17.926 ( -3.100 2.716 -0.042) 4.122 18.586 ( -0.208 -5.745 -5.464) 7.931 18.802 ( 2.088 0.867 -3.423) 4.102 25.875 ( -1.826 1.423 1.675) 2.858 25.977 ( -0.455 3.532 -0.018) 3.561 26.060 ( -0.799 1.381 1.621) 2.275 26.094 ( 0.980 -0.285 2.768) 2.950 26.246 ( 0.420 0.677 -0.465) 0.922 26.674 ( 1.874 -0.384 -8.760) 8.966 26.925 ( -0.363 -0.832 -1.194) 1.500 27.028 ( 2.536 -2.726 13.123) 13.641 27.299 ( -2.492 4.255 -9.708) 10.889 27.953 ( -1.790 -9.333 3.089) 9.993 28.355 ( 1.835 -0.820 1.286) 2.386 28.759 ( 8.883 -2.763 2.736) 9.697 29.092 ( 2.605 1.249 -2.885) 4.083 29.178 ( 0.966 13.873 -1.416) 13.978 29.505 ( -6.746 -7.675 -0.927) 10.261 29.679 ( -5.251 4.571 -0.461) 6.978 ======================= Grid point 102 (42/140) ======================= q-point: (-0.11 0.11 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.992 ( -13.989 16.350 18.984) 28.695 1.270 ( 4.192 23.532 16.942) 29.298 1.708 ( 6.766 29.806 14.585) 33.866 2.041 ( 3.736 16.632 5.103) 17.793 2.348 ( -3.297 -1.221 -8.216) 8.936 2.523 ( -4.738 6.889 0.027) 8.361 2.571 ( 7.917 7.173 -1.775) 10.830 2.779 ( 4.984 9.395 -5.067) 11.780 2.848 ( 0.149 13.649 2.041) 13.801 2.914 ( -3.141 5.033 3.211) 6.746 3.077 ( -6.205 14.722 4.153) 16.507 3.128 ( 3.222 -6.461 -1.528) 7.380 3.380 ( -0.367 -1.711 -1.715) 2.450 3.471 ( -0.283 -2.384 -3.729) 4.435 3.681 ( 0.255 -0.234 4.991) 5.003 3.909 ( 0.810 -3.081 -1.257) 3.425 4.034 ( -2.528 -0.759 -4.589) 5.294 4.108 ( -8.205 -2.677 -0.715) 8.660 4.396 ( 2.350 0.285 2.446) 3.403 4.507 ( 0.054 -2.157 3.694) 4.278 4.654 ( 2.623 -2.933 5.051) 6.403 4.685 ( -1.123 2.469 0.842) 2.841 4.835 ( 5.755 1.725 -10.610) 12.193 5.141 ( -3.594 -0.388 2.749) 4.541 5.293 ( 3.198 3.755 0.219) 4.937 5.377 ( -1.716 2.179 -7.421) 7.922 5.487 ( 0.788 2.794 -4.915) 5.709 5.822 ( -0.257 -2.904 -4.490) 5.353 5.932 ( 1.742 -3.196 1.420) 3.908 6.129 ( 1.055 -7.276 1.257) 7.459 6.289 ( -0.070 -8.205 4.565) 9.389 6.445 ( -1.285 0.399 -0.093) 1.349 6.637 ( 11.386 3.917 1.957) 12.199 6.686 ( -2.834 -2.494 0.594) 3.822 6.841 ( -7.161 5.242 2.572) 9.240 7.310 ( 3.850 -1.157 -6.151) 7.348 7.467 ( -3.489 -0.794 0.032) 3.579 7.687 ( -5.461 -9.199 -3.405) 11.227 7.879 ( 5.636 -6.947 4.718) 10.113 7.974 ( -4.889 2.524 -8.835) 10.408 8.821 ( 0.554 9.515 2.865) 9.952 9.187 ( 1.958 6.141 0.290) 6.452 9.366 ( -4.732 9.161 -9.697) 14.154 9.497 ( 1.746 -2.974 1.140) 3.632 9.582 ( -5.856 6.120 -2.410) 8.807 9.800 ( 1.843 3.086 2.265) 4.248 9.956 ( -2.474 -2.415 15.861) 16.234 10.179 ( -0.334 -7.799 8.054) 11.216 10.555 ( -0.670 3.347 -1.084) 3.582 10.857 ( 3.487 2.258 3.263) 5.282 10.998 ( 2.504 3.263 -6.964) 8.087 11.122 ( -1.804 -3.742 3.531) 5.452 11.347 ( 6.747 4.321 -3.962) 8.938 11.570 ( 4.360 1.897 -0.755) 4.815 11.676 ( 1.496 5.440 -1.613) 5.868 11.926 ( 2.268 -0.907 -3.384) 4.174 12.069 ( -5.196 1.954 1.160) 5.671 12.152 ( 0.556 -2.398 0.804) 2.590 12.263 ( 0.597 -3.470 7.353) 8.152 12.638 ( -4.122 -2.131 -8.737) 9.893 12.731 ( 2.687 -1.998 -7.552) 8.261 12.983 ( 6.474 -3.426 0.626) 7.351 13.378 ( -3.152 -1.607 2.178) 4.154 13.926 ( 5.720 -18.125 8.423) 20.789 14.874 ( -8.599 -5.797 8.563) 13.449 15.073 ( -1.978 -4.355 -0.247) 4.790 15.370 ( -7.163 4.133 -3.836) 9.116 15.428 ( 3.900 5.610 -1.775) 7.060 15.613 ( 3.618 -1.187 6.699) 7.705 15.778 ( -0.870 -1.396 -0.416) 1.697 15.870 ( 6.775 -1.766 -4.097) 8.112 15.995 ( 2.681 -2.583 -3.233) 4.931 16.247 ( -9.242 1.417 2.085) 9.579 16.376 ( 7.369 -1.854 1.643) 7.774 16.763 ( 8.178 1.090 -1.860) 8.458 17.017 ( -13.665 -0.808 -0.084) 13.689 17.211 ( -8.526 -1.201 6.670) 10.892 17.862 ( -0.314 3.114 0.861) 3.246 18.608 ( -0.294 -0.937 -11.102) 11.145 18.787 ( 2.481 1.170 -3.959) 4.817 25.850 ( -1.092 1.074 1.606) 2.219 25.921 ( 0.551 3.163 0.568) 3.260 26.061 ( -1.843 -0.665 4.114) 4.556 26.113 ( 0.326 0.472 3.550) 3.596 26.222 ( 0.602 1.956 0.537) 2.116 26.644 ( 1.909 0.716 -8.289) 8.536 26.914 ( -1.809 -0.228 -3.285) 3.757 27.100 ( -1.067 5.160 -4.064) 6.654 27.231 ( 0.791 -4.671 8.880) 10.064 28.038 ( -15.261 -8.204 -4.944) 18.018 28.391 ( -1.025 -1.550 2.011) 2.738 28.830 ( -1.810 7.096 -2.173) 7.638 29.068 ( 2.610 4.405 -0.394) 5.136 29.119 ( 12.344 2.612 5.961) 13.955 29.420 ( 11.739 1.130 -4.644) 12.675 29.679 ( -4.293 -5.854 1.980) 7.525 ======================= Grid point 105 (43/140) ======================= q-point: ( 0.22 0.22 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.284 ( 21.431 0.000 6.898) 22.514 1.450 ( 13.137 0.000 18.565) 22.743 1.662 ( 0.877 0.000 -2.089) 2.265 1.931 ( -6.319 -0.000 -5.784) 8.566 2.135 ( -11.188 -0.000 8.560) 14.087 2.363 ( -8.305 -0.000 -6.949) 10.828 2.421 ( 11.113 0.000 11.896) 16.280 2.583 ( 8.993 0.000 9.463) 13.054 2.624 ( -7.320 -0.000 6.031) 9.484 2.915 ( 12.047 0.000 -5.367) 13.188 2.990 ( 1.032 0.000 -10.724) 10.774 3.151 ( 7.480 0.000 18.316) 19.784 3.297 ( -5.096 -0.000 -5.816) 7.732 3.354 ( 1.293 0.000 -6.810) 6.932 3.845 ( -2.951 -0.000 -2.521) 3.882 3.850 ( 2.200 0.000 -2.105) 3.045 3.952 ( 1.988 0.000 0.393) 2.027 4.074 ( -11.376 -0.000 0.489) 11.387 4.269 ( -5.729 -0.000 0.992) 5.814 4.414 ( -6.081 -0.000 -5.114) 7.946 4.583 ( -0.925 -0.000 1.223) 1.534 4.769 ( -4.326 -0.000 5.234) 6.790 4.842 ( 6.501 0.000 6.822) 9.424 5.129 ( 4.722 0.000 -2.415) 5.304 5.360 ( 5.996 0.000 3.370) 6.878 5.390 ( 2.135 0.000 -11.057) 11.261 5.434 ( -5.919 -0.000 -9.542) 11.228 5.676 ( 13.941 0.000 -1.250) 13.997 6.116 ( -2.273 -0.000 3.747) 4.382 6.305 ( -13.138 -0.000 -6.050) 14.464 6.415 ( -0.680 -0.000 1.745) 1.873 6.464 ( -2.032 -0.000 8.550) 8.788 6.713 ( 5.834 0.000 -2.415) 6.314 6.843 ( 3.383 0.000 1.403) 3.662 6.907 ( 2.876 0.000 -0.985) 3.040 7.294 ( -8.479 -0.000 2.884) 8.956 7.408 ( -2.939 -0.000 0.334) 2.958 7.653 ( 10.200 0.000 -2.236) 10.443 7.738 ( -14.745 -0.000 -1.762) 14.850 7.895 ( -3.043 -0.000 -0.377) 3.067 8.770 ( -5.969 -0.000 -7.407) 9.512 8.773 ( -0.797 -0.000 3.208) 3.305 8.989 ( 2.733 0.000 6.005) 6.598 9.054 ( -6.954 -0.000 -4.362) 8.209 9.435 ( -13.563 -0.000 -0.869) 13.591 9.758 ( 4.124 0.000 -1.787) 4.495 10.265 ( -0.720 -0.000 -1.598) 1.753 10.468 ( -0.031 -0.000 3.252) 3.252 10.524 ( -1.673 -0.000 5.536) 5.783 10.828 ( 2.410 0.000 8.674) 9.003 11.058 ( 6.996 0.000 0.973) 7.063 11.186 ( 5.416 0.000 -5.309) 7.584 11.298 ( -0.159 -0.000 -9.346) 9.348 11.568 ( 3.978 0.000 12.867) 13.467 11.759 ( 3.023 0.000 -6.335) 7.020 11.933 ( -5.278 -0.000 -1.043) 5.380 12.235 ( 1.885 0.000 -4.499) 4.878 12.263 ( 7.593 0.000 8.294) 11.245 12.318 ( -5.035 -0.000 -8.165) 9.593 12.565 ( 6.939 0.000 -3.817) 7.920 12.605 ( -9.728 -0.000 7.653) 12.377 13.022 ( -15.398 -0.000 12.507) 19.837 13.180 ( -2.041 -0.000 -4.888) 5.297 13.893 ( -8.442 -0.000 6.412) 10.601 15.001 ( 0.373 0.000 -0.329) 0.497 15.169 ( -3.645 -0.000 -0.351) 3.662 15.275 ( 3.949 0.000 1.810) 4.344 15.562 ( -12.499 -0.000 3.419) 12.958 15.646 ( 6.283 0.000 -1.079) 6.375 15.808 ( 0.376 0.000 -4.370) 4.387 16.016 ( 1.670 0.000 1.972) 2.584 16.043 ( -0.692 -0.000 -3.722) 3.786 16.083 ( 4.867 0.000 -5.224) 7.140 16.413 ( -3.307 -0.000 -7.143) 7.871 16.511 ( -6.199 -0.000 8.576) 10.582 16.552 ( -5.601 -0.000 0.677) 5.641 17.994 ( 23.691 0.000 -17.163) 29.254 18.062 ( 3.896 0.000 8.198) 9.076 18.423 ( 5.562 0.000 0.956) 5.644 18.781 ( 1.962 0.000 -1.314) 2.362 25.863 ( 0.080 0.000 -0.256) 0.268 25.902 ( 1.800 0.000 0.408) 1.845 26.018 ( -1.051 -0.000 2.549) 2.758 26.097 ( -1.331 -0.000 1.126) 1.743 26.386 ( -0.278 -0.000 6.746) 6.752 26.612 ( -3.951 -0.000 -5.452) 6.733 26.707 ( 4.812 0.000 5.070) 6.990 26.857 ( 0.507 0.000 -3.054) 3.096 27.569 ( -10.108 -0.000 7.502) 12.588 27.869 ( 8.395 0.000 11.688) 14.391 28.223 ( -6.103 -0.000 -0.970) 6.179 28.448 ( -2.914 -0.000 -1.325) 3.201 28.566 ( 1.418 0.000 -0.655) 1.562 29.116 ( -13.694 -0.000 -8.069) 15.895 29.369 ( 4.659 0.000 -3.421) 5.780 31.000 ( 19.932 0.000 -12.437) 23.494 ======================= Grid point 106 (44/140) ======================= q-point: ( 0.33 0.22 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.520 ( 14.964 -8.816 0.461) 17.374 1.678 ( 4.387 -6.726 8.766) 11.888 1.774 ( 8.184 -7.182 1.758) 11.030 1.964 ( -1.647 -10.607 -3.680) 11.347 2.206 ( -7.468 -12.083 9.371) 17.017 2.322 ( -6.344 -5.673 -6.017) 10.423 2.535 ( 3.250 -4.324 3.262) 6.316 2.647 ( -5.268 -4.729 5.923) 9.230 2.681 ( -0.789 -1.968 5.569) 5.959 2.957 ( 3.320 -3.608 -9.650) 10.824 3.034 ( 6.483 -1.364 -1.372) 6.766 3.210 ( -4.286 1.902 -6.098) 7.692 3.292 ( 2.593 -1.972 4.143) 5.271 3.472 ( 12.425 -8.554 10.698) 18.494 3.672 ( -2.417 7.621 -5.456) 9.680 3.853 ( -4.214 7.049 1.576) 8.362 4.011 ( -4.329 -0.543 -1.821) 4.727 4.017 ( 2.484 -1.752 7.465) 8.060 4.136 ( -3.321 -1.614 -3.990) 5.437 4.493 ( -6.629 -9.858 -4.340) 12.647 4.574 ( 0.117 0.981 0.954) 1.374 4.783 ( -3.729 -1.861 3.877) 5.692 4.913 ( 5.380 -0.295 -1.499) 5.592 5.153 ( 6.702 1.726 4.231) 8.112 5.265 ( -2.097 5.545 -3.675) 6.975 5.388 ( 3.176 1.981 -2.471) 4.485 5.429 ( -2.915 -5.211 -8.869) 10.692 5.769 ( 10.783 0.699 -1.192) 10.871 6.076 ( -3.724 5.269 -0.098) 6.453 6.137 ( -5.208 3.727 -1.483) 6.573 6.385 ( -2.140 2.710 -0.047) 3.453 6.502 ( -0.173 0.962 8.969) 9.022 6.685 ( 4.664 5.694 -2.743) 7.855 6.876 ( 0.539 0.590 -3.200) 3.298 6.934 ( 2.197 -3.013 5.149) 6.358 7.252 ( -3.910 2.573 -2.464) 5.290 7.377 ( -5.788 1.443 1.242) 6.093 7.464 ( -10.763 6.143 1.952) 12.546 7.828 ( 6.581 -3.182 -0.902) 7.366 7.849 ( -3.365 0.069 -1.027) 3.519 8.769 ( -5.031 -2.536 0.394) 5.648 8.797 ( -6.304 -9.630 -2.885) 11.866 9.059 ( -5.205 -7.522 -2.322) 9.437 9.093 ( 3.438 -4.251 8.491) 10.099 9.360 ( -9.354 -3.263 -2.195) 10.147 9.743 ( 3.400 3.614 -0.109) 4.963 10.288 ( -1.280 -4.270 -1.686) 4.766 10.374 ( -1.063 9.791 2.997) 10.295 10.562 ( 1.457 -1.131 2.195) 2.867 10.991 ( 2.180 -10.227 4.624) 11.434 11.146 ( 4.095 -5.342 -3.558) 7.614 11.176 ( 4.042 3.468 -6.962) 8.766 11.272 ( 2.977 -2.031 -4.752) 5.964 11.689 ( 4.954 -1.942 7.418) 9.130 11.737 ( 5.417 2.839 -2.122) 6.473 11.915 ( -5.247 -3.331 0.433) 6.230 12.177 ( -1.115 3.955 -4.413) 6.030 12.203 ( -2.269 2.899 -3.883) 5.351 12.405 ( 6.209 -3.369 4.355) 8.299 12.565 ( -2.495 1.045 6.902) 7.413 12.600 ( 2.163 0.793 -0.602) 2.381 12.979 ( -16.796 -2.287 9.424) 19.395 13.085 ( -3.153 4.265 -9.843) 11.182 13.826 ( -6.090 5.036 3.955) 8.837 14.959 ( 0.594 3.501 2.234) 4.196 15.120 ( -3.541 2.839 0.297) 4.548 15.369 ( 0.451 -5.416 -0.984) 5.523 15.491 ( -7.527 0.784 3.348) 8.275 15.571 ( 3.421 7.360 0.919) 8.168 15.818 ( 0.216 -1.912 -2.912) 3.490 15.968 ( -0.764 6.913 3.061) 7.599 16.045 ( 2.145 -0.642 -3.480) 4.138 16.071 ( 9.152 2.369 -9.203) 13.193 16.389 ( -2.474 -1.395 -1.369) 3.153 16.521 ( -6.809 -3.746 3.334) 8.457 16.608 ( -4.226 -7.591 3.244) 9.274 17.933 ( 15.644 12.730 -5.500) 20.905 18.168 ( 5.671 -1.140 4.989) 7.639 18.467 ( 1.964 0.259 -2.243) 2.993 18.798 ( 1.567 -0.942 -1.375) 2.288 25.868 ( 0.634 -0.674 0.113) 0.932 25.930 ( 1.079 -1.355 -0.367) 1.770 26.044 ( -0.365 -2.249 2.262) 3.211 26.101 ( -1.781 -1.034 1.092) 2.331 26.394 ( -0.554 1.910 4.312) 4.748 26.582 ( -2.485 -2.301 -5.382) 6.359 26.770 ( 3.486 -0.581 4.307) 5.572 26.846 ( 1.128 0.644 -1.742) 2.173 27.530 ( -6.022 -0.031 3.180) 6.810 27.952 ( 7.484 4.424 12.295) 15.059 28.258 ( -5.369 -6.381 0.684) 8.367 28.414 ( -3.939 -1.569 -3.413) 5.443 28.631 ( 0.019 -5.933 0.404) 5.947 28.961 ( -13.666 -2.267 -11.275) 17.861 29.424 ( 7.029 -1.024 1.485) 7.257 30.945 ( 15.193 14.755 -8.626) 22.868 ======================= Grid point 107 (45/140) ======================= q-point: ( 0.44 0.22 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.722 ( 1.694 -8.813 -1.127) 9.045 1.914 ( 13.245 -6.342 8.676) 17.056 1.962 ( 2.614 -6.341 2.055) 7.160 2.148 ( 0.849 -12.858 -2.877) 13.203 2.335 ( -5.983 -8.881 -11.935) 16.035 2.490 ( -1.468 -13.665 9.078) 16.471 2.672 ( -3.011 -6.257 3.253) 7.668 2.704 ( -1.230 -6.695 -6.167) 9.185 2.758 ( -4.488 -6.568 9.684) 12.533 3.006 ( 2.439 -2.466 -3.075) 4.635 3.073 ( 1.603 0.029 -1.913) 2.496 3.124 ( -2.131 -0.087 -4.089) 4.612 3.317 ( 0.151 0.856 -6.920) 6.974 3.549 ( -5.348 0.747 1.803) 5.693 3.672 ( -4.432 6.736 6.076) 10.096 3.776 ( 8.065 -5.261 8.073) 12.566 3.915 ( -4.059 1.439 2.111) 4.796 4.211 ( 6.875 -4.878 3.564) 9.152 4.246 ( 6.778 -12.470 -1.516) 14.274 4.545 ( -0.481 -1.281 0.239) 1.389 4.561 ( -6.743 -3.051 -5.750) 9.372 4.780 ( 1.390 1.632 -1.613) 2.683 4.902 ( 2.077 1.969 -5.404) 6.115 5.131 ( -0.820 5.514 -3.364) 6.511 5.243 ( 5.350 1.747 7.876) 9.680 5.354 ( -3.471 -0.721 1.600) 3.889 5.477 ( -2.580 -8.617 -6.962) 11.374 5.791 ( 6.241 3.867 -0.398) 7.353 5.900 ( -5.184 5.527 -3.312) 8.270 6.141 ( 6.473 0.728 1.785) 6.754 6.299 ( -2.377 3.609 -2.502) 4.994 6.484 ( -1.874 4.770 6.273) 8.100 6.608 ( 2.952 5.360 -0.933) 6.190 6.840 ( 0.196 1.286 -2.805) 3.092 7.026 ( -1.532 -2.561 6.091) 6.783 7.137 ( 0.225 3.996 -2.918) 4.953 7.252 ( -6.330 6.356 1.919) 9.173 7.404 ( -9.576 -3.607 1.933) 10.414 7.843 ( 3.353 -0.448 0.629) 3.441 7.912 ( 2.981 -1.670 -0.536) 3.459 8.760 ( -6.754 -1.254 3.195) 7.576 8.940 ( -5.712 -12.289 -0.816) 13.576 9.180 ( -2.447 -10.813 -1.810) 11.233 9.252 ( -0.713 -7.570 6.330) 9.893 9.396 ( -2.999 -8.706 -1.325) 9.303 9.705 ( 2.060 3.519 0.418) 4.099 10.193 ( -1.752 10.953 0.944) 11.132 10.354 ( 0.286 -4.610 -1.267) 4.790 10.562 ( 0.500 2.861 -1.126) 3.115 11.084 ( 1.962 4.059 -8.157) 9.320 11.212 ( 4.617 -7.206 2.961) 9.056 11.250 ( 2.728 -8.733 -7.329) 11.722 11.375 ( 6.671 -5.202 2.885) 8.938 11.644 ( 2.373 5.845 -4.291) 7.630 11.833 ( 6.107 -2.073 3.365) 7.274 11.941 ( -3.954 -1.448 0.978) 4.323 12.050 ( -3.606 3.807 -4.152) 6.688 12.186 ( 1.636 -1.271 0.759) 2.206 12.501 ( 1.351 -1.616 2.656) 3.390 12.572 ( -1.621 -0.640 2.729) 3.238 12.608 ( 7.992 3.029 4.214) 9.529 12.904 ( -14.102 1.229 1.852) 14.276 12.924 ( -5.407 3.032 -7.975) 10.101 13.649 ( -6.967 11.256 1.303) 13.302 14.950 ( 0.735 -0.174 2.798) 2.898 15.042 ( -3.621 2.254 1.198) 4.430 15.365 ( 3.078 6.843 -0.348) 7.511 15.450 ( -5.496 -4.695 1.383) 7.360 15.579 ( -1.629 -1.051 0.036) 1.939 15.842 ( 1.768 -1.406 -1.647) 2.796 15.876 ( 0.768 3.657 3.702) 5.260 16.030 ( 6.829 3.707 -7.085) 10.516 16.063 ( 5.194 1.014 -4.114) 6.703 16.381 ( -2.488 -0.014 0.641) 2.569 16.543 ( -8.478 -3.342 4.288) 10.071 16.733 ( -3.311 -8.324 2.475) 9.294 17.811 ( 14.126 13.443 -0.241) 19.502 18.222 ( 2.970 2.252 5.215) 6.410 18.421 ( -1.854 2.215 -3.676) 4.676 18.816 ( 1.278 -0.753 -1.851) 2.372 25.898 ( 1.024 -1.726 0.891) 2.196 25.953 ( 0.129 -1.157 -0.611) 1.315 26.097 ( -0.875 -2.680 0.155) 2.823 26.111 ( -1.148 -1.381 1.791) 2.536 26.354 ( -1.083 3.630 0.859) 3.884 26.592 ( -0.675 -3.341 -5.323) 6.321 26.811 ( 0.522 -0.926 0.782) 1.320 26.854 ( 3.156 0.847 4.178) 5.304 27.512 ( -2.946 -1.595 -1.897) 3.850 27.939 ( 3.916 10.218 11.350) 15.766 28.273 ( -4.630 -1.923 -2.377) 5.549 28.452 ( -5.053 -8.209 -3.757) 10.346 28.760 ( -1.794 -9.976 0.898) 10.175 28.914 ( -5.397 -5.745 -5.871) 9.829 29.512 ( 4.735 -2.041 3.551) 6.261 30.700 ( 11.485 21.552 -5.543) 25.043 ======================= Grid point 108 (46/140) ======================= q-point: ( 0.56 0.22 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.827 ( -0.982 1.303 5.779) 6.005 2.064 ( -1.327 -8.140 -1.691) 8.419 2.106 ( 6.675 -2.800 3.381) 7.989 2.321 ( -3.371 -6.188 -0.208) 7.050 2.416 ( 2.608 -10.605 -8.475) 13.823 2.678 ( 1.135 -6.394 2.234) 6.868 2.721 ( -2.213 -4.118 -10.493) 11.487 2.734 ( -3.906 -0.897 -0.588) 4.051 2.946 ( -2.329 -9.639 9.070) 13.439 2.971 ( 0.665 4.991 -2.765) 5.744 3.060 ( 3.441 -0.408 3.395) 4.851 3.201 ( -5.179 -2.524 -2.012) 6.103 3.261 ( 1.753 -6.024 -3.759) 7.314 3.518 ( -6.515 1.415 4.559) 8.076 3.648 ( 2.248 -3.573 0.850) 4.306 3.825 ( -0.215 2.704 2.926) 3.990 3.982 ( -2.802 -6.050 6.105) 9.041 4.363 ( 7.368 -4.589 5.216) 10.127 4.452 ( -2.339 6.812 -5.659) 9.160 4.489 ( 1.963 -7.507 -1.997) 8.012 4.553 ( -0.851 1.957 1.264) 2.481 4.757 ( 2.040 -0.388 -7.551) 7.832 4.888 ( 7.453 0.451 -2.437) 7.855 5.032 ( -0.101 1.946 -4.421) 4.831 5.223 ( -6.077 -0.396 -0.325) 6.098 5.389 ( 0.284 -1.751 1.912) 2.608 5.613 ( -1.710 -9.233 0.013) 9.390 5.753 ( 2.782 3.200 0.461) 4.265 5.835 ( 1.989 1.015 2.987) 3.730 6.123 ( -0.598 4.157 -1.938) 4.625 6.251 ( 0.283 1.993 -0.918) 2.212 6.431 ( 0.722 1.327 3.012) 3.370 6.540 ( 1.482 4.040 -0.095) 4.305 6.825 ( 0.467 -1.206 -2.891) 3.167 7.018 ( -5.089 2.180 1.949) 5.869 7.120 ( 2.823 2.319 0.448) 3.680 7.141 ( -4.272 1.182 6.539) 7.900 7.423 ( -5.808 -4.840 0.482) 7.575 7.851 ( -1.485 1.679 -1.228) 2.556 7.968 ( 6.557 -1.505 -0.496) 6.745 8.743 ( -5.975 -0.586 5.188) 7.935 9.104 ( -2.990 -10.866 2.379) 11.518 9.337 ( -1.983 -8.915 0.276) 9.137 9.363 ( 0.234 -5.304 -0.055) 5.309 9.586 ( -1.079 -10.788 0.335) 10.847 9.679 ( 3.219 -0.789 1.116) 3.497 10.007 ( -3.493 8.306 1.202) 9.090 10.429 ( 2.104 -3.031 -0.783) 3.771 10.466 ( -1.739 5.782 -3.193) 6.831 11.002 ( 1.774 2.509 -8.076) 8.641 11.275 ( 3.215 -0.806 -5.231) 6.193 11.437 ( 2.469 -6.147 4.385) 7.944 11.518 ( 6.521 4.595 -3.614) 8.758 11.560 ( 3.783 -3.202 4.040) 6.394 11.821 ( -0.961 6.940 -0.343) 7.015 11.908 ( -5.386 0.104 2.706) 6.029 12.026 ( 3.435 -4.270 -7.980) 9.681 12.257 ( 3.245 -2.540 2.138) 4.642 12.500 ( -6.959 0.271 2.488) 7.396 12.554 ( 4.267 5.149 -2.097) 7.008 12.658 ( 5.207 0.583 2.709) 5.898 12.802 ( -11.717 0.481 1.534) 11.827 12.855 ( 3.224 -3.527 -4.798) 6.772 13.382 ( -8.636 11.636 0.015) 14.491 14.970 ( -0.531 -0.270 -1.054) 1.210 15.037 ( -1.572 -3.081 3.877) 5.195 15.306 ( 0.584 1.417 0.883) 1.769 15.480 ( -3.135 3.087 -4.625) 6.384 15.533 ( -0.852 -1.545 3.663) 4.065 15.881 ( 1.513 -1.235 0.245) 1.968 15.889 ( 1.372 -1.318 -0.476) 1.961 15.974 ( 7.074 5.349 -4.503) 9.946 16.081 ( 3.827 -0.327 -0.082) 3.842 16.357 ( -3.176 0.355 0.064) 3.196 16.551 ( -8.322 -2.915 6.079) 10.710 16.846 ( -2.504 -6.438 1.235) 7.017 17.692 ( 10.011 12.902 2.532) 16.526 18.173 ( 0.389 6.175 0.392) 6.200 18.383 ( -1.772 -1.188 -0.075) 2.135 18.825 ( 1.216 -0.309 -2.399) 2.708 25.933 ( -0.504 -0.584 1.099) 1.343 25.978 ( 1.257 -1.958 0.334) 2.351 26.095 ( -2.400 -0.007 -0.136) 2.404 26.161 ( 0.375 -2.830 0.184) 2.860 26.270 ( -1.155 4.729 -1.458) 5.082 26.623 ( 1.021 -3.016 -5.842) 6.654 26.842 ( 0.021 -2.040 1.645) 2.620 26.890 ( 2.096 0.576 7.059) 7.386 27.503 ( -1.584 -1.762 -9.659) 9.945 27.816 ( -0.970 8.939 8.973) 12.703 28.281 ( -0.889 -2.372 -0.439) 2.571 28.534 ( -2.400 -6.098 -0.660) 6.586 28.937 ( -2.325 -11.222 0.115) 11.461 28.982 ( -0.163 -6.743 -0.844) 6.798 29.585 ( 1.351 -1.228 3.155) 3.645 30.365 ( 6.994 23.013 -4.557) 24.480 ======================= Grid point 109 (47/140) ======================= q-point: (-0.33 0.22 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.716 ( -6.306 9.693 6.210) 13.126 2.119 ( 2.119 7.248 3.256) 8.224 2.215 ( 0.572 -8.373 1.960) 8.618 2.366 ( -5.693 -4.636 -4.696) 8.715 2.545 ( 6.817 -0.707 0.538) 6.874 2.598 ( -2.214 5.142 -10.290) 11.714 2.757 ( 0.513 -2.899 -3.519) 4.588 2.817 ( 1.903 -6.145 0.931) 6.500 2.921 ( -0.811 -1.736 -2.488) 3.140 3.069 ( 5.199 4.394 3.285) 7.559 3.098 ( -1.531 -3.035 1.309) 3.643 3.201 ( -3.468 -6.050 2.580) 7.435 3.409 ( -0.437 -7.262 1.064) 7.352 3.483 ( -2.497 0.706 3.972) 4.744 3.757 ( 2.894 0.512 1.647) 3.369 3.778 ( 0.225 -1.728 -0.411) 1.791 4.082 ( -6.125 -6.459 5.525) 10.476 4.247 ( -3.318 9.195 -5.482) 11.208 4.426 ( -4.398 8.449 0.568) 9.542 4.517 ( 6.444 -2.188 5.258) 8.600 4.536 ( -0.854 1.009 2.213) 2.578 4.773 ( 4.146 -2.613 -8.933) 10.189 4.903 ( 3.026 1.345 -10.453) 10.965 5.040 ( 4.420 0.205 4.829) 6.550 5.226 ( -3.910 -7.385 -7.847) 11.463 5.421 ( 1.766 -0.326 0.991) 2.051 5.695 ( -1.408 -2.563 -2.353) 3.753 5.749 ( 2.013 1.558 3.633) 4.436 5.894 ( 1.902 -1.525 7.795) 8.167 6.047 ( -1.598 2.110 -1.437) 3.012 6.169 ( -4.962 3.953 1.049) 6.430 6.467 ( 3.235 -1.219 -1.782) 3.889 6.512 ( 1.550 0.407 0.648) 1.728 6.855 ( 1.571 -0.543 -1.467) 2.217 6.955 ( -1.942 -0.392 -0.316) 2.006 7.101 ( -2.638 0.422 3.403) 4.327 7.184 ( -1.031 -3.910 5.448) 6.785 7.467 ( -2.803 -3.888 -0.187) 4.797 7.774 ( -0.404 4.165 -2.973) 5.133 8.026 ( 1.443 -1.843 -3.865) 4.518 8.758 ( -2.321 -1.756 8.344) 8.837 9.280 ( -0.469 -8.986 3.790) 9.764 9.425 ( 0.759 -3.609 -1.004) 3.822 9.462 ( -0.031 -4.626 -0.234) 4.632 9.629 ( 3.814 0.306 0.437) 3.851 9.786 ( -4.187 -0.632 -3.025) 5.204 9.959 ( -0.741 -6.348 7.630) 9.953 10.299 ( -0.672 9.812 -1.669) 9.976 10.499 ( 1.226 -3.394 -1.554) 3.929 10.949 ( 2.038 1.216 -6.169) 6.610 11.240 ( 2.572 5.244 -2.613) 6.398 11.393 ( 0.338 8.858 -0.399) 8.873 11.496 ( 0.711 2.694 -1.927) 3.388 11.630 ( 0.661 2.725 3.646) 4.599 11.788 ( 3.097 -2.683 2.343) 4.720 11.902 ( -2.745 -3.859 3.480) 5.877 12.070 ( 1.686 -0.727 -8.655) 8.848 12.285 ( 1.183 2.904 -0.313) 3.151 12.400 ( -8.999 3.109 -3.397) 10.109 12.518 ( 2.917 -0.114 -0.397) 2.946 12.695 ( -0.323 -1.918 -1.648) 2.550 12.715 ( 1.643 3.410 -1.914) 4.241 13.033 ( 7.540 -10.889 2.571) 13.492 13.198 ( -7.657 1.522 2.481) 8.191 14.943 ( -1.124 2.598 1.177) 3.066 15.111 ( -2.069 -4.431 -0.008) 4.890 15.325 ( -1.960 -2.632 -1.817) 3.751 15.356 ( 0.895 4.454 0.385) 4.559 15.603 ( -0.030 -3.629 1.701) 4.008 15.868 ( 0.937 2.218 -5.077) 5.619 15.902 ( 1.436 1.082 0.187) 1.808 15.955 ( 6.982 2.217 -0.216) 7.329 16.124 ( -0.587 -1.795 3.590) 4.056 16.333 ( -0.711 -0.551 -2.134) 2.316 16.585 ( -7.426 -4.333 7.727) 11.560 16.921 ( -1.562 -4.042 -0.269) 4.341 17.548 ( 2.917 11.733 3.339) 12.543 18.064 ( 0.207 5.592 -2.560) 6.154 18.419 ( -0.298 -3.248 1.230) 3.486 18.823 ( 1.414 0.171 -2.843) 3.180 25.923 ( -1.242 1.075 1.128) 1.993 26.035 ( 1.371 -2.384 1.587) 3.176 26.067 ( -1.574 1.255 -0.570) 2.093 26.170 ( -1.116 3.493 -1.781) 4.076 26.213 ( 0.553 -1.530 0.118) 1.631 26.645 ( 1.921 -1.645 -6.277) 6.767 26.879 ( -0.763 -1.848 -0.222) 2.012 26.952 ( 1.342 -1.312 11.156) 11.313 27.421 ( -2.278 2.136 -14.413) 14.747 27.768 ( -2.803 -0.217 6.286) 6.886 28.324 ( 1.707 -1.306 2.506) 3.302 28.628 ( 3.285 -4.659 3.206) 6.540 29.048 ( 1.207 -4.427 -1.614) 4.864 29.148 ( -1.670 -10.993 1.944) 11.288 29.579 ( -1.364 4.071 0.755) 4.359 30.014 ( 1.706 18.644 -4.465) 19.247 ======================= Grid point 110 (48/140) ======================= q-point: (-0.22 0.22 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.508 ( -6.533 12.828 9.424) 17.207 1.961 ( 2.009 15.276 7.768) 17.254 2.301 ( -3.517 5.121 -0.066) 6.213 2.331 ( -1.683 -2.493 -4.553) 5.457 2.477 ( 2.235 3.729 -3.365) 5.498 2.554 ( 4.831 4.613 2.381) 7.092 2.778 ( 2.617 0.325 -4.124) 4.895 2.894 ( 0.011 -2.107 -2.067) 2.952 2.958 ( -1.953 -2.500 2.163) 3.839 3.041 ( 6.608 2.893 -2.740) 7.716 3.132 ( 0.638 -1.316 1.583) 2.155 3.318 ( -2.640 -6.463 3.531) 7.823 3.450 ( -1.670 5.003 3.933) 6.579 3.491 ( 0.023 -1.548 2.178) 2.673 3.668 ( 0.071 6.485 1.482) 6.653 3.862 ( 0.549 -2.804 -3.455) 4.483 4.029 ( -4.275 4.847 -2.158) 6.814 4.221 ( -6.443 -1.102 -3.784) 7.553 4.245 ( -3.590 0.508 7.911) 8.703 4.493 ( -2.156 2.029 2.848) 4.108 4.630 ( 8.744 1.395 8.218) 12.081 4.787 ( 1.342 -1.222 -11.148) 11.295 4.826 ( 3.241 1.730 -9.097) 9.811 5.104 ( 0.247 -1.553 5.428) 5.651 5.278 ( 1.745 -3.824 -9.750) 10.617 5.436 ( 3.127 1.067 -1.839) 3.782 5.696 ( -2.027 -0.890 -3.097) 3.807 5.719 ( 0.304 5.032 4.159) 6.535 5.948 ( -1.802 0.945 6.995) 7.285 5.999 ( -1.590 -0.250 -3.249) 3.626 6.121 ( -1.130 -0.868 4.112) 4.352 6.479 ( -0.413 -0.384 -3.825) 3.867 6.549 ( 1.539 -2.401 1.038) 3.035 6.827 ( 5.280 4.595 0.827) 7.048 6.977 ( -4.072 0.740 2.965) 5.091 7.116 ( -0.532 -5.580 -2.718) 6.229 7.302 ( -2.084 -7.551 3.334) 8.514 7.503 ( -2.471 -3.077 -1.380) 4.180 7.717 ( 1.467 0.205 -1.154) 1.878 8.004 ( -3.641 -0.265 -7.438) 8.285 8.856 ( 1.482 -4.121 10.115) 11.022 9.404 ( 1.633 -2.908 0.398) 3.359 9.433 ( 1.390 4.248 0.745) 4.531 9.519 ( -2.603 -3.378 -0.746) 4.329 9.699 ( -8.929 0.995 1.424) 9.097 9.702 ( 4.841 -4.098 -1.746) 6.579 10.032 ( -0.547 5.638 1.383) 5.831 10.194 ( 3.047 1.776 7.551) 8.335 10.549 ( 0.028 -2.878 -2.170) 3.604 10.939 ( 3.726 0.138 -1.406) 3.985 11.138 ( 1.654 6.836 -0.439) 7.047 11.212 ( -3.387 9.777 0.424) 10.355 11.437 ( 6.112 4.171 -1.604) 7.571 11.606 ( -0.330 1.150 0.805) 1.442 11.866 ( -0.572 -4.549 -1.202) 4.740 11.941 ( -1.030 5.087 -6.647) 8.433 12.043 ( 1.541 -2.928 4.118) 5.283 12.197 ( 0.485 6.114 -0.654) 6.168 12.265 ( -7.306 3.063 -0.165) 7.924 12.549 ( -2.009 -3.233 -6.783) 7.778 12.672 ( 3.888 -0.240 -6.953) 7.969 12.773 ( 3.332 -5.386 -1.025) 6.416 13.210 ( -5.432 -5.732 5.289) 9.504 13.344 ( 7.342 -14.822 6.543) 17.787 14.883 ( -1.371 4.162 3.494) 5.605 15.098 ( -2.409 2.775 -0.883) 3.780 15.339 ( -1.283 -4.861 -2.038) 5.425 15.390 ( -0.733 -3.613 -0.916) 3.799 15.651 ( 0.959 -0.186 1.709) 1.969 15.809 ( 0.457 2.790 -2.412) 3.716 15.887 ( 1.050 1.511 0.230) 1.854 15.969 ( 6.565 1.586 -2.861) 7.334 16.157 ( -9.333 -3.550 6.018) 11.658 16.360 ( 8.029 -1.034 -4.176) 9.109 16.653 ( -6.160 -5.508 7.621) 11.241 16.957 ( -0.567 -1.689 -1.690) 2.456 17.381 ( -3.859 9.225 3.454) 10.579 17.976 ( 1.553 3.998 -2.253) 4.845 18.485 ( 0.674 -3.999 -1.482) 4.318 18.815 ( 1.890 0.554 -3.104) 3.676 25.897 ( -1.096 1.548 1.647) 2.512 26.026 ( -0.176 2.298 -0.697) 2.408 26.075 ( -0.549 -0.061 1.647) 1.737 26.119 ( 0.696 1.051 1.997) 2.361 26.239 ( -0.068 -1.150 -0.675) 1.335 26.647 ( 2.152 -0.460 -6.169) 6.550 26.891 ( -1.667 -1.196 -1.754) 2.699 27.060 ( 1.121 -2.897 13.039) 13.404 27.283 ( -2.824 3.129 -13.613) 14.251 27.800 ( -5.524 -4.532 0.479) 7.161 28.365 ( 0.642 -0.444 3.472) 3.558 28.803 ( 12.718 -5.549 7.703) 15.870 29.106 ( 2.724 -1.267 -0.495) 3.045 29.309 ( -3.452 -9.157 -0.183) 9.788 29.420 ( 0.221 12.373 -1.089) 12.423 29.745 ( -4.431 9.516 -5.017) 11.635 ======================= Grid point 111 (49/140) ======================= q-point: (-0.11 0.22 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.288 ( -2.151 15.126 12.993) 20.056 1.738 ( 4.053 18.882 11.277) 22.363 2.150 ( 3.148 12.023 3.533) 12.921 2.240 ( -5.667 4.769 -2.735) 7.896 2.399 ( 4.615 9.720 2.507) 11.049 2.561 ( -1.206 1.325 4.037) 4.417 2.733 ( 6.335 5.488 -4.610) 9.566 2.887 ( 0.360 2.634 -3.049) 4.046 2.958 ( 1.257 2.314 2.717) 3.784 3.046 ( -0.107 0.927 2.187) 2.378 3.134 ( 3.601 4.933 -3.164) 6.878 3.290 ( -3.441 10.194 3.411) 11.287 3.365 ( -5.777 1.805 -1.335) 6.198 3.445 ( 2.444 4.292 1.998) 5.328 3.674 ( 3.684 -3.504 1.532) 5.310 3.877 ( 0.262 -2.880 -1.805) 3.409 3.953 ( -5.431 -0.326 -2.404) 5.948 4.053 ( -6.742 6.121 -2.109) 9.347 4.382 ( -5.040 -9.149 3.541) 11.029 4.462 ( -0.757 2.732 4.230) 5.092 4.676 ( 3.699 2.908 4.184) 6.296 4.774 ( 5.188 -0.664 -1.446) 5.426 4.827 ( 5.438 -1.148 -9.667) 11.150 5.117 ( -5.732 0.472 3.690) 6.833 5.286 ( 2.006 -1.239 -11.214) 11.459 5.420 ( 5.800 2.783 -1.007) 6.511 5.581 ( -2.139 7.444 -1.414) 7.874 5.741 ( 0.453 -2.968 -0.773) 3.100 5.926 ( -1.304 0.038 1.881) 2.288 6.027 ( -0.224 -4.347 -1.952) 4.771 6.200 ( 0.433 -4.899 6.630) 8.255 6.443 ( -1.371 0.810 -3.100) 3.485 6.615 ( -0.214 -3.637 1.345) 3.884 6.808 ( 5.082 4.147 1.991) 6.855 6.891 ( -2.913 5.582 2.090) 6.634 7.220 ( 1.644 -7.269 -6.180) 9.682 7.398 ( -3.856 -5.062 0.385) 6.375 7.516 ( -3.259 -3.108 -2.403) 5.104 7.795 ( -0.936 -6.406 1.437) 6.631 7.927 ( -3.979 0.719 -5.554) 6.870 8.957 ( 2.411 1.299 6.148) 6.730 9.343 ( 0.281 8.142 4.761) 9.436 9.397 ( -2.521 3.777 -6.499) 7.928 9.458 ( -4.261 1.323 -2.873) 5.307 9.631 ( -5.984 4.521 -0.461) 7.514 9.793 ( 1.547 -5.254 -3.563) 6.534 9.971 ( -2.149 0.467 9.677) 9.923 10.218 ( 1.900 3.968 10.401) 11.293 10.562 ( -1.147 -0.449 -2.326) 2.631 10.986 ( 7.523 2.769 3.472) 8.736 11.061 ( 4.106 2.284 -0.677) 4.747 11.081 ( -2.076 2.394 0.826) 3.275 11.432 ( 5.590 2.228 -0.772) 6.067 11.618 ( 5.944 -0.554 -1.621) 6.186 11.767 ( -2.753 7.850 -4.619) 9.515 11.903 ( 0.975 -2.009 -5.183) 5.644 12.083 ( -2.146 1.308 0.214) 2.522 12.143 ( 2.977 0.831 0.557) 3.141 12.246 ( -0.973 -2.726 8.618) 9.091 12.520 ( -4.530 -1.710 -9.893) 11.015 12.681 ( 1.849 -1.418 -6.200) 6.623 12.911 ( 3.751 -7.995 -2.981) 9.321 13.295 ( -6.760 -5.240 6.753) 10.897 13.691 ( 1.399 -16.682 6.521) 17.966 14.839 ( -2.353 1.619 6.522) 7.120 15.038 ( -0.858 1.283 0.233) 1.561 15.333 ( -7.022 0.377 -3.533) 7.869 15.483 ( 5.165 -4.561 -0.814) 6.938 15.635 ( -0.192 2.802 1.911) 3.397 15.763 ( -2.675 1.190 0.356) 2.949 15.888 ( 3.207 -0.252 -1.250) 3.452 15.982 ( 5.753 0.008 -5.466) 7.935 16.151 ( -12.978 -3.203 4.032) 13.963 16.421 ( 6.147 0.044 -0.911) 6.215 16.756 ( -0.872 -5.714 4.525) 7.341 16.955 ( 2.461 1.182 -2.695) 3.836 17.226 ( -7.370 4.618 3.365) 9.325 17.935 ( 4.101 2.706 0.007) 4.913 18.535 ( 1.313 -2.779 -6.313) 7.021 18.805 ( 2.406 0.759 -3.124) 4.016 25.872 ( -0.667 1.524 1.724) 2.396 25.983 ( 1.120 2.803 -0.221) 3.027 26.068 ( -1.358 0.490 3.449) 3.739 26.140 ( 0.407 0.038 3.805) 3.827 26.243 ( -0.050 0.076 -0.207) 0.226 26.637 ( 2.665 0.319 -5.274) 5.918 26.875 ( -2.584 -0.301 -3.138) 4.077 27.110 ( -3.734 2.707 -10.489) 11.458 27.226 ( 1.551 -3.504 12.441) 13.018 27.821 ( -8.375 -4.391 -1.997) 9.665 28.380 ( -1.297 0.051 2.831) 3.115 28.937 ( 1.622 5.451 -1.822) 5.972 29.163 ( 5.466 2.069 4.686) 7.492 29.300 ( 5.396 7.524 2.542) 9.601 29.356 ( -3.789 -6.166 -4.254) 8.395 29.615 ( 5.235 -3.715 -2.733) 6.977 ======================= Grid point 115 (50/140) ======================= q-point: ( 0.33 0.33 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.422 ( 5.284 0.000 -15.465) 16.343 1.666 ( -1.535 -0.000 0.185) 1.546 1.861 ( 2.190 0.000 0.230) 2.202 1.879 ( 19.967 0.000 7.783) 21.430 2.085 ( -11.179 -0.000 15.409) 19.037 2.180 ( -0.409 -0.000 -9.781) 9.790 2.554 ( 3.454 0.000 -3.783) 5.122 2.558 ( -7.764 -0.000 4.053) 8.758 2.679 ( -6.749 -0.000 7.558) 10.132 2.917 ( 2.825 0.000 -1.959) 3.438 3.084 ( 5.164 0.000 -1.945) 5.518 3.185 ( -0.871 -0.000 -0.417) 0.965 3.258 ( 0.141 0.000 -5.952) 5.954 3.610 ( 15.714 0.000 20.028) 25.457 3.766 ( -1.022 -0.000 -5.857) 5.946 3.783 ( -0.039 -0.000 -7.808) 7.809 3.942 ( -7.366 -0.000 2.039) 7.643 4.065 ( 2.206 0.000 4.650) 5.147 4.179 ( -2.088 -0.000 -1.613) 2.639 4.251 ( -8.471 -0.000 -2.498) 8.831 4.599 ( -0.229 -0.000 1.343) 1.362 4.744 ( -5.891 -0.000 6.145) 8.513 4.946 ( 7.624 0.000 -9.108) 11.878 5.226 ( 3.545 0.000 4.907) 6.053 5.263 ( -4.360 -0.000 -6.964) 8.216 5.318 ( 1.122 0.000 -5.585) 5.696 5.458 ( 2.985 0.000 1.186) 3.212 5.849 ( 8.641 0.000 0.562) 8.659 6.065 ( -9.604 -0.000 -3.431) 10.198 6.154 ( 2.554 0.000 3.034) 3.966 6.400 ( -1.217 -0.000 -0.412) 1.285 6.568 ( 1.946 0.000 8.859) 9.070 6.750 ( 1.680 0.000 -3.317) 3.718 6.836 ( -1.500 -0.000 -2.128) 2.603 6.951 ( 3.840 0.000 -0.892) 3.942 7.258 ( -2.751 -0.000 4.771) 5.507 7.344 ( -6.907 -0.000 0.867) 6.961 7.479 ( -13.027 -0.000 -1.455) 13.108 7.674 ( -3.682 -0.000 0.426) 3.706 7.944 ( 8.423 0.000 -2.617) 8.820 8.614 ( -4.362 -0.000 -5.935) 7.365 8.749 ( -5.831 -0.000 6.461) 8.703 8.949 ( -5.160 -0.000 2.535) 5.749 9.135 ( -0.297 -0.000 7.925) 7.931 9.266 ( -1.206 -0.000 -2.784) 3.034 9.816 ( 4.754 0.000 -1.863) 5.106 10.182 ( -4.235 -0.000 -5.075) 6.610 10.495 ( 0.114 0.000 1.202) 1.207 10.540 ( -1.556 -0.000 1.135) 1.926 10.881 ( 0.103 0.000 -5.780) 5.781 11.127 ( 3.212 0.000 -0.232) 3.220 11.235 ( 6.921 0.000 -4.443) 8.225 11.266 ( 2.742 0.000 1.885) 3.327 11.775 ( 4.312 0.000 -3.331) 5.449 11.784 ( 7.686 0.000 10.676) 13.155 11.849 ( -3.359 -0.000 -1.035) 3.514 12.163 ( -3.435 -0.000 -5.486) 6.473 12.202 ( -1.846 -0.000 -3.115) 3.621 12.382 ( -3.213 -0.000 -1.049) 3.380 12.562 ( -4.633 -0.000 4.623) 6.545 12.657 ( 3.859 0.000 6.441) 7.509 12.917 ( -8.069 -0.000 8.639) 11.821 13.034 ( -4.346 -0.000 -12.226) 12.975 13.856 ( -2.891 -0.000 2.350) 3.726 15.014 ( 1.114 0.000 0.288) 1.151 15.116 ( -2.827 -0.000 0.420) 2.858 15.343 ( 3.505 0.000 0.303) 3.518 15.402 ( -11.825 -0.000 4.661) 12.711 15.704 ( 2.492 0.000 -0.204) 2.501 15.786 ( 0.106 0.000 -2.516) 2.519 16.010 ( 2.438 0.000 -4.862) 5.439 16.035 ( 1.071 0.000 -3.086) 3.267 16.155 ( 7.793 0.000 -1.857) 8.011 16.316 ( -3.338 -0.000 -0.915) 3.462 16.494 ( -3.384 -0.000 1.679) 3.778 16.521 ( -2.546 -0.000 6.126) 6.634 18.143 ( 13.172 0.000 -8.504) 15.678 18.200 ( 4.395 0.000 6.768) 8.069 18.487 ( -0.635 -0.000 2.558) 2.636 18.793 ( 1.191 0.000 -1.289) 1.755 25.863 ( 0.430 0.000 -0.351) 0.555 25.932 ( 1.946 0.000 -0.345) 1.976 26.027 ( -0.907 -0.000 1.973) 2.171 26.082 ( -1.867 -0.000 0.981) 2.109 26.418 ( -1.208 -0.000 1.125) 1.650 26.523 ( -1.480 -0.000 -3.777) 4.057 26.811 ( 2.588 0.000 3.544) 4.389 26.857 ( 1.173 0.000 0.582) 1.309 27.488 ( -4.830 -0.000 -1.674) 5.112 28.109 ( 6.408 0.000 9.729) 11.650 28.163 ( -4.173 -0.000 6.870) 8.038 28.409 ( -2.062 -0.000 0.864) 2.235 28.579 ( 0.851 0.000 -0.887) 1.229 28.762 ( -11.990 -0.000 -12.376) 17.232 29.478 ( 5.694 0.000 3.128) 6.496 31.124 ( 11.099 0.000 -10.426) 15.228 ======================= Grid point 116 (51/140) ======================= q-point: ( 0.44 0.33 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.494 ( 2.801 -12.026 -13.187) 18.066 1.806 ( 0.237 -15.789 0.505) 15.799 1.906 ( -0.992 -7.630 -6.469) 10.052 2.053 ( 9.646 0.071 3.244) 10.177 2.127 ( 4.973 -5.128 1.523) 7.304 2.293 ( -2.709 -10.950 6.419) 12.979 2.543 ( -2.550 -4.646 0.408) 5.315 2.569 ( -8.323 -3.642 -1.051) 9.145 2.679 ( -4.332 -3.358 1.901) 5.802 2.974 ( 2.959 -3.285 4.389) 6.230 3.072 ( -0.465 0.577 -1.961) 2.096 3.160 ( 2.697 3.810 -1.056) 4.787 3.268 ( -0.252 -1.804 -5.141) 5.454 3.588 ( 0.152 7.033 -4.227) 8.207 3.791 ( -0.090 2.128 11.626) 11.819 3.851 ( 3.176 2.724 5.097) 6.594 3.913 ( -6.436 3.712 0.379) 7.439 4.030 ( 3.276 -12.485 -3.200) 13.298 4.207 ( 5.637 -4.519 2.456) 7.630 4.349 ( -3.817 -9.567 -4.737) 11.337 4.581 ( -0.462 1.671 0.151) 1.741 4.748 ( -6.690 -2.417 4.320) 8.322 4.941 ( 8.421 1.129 -11.707) 14.466 5.162 ( -3.429 4.250 -4.673) 7.188 5.269 ( -2.435 -3.366 -3.499) 5.432 5.367 ( 4.381 -2.751 7.147) 8.823 5.423 ( 0.672 6.320 1.244) 6.476 5.897 ( 5.542 2.018 2.544) 6.424 5.938 ( -4.929 5.471 -1.104) 7.447 6.206 ( 6.026 -1.328 0.500) 6.190 6.343 ( -1.141 4.838 -2.857) 5.734 6.579 ( -1.500 4.178 5.168) 6.813 6.703 ( 0.025 3.795 -1.531) 4.092 6.817 ( -0.799 0.097 -5.043) 5.107 7.003 ( 1.066 -2.794 3.206) 4.384 7.209 ( 0.614 4.288 0.346) 4.346 7.300 ( -7.278 -0.786 3.368) 8.058 7.328 ( -7.571 5.641 2.981) 9.901 7.742 ( -4.003 -7.520 -0.695) 8.547 7.968 ( 6.896 1.942 -1.809) 7.389 8.669 ( -2.284 -9.761 -3.459) 10.604 8.748 ( -5.743 -2.000 8.916) 10.792 8.993 ( -3.475 -6.908 3.010) 8.298 9.157 ( -5.197 -4.574 0.900) 6.981 9.309 ( 4.043 -1.993 4.136) 6.117 9.783 ( 2.171 4.248 -1.347) 4.957 10.227 ( -0.534 -8.151 -5.390) 9.787 10.364 ( -1.649 10.095 -1.242) 10.304 10.575 ( -0.068 -1.242 -2.153) 2.486 10.924 ( -0.422 -9.523 -17.607) 20.022 11.179 ( 3.072 -2.321 2.631) 4.663 11.248 ( 5.857 1.657 3.939) 7.250 11.344 ( 4.041 -4.234 2.972) 6.564 11.744 ( 3.606 5.419 -2.763) 7.071 11.845 ( -3.242 -2.982 0.175) 4.408 11.906 ( 6.403 -0.787 4.812) 8.048 12.083 ( -1.848 3.718 -3.206) 5.246 12.181 ( 0.598 -0.675 0.867) 1.251 12.374 ( -10.397 -6.568 -4.250) 13.011 12.553 ( -3.318 -0.793 2.544) 4.256 12.708 ( 2.273 0.383 4.653) 5.193 12.862 ( -8.360 1.147 -8.408) 11.912 12.941 ( 2.703 5.647 3.942) 7.398 13.782 ( -2.821 7.280 -0.052) 7.808 14.989 ( 0.593 2.651 1.490) 3.098 15.076 ( -2.944 3.282 1.636) 4.703 15.332 ( -3.396 -2.332 0.270) 4.129 15.451 ( -0.267 -4.317 1.562) 4.599 15.611 ( -0.219 8.815 1.014) 8.876 15.801 ( 0.756 -2.724 -1.580) 3.238 15.968 ( -0.199 5.317 -2.906) 6.062 16.056 ( 4.545 -2.791 -4.080) 6.715 16.144 ( 7.234 4.511 -3.496) 9.214 16.350 ( -2.846 -2.858 2.835) 4.930 16.479 ( -3.600 -0.616 4.031) 5.439 16.595 ( -2.433 -6.615 3.695) 7.958 18.109 ( 11.669 9.443 -1.281) 15.065 18.284 ( 3.208 -0.440 4.903) 5.876 18.447 ( -3.924 3.486 0.795) 5.309 18.802 ( 0.842 -0.773 -1.604) 1.970 25.880 ( 0.736 -1.492 0.264) 1.684 25.944 ( 1.120 -0.158 -0.383) 1.194 26.050 ( -0.848 -2.194 0.440) 2.393 26.082 ( -1.942 -1.208 0.994) 2.494 26.387 ( -1.658 1.884 -2.142) 3.299 26.520 ( 0.002 -2.202 -3.227) 3.907 26.824 ( 0.677 0.989 1.871) 2.222 26.890 ( 1.441 -1.059 3.706) 4.115 27.445 ( -3.390 -0.910 -5.638) 6.641 28.172 ( 1.468 4.316 13.450) 14.202 28.189 ( -4.789 -1.292 -4.426) 6.648 28.333 ( -1.079 0.275 1.428) 1.811 28.634 ( -0.110 -4.952 0.128) 4.955 28.739 ( -2.145 -7.516 -2.934) 8.349 29.539 ( 3.037 -0.766 4.499) 5.481 31.038 ( 8.682 12.724 -9.478) 18.086 ======================= Grid point 117 (52/140) ======================= q-point: (-0.44 -0.67 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.722 ( 2.078 -15.129 -2.748) 15.516 1.922 ( -4.398 -5.322 -2.367) 7.299 2.120 ( 4.280 -6.558 0.242) 7.835 2.157 ( -1.944 -6.111 -6.014) 8.791 2.263 ( 9.009 -9.336 -0.365) 12.979 2.449 ( -5.046 -10.762 -3.116) 12.288 2.581 ( -7.561 -6.696 -1.718) 10.245 2.652 ( -1.238 -6.306 -0.461) 6.442 2.785 ( -1.138 -10.681 5.482) 12.060 3.064 ( 1.741 3.733 -1.992) 4.575 3.093 ( 0.824 -4.116 0.754) 4.265 3.115 ( 2.111 0.137 7.454) 7.748 3.217 ( 0.674 1.045 -9.259) 9.342 3.511 ( -1.674 1.738 1.836) 3.032 3.681 ( -2.060 5.704 5.572) 8.236 3.858 ( -4.082 -0.580 1.701) 4.460 3.924 ( -0.855 -2.103 7.851) 8.173 4.284 ( 3.418 -11.015 -0.990) 11.576 4.342 ( -1.362 -6.354 -2.051) 6.815 4.452 ( 6.075 -6.024 -6.534) 10.765 4.557 ( 0.307 0.080 -0.353) 0.475 4.737 ( -3.933 -0.416 -2.457) 4.656 4.943 ( 8.385 1.397 -8.413) 11.960 5.031 ( -4.258 3.289 -1.536) 5.595 5.275 ( -4.340 4.895 0.026) 6.543 5.314 ( -1.258 -1.196 -0.233) 1.752 5.507 ( 3.650 -4.759 6.063) 8.528 5.837 ( 0.585 3.885 1.873) 4.352 5.910 ( 4.409 2.623 5.581) 7.581 6.208 ( 0.215 7.115 -4.351) 8.343 6.265 ( 1.784 -0.229 -3.464) 3.903 6.489 ( -1.846 4.176 2.692) 5.301 6.625 ( -0.269 4.473 0.698) 4.535 6.788 ( 0.533 -0.665 -5.206) 5.276 7.036 ( -4.295 1.294 5.122) 6.808 7.188 ( -3.986 4.855 4.809) 7.911 7.203 ( 3.585 2.822 2.912) 5.412 7.301 ( -3.872 -4.176 0.896) 5.765 7.815 ( -1.414 -3.596 -1.738) 4.237 7.977 ( 2.132 0.074 -2.385) 3.200 8.726 ( -3.550 -1.273 5.906) 7.008 8.909 ( -0.806 -12.312 5.805) 13.636 9.133 ( -1.642 -11.170 -1.767) 11.428 9.243 ( -2.798 -7.780 2.107) 8.532 9.438 ( 2.510 -7.554 6.735) 10.427 9.724 ( 0.227 3.095 -1.225) 3.337 10.161 ( -1.350 10.786 -1.732) 11.007 10.329 ( 0.569 -6.189 -4.489) 7.667 10.538 ( -0.013 3.345 -4.104) 5.295 10.950 ( 1.321 -3.558 -18.080) 18.474 11.237 ( 2.425 -2.763 -2.699) 4.560 11.388 ( 5.739 -5.956 8.138) 11.603 11.505 ( 4.721 -8.687 5.463) 11.296 11.638 ( 0.715 6.674 -2.026) 7.011 11.864 ( -3.610 -0.983 -0.188) 3.746 11.929 ( 1.249 2.155 -1.224) 2.775 11.988 ( 0.082 3.848 -3.078) 4.928 12.257 ( 4.411 -2.617 3.792) 6.378 12.379 ( -10.759 -4.976 -3.268) 12.296 12.573 ( -0.331 -2.858 -0.415) 2.907 12.709 ( -5.022 1.226 -2.244) 5.636 12.723 ( -4.519 0.103 -7.039) 8.365 12.914 ( 8.228 6.222 8.628) 13.449 13.565 ( -3.699 14.102 -1.922) 14.706 14.960 ( -1.399 0.972 0.316) 1.733 15.026 ( -1.227 0.994 3.410) 3.758 15.370 ( 1.209 -1.065 -3.967) 4.282 15.414 ( -1.737 4.609 2.674) 5.605 15.566 ( -0.948 -1.402 1.471) 2.242 15.859 ( -0.550 0.515 -2.632) 2.738 15.866 ( 0.589 -0.823 -1.848) 2.107 16.098 ( 5.155 4.594 -3.412) 7.702 16.115 ( 6.255 -0.429 -0.611) 6.300 16.356 ( -2.627 0.813 3.377) 4.355 16.490 ( -4.823 -1.555 6.050) 7.892 16.719 ( -1.856 -7.645 2.297) 8.196 17.998 ( 7.464 13.303 2.128) 15.402 18.276 ( -2.082 5.434 2.372) 6.285 18.377 ( 0.207 0.812 1.642) 1.843 18.812 ( 0.818 -0.711 -2.276) 2.521 25.918 ( 0.165 -1.591 0.939) 1.855 25.960 ( 0.869 -1.258 0.291) 1.556 26.068 ( -1.498 -1.092 -0.561) 1.937 26.110 ( -1.082 -2.899 -0.120) 3.096 26.314 ( -1.542 3.198 -3.753) 5.167 26.556 ( 1.551 -3.053 -3.651) 5.005 26.829 ( -0.117 -0.405 1.652) 1.705 26.936 ( 0.365 -0.593 6.373) 6.411 27.407 ( -2.557 -1.544 -9.849) 10.292 27.968 ( -6.862 9.049 -4.190) 12.105 28.263 ( 3.049 -1.479 7.072) 7.842 28.440 ( 1.594 -6.484 6.332) 9.202 28.749 ( -1.011 -9.130 0.780) 9.219 28.871 ( 2.494 -7.040 1.465) 7.611 29.587 ( -0.187 -0.876 4.184) 4.279 30.759 ( 5.380 20.826 -8.722) 23.210 ======================= Grid point 118 (53/140) ======================= q-point: (-0.33 -0.67 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.817 ( -5.989 3.312 3.230) 7.568 2.066 ( 3.994 -10.791 1.590) 11.616 2.139 ( -6.603 -5.431 -5.286) 10.052 2.244 ( 2.807 -3.294 2.903) 5.211 2.473 ( -0.987 -8.528 -12.995) 15.575 2.572 ( 3.048 -5.833 2.560) 7.061 2.624 ( -5.124 -7.186 -5.622) 10.464 2.747 ( 2.733 -5.405 1.495) 6.239 2.945 ( 1.543 5.763 -4.329) 7.371 3.006 ( 0.624 -9.120 4.990) 10.415 3.103 ( -1.042 -1.833 -3.519) 4.102 3.191 ( 1.536 -0.833 2.649) 3.173 3.285 ( 4.875 -4.834 3.542) 7.725 3.480 ( -4.260 0.213 5.448) 6.919 3.691 ( 1.079 -3.878 1.960) 4.477 3.841 ( -2.062 2.107 3.626) 4.673 3.982 ( -4.375 -4.050 4.517) 7.479 4.288 ( -4.738 3.259 -7.843) 9.725 4.450 ( -0.182 1.165 -3.761) 3.942 4.513 ( 1.998 -7.555 0.836) 7.859 4.583 ( -0.678 2.062 1.634) 2.717 4.734 ( 5.752 -2.425 -7.227) 9.550 4.896 ( 0.749 1.166 -4.642) 4.845 5.035 ( -3.343 -3.877 -8.456) 9.885 5.161 ( 6.333 5.408 7.172) 10.991 5.375 ( -3.521 -5.611 0.665) 6.658 5.607 ( 0.563 -3.583 -1.558) 3.948 5.832 ( 3.679 1.908 5.135) 6.599 5.938 ( 2.942 1.081 4.575) 5.546 6.089 ( -0.558 4.502 -0.734) 4.595 6.199 ( -4.159 3.279 -1.861) 5.614 6.460 ( -1.084 0.547 0.940) 1.536 6.568 ( 0.598 3.485 1.808) 3.972 6.816 ( 4.183 -3.484 -3.807) 6.643 6.980 ( -2.516 2.765 2.938) 4.754 7.111 ( -4.315 2.455 5.524) 7.427 7.204 ( 1.631 1.659 2.446) 3.375 7.379 ( -0.174 -4.369 1.990) 4.804 7.806 ( -0.538 1.894 -3.812) 4.291 7.969 ( -2.501 -1.233 -5.180) 5.883 8.765 ( -0.683 -1.575 8.372) 8.546 9.140 ( 0.490 -10.492 8.457) 13.485 9.305 ( -1.741 -11.177 -4.041) 12.012 9.364 ( 1.082 -5.154 3.468) 6.306 9.622 ( 2.199 -3.142 2.048) 4.347 9.706 ( -1.337 -6.038 1.535) 6.372 9.994 ( 0.185 6.833 2.302) 7.213 10.367 ( -3.452 0.082 -6.674) 7.515 10.469 ( 2.653 1.113 -1.260) 3.141 10.925 ( 3.243 -1.122 -12.231) 12.703 11.283 ( 1.809 -1.249 -2.935) 3.667 11.496 ( -4.176 3.283 2.198) 5.748 11.521 ( 3.303 1.885 0.494) 3.835 11.727 ( 5.727 -2.107 6.767) 9.112 11.801 ( -2.116 2.025 -2.042) 3.570 11.876 ( -0.275 2.040 4.391) 4.849 11.973 ( 1.965 -4.081 -11.015) 11.910 12.297 ( -6.870 -1.411 -4.127) 8.137 12.335 ( -1.265 1.598 -0.396) 2.076 12.588 ( 1.293 2.891 -2.971) 4.342 12.671 ( -0.237 -1.315 -1.049) 1.699 12.710 ( -3.468 -3.800 2.404) 5.678 12.974 ( 7.692 -2.595 4.116) 9.102 13.278 ( -2.858 12.991 -2.093) 13.466 14.955 ( -0.745 -1.448 -0.546) 1.717 15.036 ( -1.853 -1.013 2.559) 3.318 15.297 ( -0.616 2.618 -1.531) 3.095 15.420 ( 0.218 0.607 -2.552) 2.632 15.580 ( 1.309 -0.180 3.670) 3.900 15.816 ( -2.951 -2.343 -5.713) 6.844 15.912 ( 0.356 -0.991 -0.424) 1.135 16.045 ( 3.276 3.792 -1.725) 5.300 16.152 ( 2.391 1.524 2.963) 4.101 16.345 ( 2.420 0.865 1.818) 3.148 16.519 ( -4.779 -2.421 7.693) 9.375 16.833 ( -0.830 -5.885 0.856) 6.005 17.794 ( -1.522 14.541 2.985) 14.922 18.155 ( -0.680 6.443 -1.397) 6.628 18.408 ( 2.546 -0.540 3.557) 4.407 18.817 ( 1.186 -0.434 -2.859) 3.125 25.931 ( -0.805 0.045 1.114) 1.375 26.006 ( 0.266 -2.447 1.486) 2.875 26.067 ( -0.187 -0.192 -0.627) 0.682 26.144 ( -1.333 -2.467 -1.914) 3.395 26.235 ( -0.571 2.812 -2.140) 3.580 26.600 ( 2.619 -2.390 -4.913) 6.059 26.844 ( -1.156 -1.170 0.126) 1.649 26.991 ( -0.053 -1.262 10.146) 10.224 27.344 ( -2.825 0.002 -13.619) 13.909 27.791 ( -4.805 4.184 -1.726) 6.601 28.338 ( 1.738 -1.139 6.158) 6.499 28.609 ( 6.660 -5.825 7.308) 11.476 28.925 ( 0.546 -10.678 0.938) 10.733 29.013 ( 2.441 -6.035 2.709) 7.051 29.597 ( -3.034 0.407 1.996) 3.655 30.358 ( 0.625 23.377 -8.570) 24.906 ======================= Grid point 119 (54/140) ======================= q-point: (-0.22 0.33 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.685 ( -5.015 8.109 6.458) 11.516 2.147 ( -1.945 -1.356 -0.998) 2.572 2.250 ( -0.755 2.356 -2.534) 3.541 2.282 ( 0.550 -6.576 5.365) 8.504 2.470 ( -2.334 -1.921 -5.578) 6.344 2.668 ( 3.491 0.547 2.252) 4.190 2.706 ( 0.876 -6.859 -5.578) 8.884 2.859 ( 2.114 -1.183 -1.150) 2.682 2.893 ( 2.553 -2.627 -2.224) 4.286 3.111 ( 2.007 -3.868 1.027) 4.477 3.160 ( 3.595 4.814 -0.638) 6.042 3.203 ( 0.176 -6.603 1.784) 6.842 3.422 ( 0.685 -5.612 1.706) 5.905 3.498 ( -3.326 -0.712 7.763) 8.476 3.749 ( -3.068 0.521 -1.464) 3.439 3.809 ( 0.464 0.514 2.728) 2.814 4.034 ( -3.494 -2.628 1.265) 4.551 4.129 ( -2.830 3.837 -6.070) 7.719 4.364 ( -3.289 6.148 2.928) 7.562 4.522 ( -2.561 1.858 2.551) 4.064 4.660 ( 3.731 -6.239 -6.335) 9.642 4.764 ( 4.009 0.530 -0.734) 4.110 4.841 ( 2.136 4.280 -6.758) 8.280 5.034 ( -6.107 -6.178 -2.567) 9.059 5.248 ( 11.240 -0.679 0.489) 11.271 5.437 ( -0.225 -2.988 0.490) 3.036 5.633 ( -1.470 -1.921 -4.495) 5.105 5.820 ( 0.325 4.096 2.839) 4.994 5.967 ( 2.694 -1.011 -2.303) 3.686 6.001 ( -6.941 4.198 5.314) 9.697 6.154 ( 1.797 1.314 4.972) 5.448 6.445 ( -2.492 -0.563 -2.771) 3.769 6.531 ( -1.938 0.534 2.372) 3.110 6.928 ( 0.343 -4.035 -1.281) 4.247 6.945 ( 6.756 1.267 2.180) 7.212 7.071 ( -3.708 1.956 3.657) 5.563 7.226 ( 1.345 -2.024 1.508) 2.860 7.443 ( -0.602 -2.550 1.936) 3.258 7.733 ( -0.224 2.794 -4.517) 5.316 7.924 ( -5.322 -0.838 -6.745) 8.632 8.854 ( 1.609 -3.204 9.146) 9.824 9.336 ( 0.252 -7.046 5.977) 9.244 9.421 ( -0.933 -5.526 -1.194) 5.730 9.444 ( -1.660 -2.592 0.644) 3.145 9.637 ( -0.689 -0.665 1.760) 2.004 9.761 ( 0.797 2.512 -1.620) 3.094 10.044 ( 2.268 -5.162 6.402) 8.531 10.257 ( -2.166 3.176 -2.736) 4.718 10.506 ( 1.506 -2.122 -1.182) 2.858 10.937 ( 4.921 -1.930 -5.750) 7.810 11.241 ( -1.861 5.201 -1.220) 5.657 11.339 ( -4.229 7.568 -1.599) 8.816 11.544 ( 6.286 1.720 0.268) 6.523 11.676 ( 0.152 6.345 3.127) 7.076 11.781 ( -3.593 -1.891 -0.858) 4.150 11.939 ( 1.678 -0.995 -4.147) 4.583 12.021 ( 2.740 -4.041 -0.733) 4.937 12.226 ( -5.236 -0.079 -5.001) 7.241 12.274 ( -1.606 4.006 -0.828) 4.395 12.513 ( -1.368 3.483 -1.560) 4.054 12.680 ( 2.057 0.528 -1.342) 2.512 12.767 ( 4.884 -0.298 -1.584) 5.143 13.089 ( -5.659 -4.780 3.250) 8.090 13.217 ( 6.538 -7.444 2.441) 10.204 14.963 ( 1.049 2.265 2.514) 3.543 15.057 ( -2.804 -3.368 -1.067) 4.510 15.272 ( -2.308 -1.221 -2.147) 3.380 15.369 ( 1.673 2.747 -1.226) 3.442 15.644 ( 2.147 -2.891 2.299) 4.272 15.811 ( -1.369 -1.416 -4.867) 5.251 15.899 ( -2.421 0.633 -0.056) 2.503 16.008 ( 0.682 1.604 -1.826) 2.525 16.122 ( -4.047 2.858 4.802) 6.899 16.399 ( 9.303 -0.726 -0.669) 9.356 16.575 ( -3.769 -3.626 8.532) 10.007 16.914 ( 1.098 -3.646 -0.372) 3.826 17.536 ( -7.754 12.705 2.644) 15.117 18.051 ( 1.390 4.758 -2.251) 5.444 18.455 ( 2.509 -0.934 1.680) 3.161 18.818 ( 1.747 -0.083 -3.073) 3.536 25.922 ( -0.692 1.006 1.772) 2.152 26.030 ( -1.794 -0.446 0.269) 1.868 26.081 ( 1.584 -0.529 0.912) 1.903 26.141 ( -0.719 0.300 -0.618) 0.994 26.213 ( -0.116 -0.835 -0.630) 1.053 26.626 ( 3.099 -1.130 -5.627) 6.522 26.850 ( -1.755 -1.028 -0.673) 2.142 27.073 ( -0.809 -2.349 9.170) 9.500 27.239 ( -2.367 1.682 -10.596) 10.986 27.726 ( -3.359 -0.480 -1.276) 3.625 28.384 ( -0.078 -0.212 5.191) 5.196 28.823 ( 10.715 -7.374 5.998) 14.324 29.085 ( 3.529 -4.236 1.511) 5.717 29.153 ( 0.944 -8.312 2.920) 8.861 29.536 ( -3.927 3.872 -1.007) 5.606 29.929 ( -4.196 19.740 -7.945) 21.688 ======================= Grid point 120 (55/140) ======================= q-point: (-0.11 0.33 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.554 ( 0.321 9.557 9.208) 13.275 2.050 ( 0.553 10.632 3.408) 11.179 2.222 ( -0.184 0.168 -6.033) 6.039 2.316 ( -2.062 4.446 6.836) 8.411 2.497 ( -0.023 -2.211 2.266) 3.166 2.646 ( 1.822 5.185 2.935) 6.230 2.785 ( 4.592 -1.990 -3.434) 6.070 2.861 ( -0.065 -1.637 -3.189) 3.585 2.961 ( 0.752 -2.588 -1.291) 2.988 3.105 ( 3.543 4.114 -1.624) 5.667 3.192 ( 2.372 -1.028 2.759) 3.781 3.282 ( -2.641 -2.274 -2.209) 4.126 3.426 ( -4.908 4.818 1.882) 7.130 3.542 ( 2.052 -0.811 4.435) 4.953 3.687 ( -0.199 0.371 -0.367) 0.559 3.794 ( -4.196 0.723 -0.970) 4.367 3.967 ( 0.615 4.924 -1.858) 5.299 4.126 ( -1.040 0.860 -0.375) 1.401 4.277 ( -2.110 0.714 6.189) 6.578 4.496 ( -4.706 0.902 4.761) 6.755 4.721 ( 3.815 -2.920 -8.431) 9.703 4.786 ( 3.488 1.165 -2.147) 4.258 4.798 ( 4.272 -1.488 -2.731) 5.285 5.063 ( -6.480 -2.620 -0.784) 7.033 5.297 ( 7.269 3.317 -3.711) 8.810 5.479 ( 3.772 -0.549 0.705) 3.877 5.607 ( -2.537 0.493 -4.861) 5.505 5.764 ( -0.556 3.037 1.953) 3.653 5.906 ( -4.220 0.048 -1.122) 4.367 5.999 ( 2.105 0.953 1.136) 2.575 6.199 ( 1.975 -0.873 8.067) 8.351 6.413 ( -2.237 -0.468 -4.204) 4.786 6.550 ( -3.859 -3.349 2.427) 5.657 6.866 ( -4.104 4.193 -0.044) 5.867 7.027 ( 5.019 4.633 4.171) 8.003 7.082 ( 3.184 -6.221 -3.907) 8.007 7.281 ( -3.014 -4.084 -0.467) 5.097 7.487 ( 2.457 -1.046 1.322) 2.980 7.699 ( -2.955 -2.081 -2.009) 4.135 7.872 ( -3.262 -1.314 -4.066) 5.376 8.969 ( -0.022 -3.665 7.305) 8.173 9.375 ( -5.926 0.853 -4.220) 7.325 9.436 ( -1.604 1.538 0.259) 2.237 9.476 ( -0.240 0.731 4.146) 4.217 9.646 ( -2.795 0.117 1.383) 3.121 9.726 ( 1.912 0.657 -0.835) 2.187 10.048 ( 1.264 4.467 1.567) 4.900 10.288 ( -1.257 -2.392 4.588) 5.325 10.536 ( 1.091 -0.871 -1.022) 1.730 10.996 ( 1.203 -2.429 1.648) 3.173 11.136 ( 1.906 2.452 -3.369) 4.583 11.205 ( 1.691 6.973 1.872) 7.415 11.534 ( 4.663 5.706 0.951) 7.430 11.640 ( 4.095 -0.259 -1.752) 4.461 11.798 ( -3.473 -3.259 -3.012) 5.635 11.861 ( 0.597 4.596 -6.012) 7.591 12.091 ( 1.815 0.127 -0.655) 1.934 12.187 ( 0.393 0.951 -2.453) 2.660 12.234 ( -2.183 -2.290 8.005) 8.608 12.444 ( -1.876 1.447 -5.085) 5.610 12.666 ( 2.945 1.142 -5.503) 6.345 12.818 ( 4.868 -3.282 -3.057) 6.619 13.165 ( -8.073 -6.912 5.719) 12.069 13.463 ( 0.576 -13.638 3.721) 14.149 14.924 ( 1.079 4.744 4.960) 6.948 15.068 ( -0.159 0.574 -0.494) 0.774 15.258 ( -4.551 -0.980 -1.920) 5.036 15.400 ( 2.443 -5.528 -1.452) 6.216 15.700 ( 2.783 0.814 1.748) 3.385 15.773 ( -1.787 2.116 -1.403) 3.104 15.890 ( -0.122 -1.218 -0.692) 1.406 15.972 ( -5.481 -1.032 -3.090) 6.376 16.067 ( -2.309 2.157 2.389) 3.961 16.457 ( 3.209 0.346 -0.343) 3.245 16.677 ( 0.412 -5.199 5.384) 7.496 16.985 ( 6.501 -2.294 -0.300) 6.901 17.284 ( -10.801 9.346 1.987) 14.421 18.004 ( 3.491 2.031 -0.889) 4.136 18.489 ( 1.632 -1.129 -2.303) 3.041 18.817 ( 2.222 0.256 -2.927) 3.684 25.906 ( -0.201 1.585 2.107) 2.645 26.015 ( -0.474 0.792 -0.713) 1.166 26.090 ( -0.084 0.789 2.672) 2.788 26.154 ( 0.121 -0.788 2.966) 3.072 26.226 ( -0.424 -1.245 -0.863) 1.573 26.639 ( 3.865 -0.458 -4.658) 6.070 26.840 ( -2.196 -0.036 -1.351) 2.579 27.053 ( -4.462 1.430 -11.060) 12.012 27.250 ( 1.691 -2.649 12.664) 13.048 27.718 ( -3.156 -2.017 -1.979) 4.237 28.396 ( -1.366 0.742 4.043) 4.332 28.994 ( 4.031 0.039 -4.567) 6.092 29.164 ( -2.466 -5.402 1.789) 6.202 29.306 ( 3.767 0.839 5.819) 6.983 29.458 ( 6.589 1.467 -0.313) 6.758 29.591 ( -4.583 6.859 -6.077) 10.246 ======================= Grid point 125 (56/140) ======================= q-point: (-0.56 -0.56 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.347 ( 7.111 0.000 -16.557) 18.020 1.588 ( -0.787 -0.000 -7.923) 7.962 1.799 ( 0.919 0.000 -10.734) 10.773 2.057 ( -9.349 -0.000 11.079) 14.497 2.219 ( 2.883 0.000 2.577) 3.867 2.248 ( 14.346 0.000 5.965) 15.537 2.438 ( -12.140 -0.000 -1.534) 12.236 2.475 ( -4.195 -0.000 0.297) 4.205 2.630 ( -2.023 -0.000 -1.181) 2.343 2.984 ( 2.812 0.000 3.766) 4.700 3.082 ( 1.365 0.000 3.099) 3.386 3.195 ( 0.257 0.000 -8.120) 8.124 3.244 ( -0.244 -0.000 2.498) 2.510 3.728 ( 0.710 0.000 -3.203) 3.280 3.728 ( -0.955 0.000 -1.911) 2.136 3.874 ( -2.519 -0.000 1.073) 2.738 3.936 ( 4.689 0.000 -0.810) 4.759 4.031 ( -0.988 -0.000 9.248) 9.301 4.146 ( -2.994 -0.000 0.970) 3.147 4.218 ( 2.162 0.000 -2.797) 3.535 4.580 ( -2.761 -0.000 -0.516) 2.809 4.706 ( -5.777 -0.000 6.321) 8.564 4.934 ( 7.606 0.000 -15.575) 17.333 5.189 ( 0.793 0.000 -2.425) 2.551 5.189 ( -3.843 -0.000 -3.691) 5.329 5.416 ( 4.053 0.000 7.646) 8.654 5.498 ( 1.839 0.000 2.195) 2.864 5.971 ( -1.072 -0.000 0.708) 1.284 5.972 ( 3.582 0.000 5.672) 6.708 6.182 ( -1.023 -0.000 -4.114) 4.239 6.397 ( 2.134 0.000 -1.359) 2.530 6.619 ( -4.627 -0.000 2.415) 5.219 6.716 ( -1.418 -0.000 -0.475) 1.496 6.804 ( 2.423 0.000 -6.743) 7.165 6.995 ( 1.701 0.000 0.735) 1.853 7.247 ( -4.184 -0.000 2.395) 4.821 7.267 ( -0.968 -0.000 5.293) 5.381 7.369 ( -4.357 -0.000 3.491) 5.583 7.629 ( -1.912 -0.000 0.695) 2.035 8.021 ( 4.199 0.000 -3.085) 5.210 8.551 ( 2.161 0.000 -2.240) 3.112 8.739 ( -6.439 -0.000 10.578) 12.384 8.939 ( -3.163 -0.000 8.264) 8.849 9.062 ( -3.939 -0.000 -4.507) 5.986 9.365 ( 3.218 0.000 7.034) 7.735 9.856 ( 3.195 0.000 -2.812) 4.256 10.080 ( 0.119 0.000 -7.251) 7.252 10.477 ( -1.178 -0.000 -3.768) 3.948 10.485 ( -2.452 -0.000 -5.004) 5.572 10.753 ( -0.158 -0.000 -15.293) 15.294 11.200 ( 2.015 0.000 2.809) 3.457 11.313 ( 6.082 0.000 -1.026) 6.167 11.363 ( 2.422 0.000 9.059) 9.377 11.785 ( -1.758 -0.000 0.851) 1.953 11.823 ( 3.223 0.000 -5.361) 6.255 11.964 ( 0.368 0.000 2.677) 2.702 12.099 ( 0.814 0.000 -1.568) 1.767 12.183 ( -9.195 -0.000 -3.131) 9.713 12.190 ( 1.497 0.000 2.314) 2.756 12.526 ( -3.883 -0.000 0.990) 4.007 12.731 ( -8.856 -0.000 -5.701) 10.533 12.745 ( 0.504 0.000 -7.716) 7.732 13.082 ( 7.470 0.000 10.378) 12.787 13.823 ( -2.171 -0.000 -1.889) 2.878 15.033 ( 0.619 0.000 0.167) 0.641 15.095 ( -0.714 -0.000 1.210) 1.405 15.305 ( -6.409 -0.000 5.611) 8.518 15.393 ( 2.410 0.000 -0.499) 2.462 15.743 ( 1.287 0.000 2.401) 2.725 15.752 ( -0.793 -0.000 -1.738) 1.910 15.992 ( -0.019 -0.000 -7.047) 7.047 16.025 ( 4.826 0.000 -4.519) 6.612 16.258 ( 5.883 0.000 0.046) 5.883 16.289 ( -2.402 -0.000 4.084) 4.738 16.478 ( -1.431 -0.000 2.704) 3.060 16.533 ( -3.223 -0.000 4.846) 5.820 18.277 ( 9.862 0.000 0.397) 9.870 18.326 ( 3.108 0.000 5.268) 6.117 18.447 ( -6.518 -0.000 2.303) 6.913 18.793 ( 0.714 0.000 -1.659) 1.806 25.873 ( 0.830 0.000 0.538) 0.989 25.952 ( 1.380 0.000 -1.027) 1.721 26.021 ( -1.662 -0.000 0.539) 1.747 26.058 ( -1.976 -0.000 0.292) 1.997 26.371 ( -2.094 -0.000 -4.504) 4.967 26.491 ( 0.991 0.000 -2.235) 2.445 26.850 ( -0.686 -0.000 1.328) 1.495 26.897 ( 0.686 0.000 3.839) 3.900 27.379 ( -2.960 -0.000 -7.277) 7.856 28.102 ( -6.651 -0.000 -11.774) 13.523 28.235 ( -1.309 -0.000 15.206) 15.263 28.396 ( -0.928 -0.000 1.416) 1.693 28.585 ( 1.307 0.000 -0.265) 1.333 28.686 ( 5.882 0.000 6.872) 9.046 29.574 ( 0.500 0.000 6.184) 6.204 31.159 ( 7.317 0.000 -10.947) 13.167 ======================= Grid point 126 (57/140) ======================= q-point: (-0.44 -0.56 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.431 ( 3.906 -13.411 -11.415) 18.039 1.765 ( 0.220 -16.156 -6.254) 17.326 1.839 ( 5.062 -11.306 -8.962) 15.289 2.066 ( -4.843 -3.191 5.038) 7.683 2.228 ( -10.713 0.333 -0.003) 10.718 2.302 ( -5.909 -5.418 -0.722) 8.050 2.437 ( 3.839 -2.131 -0.067) 4.391 2.525 ( -0.630 -7.113 0.616) 7.167 2.662 ( 1.145 -5.442 3.637) 6.645 3.046 ( 3.869 -1.761 -2.834) 5.109 3.116 ( 0.462 1.655 -2.916) 3.384 3.148 ( 1.896 -1.205 6.349) 6.735 3.221 ( -2.135 2.037 -1.688) 3.399 3.607 ( 3.731 6.232 1.149) 7.354 3.762 ( -9.270 -3.256 -3.912) 10.575 3.818 ( -0.900 7.289 0.595) 7.368 3.919 ( -2.862 -0.852 7.603) 8.168 4.142 ( 4.983 -7.758 2.204) 9.480 4.214 ( -1.618 -5.029 -2.149) 5.703 4.317 ( 2.917 -10.206 -4.165) 11.403 4.560 ( -1.394 -0.176 -0.930) 1.685 4.679 ( -4.467 0.963 2.569) 5.242 4.948 ( 6.536 -2.802 -11.049) 13.140 5.090 ( -2.334 6.150 -2.747) 7.129 5.195 ( -0.574 -1.264 -0.715) 1.561 5.467 ( 2.270 6.391 3.499) 7.632 5.505 ( 3.350 -1.998 4.998) 6.340 5.931 ( 2.417 4.367 2.880) 5.762 6.010 ( 2.082 1.584 6.530) 7.035 6.181 ( -3.930 -3.077 -5.926) 7.748 6.335 ( 1.072 6.236 -4.862) 7.980 6.547 ( -5.262 3.279 2.975) 6.877 6.688 ( 0.591 2.946 0.691) 3.083 6.776 ( 2.834 0.655 -6.817) 7.412 7.033 ( -0.641 -1.119 2.652) 2.949 7.214 ( -4.957 -0.043 -0.201) 4.961 7.287 ( -2.508 6.536 4.436) 8.288 7.314 ( 5.414 0.428 8.341) 9.954 7.708 ( 0.111 -6.908 -0.188) 6.911 7.997 ( 0.346 2.713 -3.702) 4.602 8.662 ( 3.492 -7.290 0.034) 8.083 8.775 ( -4.099 -5.589 11.079) 13.069 8.987 ( -1.181 -3.804 1.582) 4.286 9.098 ( -2.181 -8.002 3.815) 9.129 9.420 ( 0.910 -1.474 7.828) 8.017 9.780 ( 0.419 5.161 -2.958) 5.963 10.186 ( 2.778 -8.761 -7.219) 11.687 10.305 ( -1.180 8.775 -4.949) 10.144 10.519 ( -1.093 -2.400 -6.920) 7.406 10.752 ( 1.668 -7.976 -17.133) 18.972 11.213 ( 0.018 -0.341 -0.261) 0.430 11.392 ( 3.996 -3.658 2.855) 6.123 11.448 ( 2.432 -3.328 9.992) 10.809 11.743 ( -0.196 6.396 -4.052) 7.574 11.797 ( -3.343 -1.845 -1.234) 4.013 11.911 ( -7.600 -1.303 -2.164) 8.009 12.078 ( 3.153 3.962 0.314) 5.074 12.203 ( -2.418 -3.236 -0.775) 4.113 12.282 ( 8.420 -4.579 3.468) 10.193 12.504 ( -4.046 -1.487 -2.309) 4.890 12.586 ( -9.539 -0.574 -12.071) 15.396 12.740 ( 1.251 1.709 -0.953) 2.323 13.141 ( 7.328 5.689 10.282) 13.848 13.723 ( -2.374 8.018 -3.853) 9.207 14.994 ( -1.589 3.719 0.641) 4.095 15.074 ( -0.100 2.667 3.121) 4.107 15.312 ( 0.121 -2.402 1.795) 3.001 15.469 ( -0.366 -5.971 0.498) 6.002 15.605 ( -0.253 11.635 0.574) 11.652 15.810 ( 1.190 -3.414 -0.059) 3.616 15.907 ( -1.044 4.723 -6.543) 8.137 16.101 ( 5.329 -3.947 -4.005) 7.747 16.210 ( 3.051 4.369 1.188) 5.459 16.360 ( -0.806 -1.550 4.526) 4.851 16.481 ( -1.775 0.075 4.552) 4.886 16.589 ( -2.746 -6.593 3.207) 7.829 18.252 ( 0.331 9.748 3.160) 10.253 18.340 ( -1.756 2.866 4.353) 5.500 18.422 ( 3.800 0.800 2.759) 4.763 18.795 ( 0.649 -0.544 -2.128) 2.290 25.898 ( 0.646 -1.441 1.265) 2.023 25.952 ( 0.198 -0.141 -0.287) 0.376 26.028 ( -1.236 -1.979 -1.285) 2.664 26.056 ( -1.647 -1.472 -0.184) 2.216 26.317 ( -2.027 1.427 -5.258) 5.813 26.511 ( 2.215 -2.118 -2.674) 4.068 26.835 ( -1.431 0.645 1.160) 1.952 26.940 ( -0.306 -1.790 5.033) 5.351 27.325 ( -2.337 -0.428 -8.599) 8.921 27.953 ( -7.694 2.816 -13.770) 16.023 28.328 ( -0.013 -0.463 12.009) 12.018 28.406 ( 2.713 -3.184 7.691) 8.755 28.628 ( -0.290 -4.559 -0.539) 4.600 28.833 ( 8.098 -4.103 7.628) 11.857 29.600 ( -2.232 0.205 6.902) 7.257 31.043 ( 5.352 13.020 -11.345) 18.079 ======================= Grid point 127 (58/140) ======================= q-point: (-0.33 -0.56 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.682 ( -1.745 -15.576 -4.991) 16.449 1.895 ( -0.564 -6.693 0.964) 6.785 2.070 ( -6.363 1.200 0.743) 6.517 2.142 ( -3.146 -18.631 -14.380) 23.745 2.187 ( -1.458 -7.552 3.018) 8.262 2.386 ( -5.000 -9.294 -3.716) 11.188 2.502 ( 0.498 -5.625 0.438) 5.664 2.678 ( 4.109 -8.503 0.090) 9.444 2.846 ( 1.379 -10.341 5.994) 12.032 3.020 ( -1.534 -1.498 -8.209) 8.484 3.083 ( 1.372 7.250 -7.612) 10.601 3.151 ( 4.664 -1.572 2.034) 5.326 3.314 ( 2.873 -6.109 10.369) 12.373 3.542 ( 3.937 6.456 1.012) 7.629 3.716 ( -0.584 3.062 5.957) 6.723 3.789 ( -6.777 -5.886 -0.159) 8.978 3.916 ( -6.625 -0.268 4.867) 8.225 4.248 ( -4.184 -3.274 -5.051) 7.330 4.301 ( -1.467 -8.597 -2.183) 8.990 4.471 ( 3.204 -1.751 -4.668) 5.926 4.564 ( 0.541 -2.958 0.733) 3.095 4.664 ( 2.352 -3.517 -6.220) 7.522 4.941 ( -4.521 5.032 -2.953) 7.382 4.993 ( 6.260 0.633 -3.504) 7.202 5.242 ( -0.925 -4.543 2.857) 5.446 5.379 ( 4.771 7.942 5.289) 10.668 5.568 ( 1.435 -1.651 -1.153) 2.473 5.924 ( 4.953 2.409 4.844) 7.335 5.998 ( -0.323 2.891 -2.181) 3.636 6.160 ( -1.607 -0.385 1.760) 2.415 6.192 ( -4.301 5.999 -3.551) 8.191 6.484 ( -3.944 2.470 4.142) 6.230 6.633 ( -0.399 3.567 -0.199) 3.595 6.798 ( 6.409 -1.307 -3.883) 7.607 7.010 ( -3.729 1.872 4.432) 6.087 7.184 ( -0.359 4.605 4.349) 6.344 7.212 ( -0.075 -0.879 -2.293) 2.457 7.394 ( 4.226 0.477 9.225) 10.158 7.791 ( 1.187 -1.969 -2.971) 3.757 7.915 ( -4.303 1.812 -5.477) 7.197 8.760 ( 0.783 -3.243 5.104) 6.097 9.013 ( 1.403 -13.271 10.941) 17.256 9.083 ( -0.019 -8.648 -2.342) 8.959 9.283 ( 1.337 -8.961 7.100) 11.511 9.543 ( 0.485 -7.810 8.388) 11.471 9.689 ( -1.248 3.733 -2.581) 4.707 10.122 ( -0.422 7.415 -3.655) 8.278 10.261 ( -2.548 -2.877 -8.037) 8.908 10.497 ( 1.328 0.577 -5.137) 5.337 10.837 ( 6.601 -6.294 -15.608) 18.078 11.232 ( -1.594 -2.851 -0.514) 3.306 11.475 ( -3.584 -2.206 1.440) 4.448 11.595 ( 0.510 0.614 3.765) 3.848 11.674 ( 6.015 -6.745 -2.385) 9.347 11.744 ( -8.459 -0.796 -1.709) 8.667 11.910 ( -0.019 -0.929 -0.534) 1.072 12.019 ( 4.251 7.048 1.812) 8.428 12.198 ( -4.916 -0.822 -3.009) 5.822 12.371 ( 0.814 1.702 -0.639) 1.992 12.518 ( -2.067 -5.951 -5.668) 8.475 12.573 ( 1.709 -6.898 -2.334) 7.480 12.703 ( -0.266 2.343 0.987) 2.556 13.121 ( 6.118 7.386 7.414) 12.122 13.492 ( -0.942 13.875 -5.151) 14.830 14.924 ( -3.205 1.368 0.260) 3.494 15.061 ( 0.850 1.508 3.975) 4.336 15.378 ( 4.005 -1.431 -2.154) 4.767 15.405 ( -2.063 8.468 0.553) 8.733 15.569 ( -0.830 -5.265 1.057) 5.434 15.779 ( -2.009 4.654 -5.385) 7.395 15.873 ( -0.084 -2.835 -0.431) 2.869 16.106 ( 1.290 2.691 -3.483) 4.587 16.219 ( 3.917 1.629 2.054) 4.714 16.392 ( 3.048 -0.372 4.391) 5.358 16.496 ( -3.202 -1.015 6.668) 7.466 16.715 ( -1.092 -7.754 1.774) 8.029 18.024 ( -7.730 14.033 2.627) 16.235 18.259 ( -2.127 6.823 3.526) 7.969 18.472 ( 7.197 1.339 3.803) 8.249 18.800 ( 0.930 -0.803 -2.905) 3.154 25.924 ( -1.045 -0.679 1.732) 2.134 25.975 ( 0.100 -2.037 0.804) 2.192 26.047 ( -0.169 -1.802 -1.827) 2.571 26.077 ( -1.328 -2.578 -1.281) 3.170 26.252 ( -1.290 1.714 -3.732) 4.305 26.560 ( 3.733 -2.575 -4.407) 6.324 26.825 ( -1.778 -0.194 1.223) 2.167 27.000 ( -0.735 -2.306 6.900) 7.312 27.266 ( -2.086 0.140 -9.441) 9.669 27.789 ( -5.246 3.034 -8.961) 10.818 28.367 ( 0.011 -0.273 6.206) 6.213 28.596 ( 6.304 -6.517 9.023) 12.792 28.751 ( 0.320 -10.588 2.327) 10.845 28.989 ( 6.747 -3.398 5.185) 9.163 29.594 ( -4.485 1.120 5.624) 7.280 30.704 ( 0.551 22.323 -11.740) 25.228 ======================= Grid point 128 (59/140) ======================= q-point: (-0.22 -0.56 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.758 ( -5.930 2.251 5.017) 8.087 1.962 ( -9.630 -10.457 -2.916) 14.511 2.176 ( 3.477 -9.964 3.604) 11.152 2.221 ( -7.621 -5.480 -11.659) 14.968 2.345 ( 0.725 -7.701 3.474) 8.479 2.519 ( 1.340 -9.854 -5.351) 11.293 2.641 ( 0.896 -7.453 2.240) 7.834 2.846 ( 6.151 -5.321 -0.922) 8.185 2.931 ( 3.294 5.617 -6.519) 9.214 3.049 ( 1.427 -5.675 -3.374) 6.755 3.063 ( -0.439 -9.802 1.167) 9.881 3.200 ( 1.866 0.193 0.125) 1.880 3.470 ( 8.050 0.461 7.982) 11.346 3.478 ( -3.070 1.118 4.825) 5.827 3.708 ( -1.831 0.043 1.752) 2.534 3.830 ( -5.238 -1.624 2.853) 6.181 3.927 ( -2.828 -5.385 2.110) 6.438 4.182 ( 0.423 4.703 -7.787) 9.107 4.387 ( -13.075 -8.114 -1.953) 15.512 4.435 ( -0.045 2.086 1.063) 2.342 4.596 ( 4.592 -1.276 -4.902) 6.837 4.774 ( 4.732 -1.747 -4.885) 7.022 4.865 ( -3.345 -5.072 -5.628) 8.282 4.965 ( 4.235 6.655 2.413) 8.249 5.350 ( -0.132 -5.980 4.243) 7.334 5.373 ( 8.907 2.172 4.800) 10.348 5.584 ( 1.580 -1.025 -4.951) 5.297 5.879 ( -2.442 4.211 -5.162) 7.095 5.975 ( 3.195 0.927 -1.279) 3.564 6.044 ( -6.942 4.115 3.284) 8.713 6.195 ( 0.381 -1.357 5.249) 5.435 6.432 ( -3.247 2.781 2.969) 5.205 6.558 ( -3.466 3.339 0.706) 4.864 6.859 ( 2.993 -3.726 -1.584) 5.035 7.001 ( 0.352 1.214 3.011) 3.265 7.136 ( 0.314 3.223 5.956) 6.779 7.247 ( 6.927 -0.280 -2.005) 7.217 7.447 ( 1.336 0.287 7.767) 7.887 7.752 ( -2.514 2.714 -4.907) 6.145 7.839 ( -3.390 -0.147 -6.776) 7.578 8.859 ( 2.496 -3.058 6.544) 7.642 9.234 ( 1.124 -8.838 -1.305) 9.004 9.282 ( 0.243 -10.465 10.843) 15.071 9.415 ( -0.372 -1.422 2.714) 3.087 9.631 ( -1.869 -0.738 -0.285) 2.030 9.732 ( 1.628 -6.114 4.514) 7.772 10.041 ( 1.661 0.389 2.404) 2.947 10.206 ( -5.865 -1.261 -10.084) 11.733 10.494 ( 2.550 -0.580 -2.273) 3.465 10.906 ( 7.627 -2.939 -8.612) 11.873 11.249 ( -4.189 -0.615 -1.798) 4.600 11.385 ( -7.723 4.587 -1.284) 9.074 11.581 ( -1.927 -0.605 -0.628) 2.115 11.697 ( -0.013 -0.716 -2.272) 2.382 11.841 ( 0.642 2.161 2.882) 3.659 11.925 ( 4.803 -1.429 -7.099) 8.690 11.960 ( 1.885 -0.066 2.956) 3.506 12.181 ( 1.180 -0.978 -2.281) 2.748 12.306 ( -4.398 2.384 -1.076) 5.117 12.543 ( -3.359 0.532 0.189) 3.406 12.691 ( 2.333 -2.585 0.713) 3.554 12.738 ( 4.539 -5.390 -0.322) 7.054 13.071 ( -0.008 5.165 3.258) 6.107 13.271 ( 5.780 7.680 -4.698) 10.698 14.920 ( -2.541 -3.666 -0.123) 4.462 15.063 ( 1.037 1.711 3.737) 4.239 15.258 ( -2.824 3.929 -1.262) 5.000 15.431 ( 4.299 0.909 -2.558) 5.085 15.636 ( 2.024 -1.323 2.234) 3.292 15.708 ( -3.531 -3.113 -4.937) 6.821 15.881 ( -2.806 0.113 -1.131) 3.027 16.046 ( -1.039 3.285 -1.122) 3.624 16.188 ( -0.047 4.012 2.676) 4.822 16.459 ( 5.809 -0.102 1.229) 5.938 16.547 ( -0.370 -2.963 8.180) 8.708 16.841 ( 1.439 -6.247 0.839) 6.466 17.712 ( -11.408 14.947 3.037) 19.046 18.136 ( -2.177 6.095 1.005) 6.550 18.509 ( 5.677 2.256 2.515) 6.606 18.808 ( 1.583 -0.792 -3.216) 3.671 25.931 ( -1.546 -0.289 2.238) 2.735 26.006 ( -0.895 -1.186 0.741) 1.660 26.072 ( 0.105 -1.939 -0.847) 2.119 26.105 ( -0.590 -2.286 -1.253) 2.673 26.212 ( -0.027 0.769 -1.422) 1.617 26.605 ( 4.968 -1.594 -5.824) 7.819 26.826 ( -1.532 -0.580 1.808) 2.440 27.053 ( -1.877 -1.355 -0.095) 2.316 27.214 ( -0.734 -0.017 -0.199) 0.760 27.694 ( -2.414 0.643 -5.108) 5.686 28.398 ( -1.251 -0.599 4.858) 5.052 28.781 ( 5.908 -7.285 1.650) 9.524 29.008 ( 6.206 -12.031 6.560) 15.043 29.100 ( 4.292 -2.411 3.257) 5.902 29.543 ( -5.990 2.642 2.785) 7.114 30.223 ( -5.220 24.037 -10.865) 26.890 ======================= Grid point 129 (60/140) ======================= q-point: (-0.11 -0.56 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.687 ( -4.561 3.179 7.826) 9.600 2.078 ( -3.496 -7.883 -2.479) 8.973 2.167 ( -3.356 -0.730 -5.329) 6.340 2.353 ( 0.071 -4.985 3.864) 6.308 2.457 ( 0.622 -2.213 6.176) 6.590 2.645 ( -0.362 -6.567 -2.868) 7.175 2.758 ( 3.887 -3.152 0.921) 5.089 2.860 ( 2.813 1.935 -4.828) 5.913 2.924 ( 1.431 -2.046 -3.613) 4.392 3.151 ( 1.456 -0.632 -4.368) 4.647 3.187 ( 2.441 -0.428 2.528) 3.540 3.205 ( 0.165 -6.521 -2.443) 6.966 3.430 ( -2.385 2.359 3.034) 4.523 3.567 ( 2.966 -1.346 4.755) 5.764 3.665 ( -3.957 2.443 -0.261) 4.657 3.805 ( -6.118 0.327 3.541) 7.076 4.054 ( 6.229 -5.097 0.468) 8.062 4.089 ( 3.410 3.526 -1.987) 5.292 4.357 ( -4.186 4.869 5.799) 8.652 4.411 ( -12.277 -6.206 -0.192) 13.758 4.677 ( 8.468 -3.871 -5.516) 10.822 4.738 ( 0.090 0.460 -7.252) 7.267 4.881 ( 2.180 4.251 1.134) 4.910 4.958 ( -0.094 -3.927 -3.622) 5.343 5.427 ( 6.620 3.337 2.814) 7.929 5.466 ( 1.682 -4.167 4.083) 6.072 5.578 ( 2.862 0.637 -6.286) 6.936 5.777 ( -3.441 1.240 -3.691) 5.196 5.881 ( -5.892 2.600 -2.025) 6.751 6.053 ( 1.473 0.179 5.716) 5.905 6.248 ( 0.742 -1.440 4.346) 4.638 6.368 ( -2.838 1.989 -0.879) 3.575 6.500 ( -3.869 0.498 1.858) 4.321 6.901 ( -2.219 1.647 1.356) 3.079 7.005 ( 3.855 -1.615 -3.529) 5.470 7.142 ( -0.786 -0.138 5.865) 5.919 7.261 ( 3.503 4.006 0.018) 5.321 7.516 ( 5.773 -1.525 6.682) 8.961 7.661 ( -3.618 1.399 -4.053) 5.611 7.801 ( -1.128 -1.374 -5.105) 5.406 8.945 ( -0.496 -2.071 5.311) 5.722 9.329 ( -1.939 -0.760 -0.786) 2.226 9.406 ( -0.346 -3.899 -2.262) 4.521 9.472 ( -0.014 -3.020 8.957) 9.452 9.619 ( -3.462 0.420 -2.570) 4.332 9.786 ( 1.376 1.116 4.545) 4.878 10.112 ( 3.318 -0.268 -2.079) 3.925 10.189 ( -4.291 -6.438 0.084) 7.738 10.523 ( 1.999 -1.472 -1.626) 2.968 10.972 ( 2.204 -1.954 -2.169) 3.658 11.151 ( -2.151 1.989 -5.003) 5.797 11.283 ( -2.821 2.672 0.853) 3.978 11.601 ( -4.203 -4.969 -2.923) 7.134 11.691 ( 5.111 5.706 1.379) 7.784 11.760 ( 0.605 4.512 0.386) 4.569 11.903 ( 2.869 1.478 -5.852) 6.683 12.057 ( -1.612 -6.777 1.388) 7.103 12.175 ( 2.531 2.841 -2.035) 4.315 12.252 ( -1.138 1.032 2.737) 3.139 12.482 ( -1.273 3.874 1.046) 4.210 12.708 ( 3.457 2.765 -2.920) 5.303 12.841 ( 5.660 -0.847 -0.274) 5.729 13.019 ( -5.319 -2.938 0.243) 6.081 13.306 ( 2.923 -6.148 -0.647) 6.838 14.996 ( -0.944 -5.158 1.997) 5.611 15.047 ( 1.188 3.069 2.402) 4.074 15.208 ( -2.452 -0.987 -1.619) 3.099 15.400 ( 3.635 3.505 -1.089) 5.166 15.701 ( 2.141 -3.450 0.467) 4.087 15.751 ( 0.067 -4.450 -3.098) 5.422 15.828 ( -5.181 1.168 -0.783) 5.368 15.961 ( -3.556 3.804 -0.800) 5.268 16.134 ( 0.641 3.940 2.025) 4.476 16.480 ( -0.201 0.588 0.938) 1.125 16.650 ( 2.977 -2.776 4.775) 6.274 16.970 ( 6.530 -5.471 1.297) 8.617 17.391 ( -13.215 12.761 2.828) 18.587 18.052 ( -0.038 2.582 -0.410) 2.615 18.509 ( 2.747 2.302 -0.220) 3.591 18.818 ( 2.016 -0.446 -2.989) 3.633 25.933 ( -1.116 0.275 2.656) 2.894 26.010 ( -0.761 0.021 0.016) 0.761 26.097 ( -0.609 -1.305 0.702) 1.602 26.136 ( -0.523 -2.225 0.750) 2.406 26.206 ( 0.588 -0.109 -0.765) 0.971 26.639 ( 5.894 -0.890 -5.209) 7.916 26.829 ( -1.408 0.240 1.558) 2.114 26.995 ( -3.323 1.371 -9.182) 9.861 27.284 ( 2.000 -2.591 12.762) 13.175 27.664 ( -1.116 -0.888 -4.274) 4.506 28.410 ( -2.501 0.099 3.612) 4.394 28.943 ( 4.065 -6.250 -4.661) 8.793 29.123 ( 0.023 0.701 0.495) 0.859 29.328 ( 10.756 -11.295 7.829) 17.452 29.442 ( -6.017 3.374 -1.537) 7.067 29.765 ( -6.244 17.920 -5.354) 19.717 ======================= Grid point 135 (61/140) ======================= q-point: (-0.44 -0.44 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.333 ( 9.023 0.000 -12.142) 15.128 1.464 ( -4.421 -0.000 -11.134) 11.979 1.810 ( 8.761 0.000 -1.511) 8.890 1.997 ( -7.157 -0.000 0.466) 7.172 2.088 ( -22.056 -0.000 0.006) 22.056 2.205 ( -2.735 -0.000 -1.991) 3.383 2.461 ( 0.632 0.000 0.417) 0.757 2.478 ( 2.832 0.000 -0.166) 2.837 2.654 ( 3.493 0.000 5.521) 6.533 3.066 ( -6.042 -0.000 -12.850) 14.199 3.089 ( 7.549 0.000 1.497) 7.696 3.185 ( -1.407 -0.000 3.930) 4.174 3.210 ( 0.543 0.000 4.503) 4.535 3.585 ( -12.515 -0.000 0.176) 12.516 3.718 ( 0.281 0.000 -2.505) 2.521 3.905 ( 3.476 0.000 -7.608) 8.365 3.924 ( 4.164 0.000 3.984) 5.762 4.131 ( -4.152 -0.000 -6.159) 7.428 4.177 ( 5.384 0.000 0.695) 5.429 4.183 ( -1.052 -0.000 12.309) 12.354 4.534 ( 0.398 0.000 -3.420) 3.443 4.715 ( -3.180 -0.000 9.019) 9.563 4.885 ( 2.458 0.000 -10.388) 10.675 5.117 ( 0.436 0.000 -3.973) 3.997 5.207 ( 2.938 0.000 -1.466) 3.283 5.516 ( 1.627 0.000 2.806) 3.244 5.576 ( 2.806 0.000 4.240) 5.085 6.020 ( 5.087 0.000 1.821) 5.403 6.027 ( -2.983 -0.000 -4.609) 5.490 6.104 ( -3.341 -0.000 4.914) 5.942 6.357 ( -2.608 -0.000 -5.782) 6.343 6.542 ( -5.832 -0.000 3.411) 6.756 6.734 ( 3.193 0.000 -1.015) 3.350 6.771 ( 2.951 0.000 -6.293) 6.951 7.037 ( 0.401 0.000 3.117) 3.143 7.168 ( -6.313 -0.000 -0.817) 6.366 7.385 ( 3.039 0.000 3.592) 4.705 7.408 ( 5.423 0.000 9.848) 11.243 7.636 ( 1.612 0.000 1.164) 1.989 8.006 ( -1.215 -0.000 -4.569) 4.728 8.641 ( 8.869 0.000 2.278) 9.157 8.727 ( -5.368 -0.000 3.708) 6.524 8.998 ( -1.556 -0.000 2.317) 2.791 9.010 ( 0.101 0.000 11.123) 11.123 9.443 ( -2.174 -0.000 7.784) 8.082 9.863 ( 1.031 0.000 -2.087) 2.328 10.054 ( 6.701 0.000 -9.633) 11.735 10.384 ( -0.360 -0.000 -11.602) 11.607 10.394 ( -1.199 -0.000 -6.340) 6.452 10.614 ( -0.781 -0.000 -11.782) 11.808 11.203 ( -3.308 -0.000 -0.324) 3.324 11.375 ( 1.078 0.000 0.505) 1.190 11.490 ( 0.563 0.000 6.084) 6.110 11.737 ( -15.681 -0.000 -1.131) 15.722 11.764 ( 1.498 0.000 -3.704) 3.995 11.827 ( 1.074 0.000 0.634) 1.247 12.144 ( 3.670 0.000 0.779) 3.752 12.217 ( 4.145 0.000 -4.024) 5.777 12.293 ( 7.377 0.000 2.942) 7.942 12.452 ( -4.922 -0.000 -11.255) 12.284 12.458 ( -4.847 -0.000 0.082) 4.848 12.763 ( 1.564 0.000 -1.143) 1.937 13.288 ( 4.513 0.000 9.540) 10.554 13.749 ( -2.395 -0.000 -5.109) 5.642 15.031 ( -0.906 -0.000 0.243) 0.938 15.119 ( 1.407 0.000 2.223) 2.630 15.322 ( 1.036 0.000 5.685) 5.778 15.385 ( -3.129 -0.000 -0.254) 3.139 15.758 ( 3.699 0.000 -1.711) 4.076 15.785 ( -0.114 -0.000 3.060) 3.062 15.904 ( -1.400 -0.000 -7.651) 7.778 16.063 ( 5.410 0.000 -3.857) 6.645 16.312 ( -0.468 -0.000 5.096) 5.117 16.326 ( 2.713 0.000 -0.546) 2.767 16.500 ( 0.283 0.000 3.340) 3.352 16.514 ( -5.190 -0.000 5.202) 7.349 18.273 ( -12.722 -0.000 2.388) 12.944 18.457 ( 2.817 0.000 2.589) 3.826 18.470 ( 9.242 0.000 8.075) 12.273 18.789 ( 1.145 0.000 -1.407) 1.814 25.899 ( 0.951 0.000 1.963) 2.182 25.948 ( -0.783 -0.000 -1.087) 1.340 25.984 ( -2.542 -0.000 -1.359) 2.882 26.036 ( -0.187 -0.000 -0.722) 0.746 26.284 ( -2.191 -0.000 -5.458) 5.882 26.495 ( 2.337 0.000 -3.238) 3.993 26.832 ( -2.516 -0.000 1.635) 3.001 26.941 ( -0.277 -0.000 3.993) 4.002 27.267 ( -1.943 -0.000 -7.194) 7.452 27.847 ( -6.213 -0.000 -14.925) 16.167 28.362 ( -2.724 -0.000 10.513) 10.860 28.438 ( 2.996 0.000 8.554) 9.063 28.585 ( -0.074 -0.000 -0.919) 0.922 28.921 ( 10.281 0.000 8.127) 13.105 29.622 ( -3.989 -0.000 10.127) 10.885 31.146 ( 6.125 0.000 -12.679) 14.081 ======================= Grid point 136 (62/140) ======================= q-point: (-0.33 -0.44 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.367 ( -1.065 -11.922 -8.205) 14.512 1.661 ( -1.526 -21.504 -13.316) 25.339 1.887 ( -16.721 -1.188 -0.823) 16.784 1.910 ( -3.403 -4.787 -0.227) 5.878 2.065 ( 2.060 -7.832 3.430) 8.795 2.241 ( 1.065 -5.620 -0.828) 5.779 2.462 ( -3.449 0.884 0.364) 3.579 2.520 ( 0.579 -7.580 -3.170) 8.237 2.757 ( -0.556 -6.405 5.468) 8.440 2.922 ( -5.451 -0.491 -10.332) 11.692 3.131 ( -2.067 -0.205 -2.979) 3.631 3.218 ( 8.543 1.048 0.618) 8.629 3.290 ( 2.488 -3.172 8.762) 9.645 3.538 ( -9.640 -5.693 -3.435) 11.711 3.695 ( 4.356 3.652 1.866) 5.983 3.828 ( 1.495 3.155 -1.844) 3.949 3.957 ( -1.229 4.896 7.577) 9.104 4.068 ( -7.333 -2.021 -1.279) 7.713 4.238 ( 2.545 -5.033 -1.102) 5.746 4.371 ( 6.139 -9.274 -2.440) 11.386 4.542 ( 1.919 -1.672 -3.382) 4.233 4.675 ( -0.644 4.634 4.630) 6.582 4.891 ( -3.612 -1.831 -4.296) 5.903 5.091 ( 5.572 2.417 -2.121) 6.434 5.214 ( 1.803 -0.298 0.648) 1.939 5.521 ( -0.038 2.115 1.488) 2.586 5.585 ( 3.300 2.374 2.714) 4.888 5.965 ( -5.255 -0.347 -9.241) 10.636 6.039 ( 6.303 3.047 1.699) 7.204 6.115 ( -3.717 -0.588 1.953) 4.240 6.272 ( -2.252 4.660 0.573) 5.207 6.504 ( -4.798 1.504 4.542) 6.776 6.684 ( -0.007 3.854 -5.443) 6.669 6.814 ( 5.907 -1.375 -0.329) 6.074 7.032 ( -3.786 1.560 4.143) 5.825 7.148 ( -0.874 -3.597 -2.383) 4.403 7.342 ( 4.611 8.121 4.379) 10.314 7.490 ( 3.809 0.922 9.440) 10.221 7.737 ( 4.302 -5.345 -0.987) 6.932 7.916 ( -4.383 4.683 -5.140) 8.220 8.721 ( -0.238 -3.593 0.467) 3.631 8.835 ( 6.207 -10.579 1.945) 12.419 9.024 ( -0.111 -2.772 10.191) 10.562 9.173 ( 1.943 -9.081 9.687) 13.419 9.488 ( -2.023 -3.232 8.348) 9.178 9.756 ( 0.487 6.538 -2.359) 6.968 10.126 ( 0.551 -1.530 -11.964) 12.074 10.255 ( -0.144 5.995 -3.577) 6.982 10.436 ( 1.622 -5.776 -8.411) 10.331 10.651 ( 5.679 -11.257 -14.810) 19.450 11.168 ( -5.409 -1.203 -0.753) 5.592 11.401 ( -3.961 -2.559 0.099) 4.717 11.501 ( -5.219 -4.191 -5.924) 8.939 11.660 ( -5.795 -0.090 8.853) 10.582 11.731 ( 2.873 2.897 -3.549) 5.407 11.880 ( -0.060 -3.025 3.064) 4.306 12.144 ( 0.926 2.102 -0.699) 2.401 12.177 ( 1.255 1.728 -4.455) 4.940 12.338 ( -3.747 0.527 -8.819) 9.597 12.449 ( 1.415 -1.588 6.865) 7.187 12.479 ( 8.184 -5.843 -5.428) 11.427 12.750 ( 0.769 2.091 0.275) 2.245 13.308 ( 2.025 5.186 7.679) 9.485 13.641 ( -0.953 7.537 -6.181) 9.794 14.965 ( -2.537 5.226 1.082) 5.909 15.124 ( 1.908 1.991 3.486) 4.445 15.363 ( 3.743 -1.805 0.181) 4.159 15.442 ( -3.105 -6.768 2.493) 7.853 15.612 ( -0.338 14.015 -0.997) 14.055 15.824 ( -0.843 3.699 -5.823) 6.949 15.828 ( 0.857 -2.295 0.218) 2.460 16.120 ( 2.403 -0.347 -4.268) 4.910 16.288 ( 4.546 1.571 2.067) 5.234 16.398 ( 0.476 -3.258 3.224) 4.608 16.494 ( -3.616 0.160 5.424) 6.521 16.590 ( 0.037 -6.872 3.221) 7.589 18.126 ( -12.704 6.283 0.678) 14.189 18.401 ( -2.046 8.126 6.702) 10.729 18.591 ( 9.954 0.750 6.381) 11.847 18.788 ( 1.307 0.588 -1.533) 2.098 25.917 ( -1.551 -0.020 2.463) 2.911 25.946 ( 0.185 -1.612 0.083) 1.624 25.979 ( -2.236 -2.544 -2.675) 4.316 26.044 ( 0.789 -1.081 -0.899) 1.613 26.238 ( -1.763 0.508 -3.980) 4.383 26.522 ( 3.490 -2.814 -4.806) 6.572 26.822 ( -1.928 0.305 3.169) 3.722 26.977 ( -0.645 -2.266 3.161) 3.942 27.219 ( -1.700 0.117 -5.430) 5.691 27.727 ( -4.665 0.686 -11.946) 12.843 28.382 ( -1.761 -0.290 4.684) 5.013 28.578 ( 4.411 -6.112 11.401) 13.667 28.617 ( -0.361 -5.310 0.356) 5.334 29.037 ( 8.141 -1.221 3.724) 9.035 29.627 ( -4.735 1.870 11.687) 12.748 30.986 ( 3.224 15.945 -14.001) 21.463 ======================= Grid point 137 (63/140) ======================= q-point: (-0.22 -0.44 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.592 ( -6.396 -18.616 -4.012) 20.089 1.744 ( -20.107 -2.513 1.092) 20.293 1.915 ( -5.136 -14.639 -10.910) 18.966 1.980 ( -3.794 -9.374 -0.806) 10.144 2.276 ( 8.035 -7.329 4.536) 11.784 2.395 ( 3.704 -7.556 -0.394) 8.424 2.482 ( -3.315 -9.225 1.685) 9.947 2.698 ( 2.106 -13.083 -6.819) 14.903 2.891 ( -2.621 -9.273 -0.456) 9.647 2.933 ( 1.075 -5.233 -1.279) 5.493 3.052 ( 1.256 6.223 -4.144) 7.581 3.255 ( 4.899 0.567 1.890) 5.282 3.406 ( -0.802 -4.836 4.526) 6.672 3.590 ( -4.499 -5.930 -2.976) 8.017 3.681 ( 2.413 1.413 1.062) 2.991 3.810 ( 3.370 4.915 7.504) 9.582 3.899 ( -1.832 0.541 6.440) 6.718 4.070 ( -9.065 -6.080 -2.663) 11.235 4.270 ( -0.232 1.492 -3.535) 3.844 4.494 ( 4.240 -0.637 -2.173) 4.807 4.570 ( 1.231 -1.652 -3.070) 3.697 4.690 ( 3.403 -5.514 -2.076) 6.804 4.816 ( -2.601 2.708 -4.444) 5.818 5.100 ( 4.253 3.089 1.125) 5.375 5.287 ( 2.048 -4.489 5.998) 7.767 5.485 ( 1.107 2.427 1.823) 3.231 5.593 ( 5.712 1.058 -0.802) 5.865 5.862 ( -5.113 1.539 -10.101) 11.426 6.024 ( -1.999 4.025 -3.558) 5.732 6.063 ( 0.679 2.050 0.289) 2.179 6.213 ( -2.500 2.078 6.455) 7.227 6.475 ( -2.906 1.298 5.541) 6.390 6.586 ( -3.031 3.787 -3.057) 5.734 6.841 ( 1.235 0.079 0.091) 1.241 7.027 ( -2.027 -0.595 4.676) 5.131 7.214 ( 3.581 0.766 -2.779) 4.597 7.304 ( 9.788 1.237 5.103) 11.108 7.528 ( 1.090 1.937 8.871) 9.146 7.743 ( -5.414 4.156 -3.475) 7.659 7.822 ( 3.217 0.676 -5.025) 6.005 8.830 ( 2.188 -6.624 2.414) 7.382 9.061 ( 4.407 -10.141 -2.102) 11.255 9.195 ( 0.949 -8.527 14.248) 16.632 9.383 ( 2.065 -6.578 6.205) 9.275 9.569 ( -4.253 -3.102 4.243) 6.761 9.710 ( 3.129 -1.284 4.192) 5.387 10.040 ( -1.890 0.012 -13.394) 13.527 10.124 ( -4.245 4.668 -3.093) 7.027 10.477 ( 1.821 -1.905 -4.505) 5.219 10.861 ( 12.553 -7.684 -10.687) 18.189 11.157 ( -7.871 -3.226 -0.761) 8.540 11.364 ( -7.859 0.954 -0.056) 7.917 11.484 ( -5.836 -2.651 -10.484) 12.289 11.698 ( 3.009 -2.801 3.185) 5.200 11.780 ( 0.103 -5.195 1.568) 5.428 11.916 ( 2.122 -0.604 0.471) 2.256 12.099 ( 2.723 6.756 1.280) 7.396 12.167 ( 2.948 -1.520 -1.340) 3.577 12.248 ( -7.935 -1.229 -5.739) 9.870 12.502 ( -1.554 -2.394 4.174) 5.056 12.644 ( 9.372 -4.720 -5.220) 11.720 12.735 ( 2.691 0.067 2.200) 3.477 13.238 ( 1.123 8.206 5.739) 10.077 13.447 ( 3.267 10.991 -7.266) 13.574 14.882 ( -2.775 1.680 1.881) 3.750 15.123 ( 1.475 2.212 3.941) 4.754 15.355 ( -3.951 10.616 -0.916) 11.364 15.440 ( 5.828 -2.046 -2.809) 6.785 15.549 ( -1.888 -6.666 0.954) 6.993 15.718 ( -0.819 4.709 -2.395) 5.346 15.858 ( -0.242 -0.478 -1.378) 1.478 16.078 ( -1.194 2.511 -2.371) 3.654 16.271 ( 1.361 3.894 1.046) 4.255 16.486 ( -1.922 0.157 3.716) 4.186 16.528 ( 3.605 -5.519 4.182) 7.806 16.747 ( 3.637 -7.672 2.839) 8.952 17.869 ( -12.961 12.629 1.238) 18.139 18.241 ( -7.593 8.934 6.850) 13.579 18.644 ( 8.782 4.999 3.711) 10.765 18.786 ( 1.245 -1.024 -3.377) 3.743 25.914 ( -2.821 -0.697 2.324) 3.721 25.985 ( 0.519 -1.596 0.782) 1.852 26.004 ( -2.180 -3.529 -1.698) 4.482 26.070 ( 0.873 -1.545 -1.051) 2.063 26.210 ( -0.276 -0.028 -1.944) 1.964 26.589 ( 6.756 -2.845 -5.353) 9.077 26.825 ( -1.113 0.028 4.152) 4.299 27.008 ( -1.087 -1.041 -4.103) 4.370 27.210 ( -0.723 -1.689 4.685) 5.033 27.649 ( -1.733 -0.373 -7.832) 8.030 28.396 ( -1.935 -0.513 3.708) 4.214 28.694 ( 2.170 -6.415 -1.758) 6.996 28.871 ( 5.663 -13.581 9.282) 17.397 29.119 ( 4.665 -1.381 -0.230) 4.871 29.593 ( -4.721 4.501 10.776) 12.596 30.540 ( -5.312 25.513 -14.453) 29.799 ======================= Grid point 138 (64/140) ======================= q-point: (-0.11 -0.44 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.657 ( -16.549 -2.537 7.235) 18.239 1.805 ( -9.164 -16.249 -4.722) 19.243 2.011 ( -1.192 -9.404 -3.891) 10.247 2.217 ( 1.520 -13.603 0.197) 13.689 2.459 ( 4.519 -4.206 4.667) 7.739 2.499 ( -1.923 -7.161 -0.678) 7.446 2.675 ( 1.659 -9.903 -1.236) 10.116 2.840 ( 2.537 -5.160 -7.155) 9.179 2.917 ( 2.391 4.779 -5.357) 7.567 3.058 ( -0.577 -8.197 0.414) 8.227 3.075 ( 2.762 -8.842 -1.121) 9.331 3.275 ( 4.405 3.847 2.911) 6.533 3.454 ( -4.636 -0.412 2.990) 5.532 3.589 ( -3.229 0.291 -0.595) 3.296 3.694 ( -4.058 -2.868 2.359) 5.501 3.772 ( 3.494 5.257 2.807) 6.908 4.008 ( 5.480 -5.840 6.345) 10.217 4.110 ( -7.059 -7.936 -1.884) 10.787 4.203 ( -0.415 1.499 -3.284) 3.634 4.459 ( -3.441 6.590 6.194) 9.676 4.617 ( 3.634 -4.872 -4.659) 7.658 4.751 ( 1.692 0.316 -5.334) 5.605 4.821 ( 3.641 -5.812 -6.551) 9.484 5.040 ( 1.192 6.803 2.270) 7.271 5.418 ( 2.344 -4.470 5.130) 7.196 5.482 ( 0.566 -0.382 -1.185) 1.368 5.642 ( 8.567 0.113 1.477) 8.694 5.745 ( -3.540 2.605 -8.126) 9.239 5.874 ( -6.909 4.433 -3.468) 8.911 6.073 ( 0.901 -0.454 2.053) 2.288 6.205 ( -4.535 -0.733 4.494) 6.427 6.443 ( 1.234 4.124 1.082) 4.439 6.502 ( -2.614 1.424 -0.204) 2.984 6.880 ( -0.919 -2.728 2.672) 3.928 7.037 ( -0.473 0.102 2.379) 2.428 7.155 ( 1.186 4.611 -1.657) 5.041 7.397 ( 4.440 4.051 5.564) 8.190 7.575 ( 5.075 -2.813 4.047) 7.075 7.632 ( -3.157 3.066 0.418) 4.421 7.798 ( 4.717 1.967 -4.884) 7.069 8.940 ( 0.102 -1.737 3.307) 3.737 9.239 ( 2.806 -9.276 -2.949) 10.129 9.352 ( -0.564 -2.157 2.443) 3.308 9.484 ( 1.559 -2.730 11.586) 12.005 9.585 ( -2.616 0.487 -1.005) 2.844 9.803 ( 0.683 -2.366 3.928) 4.636 10.023 ( -2.249 -6.596 -10.220) 12.369 10.070 ( -1.881 -3.544 1.488) 4.279 10.512 ( 3.312 -1.628 -2.443) 4.426 10.959 ( 5.055 -0.232 -4.806) 6.979 11.108 ( -6.396 -0.791 -4.470) 7.843 11.289 ( -5.571 1.371 1.803) 6.014 11.448 ( -5.160 -4.352 -5.905) 8.969 11.797 ( 4.341 1.426 4.283) 6.263 11.823 ( -0.981 -2.868 -1.859) 3.556 11.926 ( 1.546 0.605 -5.413) 5.662 11.979 ( 0.187 4.816 -0.554) 4.851 12.206 ( -5.696 -0.777 0.166) 5.751 12.262 ( 5.563 -2.561 2.113) 6.478 12.524 ( -0.524 0.673 3.201) 3.313 12.733 ( 1.244 -3.111 1.006) 3.499 12.807 ( 5.547 -2.276 -3.127) 6.762 13.106 ( 3.111 10.586 2.207) 11.252 13.315 ( 5.722 4.353 -6.077) 9.414 14.905 ( -1.232 -4.252 3.745) 5.799 15.081 ( -3.648 2.200 -0.360) 4.275 15.233 ( 1.863 3.207 2.880) 4.696 15.487 ( 5.225 1.672 -3.025) 6.265 15.621 ( -2.266 -3.761 -3.243) 5.459 15.683 ( 1.338 -2.626 1.930) 3.523 15.829 ( -1.017 1.853 -2.146) 3.012 15.998 ( -3.124 3.845 -1.116) 5.078 16.217 ( 0.948 3.970 1.150) 4.241 16.478 ( -3.974 -0.075 2.889) 4.913 16.653 ( 4.333 -3.040 1.594) 5.528 16.929 ( 7.870 -6.889 3.178) 10.932 17.528 ( -15.701 14.688 3.372) 21.763 18.092 ( -6.041 4.398 2.799) 7.980 18.606 ( 4.343 5.942 -0.060) 7.360 18.804 ( 1.938 -1.208 -3.235) 3.959 25.920 ( -2.857 -1.076 2.423) 3.897 26.011 ( 0.563 -0.442 1.142) 1.348 26.041 ( -2.298 -3.503 -0.454) 4.214 26.094 ( -0.269 -1.818 -1.198) 2.194 26.213 ( 1.397 -0.204 -0.467) 1.487 26.657 ( 8.629 -0.830 -4.679) 9.851 26.836 ( -1.167 0.272 3.018) 3.247 26.959 ( -1.631 1.141 -6.407) 6.709 27.310 ( 1.711 -3.688 12.204) 12.863 27.627 ( 1.315 -0.543 -5.240) 5.430 28.400 ( -2.965 -0.214 2.631) 3.969 28.828 ( 3.005 -7.753 -4.399) 9.407 29.137 ( 1.885 -1.188 -1.151) 2.508 29.199 ( 5.815 -12.313 0.959) 13.651 29.509 ( -4.321 6.550 9.013) 11.951 29.998 ( -9.971 21.049 -9.002) 24.971 ======================= Grid point 145 (65/140) ======================= q-point: (-0.33 -0.33 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.200 ( -14.235 -0.000 -12.808) 19.149 1.376 ( 8.293 0.000 -7.558) 11.220 1.606 ( -27.715 -0.000 -8.742) 29.061 1.993 ( -1.144 -0.000 2.658) 2.894 2.002 ( 8.494 0.000 8.358) 11.917 2.178 ( 4.707 0.000 -3.729) 6.005 2.399 ( -17.965 -0.000 -4.223) 18.454 2.477 ( 2.532 0.000 -1.731) 3.067 2.625 ( -12.418 -0.000 1.899) 12.562 2.853 ( -0.740 -0.000 -2.322) 2.437 3.077 ( -3.977 -0.000 -3.014) 4.990 3.279 ( 7.928 0.000 3.040) 8.491 3.334 ( 5.214 0.000 3.724) 6.407 3.491 ( -0.439 -0.000 0.836) 0.944 3.721 ( 0.854 0.000 1.980) 2.156 3.830 ( -4.084 -0.000 -6.339) 7.541 4.037 ( 5.047 0.000 5.140) 7.204 4.068 ( 3.265 0.000 -4.106) 5.246 4.227 ( -4.902 -0.000 6.315) 7.995 4.286 ( 8.183 0.000 -3.165) 8.774 4.529 ( 4.061 0.000 -4.939) 6.394 4.770 ( -2.751 -0.000 11.051) 11.389 4.822 ( -2.648 -0.000 -1.023) 2.839 5.121 ( 4.600 0.000 -4.321) 6.311 5.230 ( 0.891 0.000 -0.850) 1.231 5.529 ( -0.755 -0.000 -0.605) 0.967 5.646 ( 1.464 0.000 3.847) 4.116 5.858 ( -6.536 -0.000 -11.267) 13.025 6.085 ( -3.395 -0.000 1.108) 3.572 6.132 ( 8.611 0.000 -3.199) 9.186 6.301 ( -2.788 -0.000 3.039) 4.124 6.510 ( -3.446 -0.000 5.076) 6.135 6.682 ( -1.075 -0.000 -8.224) 8.294 6.851 ( 5.226 0.000 1.878) 5.553 7.046 ( -3.941 -0.000 4.596) 6.054 7.065 ( -3.110 -0.000 -2.937) 4.277 7.488 ( 2.816 0.000 6.164) 6.776 7.601 ( 9.150 0.000 4.622) 10.252 7.699 ( 4.987 0.000 0.634) 5.027 7.905 ( -4.517 -0.000 -5.184) 6.876 8.646 ( -2.551 -0.000 -5.293) 5.876 8.839 ( 10.331 0.000 4.907) 11.437 9.063 ( -0.443 -0.000 12.434) 12.442 9.157 ( 4.334 0.000 11.089) 11.906 9.484 ( -1.479 -0.000 7.789) 7.928 9.857 ( -0.528 -0.000 0.591) 0.792 10.069 ( 7.958 0.000 -12.308) 14.656 10.270 ( 3.321 0.000 -14.440) 14.817 10.335 ( -0.249 -0.000 -3.062) 3.072 10.480 ( -1.785 -0.000 -11.132) 11.274 11.094 ( -8.134 -0.000 -2.641) 8.552 11.350 ( -3.721 -0.000 -0.320) 3.735 11.382 ( -7.858 -0.000 -4.777) 9.196 11.654 ( -7.811 -0.000 8.031) 11.203 11.775 ( 4.981 0.000 -4.270) 6.561 11.869 ( 0.786 0.000 3.359) 3.450 12.110 ( -2.163 -0.000 -6.374) 6.731 12.159 ( -1.783 -0.000 -3.808) 4.205 12.340 ( -0.996 -0.000 -4.669) 4.774 12.444 ( 8.606 0.000 -7.157) 11.193 12.517 ( 7.098 0.000 9.420) 11.795 12.777 ( 0.673 0.000 0.623) 0.917 13.385 ( -2.769 -0.000 7.043) 7.568 13.672 ( 0.534 0.000 -5.914) 5.938 15.025 ( -0.187 -0.000 0.993) 1.010 15.171 ( 2.063 0.000 1.563) 2.588 15.315 ( -5.213 -0.000 1.270) 5.366 15.427 ( 5.523 0.000 3.982) 6.809 15.730 ( -5.393 -0.000 -5.364) 7.606 15.808 ( 4.019 0.000 -1.442) 4.270 15.858 ( 0.355 0.000 -0.207) 0.411 16.122 ( 6.095 0.000 -2.595) 6.624 16.328 ( -1.042 -0.000 -1.273) 1.645 16.370 ( 2.870 0.000 1.971) 3.481 16.481 ( -6.440 -0.000 6.450) 9.115 16.559 ( 3.416 0.000 3.680) 5.021 18.070 ( -13.783 -0.000 -0.094) 13.783 18.499 ( -1.139 -0.000 2.657) 2.891 18.673 ( 5.290 0.000 3.240) 6.203 18.858 ( 6.274 0.000 10.254) 12.021 25.913 ( -1.979 -0.000 -0.960) 2.200 25.915 ( -3.653 -0.000 -0.293) 3.665 25.947 ( 1.637 0.000 2.047) 2.621 26.038 ( 1.255 0.000 -0.945) 1.570 26.210 ( -1.973 -0.000 -2.397) 3.105 26.481 ( 1.514 0.000 -5.990) 6.178 26.835 ( -0.804 -0.000 5.198) 5.260 26.962 ( -0.544 -0.000 1.460) 1.558 27.183 ( -1.894 -0.000 -3.371) 3.867 27.635 ( -4.224 -0.000 -11.620) 12.364 28.383 ( -2.320 -0.000 4.395) 4.969 28.572 ( -0.033 -0.000 -1.326) 1.326 28.602 ( 2.733 0.000 11.673) 11.988 29.090 ( 5.732 0.000 -1.085) 5.834 29.684 ( -3.714 -0.000 15.959) 16.385 31.104 ( 6.561 0.000 -16.421) 17.683 ======================= Grid point 146 (66/140) ======================= q-point: (-0.22 -0.33 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.166 ( -14.650 -17.001 -7.790) 23.756 1.405 ( -26.242 -8.605 -9.618) 29.243 1.565 ( 1.302 -16.266 -6.241) 17.471 1.931 ( -10.428 3.060 1.183) 10.932 2.189 ( 0.823 -9.792 4.957) 11.006 2.258 ( -5.945 -8.191 -1.089) 10.179 2.338 ( 5.426 -9.778 1.525) 11.286 2.507 ( 2.498 -3.964 -3.207) 5.678 2.676 ( -5.360 -9.858 1.995) 11.397 2.871 ( -0.040 -2.616 0.253) 2.628 3.059 ( -3.208 -2.518 -2.225) 4.645 3.324 ( 2.293 6.394 -1.402) 6.936 3.383 ( 2.770 -3.538 2.432) 5.109 3.470 ( 2.676 0.059 -0.504) 2.724 3.752 ( -2.197 1.237 -2.420) 3.494 3.825 ( 1.418 -5.804 5.634) 8.212 3.998 ( 2.256 4.398 -0.150) 4.945 4.068 ( 2.195 7.921 7.800) 11.331 4.242 ( 1.394 -4.035 -1.671) 4.584 4.412 ( 5.468 -7.178 -7.403) 11.671 4.543 ( 2.981 -0.473 -5.064) 5.895 4.731 ( -2.023 4.452 8.281) 9.617 4.820 ( -1.644 0.730 0.563) 1.885 5.136 ( 1.816 0.029 -2.005) 2.705 5.268 ( 1.628 -3.971 4.157) 5.975 5.509 ( -1.327 0.743 -0.766) 1.703 5.651 ( 0.576 1.947 -0.043) 2.031 5.771 ( -3.010 -1.665 -10.311) 10.870 6.043 ( -2.699 3.078 -1.825) 4.482 6.140 ( 6.364 3.373 -4.545) 8.517 6.273 ( -1.952 2.885 4.812) 5.941 6.493 ( -3.215 1.385 4.963) 6.073 6.600 ( -3.127 2.832 -5.603) 7.013 6.871 ( 0.088 1.754 1.698) 2.443 7.002 ( -5.756 -0.038 3.323) 6.647 7.150 ( 3.893 -8.024 -2.831) 9.357 7.510 ( 9.518 6.030 4.402) 12.097 7.591 ( 0.186 2.802 5.266) 5.968 7.774 ( -1.076 2.679 -3.346) 4.419 7.842 ( 4.264 -0.337 -0.506) 4.307 8.684 ( -0.174 -8.663 -3.491) 9.342 8.988 ( 7.990 -5.373 2.550) 9.961 9.157 ( 0.307 -4.128 14.169) 14.761 9.317 ( 4.721 -6.577 7.526) 11.054 9.534 ( -1.050 -1.726 6.858) 7.150 9.770 ( 1.053 4.829 2.986) 5.774 9.974 ( -2.129 3.709 -15.419) 16.001 10.209 ( -1.657 8.377 -2.226) 8.824 10.407 ( 2.136 -5.994 -4.470) 7.776 10.666 ( 15.011 -22.131 -13.681) 30.038 11.033 ( -8.705 -2.310 -2.515) 9.351 11.308 ( -6.294 -0.590 -0.247) 6.326 11.345 ( -5.361 -2.508 -4.858) 7.657 11.632 ( -8.242 -2.877 3.342) 9.347 11.781 ( 5.790 0.898 -2.073) 6.215 11.909 ( 0.070 -2.909 3.543) 4.585 12.104 ( -6.422 0.295 -5.520) 8.473 12.137 ( 2.025 -4.509 -1.521) 5.172 12.245 ( -0.376 6.476 -3.558) 7.399 12.493 ( 5.343 -1.562 -3.484) 6.567 12.647 ( 8.918 -2.643 2.819) 9.719 12.775 ( 1.230 1.045 1.932) 2.517 13.355 ( -4.577 3.138 6.520) 8.562 13.600 ( 4.164 6.982 -5.576) 9.858 14.951 ( -1.146 6.410 2.686) 7.044 15.187 ( 1.766 1.031 2.342) 3.110 15.361 ( -1.432 -6.538 -1.160) 6.793 15.481 ( 0.945 2.766 -0.881) 3.053 15.561 ( -1.320 8.657 0.696) 8.785 15.780 ( -0.991 5.445 -1.433) 5.717 15.846 ( 2.324 -0.997 -1.372) 2.877 16.102 ( 0.614 3.290 -4.043) 5.248 16.349 ( 0.656 3.981 0.371) 4.052 16.424 ( -2.890 -7.722 3.593) 8.994 16.489 ( 0.516 -2.220 1.830) 2.923 16.680 ( 6.520 -6.845 4.424) 10.437 17.920 ( -12.434 5.264 -1.523) 13.588 18.389 ( -8.273 10.726 7.266) 15.372 18.735 ( 3.450 -2.541 -2.719) 5.075 18.888 ( 7.135 9.847 10.419) 16.013 25.887 ( -3.068 -0.612 0.179) 3.134 25.923 ( -1.991 -2.899 -1.090) 3.681 25.979 ( 0.894 -0.411 3.712) 3.840 26.054 ( 1.204 -0.877 -0.629) 1.617 26.190 ( -1.167 -0.414 -1.089) 1.649 26.538 ( 5.980 -6.756 -4.829) 10.233 26.853 ( -0.019 0.869 5.533) 5.601 26.969 ( -0.463 -0.605 -2.741) 2.845 27.183 ( -1.791 -2.768 4.102) 5.263 27.574 ( -1.566 -2.255 -8.540) 8.970 28.390 ( -2.056 -0.401 3.309) 3.917 28.598 ( 0.362 -4.060 -1.949) 4.518 28.753 ( 3.166 -8.996 8.542) 12.803 29.116 ( 2.500 -0.828 -4.280) 5.026 29.708 ( -2.809 3.780 15.794) 16.481 30.849 ( -0.997 22.799 -19.925) 30.295 ======================= Grid point 147 (67/140) ======================= q-point: (-0.11 -0.33 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.350 ( -15.460 -21.181 -8.190) 27.472 1.400 ( -23.535 -12.089 6.523) 27.251 1.803 ( -6.102 -14.895 0.462) 16.103 1.951 ( 0.456 -16.232 -4.692) 16.903 2.327 ( -2.439 -8.096 2.595) 8.845 2.455 ( 2.562 -4.903 2.046) 5.898 2.520 ( 6.123 -8.432 -0.075) 10.421 2.693 ( 6.202 -13.401 -4.390) 15.405 2.844 ( -2.103 -11.934 -0.894) 12.151 2.943 ( -1.152 -6.686 1.962) 7.063 3.035 ( 0.685 4.746 -1.894) 5.156 3.280 ( -4.292 -6.335 0.591) 7.675 3.412 ( -0.900 1.748 1.559) 2.509 3.508 ( -0.514 -1.659 -1.977) 2.632 3.702 ( -1.748 1.840 -1.271) 2.839 3.910 ( 0.416 5.391 -0.116) 5.408 3.983 ( 1.118 -4.719 6.802) 8.354 4.037 ( 5.197 2.197 9.290) 10.869 4.259 ( 4.291 2.619 -3.195) 5.957 4.513 ( -3.554 0.997 -3.553) 5.124 4.551 ( 5.862 -7.156 -4.041) 10.094 4.688 ( -2.574 2.118 2.830) 4.373 4.812 ( 5.228 0.070 -4.385) 6.824 5.125 ( -1.027 1.767 1.444) 2.502 5.391 ( 1.302 -4.515 4.609) 6.582 5.482 ( 0.554 1.371 -0.980) 1.774 5.605 ( -5.598 -2.616 -6.388) 8.888 5.775 ( 6.992 0.369 -2.661) 7.491 5.909 ( -4.019 7.030 -3.554) 8.844 6.102 ( 2.582 2.617 -2.435) 4.409 6.229 ( -2.158 3.352 5.256) 6.597 6.484 ( -2.131 -0.392 3.429) 4.057 6.508 ( -1.017 2.571 -4.287) 5.101 6.855 ( -2.012 0.041 2.580) 3.273 6.979 ( -8.127 -2.458 2.015) 8.726 7.265 ( 5.637 0.362 -2.547) 6.196 7.498 ( 7.231 3.548 3.235) 8.680 7.577 ( -3.158 1.923 2.863) 4.676 7.727 ( 5.861 3.019 2.799) 7.162 7.865 ( 6.788 1.693 -1.188) 7.096 8.858 ( 0.165 -10.045 0.171) 10.047 9.129 ( 3.419 -3.918 -0.418) 5.217 9.299 ( 0.413 -5.991 5.500) 8.143 9.473 ( 2.819 -5.072 3.714) 6.890 9.606 ( 1.779 -1.807 10.519) 10.820 9.786 ( 0.190 -0.347 1.522) 1.572 9.851 ( -3.964 -3.537 -10.110) 11.421 10.063 ( -1.588 5.162 -1.210) 5.534 10.480 ( 3.686 -3.759 -2.477) 5.819 10.985 ( 11.259 -5.263 -4.821) 13.331 10.988 ( -8.789 -0.831 -3.679) 9.564 11.260 ( -7.317 0.495 1.685) 7.525 11.329 ( -1.443 -3.293 -8.982) 9.675 11.682 ( -5.474 -7.681 0.576) 9.449 11.832 ( 6.557 -2.623 -4.060) 8.146 11.955 ( -6.252 5.712 -2.294) 8.774 12.032 ( -2.760 -3.892 1.051) 4.886 12.140 ( -0.393 1.782 3.322) 3.790 12.238 ( 1.669 -4.344 0.578) 4.690 12.547 ( 7.016 -1.069 -2.390) 7.488 12.722 ( 4.177 -0.180 -0.231) 4.188 12.818 ( 5.597 -1.421 -0.775) 5.826 13.302 ( -0.182 4.596 6.695) 8.123 13.464 ( 8.425 10.785 -5.828) 14.875 14.895 ( -0.309 1.205 5.876) 6.007 15.129 ( -4.639 7.800 -0.321) 9.081 15.318 ( 0.730 3.446 3.075) 4.676 15.451 ( 1.448 -5.513 -5.302) 7.784 15.582 ( 2.421 -0.368 1.246) 2.748 15.693 ( -1.184 2.295 1.436) 2.955 15.847 ( 2.064 1.404 -4.045) 4.753 16.028 ( -1.750 3.057 -2.293) 4.203 16.286 ( 0.371 3.242 -0.859) 3.375 16.446 ( -7.763 -0.759 5.515) 9.553 16.614 ( 5.929 -5.663 -2.370) 8.535 16.895 ( 8.935 -7.595 5.058) 12.771 17.659 ( -14.778 13.184 0.330) 19.808 18.146 ( -14.129 8.843 8.247) 18.596 18.765 ( 1.100 4.594 -2.117) 5.177 18.787 ( 5.036 3.746 -1.299) 6.410 25.885 ( -2.901 -1.338 1.347) 3.467 25.959 ( -2.319 -3.442 -0.308) 4.161 26.010 ( 0.234 -0.873 2.796) 2.939 26.069 ( 0.371 -0.609 -0.824) 1.090 26.205 ( 0.818 -1.666 -0.453) 1.910 26.686 ( 11.493 -2.940 -5.212) 12.958 26.853 ( -1.035 1.240 3.486) 3.842 26.945 ( -0.337 0.632 -1.881) 2.013 27.291 ( -0.378 -5.373 8.462) 10.031 27.620 ( 7.274 -2.912 -0.821) 7.878 28.389 ( -2.436 0.130 2.117) 3.231 28.694 ( 1.856 -7.437 -3.805) 8.558 29.010 ( 3.742 -13.441 1.678) 14.053 29.118 ( 0.183 -1.034 -5.447) 5.548 29.662 ( -2.819 7.315 12.971) 15.156 30.230 ( -15.521 25.610 -16.755) 34.314 ======================= Grid point 155 (68/140) ======================= q-point: (-0.22 -0.22 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.795 ( -21.857 -0.000 -9.354) 23.774 1.020 ( -31.090 -0.000 -15.964) 34.949 1.421 ( -0.334 -0.000 -2.291) 2.316 1.750 ( -36.035 -0.000 2.140) 36.098 2.119 ( 2.085 0.000 1.029) 2.325 2.150 ( 2.585 0.000 5.097) 5.715 2.329 ( 11.055 0.000 2.649) 11.368 2.524 ( 6.006 0.000 -1.190) 6.123 2.574 ( -3.315 -0.000 4.361) 5.478 2.845 ( -1.106 -0.000 0.624) 1.270 2.986 ( -4.215 -0.000 -2.543) 4.923 3.367 ( 2.722 0.000 -1.394) 3.058 3.446 ( 5.649 0.000 0.075) 5.649 3.504 ( 0.194 0.000 -0.658) 0.686 3.708 ( -5.649 -0.000 -1.230) 5.781 3.776 ( 0.556 0.000 6.073) 6.098 4.115 ( 5.167 0.000 -3.270) 6.115 4.186 ( -2.242 -0.000 0.769) 2.370 4.206 ( 10.901 0.000 3.715) 11.517 4.348 ( 5.121 0.000 -4.546) 6.848 4.553 ( 4.808 0.000 -4.403) 6.519 4.781 ( -3.703 -0.000 1.997) 4.208 4.838 ( -2.950 -0.000 11.559) 11.929 5.158 ( 2.989 0.000 -1.600) 3.390 5.216 ( -3.952 -0.000 4.053) 5.661 5.473 ( -7.388 -0.000 -0.719) 7.422 5.647 ( -1.259 -0.000 -13.858) 13.915 5.709 ( 3.274 0.000 1.045) 3.437 6.059 ( -0.078 -0.000 -0.715) 0.719 6.196 ( 6.853 0.000 -8.699) 11.074 6.308 ( -1.446 -0.000 5.152) 5.350 6.516 ( -3.768 -0.000 6.534) 7.543 6.569 ( -2.702 -0.000 -6.850) 7.363 6.898 ( -0.967 -0.000 1.244) 1.576 7.011 ( -0.344 -0.000 -8.244) 8.251 7.014 ( -5.825 -0.000 4.831) 7.568 7.556 ( -2.085 -0.000 5.489) 5.872 7.730 ( 1.231 0.000 -6.651) 6.764 7.781 ( 10.092 0.000 0.954) 10.137 7.865 ( 3.232 0.000 3.018) 4.422 8.582 ( 1.043 0.000 -3.881) 4.019 9.006 ( 4.508 0.000 3.263) 5.565 9.206 ( 1.157 0.000 14.058) 14.105 9.345 ( 6.547 0.000 7.862) 10.232 9.557 ( 1.665 0.000 6.246) 6.464 9.857 ( -0.367 -0.000 -0.076) 0.375 10.044 ( 3.832 0.000 -9.448) 10.195 10.232 ( 7.463 0.000 -9.587) 12.149 10.329 ( 0.970 0.000 0.417) 1.056 10.366 ( 1.361 0.000 -8.928) 9.031 10.933 ( -8.036 -0.000 -2.449) 8.401 11.253 ( -6.216 -0.000 0.260) 6.221 11.278 ( -3.804 -0.000 -1.239) 4.001 11.544 ( -9.612 -0.000 1.683) 9.758 11.793 ( -1.828 -0.000 -9.201) 9.381 11.881 ( 0.464 0.000 1.994) 2.048 12.057 ( -3.539 -0.000 -0.226) 3.547 12.108 ( 2.589 0.000 1.107) 2.815 12.283 ( -1.385 -0.000 -2.837) 3.157 12.489 ( 7.606 0.000 -10.375) 12.865 12.712 ( 5.175 0.000 7.260) 8.915 12.801 ( 1.451 0.000 1.498) 2.085 13.353 ( -9.811 -0.000 8.062) 12.699 13.684 ( 7.285 0.000 -2.255) 7.626 15.057 ( 2.459 0.000 2.828) 3.748 15.171 ( -1.645 -0.000 -2.219) 2.762 15.294 ( -1.233 -0.000 4.767) 4.923 15.505 ( -0.871 -0.000 -5.541) 5.609 15.624 ( 0.744 0.000 1.535) 1.705 15.836 ( -1.700 -0.000 -4.084) 4.424 15.854 ( 3.897 0.000 -1.590) 4.209 16.188 ( 3.476 0.000 -0.420) 3.501 16.290 ( -3.681 -0.000 2.546) 4.475 16.426 ( 4.893 0.000 -2.751) 5.614 16.432 ( -7.005 -0.000 4.640) 8.402 16.686 ( 7.653 0.000 3.433) 8.388 17.858 ( -10.957 -0.000 -2.685) 11.281 18.473 ( -5.676 -0.000 3.319) 6.575 18.713 ( 2.929 0.000 -3.569) 4.617 19.162 ( 11.642 0.000 15.728) 19.568 25.854 ( -2.710 -0.000 -0.909) 2.859 25.877 ( -1.447 -0.000 -0.651) 1.587 26.029 ( 2.344 0.000 9.104) 9.401 26.052 ( 1.311 0.000 -0.209) 1.328 26.183 ( -1.699 -0.000 3.626) 4.004 26.440 ( 0.916 0.000 -5.093) 5.174 26.898 ( 0.891 0.000 5.830) 5.898 26.954 ( 0.004 0.000 -1.837) 1.837 27.155 ( -2.657 -0.000 7.089) 7.571 27.483 ( -2.768 -0.000 -7.845) 8.319 28.384 ( -2.324 -0.000 3.180) 3.939 28.561 ( 0.512 0.000 -1.567) 1.648 28.722 ( 1.137 0.000 5.738) 5.849 29.095 ( 0.978 0.000 -5.881) 5.962 29.801 ( -2.633 -0.000 15.486) 15.708 30.988 ( 5.224 0.000 -31.646) 32.074 ======================= Grid point 156 (69/140) ======================= q-point: (-0.11 -0.22 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.809 ( -19.519 -20.980 -5.221) 29.127 0.954 ( -20.642 -23.273 0.849) 31.120 1.402 ( -34.963 -13.174 7.169) 38.045 1.665 ( 0.121 -10.734 -2.907) 11.122 2.263 ( 5.271 -6.914 4.595) 9.834 2.293 ( 3.455 -12.362 1.210) 12.893 2.498 ( 8.759 -10.301 -2.801) 13.809 2.530 ( 0.715 1.228 2.261) 2.671 2.657 ( -0.173 -7.325 2.221) 7.656 2.862 ( -1.778 -2.700 1.699) 3.652 2.987 ( -4.128 -5.202 -0.877) 6.699 3.302 ( -0.292 8.805 -3.647) 9.535 3.421 ( 0.785 0.843 -0.390) 1.216 3.513 ( 2.620 -0.114 -1.581) 3.062 3.672 ( -4.860 -0.579 1.330) 5.072 3.911 ( 0.510 -8.064 5.550) 9.803 4.045 ( 1.702 7.109 -0.201) 7.313 4.159 ( 3.559 2.894 1.989) 5.000 4.326 ( 7.626 0.979 2.192) 7.995 4.423 ( 5.916 -7.031 -6.588) 11.307 4.535 ( 1.913 4.111 -2.871) 5.367 4.754 ( -0.828 1.522 2.259) 2.847 4.839 ( -0.822 2.123 3.900) 4.516 5.132 ( -1.686 0.792 2.149) 2.844 5.316 ( -1.428 -7.442 4.785) 8.962 5.410 ( -10.491 -2.645 -2.060) 11.014 5.579 ( 4.761 3.718 -9.954) 11.643 5.779 ( 5.975 -4.220 -3.050) 7.925 6.004 ( -0.047 6.357 -1.193) 6.468 6.164 ( 3.216 3.378 -4.222) 6.291 6.306 ( 0.394 2.594 4.128) 4.892 6.479 ( -3.281 1.519 2.604) 4.456 6.513 ( -2.574 1.702 -1.489) 3.426 6.869 ( -2.427 0.626 1.288) 2.818 6.881 ( -11.276 1.144 0.316) 11.339 7.183 ( 4.450 -11.258 -4.277) 12.838 7.572 ( -4.266 -0.656 2.258) 4.871 7.689 ( 9.480 5.812 -0.301) 11.124 7.822 ( 7.257 1.132 2.149) 7.653 7.922 ( 4.982 -0.353 -1.140) 5.123 8.676 ( 1.338 -9.620 -0.357) 9.720 9.094 ( 3.852 -5.285 -0.551) 6.563 9.264 ( -0.954 -0.193 6.674) 6.745 9.434 ( 3.385 -2.178 1.865) 4.436 9.632 ( 3.441 -3.423 8.995) 10.221 9.776 ( -6.401 6.544 -7.358) 11.744 9.829 ( -0.625 3.618 6.789) 7.718 10.193 ( 2.501 8.843 0.141) 9.191 10.428 ( 3.950 -5.026 -0.397) 6.405 10.831 ( 12.338 -18.859 -7.048) 23.613 10.904 ( 5.601 -10.161 -7.360) 13.740 11.211 ( -6.248 -0.187 0.020) 6.251 11.241 ( -3.603 0.070 -1.751) 4.006 11.526 ( -6.370 -5.031 1.442) 8.244 11.717 ( -9.758 -4.569 -12.790) 16.724 11.928 ( -0.771 -1.113 6.612) 6.749 12.045 ( 2.215 0.347 5.553) 5.989 12.175 ( 0.670 -3.463 1.366) 3.782 12.212 ( -0.077 4.361 -0.966) 4.467 12.547 ( 12.095 -4.844 -11.022) 17.066 12.764 ( 2.982 0.665 1.610) 3.453 12.834 ( 3.437 -0.971 1.833) 4.015 13.326 ( -6.967 -1.382 8.371) 10.978 13.699 ( 11.933 7.109 2.510) 14.115 14.996 ( 1.524 6.263 6.199) 8.943 15.207 ( -0.111 0.755 -0.658) 1.008 15.341 ( -1.113 -3.737 -0.799) 3.980 15.390 ( -3.929 4.863 -1.246) 6.375 15.621 ( 0.476 2.805 -1.974) 3.463 15.745 ( -0.680 3.679 1.008) 3.875 15.871 ( 3.230 1.226 -2.688) 4.377 16.069 ( -0.026 5.695 -2.747) 6.323 16.324 ( -2.069 2.858 -2.073) 4.092 16.379 ( -8.603 -2.988 7.479) 11.785 16.552 ( 7.764 -6.290 -3.847) 10.707 16.849 ( 7.846 -8.399 4.589) 12.376 17.723 ( -8.824 6.137 -3.837) 11.412 18.275 ( -18.100 15.907 9.500) 25.901 18.740 ( 2.410 -1.819 -3.988) 5.002 19.032 ( -0.694 19.180 -1.988) 19.295 25.845 ( -2.079 -1.312 0.170) 2.465 25.892 ( -1.303 -2.540 -0.379) 2.879 26.044 ( 0.058 2.620 7.349) 7.803 26.070 ( 0.406 0.707 1.717) 1.901 26.173 ( -0.734 -1.263 0.125) 1.466 26.646 ( 12.754 -10.976 -7.306) 18.344 26.903 ( 0.835 1.874 5.140) 5.534 26.954 ( 0.433 -0.031 1.973) 2.020 27.234 ( -1.769 -3.056 9.329) 9.975 27.596 ( 14.186 -13.479 7.887) 21.098 28.382 ( -2.369 -0.086 1.644) 2.884 28.588 ( 1.156 -4.071 -2.447) 4.889 28.832 ( 0.842 -9.359 0.702) 9.423 29.077 ( 0.511 -0.588 -5.872) 5.923 29.807 ( -3.693 4.636 12.384) 13.729 30.443 ( -21.594 30.688 -36.868) 52.606 ======================= Grid point 165 (70/140) ======================= q-point: (-0.11 -0.11 0.17) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.421 ( -19.557 -0.000 9.139) 21.587 0.445 ( -21.765 -0.000 10.302) 24.080 1.020 ( -47.679 -0.000 21.556) 52.325 1.603 ( 4.081 0.000 -0.420) 4.103 2.150 ( 1.237 0.000 0.082) 1.240 2.276 ( 3.960 0.000 5.096) 6.453 2.475 ( 11.673 0.000 -7.649) 13.956 2.550 ( -4.136 -0.000 2.242) 4.705 2.633 ( 2.779 0.000 6.022) 6.633 2.839 ( -1.225 -0.000 2.523) 2.804 2.887 ( -5.692 -0.000 -2.239) 6.116 3.361 ( 1.286 0.000 -5.875) 6.014 3.477 ( 0.138 0.000 -4.478) 4.480 3.496 ( 1.943 0.000 -1.664) 2.558 3.646 ( -4.124 -0.000 4.839) 6.358 3.844 ( -0.986 -0.000 8.001) 8.061 4.095 ( -0.914 -0.000 -2.782) 2.929 4.234 ( 4.675 0.000 -0.592) 4.712 4.380 ( 4.395 0.000 -2.512) 5.062 4.412 ( 10.960 0.000 -1.160) 11.021 4.600 ( 5.515 0.000 -2.529) 6.067 4.742 ( -3.232 -0.000 1.301) 3.484 4.896 ( -1.997 -0.000 4.652) 5.063 5.135 ( -2.687 -0.000 -4.363) 5.124 5.258 ( -0.121 -0.000 13.772) 13.773 5.320 ( -8.171 -0.000 1.683) 8.342 5.577 ( 5.655 0.000 -11.508) 12.822 5.750 ( 2.734 0.000 -3.003) 4.061 6.069 ( 1.608 0.000 0.363) 1.649 6.220 ( 5.508 0.000 5.481) 7.771 6.342 ( -0.943 -0.000 4.418) 4.518 6.513 ( 1.388 0.000 0.055) 1.389 6.521 ( -4.681 -0.000 7.925) 9.205 6.797 ( -9.627 -0.000 -8.670) 12.956 6.882 ( -1.934 -0.000 -1.470) 2.430 6.963 ( -6.055 -0.000 3.964) 7.237 7.536 ( -3.661 -0.000 0.709) 3.729 7.766 ( 7.838 0.000 2.226) 8.148 7.924 ( 2.200 0.000 -4.094) 4.647 7.924 ( 6.424 0.000 1.018) 6.504 8.600 ( 2.355 0.000 -1.367) 2.722 9.045 ( -0.276 -0.000 -0.804) 0.849 9.263 ( -3.706 -0.000 -5.168) 6.359 9.462 ( 1.650 0.000 0.298) 1.677 9.634 ( -0.275 -0.000 3.208) 3.220 9.835 ( 0.200 0.000 -3.972) 3.978 10.245 ( 22.427 0.000 24.530) 33.237 10.300 ( 9.194 0.000 -3.230) 9.745 10.362 ( 1.821 0.000 1.563) 2.399 10.384 ( 5.213 0.000 0.024) 5.213 10.821 ( -4.081 -0.000 0.244) 4.088 11.186 ( -4.653 -0.000 3.791) 6.002 11.223 ( -1.267 -0.000 -0.286) 1.298 11.448 ( -5.693 -0.000 4.007) 6.962 11.518 ( -10.623 -0.000 -4.324) 11.469 11.950 ( -0.918 -0.000 4.471) 4.564 12.088 ( 1.220 0.000 6.367) 6.483 12.151 ( 0.844 0.000 0.683) 1.086 12.309 ( 8.037 0.000 9.193) 12.211 12.474 ( 6.179 0.000 -13.463) 14.814 12.785 ( -0.803 -0.000 0.119) 0.812 12.869 ( 5.347 0.000 1.923) 5.682 13.271 ( -13.395 -0.000 13.611) 19.096 13.923 ( 22.503 0.000 11.541) 25.290 15.124 ( -1.094 -0.000 -1.464) 1.827 15.186 ( 8.979 0.000 8.097) 12.091 15.319 ( -1.173 -0.000 2.775) 3.013 15.373 ( -4.717 -0.000 -4.742) 6.688 15.587 ( -10.847 -0.000 -13.084) 16.995 15.801 ( 3.769 0.000 3.650) 5.247 15.897 ( 4.235 0.000 -3.028) 5.206 16.201 ( -2.167 -0.000 0.655) 2.264 16.299 ( -0.481 -0.000 9.964) 9.976 16.357 ( -4.936 -0.000 -0.340) 4.948 16.484 ( 8.020 0.000 -6.152) 10.108 16.820 ( 3.024 0.000 3.675) 4.760 17.708 ( -1.961 -0.000 -4.730) 5.121 18.400 ( -7.806 -0.000 4.201) 8.865 18.723 ( 3.147 0.000 -3.741) 4.889 19.179 ( -21.474 -0.000 -45.976) 50.744 25.822 ( -0.999 -0.000 0.642) 1.187 25.857 ( -0.538 -0.000 -0.234) 0.587 26.073 ( 0.827 0.000 0.909) 1.228 26.138 ( 1.332 0.000 0.964) 1.645 26.312 ( 5.098 0.000 10.030) 11.251 26.426 ( 1.959 0.000 -1.682) 2.582 26.941 ( -1.162 -0.000 1.502) 1.899 26.951 ( 0.736 0.000 -0.376) 0.827 27.412 ( 0.659 0.000 -1.944) 2.052 27.546 ( 38.502 0.000 67.360) 77.587 28.369 ( -2.532 -0.000 1.073) 2.750 28.556 ( 0.923 0.000 -1.876) 2.091 28.746 ( -0.792 -0.000 -1.075) 1.335 29.053 ( 1.696 0.000 -5.163) 5.434 29.865 ( -5.833 -0.000 9.514) 11.160 30.287 ( -45.084 -0.000 -81.722) 93.333 ======================= Grid point 166 (71/140) ======================= 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.068 ( 7.840 0.000 25.158) 26.351 1.205 ( -20.144 -0.000 28.334) 34.765 1.690 ( 0.051 0.000 10.055) 10.055 1.873 ( 15.325 0.000 26.884) 30.946 2.048 ( 4.009 0.000 -10.329) 11.079 2.208 ( 5.381 0.000 -3.960) 6.681 2.355 ( 6.814 0.000 -12.384) 14.135 2.578 ( -9.518 -0.000 7.708) 12.248 2.728 ( -0.939 -0.000 -1.336) 1.633 2.840 ( -6.317 -0.000 9.701) 11.576 3.042 ( -5.743 -0.000 -16.082) 17.077 3.051 ( 1.244 0.000 11.492) 11.559 3.282 ( 4.371 0.000 -9.902) 10.824 3.393 ( -0.841 -0.000 -4.988) 5.058 3.866 ( -3.259 -0.000 11.741) 12.185 3.935 ( 0.048 0.000 -6.841) 6.841 3.939 ( -2.283 -0.000 -3.124) 3.869 4.319 ( 2.577 0.000 2.070) 3.305 4.332 ( 5.123 0.000 -7.542) 9.117 4.383 ( -2.654 -0.000 -5.927) 6.494 4.686 ( 4.200 0.000 5.817) 7.174 4.763 ( 5.793 0.000 7.033) 9.111 4.847 ( -12.610 -0.000 1.018) 12.651 5.181 ( 0.300 0.000 0.748) 0.806 5.238 ( -2.225 -0.000 -0.450) 2.270 5.275 ( 4.624 0.000 -13.551) 14.318 5.297 ( 0.645 0.000 3.777) 3.832 5.571 ( -1.751 -0.000 -8.812) 8.984 6.178 ( 0.264 0.000 4.898) 4.905 6.433 ( 11.038 0.000 -6.063) 12.594 6.449 ( -2.520 -0.000 4.492) 5.151 6.554 ( 2.159 0.000 -0.127) 2.163 6.638 ( -6.612 -0.000 4.148) 7.805 6.674 ( -2.109 -0.000 -1.448) 2.558 6.981 ( -8.186 -0.000 4.720) 9.449 7.112 ( 15.595 0.000 0.089) 15.595 7.452 ( -1.166 -0.000 0.020) 1.166 7.617 ( -6.298 -0.000 -6.933) 9.367 8.019 ( -0.796 -0.000 1.603) 1.790 8.034 ( 3.911 0.000 1.299) 4.121 8.648 ( 1.851 0.000 5.193) 5.513 8.892 ( -2.502 -0.000 -6.719) 7.169 9.044 ( -1.790 -0.000 -2.433) 3.020 9.231 ( -4.092 -0.000 -9.481) 10.326 9.695 ( 1.642 0.000 1.440) 2.184 9.723 ( -0.677 -0.000 -1.755) 1.881 10.431 ( -9.614 -0.000 1.472) 9.726 10.469 ( 8.503 0.000 -0.368) 8.511 10.548 ( -3.253 -0.000 5.323) 6.239 10.553 ( 6.047 0.000 5.575) 8.225 10.929 ( 1.556 0.000 5.886) 6.089 11.126 ( -1.096 -0.000 -3.975) 4.124 11.329 ( -1.741 -0.000 4.367) 4.701 11.561 ( 15.865 0.000 -11.281) 19.467 11.594 ( -4.889 -0.000 9.877) 11.021 11.916 ( 1.456 0.000 -3.529) 3.818 12.125 ( 0.147 0.000 1.321) 1.330 12.159 ( -1.551 -0.000 0.653) 1.683 12.286 ( 8.606 0.000 -4.511) 9.717 12.502 ( -6.727 -0.000 -10.499) 12.469 12.870 ( -0.660 -0.000 6.197) 6.232 13.008 ( 7.284 0.000 -0.238) 7.288 13.598 ( -13.346 -0.000 19.335) 23.494 14.228 ( 6.399 0.000 -11.729) 13.361 15.093 ( -11.122 -0.000 -0.130) 11.123 15.115 ( 4.025 0.000 -0.575) 4.066 15.312 ( -5.071 -0.000 0.531) 5.099 15.322 ( 6.967 0.000 -0.216) 6.971 15.690 ( 10.556 0.000 2.706) 10.897 15.810 ( 0.588 0.000 -4.911) 4.946 15.997 ( -7.599 -0.000 6.703) 10.132 16.136 ( -1.841 -0.000 -1.499) 2.375 16.174 ( -0.409 -0.000 -3.320) 3.345 16.360 ( 5.032 0.000 -9.212) 10.497 16.760 ( 21.786 0.000 2.567) 21.937 16.830 ( -10.468 -0.000 -0.124) 10.469 17.529 ( -41.822 -0.000 4.689) 42.084 17.688 ( 17.742 0.000 -3.173) 18.023 18.431 ( -7.491 -0.000 5.850) 9.504 18.660 ( 5.711 0.000 -5.022) 7.605 25.862 ( 0.707 0.000 0.485) 0.857 25.867 ( 0.057 0.000 1.134) 1.136 26.085 ( -2.988 -0.000 0.017) 2.988 26.113 ( 0.297 0.000 0.292) 0.417 26.399 ( -0.430 -0.000 5.792) 5.808 26.527 ( 5.056 0.000 2.404) 5.599 26.787 ( -5.499 -0.000 -4.017) 6.810 26.864 ( -0.995 -0.000 -4.379) 4.490 27.608 ( 7.784 0.000 8.722) 11.690 28.030 ( -13.843 -0.000 -10.627) 17.452 28.508 ( 2.187 0.000 -2.185) 3.091 28.527 ( -2.933 -0.000 -4.615) 5.468 28.710 ( -28.124 -0.000 8.449) 29.366 28.989 ( 10.313 0.000 -5.183) 11.542 29.781 ( 54.443 0.000 4.097) 54.597 29.825 ( -21.939 -0.000 1.420) 21.985 ======================= Grid point 167 (72/140) ======================= q-point: ( 0.11 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.254 ( -9.515 -6.763 24.929) 27.527 1.413 ( 6.318 -13.687 20.581) 25.512 1.778 ( -1.855 -10.421 -7.095) 12.743 2.077 ( 0.976 -5.264 -8.468) 10.019 2.198 ( 10.318 -8.565 8.797) 16.038 2.342 ( 9.452 -6.397 18.280) 21.551 2.388 ( 5.947 -5.453 -11.911) 14.386 2.633 ( -2.738 -11.062 6.167) 12.957 2.801 ( -5.022 -9.034 0.399) 10.344 2.854 ( -4.827 -2.587 7.748) 9.488 2.950 ( -1.496 -2.451 -14.445) 14.728 3.122 ( 1.924 -0.422 11.152) 11.325 3.267 ( 2.957 -0.072 -9.302) 9.761 3.355 ( -0.901 -0.106 -6.091) 6.158 3.816 ( -6.118 3.574 0.327) 7.093 3.911 ( 0.999 1.589 3.713) 4.161 3.957 ( -1.588 -2.822 0.180) 3.243 4.182 ( 1.851 9.299 -4.239) 10.386 4.308 ( -6.864 -0.410 -2.393) 7.281 4.488 ( 6.012 -7.780 -6.774) 11.939 4.695 ( -10.676 4.746 0.812) 11.712 4.765 ( 7.180 1.027 8.054) 10.838 4.866 ( 3.224 -2.047 7.473) 8.392 5.112 ( -8.521 0.588 -8.020) 11.716 5.205 ( 3.667 4.523 -3.794) 6.950 5.284 ( 1.165 -3.982 -2.881) 5.051 5.387 ( 9.583 -1.786 5.031) 10.969 5.555 ( -2.946 -5.119 -9.507) 11.192 6.126 ( -1.004 7.191 4.095) 8.336 6.320 ( 0.475 11.487 -5.441) 12.719 6.424 ( -0.833 3.050 3.205) 4.502 6.527 ( 3.026 4.439 -1.526) 5.585 6.688 ( -8.186 -5.373 -0.801) 9.824 6.729 ( 9.133 -4.512 4.683) 11.212 6.884 ( -4.036 5.629 6.652) 9.604 7.210 ( 9.738 2.006 -6.316) 11.779 7.453 ( -0.373 -0.054 2.211) 2.243 7.559 ( -4.757 -1.162 -5.801) 7.591 7.931 ( -7.679 5.786 2.553) 9.948 8.030 ( -0.916 2.011 -0.243) 2.223 8.769 ( 2.959 -7.370 5.062) 9.418 8.915 ( -1.154 -8.450 -6.873) 10.953 9.077 ( -2.846 -6.079 0.859) 6.767 9.216 ( -3.275 -6.778 -7.661) 10.741 9.693 ( -2.253 2.077 1.412) 3.374 9.738 ( -2.747 -3.529 0.322) 4.484 10.361 ( -9.237 -0.226 3.189) 9.774 10.403 ( 1.123 7.286 5.587) 9.250 10.538 ( -1.266 0.492 3.691) 3.933 10.771 ( 13.170 -7.433 -2.777) 15.375 10.981 ( 2.455 -1.559 5.663) 6.366 11.110 ( -0.580 -0.904 -4.297) 4.429 11.311 ( -3.050 0.438 -1.398) 3.384 11.573 ( 9.218 3.026 -10.342) 14.180 11.635 ( -2.549 -2.332 9.331) 9.950 11.920 ( 6.702 0.929 -4.459) 8.103 12.094 ( -2.439 1.741 4.386) 5.312 12.208 ( 2.980 -1.762 1.808) 3.906 12.324 ( 6.591 1.203 -4.056) 7.832 12.386 ( -3.995 1.339 -10.257) 11.089 12.824 ( -5.082 4.475 5.740) 8.877 13.032 ( 4.536 2.832 -3.346) 6.308 13.576 ( -14.686 0.358 16.115) 21.806 14.116 ( -3.098 6.844 -7.846) 10.862 15.025 ( -7.089 0.164 3.993) 8.138 15.205 ( 1.673 -2.985 -1.861) 3.895 15.272 ( 3.135 5.015 1.048) 6.006 15.331 ( 4.284 -0.159 0.757) 4.354 15.742 ( -1.229 3.187 -3.269) 4.728 15.781 ( 6.145 -1.224 -0.982) 6.342 15.905 ( -6.758 4.632 1.041) 8.258 16.007 ( 0.141 8.517 -0.643) 8.542 16.178 ( -5.601 -2.120 1.667) 6.217 16.390 ( 3.886 -2.056 -6.798) 8.095 16.785 ( -10.094 -4.486 -1.374) 11.131 16.894 ( 1.046 -2.278 2.814) 3.769 17.346 ( -6.188 2.473 6.166) 9.079 17.845 ( 18.927 -0.914 -1.472) 19.006 18.427 ( -4.878 -2.067 3.225) 6.202 18.689 ( 5.440 -0.839 -4.857) 7.340 25.868 ( -0.527 -0.379 0.915) 1.122 25.894 ( 1.160 -1.928 0.038) 2.250 26.087 ( -2.362 -1.995 1.409) 3.398 26.130 ( 0.001 -1.623 0.240) 1.641 26.404 ( 0.155 2.407 7.436) 7.817 26.567 ( 4.047 0.313 -1.499) 4.327 26.755 ( -3.641 -2.052 -2.057) 4.658 26.841 ( -0.961 -0.389 -5.106) 5.210 27.682 ( 7.271 3.922 12.354) 14.862 27.857 ( -11.742 2.132 -7.540) 14.116 28.465 ( -2.910 2.403 2.809) 4.705 28.542 ( -3.462 -7.149 -6.058) 9.990 28.730 ( -13.098 -13.113 4.880) 19.165 29.080 ( 10.933 -3.027 -2.150) 11.546 29.600 ( -22.615 4.397 -3.731) 23.339 30.059 ( 41.097 11.442 -1.924) 42.704 ======================= Grid point 168 (73/140) ======================= q-point: ( 0.22 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.473 ( -0.469 -9.711 19.121) 21.450 1.769 ( 5.644 -11.823 12.164) 17.877 1.886 ( -2.187 -10.025 -10.396) 14.607 2.193 ( 2.978 -9.368 -2.338) 10.104 2.377 ( 1.817 -5.870 -5.830) 8.471 2.524 ( 5.706 -12.192 -5.204) 14.432 2.589 ( 1.922 -4.559 13.139) 14.040 2.867 ( -5.293 -6.177 0.948) 8.190 2.877 ( -1.059 -5.860 -7.354) 9.462 2.928 ( -5.069 -9.758 5.199) 12.163 3.056 ( 1.648 -11.635 3.231) 12.187 3.194 ( -1.378 3.107 -6.583) 7.409 3.222 ( 4.231 -2.380 2.737) 5.573 3.399 ( 8.840 -6.771 -0.208) 11.137 3.734 ( -6.095 1.597 2.975) 6.968 3.860 ( -3.630 2.717 1.340) 4.729 3.984 ( -0.536 4.930 -0.689) 5.006 4.068 ( 0.430 -0.595 7.593) 7.628 4.288 ( -4.318 -4.030 -5.783) 8.266 4.545 ( -1.112 2.893 -2.214) 3.809 4.611 ( 2.612 -2.790 -4.524) 5.922 4.825 ( 2.561 0.858 3.196) 4.184 4.904 ( 3.824 4.255 1.205) 5.846 4.994 ( -4.214 2.399 -7.583) 9.001 5.170 ( 0.203 -0.544 3.737) 3.782 5.368 ( 3.313 -4.606 -3.894) 6.881 5.505 ( 4.495 -2.901 3.324) 6.299 5.605 ( -2.141 -7.325 -5.049) 9.150 6.013 ( 0.202 6.411 2.137) 6.761 6.084 ( -1.779 11.300 -4.707) 12.369 6.392 ( 0.040 2.403 2.702) 3.616 6.451 ( 2.681 5.560 -1.145) 6.278 6.679 ( -9.606 -3.579 -2.239) 10.492 6.818 ( -0.950 4.030 7.682) 8.726 6.914 ( 7.991 -4.102 3.663) 9.701 7.151 ( 4.864 4.860 -8.186) 10.691 7.443 ( -3.521 3.592 1.960) 5.398 7.516 ( 2.213 0.568 -0.575) 2.356 7.787 ( -9.809 3.188 1.953) 10.498 7.976 ( -0.364 3.420 -0.518) 3.478 8.929 ( -2.952 -8.207 0.636) 8.745 9.075 ( 2.755 -11.895 -2.952) 12.561 9.195 ( -4.727 -8.682 2.499) 10.197 9.328 ( -1.087 -11.967 -3.374) 12.481 9.617 ( -5.904 4.069 4.280) 8.351 9.741 ( -5.003 -0.005 -2.139) 5.441 10.283 ( -5.123 5.636 8.034) 11.070 10.376 ( -2.937 -0.991 4.357) 5.347 10.535 ( 0.264 0.412 -0.971) 1.088 10.953 ( 14.960 -3.766 -5.617) 16.418 11.067 ( -1.357 0.151 -1.471) 2.007 11.107 ( 4.021 -4.066 3.530) 6.720 11.286 ( -3.010 -3.615 -7.634) 8.966 11.538 ( 5.589 2.238 -6.391) 8.780 11.705 ( 0.023 -2.447 5.136) 5.689 11.931 ( 10.008 3.929 -2.122) 10.959 12.094 ( -4.547 -2.336 3.139) 5.999 12.217 ( -1.893 2.797 -1.501) 3.696 12.286 ( 3.956 1.625 -0.134) 4.279 12.377 ( 7.062 -0.682 -5.191) 8.791 12.731 ( -5.273 4.880 5.842) 9.260 12.942 ( 1.546 6.938 -6.307) 9.503 13.496 ( -15.639 3.109 10.065) 18.856 13.907 ( -4.673 10.173 -5.254) 12.367 14.996 ( -4.695 0.941 4.950) 6.887 15.172 ( -0.220 5.749 5.071) 7.669 15.202 ( 1.614 1.603 -1.819) 2.912 15.479 ( 7.413 -6.704 -0.901) 10.035 15.668 ( -3.454 1.556 0.567) 3.830 15.805 ( 1.036 4.102 -0.792) 4.305 15.835 ( 1.202 -1.584 -2.219) 2.979 15.894 ( -0.125 3.458 -2.571) 4.311 16.123 ( -10.330 1.132 -0.295) 10.396 16.421 ( 1.918 -1.484 -1.761) 2.997 16.764 ( -7.558 -2.887 -2.243) 8.396 16.977 ( -5.172 -6.607 7.169) 11.037 17.307 ( 7.081 6.737 3.031) 10.233 17.973 ( 16.263 1.828 -0.914) 16.391 18.440 ( -3.221 -1.653 1.433) 3.893 18.720 ( 5.021 -0.718 -4.819) 6.996 25.884 ( -0.425 -1.416 1.339) 1.995 25.937 ( 1.200 -2.125 -0.897) 2.600 26.119 ( -1.713 -2.380 2.187) 3.658 26.161 ( -0.769 -1.795 0.322) 1.980 26.389 ( -0.841 3.346 5.819) 6.765 26.570 ( 3.370 0.490 -5.498) 6.467 26.772 ( -0.787 -1.929 1.240) 2.425 26.816 ( -0.415 -0.624 -3.719) 3.793 27.670 ( -4.723 3.923 2.988) 6.828 27.760 ( 3.812 4.328 4.605) 7.380 28.443 ( -4.625 -0.943 4.945) 6.836 28.613 ( -2.791 -7.496 -8.346) 11.560 28.902 ( -9.002 -14.670 0.576) 17.222 29.232 ( 5.158 -4.778 2.328) 7.406 29.335 ( -13.944 3.122 -7.046) 15.932 30.069 ( 28.594 17.260 -1.499) 33.433 ======================= Grid point 169 (74/140) ======================= q-point: ( 0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( 3.674 -7.138 13.287) 15.524 1.984 ( -1.070 -8.133 2.682) 8.631 2.038 ( 3.477 -9.328 -1.554) 10.075 2.356 ( -3.231 -8.358 0.349) 8.968 2.444 ( 9.256 -3.584 -10.346) 14.337 2.647 ( -4.881 -3.297 -3.714) 6.963 2.746 ( 6.548 -5.613 5.083) 10.011 2.854 ( -2.326 0.166 -1.425) 2.733 2.940 ( -2.418 -1.108 -0.025) 2.660 3.013 ( -5.985 2.835 -8.872) 11.071 3.071 ( -3.304 -6.804 2.686) 8.027 3.265 ( 0.783 -0.698 -1.896) 2.167 3.293 ( -1.315 -11.251 3.269) 11.790 3.596 ( 1.668 1.627 1.925) 3.022 3.738 ( -0.603 0.011 -0.295) 0.671 3.804 ( 3.923 -4.001 6.287) 8.421 3.933 ( -3.333 -1.632 4.934) 6.173 4.179 ( 2.188 -3.533 8.634) 9.582 4.313 ( 1.496 -4.694 -3.951) 6.316 4.514 ( 0.864 1.204 -1.745) 2.290 4.608 ( 0.928 2.483 -4.690) 5.388 4.788 ( -4.655 -1.109 -6.604) 8.155 4.877 ( -2.050 5.456 -1.262) 5.963 4.893 ( 9.122 3.515 -0.291) 9.780 5.248 ( -0.680 -5.623 3.823) 6.834 5.407 ( 2.359 -0.145 -7.333) 7.704 5.602 ( 0.745 -2.794 4.442) 5.300 5.693 ( -2.288 -5.848 -0.534) 6.302 5.890 ( -2.481 3.875 -2.752) 5.362 5.994 ( 5.403 0.856 1.314) 5.626 6.342 ( -2.515 2.901 -1.609) 4.163 6.394 ( 1.620 2.689 0.432) 3.169 6.637 ( -9.370 -0.083 0.272) 9.374 6.808 ( 0.965 1.009 6.028) 6.188 6.953 ( 4.004 2.133 -4.885) 6.667 7.150 ( 1.981 -1.852 0.732) 2.809 7.329 ( -5.921 4.223 4.313) 8.455 7.571 ( 8.579 -0.177 1.014) 8.640 7.699 ( -5.169 0.995 1.855) 5.582 7.898 ( 0.199 5.271 -1.120) 5.393 8.999 ( -8.102 -5.385 0.104) 9.729 9.264 ( 1.095 -2.215 2.587) 3.577 9.296 ( -3.168 -11.172 -0.936) 11.650 9.494 ( -6.006 -5.850 -2.774) 8.831 9.585 ( 1.073 -0.512 4.858) 5.001 9.668 ( -2.318 -3.078 -1.874) 4.285 10.199 ( -8.864 2.577 8.275) 12.397 10.370 ( -0.691 2.583 1.036) 2.867 10.514 ( -0.511 0.831 -2.862) 3.023 10.986 ( -0.398 1.652 -7.555) 7.744 11.102 ( 13.619 0.397 -2.782) 13.906 11.245 ( 1.774 -3.917 -1.269) 4.483 11.322 ( 1.743 -6.924 -3.398) 7.908 11.540 ( 1.555 -1.958 -1.991) 3.197 11.758 ( 2.106 -0.633 0.629) 2.287 11.934 ( 5.907 2.120 1.769) 6.521 12.104 ( -3.404 -0.656 0.292) 3.479 12.158 ( 0.754 2.025 0.731) 2.281 12.323 ( 6.857 -0.318 1.347) 6.995 12.429 ( 5.949 -1.489 -3.003) 6.828 12.623 ( -3.726 6.292 3.165) 7.968 12.818 ( 1.679 4.405 -4.317) 6.392 13.323 ( -15.803 6.677 4.264) 17.677 13.656 ( -5.482 11.543 -3.911) 13.364 14.978 ( -1.345 -0.517 0.918) 1.709 15.136 ( -0.961 1.182 5.729) 5.928 15.212 ( 1.660 -1.182 1.200) 2.365 15.520 ( 4.181 7.196 -1.606) 8.476 15.677 ( -3.212 -4.032 1.741) 5.441 15.786 ( 3.100 0.373 1.145) 3.326 15.808 ( -3.381 -0.269 -6.009) 6.900 15.874 ( 0.891 0.398 -2.393) 2.585 16.044 ( -4.993 -1.114 1.191) 5.252 16.444 ( -0.842 -1.205 -0.019) 1.470 16.746 ( -3.894 -0.945 -0.481) 4.036 17.091 ( -9.775 -9.255 6.481) 14.940 17.257 ( 11.398 8.905 2.920) 14.756 18.023 ( 11.539 3.917 -2.524) 12.445 18.451 ( -3.299 -1.756 2.347) 4.413 18.743 ( 4.311 -0.355 -4.589) 6.306 25.924 ( 0.218 -2.376 1.838) 3.012 25.970 ( 0.401 -1.505 -1.117) 1.916 26.154 ( -0.783 -1.467 2.319) 2.853 26.170 ( -1.763 -0.376 -0.512) 1.874 26.326 ( -2.446 4.631 1.241) 5.382 26.558 ( 4.320 0.552 -6.455) 7.786 26.812 ( 0.787 -1.246 4.229) 4.479 26.836 ( 0.379 -2.391 0.618) 2.499 27.583 ( -3.824 1.177 -5.929) 7.153 27.732 ( 4.756 7.764 11.215) 14.446 28.448 ( -7.180 -1.775 3.259) 8.082 28.662 ( -2.846 -6.088 -8.989) 11.223 29.071 ( -6.401 -11.119 -0.446) 12.838 29.131 ( -11.162 -2.110 -5.978) 12.836 29.442 ( 7.410 -5.453 4.376) 10.188 29.945 ( 19.245 17.901 -0.569) 26.289 ======================= Grid point 170 (75/140) ======================= q-point: (-0.56 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.863 ( -0.813 -1.224 9.183) 9.300 2.068 ( -1.782 -0.073 2.642) 3.187 2.184 ( 2.208 -5.646 0.872) 6.125 2.413 ( -1.865 -2.329 0.143) 2.987 2.522 ( 8.140 0.706 -8.635) 11.888 2.607 ( -2.352 1.435 -4.613) 5.373 2.785 ( -7.703 2.461 -10.992) 13.646 2.849 ( -0.946 -0.838 0.608) 1.402 2.885 ( 4.000 -3.355 3.487) 6.278 2.966 ( -0.346 2.269 2.067) 3.089 3.158 ( -1.241 -3.397 -2.128) 4.196 3.284 ( 0.252 -1.371 4.216) 4.441 3.451 ( -0.955 -5.556 4.065) 6.950 3.525 ( -2.778 2.479 -2.721) 4.612 3.697 ( 0.068 -0.734 1.054) 1.286 3.865 ( -7.200 1.656 4.385) 8.591 4.082 ( 9.638 -5.795 2.809) 11.592 4.275 ( 4.866 0.575 7.189) 8.700 4.398 ( -4.100 1.612 0.700) 4.461 4.471 ( 3.681 -2.321 -0.877) 4.440 4.536 ( -1.274 2.407 -4.429) 5.200 4.760 ( -2.863 1.354 -5.518) 6.362 4.783 ( 0.786 1.331 0.353) 1.586 4.910 ( 6.637 0.959 -2.144) 7.041 5.357 ( -2.332 -4.089 -2.871) 5.514 5.367 ( 0.776 -1.615 -5.180) 5.481 5.639 ( 3.926 0.905 3.063) 5.061 5.737 ( -3.884 -2.247 -0.536) 4.519 5.871 ( 0.676 0.407 4.682) 4.748 6.062 ( 2.898 -2.641 -1.590) 4.231 6.264 ( -3.583 1.171 -1.981) 4.258 6.397 ( 2.233 -0.867 1.338) 2.743 6.534 ( -7.698 3.753 0.857) 8.607 6.860 ( 0.815 -3.807 2.710) 4.744 6.947 ( 5.861 1.263 -3.030) 6.717 7.142 ( -5.379 0.198 -1.067) 5.488 7.319 ( -3.877 -3.150 9.097) 10.378 7.588 ( -0.794 0.963 -1.703) 2.112 7.731 ( 8.570 1.062 -1.680) 8.797 7.810 ( 2.095 3.734 3.706) 5.663 8.995 ( -10.397 -2.234 3.516) 11.201 9.285 ( 1.297 -1.468 -0.870) 2.144 9.408 ( 2.686 0.635 -2.302) 3.594 9.460 ( -4.085 -0.304 -2.332) 4.713 9.565 ( -3.720 -2.900 1.974) 5.114 9.879 ( 1.969 -11.875 3.602) 12.565 10.128 ( -10.179 1.306 5.071) 11.447 10.287 ( 1.210 8.022 1.256) 8.209 10.473 ( -0.160 0.714 -4.710) 4.767 10.924 ( -0.026 1.344 -6.507) 6.644 11.123 ( 11.552 5.836 -4.561) 13.723 11.244 ( -3.290 -0.902 -5.334) 6.332 11.490 ( 4.655 -6.029 2.719) 8.087 11.602 ( -0.834 -4.841 0.124) 4.913 11.750 ( 0.072 2.461 1.706) 2.995 11.982 ( 3.502 -2.360 -2.840) 5.089 12.051 ( -4.531 1.633 2.397) 5.380 12.189 ( 6.597 1.688 3.314) 7.573 12.362 ( 2.869 1.117 -1.065) 3.258 12.500 ( 2.482 -1.351 2.930) 4.071 12.552 ( 2.646 -1.749 -1.664) 3.582 12.795 ( 4.481 -1.177 -3.668) 5.909 13.084 ( -13.715 8.195 0.520) 15.985 13.425 ( -4.555 8.309 -1.564) 9.604 14.992 ( -0.913 -1.330 -1.789) 2.409 15.166 ( -1.554 -2.578 6.287) 6.971 15.261 ( 4.791 1.802 2.880) 5.873 15.399 ( 0.336 4.860 -0.931) 4.960 15.709 ( -6.169 -2.130 -2.966) 7.168 15.715 ( 1.728 3.531 -3.368) 5.176 15.829 ( 1.739 0.007 1.640) 2.390 15.861 ( 0.310 -0.236 -1.341) 1.397 16.091 ( -0.049 -4.127 0.799) 4.204 16.453 ( -2.535 -1.488 0.274) 2.952 16.733 ( -2.021 -0.270 0.924) 2.239 17.163 ( -10.143 -4.876 2.658) 11.564 17.251 ( 9.684 3.151 5.343) 11.500 18.015 ( 5.627 2.378 -3.624) 7.103 18.474 ( -2.784 -2.326 2.852) 4.614 18.752 ( 3.480 0.275 -4.480) 5.679 25.973 ( -0.998 -0.960 1.581) 2.101 25.988 ( 0.731 -1.972 0.348) 2.132 26.136 ( -2.158 1.851 -0.331) 2.862 26.185 ( 0.574 -1.360 0.298) 1.506 26.221 ( -2.578 4.697 -1.330) 5.521 26.560 ( 4.668 0.225 -4.894) 6.767 26.859 ( 1.543 -0.610 3.772) 4.121 26.900 ( 0.715 -2.846 5.503) 6.237 27.493 ( -2.459 2.037 -11.098) 11.548 27.718 ( 4.710 4.418 13.353) 14.833 28.414 ( -8.246 -1.245 -1.355) 8.449 28.685 ( -2.545 -3.806 -7.674) 8.936 29.068 ( -3.230 -1.668 -3.218) 4.854 29.247 ( -4.962 -11.777 1.244) 12.841 29.548 ( 3.887 1.932 1.162) 4.493 29.806 ( 10.638 10.405 1.854) 14.995 ======================= Grid point 171 (76/140) ======================= q-point: (-0.44 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.838 ( -9.228 4.170 9.057) 13.586 1.965 ( -4.259 11.406 5.052) 13.182 2.268 ( 4.128 1.057 6.780) 8.008 2.396 ( 0.086 5.484 -1.722) 5.749 2.453 ( 3.689 4.033 -9.660) 11.099 2.506 ( -6.114 3.649 -4.220) 8.277 2.685 ( 1.466 3.727 -4.395) 5.946 2.859 ( 4.188 2.104 -1.087) 4.811 2.925 ( -1.627 2.018 2.028) 3.291 2.985 ( 0.754 -5.315 -1.093) 5.479 3.172 ( -1.387 -2.207 -2.190) 3.404 3.316 ( 4.627 4.270 4.896) 7.975 3.499 ( -4.962 -3.498 0.984) 6.150 3.508 ( 0.136 0.038 1.062) 1.071 3.759 ( 4.357 -3.317 -1.083) 5.582 3.784 ( -7.610 2.795 4.821) 9.432 4.171 ( 1.886 3.265 -1.731) 4.149 4.257 ( -1.519 4.707 2.095) 5.371 4.341 ( 6.966 3.857 8.895) 11.938 4.464 ( -8.558 -2.488 3.688) 9.645 4.591 ( 6.753 -2.937 -5.131) 8.975 4.686 ( -4.529 1.497 -2.231) 5.266 4.734 ( 3.185 5.405 -4.906) 7.964 4.978 ( 5.974 -3.778 -0.973) 7.135 5.333 ( 0.993 -1.477 -7.369) 7.581 5.405 ( -4.788 -2.364 -2.695) 5.981 5.684 ( 2.658 -0.462 1.182) 2.946 5.716 ( -1.492 1.017 -0.057) 1.806 5.883 ( 4.144 3.468 5.619) 7.795 6.070 ( -1.939 0.130 -2.033) 2.813 6.251 ( -3.056 -2.239 0.142) 3.791 6.406 ( -2.450 2.808 1.037) 3.868 6.473 ( 1.507 -1.951 -0.510) 2.517 6.913 ( -2.518 1.112 -1.527) 3.148 7.007 ( 4.503 -7.659 -0.793) 8.920 7.098 ( -2.937 1.218 1.786) 3.647 7.426 ( -4.545 -7.972 7.196) 11.662 7.567 ( -0.357 -0.600 -0.956) 1.184 7.664 ( 1.665 4.890 -4.284) 6.710 7.891 ( 9.483 -0.271 2.849) 9.905 8.978 ( -8.759 -2.444 5.989) 10.888 9.290 ( 5.480 2.888 -6.442) 8.937 9.416 ( 3.844 -0.644 0.756) 3.970 9.433 ( -1.340 0.150 -0.161) 1.358 9.608 ( -1.817 -3.472 0.091) 3.919 10.008 ( 2.032 5.135 1.622) 5.755 10.054 ( -9.927 -0.719 1.732) 10.103 10.153 ( -0.615 5.885 6.948) 9.126 10.479 ( 4.604 -1.802 -2.991) 5.778 10.871 ( 1.663 2.137 -5.763) 6.367 11.077 ( 7.772 5.590 -3.060) 10.051 11.198 ( -5.887 -0.708 -3.616) 6.945 11.500 ( -5.411 5.695 2.924) 8.382 11.667 ( -1.678 -2.865 -1.218) 3.537 11.774 ( 2.683 -3.255 1.611) 4.516 11.980 ( 1.504 3.320 -4.648) 5.907 12.037 ( -2.042 -1.380 2.710) 3.663 12.177 ( 3.097 4.783 2.561) 6.248 12.387 ( 5.153 -1.687 -2.649) 6.035 12.510 ( -3.385 0.422 3.440) 4.844 12.664 ( 0.367 -5.877 -3.921) 7.074 12.807 ( -6.569 0.901 -5.078) 8.352 12.999 ( 11.191 -6.307 3.144) 13.225 13.322 ( -1.064 1.171 2.961) 3.358 14.972 ( -3.202 0.465 -0.841) 3.343 15.175 ( -0.043 6.803 5.554) 8.782 15.282 ( 2.294 -4.924 2.091) 5.820 15.427 ( 3.589 -3.510 -0.922) 5.104 15.617 ( 0.330 4.280 -1.477) 4.539 15.711 ( -0.241 0.099 -3.172) 3.182 15.819 ( -0.107 2.031 2.215) 3.007 15.882 ( -0.309 -2.275 -1.340) 2.659 16.151 ( 1.022 -2.510 -1.803) 3.255 16.461 ( -3.817 -2.115 0.633) 4.410 16.724 ( 0.112 1.315 0.619) 1.458 17.175 ( 3.879 1.070 2.552) 4.765 17.303 ( -7.707 -4.726 3.782) 9.800 18.012 ( -1.101 -1.955 -2.866) 3.640 18.513 ( -1.530 -3.002 1.341) 3.626 18.743 ( 2.808 1.012 -4.625) 5.504 25.960 ( -2.295 0.889 1.168) 2.724 26.034 ( 0.401 -0.408 0.600) 0.829 26.083 ( -1.075 1.543 0.354) 1.914 26.133 ( -1.770 2.976 0.406) 3.486 26.213 ( 1.476 -0.878 -0.454) 1.776 26.568 ( 3.930 0.187 -4.784) 6.194 26.894 ( 1.694 -0.341 1.818) 2.508 26.991 ( 1.602 -2.354 9.549) 9.964 27.372 ( -2.831 2.783 -11.825) 12.474 27.795 ( 6.971 -0.565 12.111) 13.986 28.366 ( -5.939 -1.264 -3.264) 6.894 28.677 ( -1.060 -1.043 -5.577) 5.772 29.055 ( -0.148 0.318 -3.495) 3.513 29.339 ( 1.277 5.978 -1.300) 6.250 29.514 ( -3.724 -5.807 2.134) 7.221 29.790 ( 1.136 0.791 2.370) 2.745 ======================= Grid point 172 (77/140) ======================= q-point: (-0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.682 ( -8.641 12.800 11.316) 19.146 1.717 ( -9.582 14.110 13.443) 21.717 2.194 ( -3.025 15.116 -1.183) 15.461 2.227 ( 0.793 13.493 9.928) 16.770 2.346 ( 0.983 2.554 -10.284) 10.642 2.420 ( 2.990 3.649 -4.896) 6.799 2.632 ( 2.100 2.112 1.346) 3.269 2.814 ( 2.615 5.962 -3.298) 7.298 2.924 ( 2.680 -0.685 1.354) 3.080 3.024 ( 0.067 1.156 1.051) 1.564 3.163 ( -1.382 5.594 1.525) 5.960 3.285 ( 2.035 0.482 -3.304) 3.911 3.426 ( 1.658 6.924 -1.407) 7.258 3.563 ( -5.287 -0.979 3.368) 6.345 3.686 ( -6.841 1.964 6.461) 9.613 3.832 ( 3.129 -1.540 -2.348) 4.204 4.060 ( -4.533 1.931 0.615) 4.965 4.257 ( 2.614 -1.029 3.181) 4.244 4.417 ( 7.653 2.052 10.391) 13.067 4.432 ( -3.323 4.553 -1.251) 5.774 4.571 ( -1.012 1.378 -7.007) 7.213 4.631 ( 7.136 -0.001 -9.975) 12.264 4.729 ( -2.985 -3.711 5.903) 7.584 5.079 ( 4.866 -3.516 -3.005) 6.713 5.329 ( 0.270 1.779 -5.117) 5.424 5.364 ( -5.598 -2.027 -3.788) 7.056 5.658 ( -1.662 3.887 0.079) 4.228 5.720 ( 1.004 -1.576 -0.249) 1.885 5.875 ( 5.545 4.088 1.306) 7.012 6.051 ( -1.262 -1.280 -0.859) 1.993 6.265 ( -5.799 -3.457 3.348) 7.536 6.390 ( 4.057 -0.588 -2.761) 4.943 6.527 ( 2.006 -1.875 1.987) 3.390 6.830 ( -7.636 1.717 -1.083) 7.901 7.055 ( -1.667 3.582 2.645) 4.754 7.175 ( 1.982 -7.748 -2.911) 8.510 7.530 ( -5.136 -4.015 2.101) 6.850 7.597 ( 2.625 -1.086 -4.902) 5.665 7.643 ( 3.564 -4.619 4.298) 7.246 7.942 ( 5.777 1.221 -2.942) 6.597 8.975 ( -4.566 1.255 3.873) 6.118 9.259 ( 4.587 7.283 2.160) 8.874 9.359 ( 1.028 -2.234 -3.511) 4.287 9.485 ( 3.783 4.582 -3.759) 7.031 9.659 ( 3.351 -2.487 -1.984) 4.620 9.835 ( -2.535 8.280 -5.362) 10.185 10.035 ( -3.007 -2.678 13.018) 13.626 10.154 ( 0.638 3.475 11.479) 12.011 10.537 ( 5.674 -0.109 -1.830) 5.963 10.832 ( 1.778 0.502 -4.829) 5.171 11.026 ( 6.422 6.152 -2.849) 9.338 11.149 ( -7.724 -2.317 -1.741) 8.250 11.351 ( -6.954 6.115 3.244) 9.812 11.627 ( -3.477 3.366 -4.538) 6.634 11.841 ( -0.607 -1.485 -2.670) 3.114 11.877 ( 0.533 5.497 0.028) 5.523 12.079 ( -0.089 -2.639 2.248) 3.468 12.162 ( 1.227 0.457 4.209) 4.408 12.378 ( -5.227 2.400 -8.444) 10.217 12.503 ( 4.221 -0.123 5.182) 6.684 12.657 ( -4.539 -2.847 -7.320) 9.071 12.824 ( 2.152 -3.514 -0.764) 4.191 13.317 ( 15.361 -11.674 2.949) 19.518 13.398 ( 2.713 -7.153 7.795) 10.922 14.952 ( -3.928 -2.629 0.419) 4.745 15.116 ( -0.578 2.700 6.104) 6.699 15.361 ( 1.657 -1.271 -3.969) 4.484 15.518 ( 7.448 -1.349 3.432) 8.310 15.559 ( -1.881 2.451 1.527) 3.446 15.688 ( 0.828 0.176 -3.145) 3.257 15.803 ( -0.586 0.457 2.057) 2.187 15.911 ( 0.168 -2.365 -2.439) 3.402 16.173 ( 2.352 -0.657 -4.772) 5.361 16.467 ( -5.047 -1.979 1.160) 5.544 16.688 ( 2.193 4.080 -0.004) 4.632 17.196 ( 10.920 6.464 3.188) 13.084 17.340 ( -17.129 -10.964 0.719) 20.351 18.032 ( -9.787 -6.276 -1.102) 11.678 18.557 ( -0.932 -3.029 -2.119) 3.812 18.718 ( 2.648 1.520 -5.047) 5.898 25.925 ( -2.167 1.780 1.293) 3.088 25.986 ( -1.221 3.247 -1.125) 3.647 26.092 ( 0.310 -0.066 2.274) 2.296 26.117 ( -0.228 -0.632 4.814) 4.861 26.226 ( 1.352 0.586 -0.882) 1.717 26.563 ( 2.974 0.677 -5.404) 6.205 26.912 ( 0.775 -0.156 -0.765) 1.100 27.096 ( 3.066 -1.338 10.219) 10.753 27.249 ( -3.083 1.837 -9.417) 10.077 27.964 ( 7.842 -6.087 9.469) 13.719 28.338 ( -1.388 -0.603 -2.150) 2.630 28.660 ( 3.382 1.414 -2.467) 4.419 29.018 ( 2.331 2.617 -3.748) 5.131 29.142 ( 0.940 12.856 -3.590) 13.381 29.626 ( -8.620 -6.312 -2.048) 10.879 29.793 ( -6.889 -3.985 4.336) 9.063 ======================= Grid point 173 (78/140) ======================= q-point: (-0.22 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.411 ( -1.687 20.546 16.914) 26.665 1.485 ( -14.187 12.647 17.690) 25.965 1.859 ( -10.504 19.858 16.521) 27.887 2.013 ( 5.692 17.552 7.043) 19.751 2.283 ( 1.438 0.605 -10.625) 10.739 2.318 ( 8.262 8.219 -11.515) 16.383 2.636 ( -4.448 6.718 1.288) 8.159 2.681 ( 4.184 5.843 4.624) 8.546 2.900 ( 0.131 7.977 3.474) 8.701 3.004 ( -3.572 8.156 2.896) 9.363 3.030 ( 3.726 -0.496 -2.424) 4.472 3.212 ( -1.619 6.808 -0.720) 7.035 3.362 ( -1.515 0.824 -4.182) 4.524 3.447 ( -3.110 3.139 -0.195) 4.423 3.756 ( -1.769 -4.697 6.197) 7.974 3.880 ( 1.775 -3.858 -1.565) 4.526 4.036 ( -2.331 -0.157 -0.793) 2.468 4.218 ( -7.921 3.060 -6.440) 10.657 4.360 ( 5.210 0.257 3.938) 6.536 4.480 ( 6.453 3.393 3.549) 8.109 4.565 ( 6.212 1.131 -2.952) 6.970 4.648 ( 7.229 -0.921 -3.744) 8.193 4.828 ( -8.772 -8.509 4.809) 13.133 5.140 ( 3.582 -2.559 -4.578) 6.351 5.230 ( 1.258 4.873 -4.662) 6.861 5.358 ( -5.675 -2.820 -2.853) 6.949 5.520 ( -4.485 8.527 -0.034) 9.635 5.753 ( 3.105 1.873 -5.366) 6.477 5.903 ( 3.060 -5.841 2.119) 6.927 6.113 ( 1.608 -6.396 0.370) 6.605 6.329 ( -1.586 -4.995 2.701) 5.896 6.438 ( 2.741 -2.892 -0.030) 3.985 6.565 ( 1.239 1.462 3.425) 3.925 6.778 ( -6.354 -3.235 1.671) 7.323 6.970 ( -4.610 5.243 3.317) 7.730 7.217 ( 0.415 0.835 -5.781) 5.856 7.522 ( -4.994 -1.143 -2.082) 5.531 7.683 ( 2.314 -6.610 -3.711) 7.925 7.791 ( 8.156 -4.260 2.463) 9.525 7.930 ( 2.520 1.379 -2.408) 3.749 8.874 ( -2.522 8.663 2.283) 9.307 9.138 ( 1.987 8.094 -2.750) 8.776 9.317 ( 0.230 10.424 -6.887) 12.496 9.447 ( 2.908 0.079 -1.068) 3.099 9.621 ( 0.072 0.890 -0.881) 1.254 9.779 ( 0.783 -0.315 -2.975) 3.093 10.131 ( 1.210 1.967 15.331) 15.504 10.250 ( 3.576 -8.393 11.492) 14.673 10.540 ( 3.052 2.554 0.291) 3.990 10.822 ( 2.165 0.779 -7.183) 7.542 10.925 ( 1.414 6.996 0.206) 7.140 11.178 ( 1.386 -4.245 0.665) 4.514 11.236 ( -4.693 3.547 1.048) 5.975 11.501 ( -1.022 4.799 -4.175) 6.443 11.731 ( -4.643 6.365 2.909) 8.398 11.892 ( -0.965 -3.168 -2.872) 4.383 12.136 ( 1.455 -2.041 1.339) 2.842 12.176 ( -4.091 0.922 2.484) 4.875 12.266 ( -0.205 1.192 -5.029) 5.173 12.594 ( 5.709 -2.059 4.170) 7.364 12.642 ( -4.014 -3.797 -7.046) 8.954 12.892 ( 5.333 -1.323 -0.229) 5.500 13.506 ( -1.711 -4.880 10.930) 12.091 13.737 ( 19.306 -13.248 1.184) 23.445 15.024 ( -2.779 -8.019 1.706) 8.657 15.132 ( -2.672 -2.587 4.295) 5.681 15.324 ( 4.294 4.854 -4.447) 7.859 15.489 ( -8.826 1.971 -0.443) 9.054 15.588 ( 7.543 3.609 6.138) 10.373 15.709 ( 1.514 -3.424 -2.468) 4.485 15.836 ( 0.491 -4.050 2.158) 4.615 15.944 ( 2.294 -1.992 -2.805) 4.134 16.177 ( 3.767 -0.285 -5.252) 6.470 16.453 ( -5.394 -0.526 0.456) 5.439 16.634 ( 4.807 5.276 0.795) 7.182 17.136 ( 3.196 8.231 1.182) 8.908 17.422 ( -9.042 -10.291 -0.476) 13.707 18.036 ( -21.693 -8.230 -1.287) 23.238 18.562 ( -2.576 -0.767 -4.951) 5.634 18.687 ( 3.115 1.665 -5.812) 6.801 25.886 ( -1.385 1.761 1.495) 2.694 25.921 ( -0.402 3.029 -0.595) 3.113 26.109 ( 0.442 0.123 2.240) 2.287 26.170 ( -1.673 -1.720 5.783) 6.261 26.211 ( 1.926 0.878 1.667) 2.694 26.540 ( 2.615 1.427 -5.112) 5.917 26.901 ( -0.714 0.184 -3.284) 3.366 27.065 ( -2.525 4.433 -7.816) 9.334 27.289 ( 3.653 -4.510 10.318) 11.838 28.159 ( -6.304 -10.497 -3.777) 12.813 28.373 ( 8.738 -0.671 5.288) 10.236 28.675 ( 13.840 3.996 -0.957) 14.437 28.941 ( 5.480 9.598 0.725) 11.076 28.989 ( 6.218 2.783 -0.824) 6.862 29.483 ( -17.051 5.780 -10.649) 20.918 29.881 ( -12.836 -9.098 7.495) 17.428 ======================= Grid point 174 (79/140) ======================= q-point: (-0.11 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.120 ( 0.726 21.102 18.591) 28.133 1.292 ( -15.856 8.328 25.886) 31.478 1.639 ( -1.378 12.275 33.339) 35.554 1.845 ( 7.575 12.454 8.782) 17.018 2.165 ( 7.045 9.393 -13.847) 18.155 2.230 ( 1.211 1.031 -10.589) 10.708 2.425 ( 2.671 8.903 -4.789) 10.456 2.637 ( -6.040 4.523 8.283) 11.205 2.837 ( -1.365 2.097 6.167) 6.655 2.847 ( -2.684 7.907 -0.636) 8.374 3.010 ( 0.631 3.056 8.174) 8.750 3.146 ( -5.392 -1.433 -7.418) 9.282 3.306 ( 2.225 1.029 -8.948) 9.278 3.417 ( 0.441 -0.099 -4.724) 4.746 3.826 ( -2.688 -1.250 10.107) 10.533 3.926 ( -2.020 -2.442 -3.688) 4.862 3.998 ( -1.260 1.479 -2.410) 3.096 4.190 ( 1.282 -6.066 -3.887) 7.317 4.394 ( 0.734 -0.181 -1.781) 1.935 4.440 ( 7.221 7.272 -2.789) 10.621 4.611 ( 3.695 -2.763 1.133) 4.751 4.713 ( 6.826 1.221 3.088) 7.591 4.882 ( -11.401 -5.169 2.563) 12.777 5.160 ( 4.088 2.986 3.708) 6.275 5.219 ( 4.037 -4.199 -8.259) 10.106 5.325 ( -5.766 0.857 -1.606) 6.046 5.353 ( -5.188 3.535 -3.625) 7.249 5.666 ( 0.756 4.622 -8.235) 9.474 6.075 ( 1.850 -7.487 4.146) 8.756 6.288 ( 6.325 -9.243 -1.061) 11.250 6.410 ( -0.103 -3.375 2.869) 4.431 6.514 ( -0.781 -2.803 0.180) 2.916 6.583 ( 2.602 -2.573 4.508) 5.807 6.804 ( -4.437 3.541 -0.299) 5.685 6.880 ( -5.413 -3.555 8.029) 10.315 7.145 ( 3.950 5.992 -3.673) 8.062 7.480 ( -3.836 0.476 -1.435) 4.124 7.707 ( -3.051 -0.205 -9.399) 9.883 7.944 ( 5.826 -4.831 1.890) 7.801 7.958 ( 6.112 -1.044 2.763) 6.788 8.710 ( -1.253 8.886 3.267) 9.550 8.997 ( -0.848 6.040 -6.121) 8.642 9.133 ( -0.914 6.855 -4.480) 8.240 9.346 ( -2.377 4.337 -8.788) 10.084 9.692 ( 0.570 -2.295 1.597) 2.853 9.733 ( 0.644 3.207 0.004) 3.271 10.260 ( 6.593 -6.731 8.467) 12.667 10.432 ( -0.174 -3.901 6.500) 7.583 10.523 ( -0.624 1.311 3.539) 3.825 10.699 ( 1.450 9.657 -5.833) 11.374 10.894 ( 0.994 0.781 5.601) 5.742 11.162 ( -1.718 1.064 -2.934) 3.562 11.290 ( 1.723 -2.981 4.860) 5.956 11.466 ( 10.907 -0.284 -6.225) 12.562 11.624 ( -5.213 4.102 7.568) 10.064 11.916 ( -1.135 -2.301 -3.481) 4.325 12.122 ( -5.261 -0.200 0.988) 5.357 12.175 ( 1.005 -0.098 1.086) 1.482 12.258 ( 6.329 0.932 -5.683) 8.557 12.586 ( -6.412 -2.008 -9.364) 11.526 12.758 ( 4.939 -4.818 8.762) 11.153 12.953 ( 7.371 -0.020 -0.111) 7.372 13.588 ( -8.338 -1.492 16.253) 18.328 14.081 ( 19.601 -9.559 -6.742) 22.826 15.119 ( -0.907 -0.205 0.169) 0.945 15.186 ( -3.546 -4.554 -1.354) 5.929 15.258 ( -1.715 0.861 -0.084) 1.920 15.363 ( -7.896 2.061 -0.546) 8.179 15.611 ( 11.154 4.063 5.526) 13.094 15.783 ( 0.743 -4.355 -2.898) 5.283 15.968 ( -1.459 -5.177 5.487) 7.684 16.005 ( 3.073 -8.611 -3.713) 9.868 16.188 ( 2.064 -0.156 -3.227) 3.834 16.407 ( -0.747 1.864 -3.412) 3.959 16.621 ( 11.751 3.763 3.464) 12.816 16.987 ( -3.901 8.731 -0.456) 9.574 17.532 ( -0.633 -7.545 -1.078) 7.648 17.898 ( -35.226 -2.170 -5.652) 35.743 18.494 ( -6.254 2.424 0.500) 6.726 18.658 ( 4.885 1.634 -5.735) 7.709 25.865 ( -0.513 0.787 1.604) 1.859 25.876 ( 0.508 2.038 0.190) 2.109 26.111 ( -0.203 0.618 0.793) 1.025 26.136 ( -1.889 2.276 -0.546) 3.008 26.313 ( 0.846 -4.907 8.539) 9.884 26.512 ( 3.352 2.257 -1.769) 4.411 26.862 ( -2.923 0.641 -5.235) 6.030 26.928 ( -3.035 3.741 -5.812) 7.549 27.464 ( 6.136 -4.681 9.700) 12.396 28.155 ( -12.501 -4.066 -10.651) 16.919 28.470 ( 0.724 -2.939 0.402) 3.054 28.621 ( 1.802 6.284 -6.013) 8.882 28.924 ( 3.961 1.906 -4.148) 6.043 29.085 ( -20.441 8.612 -2.848) 22.363 29.254 ( 44.126 -1.391 13.395) 46.136 29.920 ( -17.742 -5.313 5.333) 19.273 ======================= Grid point 176 (80/140) ======================= q-point: ( 0.11 0.11 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.276 ( -4.160 -0.000 21.982) 22.373 1.449 ( 10.506 0.000 20.202) 22.770 1.595 ( -1.685 -0.000 -11.863) 11.982 1.971 ( -4.435 -0.000 -5.863) 7.352 2.244 ( 8.106 0.000 5.454) 9.770 2.286 ( 3.366 0.000 -20.468) 20.743 2.487 ( -4.573 -0.000 14.259) 14.974 2.568 ( 11.244 0.000 19.939) 22.891 2.671 ( 2.197 0.000 -14.410) 14.577 2.834 ( -6.856 -0.000 11.305) 13.222 2.865 ( 3.189 0.000 -7.366) 8.027 3.194 ( 3.711 0.000 6.066) 7.111 3.257 ( 3.566 0.000 -3.009) 4.666 3.303 ( -3.205 -0.000 -6.470) 7.220 3.844 ( -3.246 -0.000 -2.698) 4.221 3.859 ( -3.079 -0.000 -4.038) 5.078 3.967 ( 1.060 0.000 9.088) 9.149 4.226 ( -8.030 -0.000 -4.387) 9.150 4.343 ( 4.666 0.000 -6.708) 8.172 4.352 ( -2.063 -0.000 1.297) 2.436 4.654 ( -8.183 -0.000 -0.264) 8.187 4.877 ( 2.569 0.000 8.641) 9.015 4.880 ( -1.547 -0.000 8.047) 8.194 5.031 ( -0.703 -0.000 -8.878) 8.905 5.250 ( 2.910 0.000 -6.355) 6.990 5.268 ( 3.955 0.000 -1.165) 4.122 5.445 ( -2.741 -0.000 -6.403) 6.965 5.477 ( 11.573 0.000 3.347) 12.047 6.196 ( -3.211 -0.000 3.761) 4.945 6.382 ( -5.157 -0.000 -9.924) 11.184 6.462 ( -0.951 -0.000 3.792) 3.909 6.586 ( -4.374 -0.000 4.699) 6.419 6.605 ( 4.642 0.000 -1.816) 4.984 6.759 ( 8.253 0.000 2.208) 8.543 6.914 ( -4.283 -0.000 1.849) 4.665 7.309 ( 9.816 0.000 -5.592) 11.297 7.463 ( -0.903 -0.000 3.854) 3.958 7.493 ( 0.223 0.000 -0.758) 0.790 7.935 ( -11.021 -0.000 -0.462) 11.031 7.993 ( -7.087 -0.000 -0.558) 7.109 8.770 ( 4.710 0.000 5.248) 7.052 8.779 ( -3.657 -0.000 -6.732) 7.661 9.028 ( -0.104 -0.000 5.133) 5.134 9.089 ( -3.813 -0.000 -5.606) 6.780 9.660 ( -10.147 -0.000 0.547) 10.161 9.703 ( 0.894 0.000 -0.977) 1.324 10.279 ( -5.862 -0.000 -0.451) 5.879 10.500 ( -0.742 -0.000 1.559) 1.727 10.586 ( -0.328 -0.000 3.336) 3.352 10.774 ( 11.336 0.000 1.453) 11.429 11.011 ( 2.035 0.000 5.204) 5.588 11.082 ( 1.135 0.000 -5.065) 5.191 11.269 ( -4.993 -0.000 -3.907) 6.340 11.607 ( 6.232 0.000 -10.311) 12.048 11.661 ( 0.009 0.000 12.164) 12.164 11.930 ( 3.069 0.000 -5.256) 6.087 12.143 ( 1.324 0.000 -2.845) 3.138 12.220 ( 6.219 0.000 4.897) 7.916 12.308 ( -4.953 -0.000 -9.239) 10.483 12.399 ( 9.418 0.000 -0.180) 9.420 12.823 ( -9.265 -0.000 3.872) 10.041 13.072 ( 2.633 0.000 -4.252) 5.002 13.520 ( -20.309 -0.000 16.676) 26.278 14.086 ( -8.508 -0.000 -4.493) 9.622 15.011 ( -2.088 -0.000 1.207) 2.412 15.197 ( 3.760 0.000 1.157) 3.934 15.250 ( -1.675 -0.000 0.585) 1.775 15.471 ( 11.374 0.000 -1.138) 11.431 15.748 ( -0.819 -0.000 -6.460) 6.512 15.778 ( -1.918 -0.000 0.481) 1.977 15.903 ( -5.128 -0.000 1.309) 5.292 16.075 ( -4.883 -0.000 -0.184) 4.887 16.167 ( -2.513 -0.000 4.483) 5.139 16.331 ( 3.144 0.000 -9.288) 9.806 16.647 ( -8.315 -0.000 -2.208) 8.604 16.797 ( -17.017 -0.000 6.723) 18.297 17.479 ( 21.847 0.000 -1.671) 21.911 18.002 ( 17.881 0.000 4.987) 18.563 18.396 ( -2.686 -0.000 4.568) 5.299 18.701 ( 5.063 0.000 -4.035) 6.474 25.866 ( -0.524 -0.000 -0.241) 0.577 25.882 ( 1.138 0.000 0.382) 1.200 26.062 ( -1.566 -0.000 2.164) 2.671 26.116 ( -0.110 -0.000 0.199) 0.227 26.452 ( -0.707 -0.000 4.990) 5.040 26.570 ( 0.500 0.000 -5.982) 6.003 26.731 ( 0.030 0.000 5.136) 5.136 26.820 ( 0.654 0.000 -2.806) 2.881 27.744 ( -10.990 -0.000 -7.002) 13.031 27.843 ( 9.151 0.000 11.616) 14.788 28.401 ( -9.101 -0.000 2.423) 9.418 28.530 ( 2.285 0.000 -0.757) 2.407 28.537 ( -9.388 -0.000 8.044) 12.362 29.135 ( 10.807 0.000 -0.887) 10.843 29.416 ( -23.593 -0.000 -9.088) 25.283 30.437 ( 34.792 0.000 -9.781) 36.140 ======================= Grid point 177 (81/140) ======================= q-point: ( 0.22 0.11 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.434 ( 2.055 -9.853 13.639) 16.951 1.621 ( 1.444 -8.161 -9.317) 12.470 1.722 ( 8.297 -9.243 13.498) 18.343 1.983 ( -5.314 -9.184 -4.797) 11.645 2.242 ( -3.938 -7.636 -19.533) 21.339 2.358 ( 6.437 -3.982 4.912) 9.023 2.561 ( -5.082 -9.822 3.896) 11.725 2.676 ( 7.729 -4.357 -10.505) 13.750 2.777 ( 0.750 -2.252 8.473) 8.799 2.869 ( -2.119 -2.882 12.945) 13.430 2.942 ( 3.831 -5.935 0.479) 7.080 3.176 ( -0.740 2.286 -9.475) 9.774 3.257 ( 0.977 -0.614 -3.504) 3.689 3.376 ( 10.993 -5.176 8.295) 14.712 3.735 ( -5.548 3.048 3.561) 7.263 3.893 ( -1.512 -1.258 -2.085) 2.866 4.008 ( 0.579 0.577 3.990) 4.073 4.129 ( -3.897 3.135 0.276) 5.009 4.200 ( -5.894 2.773 0.766) 6.559 4.493 ( 1.538 -8.695 -6.389) 10.899 4.582 ( -2.446 3.198 -0.006) 4.026 4.822 ( -6.028 2.384 -5.055) 8.220 4.925 ( -4.339 -2.185 0.604) 4.896 5.058 ( 10.908 2.430 5.354) 12.392 5.222 ( 1.776 2.049 -1.197) 2.964 5.310 ( 2.055 -3.804 -2.589) 5.040 5.427 ( -1.626 -2.085 -3.369) 4.282 5.588 ( 10.697 -0.651 1.403) 10.808 6.130 ( -2.634 6.023 2.732) 7.119 6.205 ( -5.915 8.156 -6.593) 12.040 6.446 ( -1.969 2.737 3.158) 4.620 6.567 ( 2.848 4.272 -0.193) 5.138 6.591 ( -1.101 0.824 -0.452) 1.447 6.849 ( 0.505 -1.145 -0.791) 1.481 6.936 ( 3.806 -4.152 6.476) 8.583 7.242 ( 1.459 7.373 -6.918) 10.215 7.474 ( -2.983 0.847 3.224) 4.474 7.539 ( 5.764 -0.338 2.417) 6.259 7.790 ( -9.608 4.569 0.340) 10.644 7.949 ( -7.194 -2.247 -1.892) 7.770 8.802 ( -2.493 -7.152 -3.458) 8.326 8.864 ( -0.889 -7.233 1.996) 7.556 9.096 ( -1.369 -4.875 1.086) 5.179 9.126 ( 0.726 -6.960 4.547) 8.346 9.578 ( -15.076 -1.601 0.972) 15.192 9.706 ( 1.143 0.562 0.641) 1.426 10.286 ( -2.148 -4.241 -2.375) 5.314 10.432 ( -2.418 7.521 2.794) 8.380 10.556 ( 0.222 1.908 0.120) 1.924 10.922 ( 6.150 -7.291 -6.496) 11.541 11.069 ( 2.767 -0.170 -1.102) 2.983 11.080 ( 2.896 -2.752 0.526) 4.030 11.213 ( -0.832 0.619 -1.951) 2.209 11.587 ( 5.643 2.196 -7.858) 9.920 11.731 ( 2.209 -0.207 9.900) 10.146 11.951 ( 1.194 -3.843 -5.196) 6.572 12.104 ( 1.588 3.568 -1.354) 4.133 12.207 ( -3.264 2.080 -5.093) 6.397 12.332 ( 6.230 -3.434 0.102) 7.114 12.459 ( 10.029 3.093 3.192) 10.970 12.755 ( -8.529 1.418 4.413) 9.707 13.011 ( -0.674 4.358 -8.132) 9.251 13.422 ( -22.518 0.289 11.953) 25.495 13.962 ( -7.217 5.097 -3.343) 9.447 15.000 ( -2.087 0.401 3.859) 4.406 15.177 ( -2.787 2.320 0.717) 3.697 15.337 ( 3.230 -4.121 -0.897) 5.313 15.464 ( 8.297 5.996 1.913) 10.414 15.673 ( -4.414 2.713 -0.744) 5.234 15.784 ( -3.173 -2.581 -1.653) 4.411 15.856 ( 3.914 2.175 -5.851) 7.368 16.014 ( -1.089 6.444 3.667) 7.493 16.071 ( -5.702 2.996 -1.587) 6.634 16.383 ( 1.081 -3.668 -2.025) 4.327 16.630 ( -5.400 -4.637 -1.559) 7.286 16.784 ( -13.131 -7.770 6.717) 16.671 17.577 ( 21.057 7.460 -2.021) 22.430 18.142 ( 12.264 1.483 7.567) 14.486 18.414 ( 0.427 -0.134 1.985) 2.035 18.725 ( 4.566 -0.547 -3.993) 6.090 25.867 ( -0.204 -0.838 0.311) 0.917 25.908 ( 1.045 -1.658 -0.528) 2.030 26.078 ( -1.233 -1.797 2.060) 2.999 26.129 ( -0.610 -1.436 0.579) 1.664 26.444 ( -1.741 1.967 2.082) 3.352 26.542 ( -0.443 -0.863 -6.748) 6.817 26.775 ( 1.853 -0.617 4.925) 5.298 26.817 ( 1.934 0.518 0.732) 2.132 27.624 ( -8.126 0.917 -6.719) 10.584 27.951 ( 8.947 3.123 13.462) 16.463 28.412 ( -7.693 -4.074 4.755) 9.919 28.452 ( -3.675 0.396 -0.526) 3.733 28.658 ( -3.268 -9.197 2.906) 10.184 29.121 ( -19.780 -0.562 -9.536) 21.966 29.299 ( 9.661 -1.889 -0.089) 9.844 30.517 ( 26.100 11.776 -9.900) 30.297 ======================= Grid point 178 (82/140) ======================= q-point: ( 0.33 0.11 -0.67) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.708 ( 2.826 -11.726 7.171) 14.032 1.777 ( 6.767 -9.542 -0.812) 11.726 1.962 ( 4.330 -6.842 6.160) 10.174 2.120 ( -3.590 -13.224 -5.597) 14.801 2.285 ( -4.804 -10.972 -16.485) 20.378 2.525 ( 6.287 -7.026 -1.262) 9.512 2.711 ( -2.694 -7.762 -2.481) 8.583 2.785 ( -2.841 -1.561 6.843) 7.572 2.820 ( 0.185 -8.852 -1.437) 8.970 2.988 ( -0.033 -2.859 8.886) 9.335 3.007 ( 0.277 0.199 -6.719) 6.727 3.123 ( -1.348 -5.013 -0.028) 5.191 3.246 ( -0.408 -0.335 -6.812) 6.832 3.648 ( 5.988 -8.756 2.767) 10.962 3.698 ( 0.735 3.183 7.403) 8.092 3.831 ( -3.149 2.805 7.708) 8.787 3.962 ( -0.859 3.098 -0.034) 3.215 4.165 ( 1.275 -7.793 -0.298) 7.902 4.207 ( -0.458 -2.876 5.866) 6.549 4.526 ( 1.412 1.453 -2.961) 3.587 4.601 ( -0.478 -7.264 -6.654) 9.863 4.686 ( -3.612 5.040 -6.810) 9.210 4.894 ( -4.860 0.997 -2.412) 5.516 5.064 ( 7.149 7.068 -0.521) 10.066 5.233 ( 2.882 -0.720 3.874) 4.881 5.394 ( 1.411 -0.763 1.416) 2.140 5.476 ( -2.564 -9.613 -0.953) 9.995 5.666 ( 7.138 0.187 0.385) 7.151 5.950 ( -4.914 8.274 -4.007) 10.424 6.084 ( 2.720 3.589 1.667) 4.802 6.362 ( -5.762 3.935 0.057) 6.978 6.484 ( 4.131 5.806 -3.127) 7.781 6.594 ( -1.194 0.357 1.654) 2.071 6.845 ( -1.386 0.244 1.033) 1.746 7.034 ( 4.095 3.450 3.187) 6.231 7.134 ( -0.272 -0.832 -1.518) 1.752 7.393 ( -5.958 6.042 4.981) 9.839 7.571 ( -6.392 -1.613 1.154) 6.693 7.723 ( 6.479 0.817 1.905) 6.802 7.926 ( -3.596 -0.302 -2.333) 4.297 8.873 ( -3.713 -4.136 1.758) 5.829 9.033 ( -5.547 -13.666 -0.331) 14.752 9.203 ( -0.721 -7.993 1.504) 8.165 9.310 ( 0.505 -9.208 5.191) 10.582 9.511 ( -10.329 -3.378 1.540) 10.976 9.690 ( -0.065 2.825 0.628) 2.894 10.256 ( -4.912 7.352 2.495) 9.188 10.351 ( -2.286 -3.294 -1.938) 4.453 10.524 ( 0.844 1.883 -3.864) 4.380 10.956 ( -0.121 -0.550 -13.303) 13.315 11.127 ( 2.118 -5.402 -8.594) 10.369 11.168 ( 7.755 -3.070 5.179) 9.818 11.287 ( 7.906 -4.092 4.176) 9.832 11.548 ( 3.259 2.569 -4.481) 6.108 11.788 ( 3.755 0.506 4.581) 5.945 12.001 ( 2.054 -1.451 -7.507) 7.917 12.035 ( -4.549 1.334 1.381) 4.937 12.172 ( 1.366 -0.604 1.158) 1.890 12.419 ( 5.055 -2.326 -4.330) 7.050 12.490 ( 11.212 5.569 7.299) 14.491 12.689 ( -5.192 2.647 3.236) 6.666 12.868 ( -2.241 4.695 -7.874) 9.438 13.270 ( -21.994 2.241 5.471) 22.775 13.763 ( -7.053 9.713 -3.775) 12.583 14.991 ( -1.618 1.649 3.475) 4.173 15.126 ( -4.416 0.302 2.928) 5.307 15.300 ( 4.511 5.489 -0.951) 7.168 15.543 ( -2.076 -4.977 0.768) 5.447 15.616 ( -2.577 0.961 1.266) 3.028 15.785 ( 1.243 -0.231 -3.657) 3.870 15.838 ( 5.438 0.806 -7.272) 9.116 15.908 ( 0.899 5.845 4.282) 7.301 16.015 ( -1.956 0.044 -0.132) 1.961 16.416 ( -1.250 -1.056 0.458) 1.699 16.671 ( -3.888 -4.006 0.140) 5.584 16.873 ( -10.621 -9.103 5.605) 15.070 17.564 ( 17.225 10.577 1.419) 20.263 18.202 ( 9.280 5.765 4.816) 11.939 18.416 ( -1.742 -0.405 1.512) 2.342 18.747 ( 3.925 -0.412 -4.181) 5.750 25.897 ( 0.472 -2.037 1.179) 2.401 25.941 ( 0.588 -1.725 -0.984) 2.071 26.115 ( -1.109 -2.409 0.700) 2.743 26.150 ( -1.443 -1.166 1.268) 2.247 26.376 ( -2.417 3.823 -2.409) 5.125 26.533 ( 0.702 -1.595 -5.774) 6.031 26.814 ( 0.954 -1.199 2.329) 2.788 26.859 ( 3.523 0.028 7.451) 8.242 27.524 ( -5.152 0.476 -8.343) 9.817 27.985 ( 6.751 8.813 13.856) 17.755 28.365 ( -9.476 -0.542 -1.544) 9.616 28.499 ( -3.792 -6.562 -1.357) 7.700 28.818 ( -3.964 -11.713 1.932) 12.516 28.973 ( -11.418 -3.595 -7.908) 14.346 29.451 ( 9.033 -3.772 5.336) 11.149 30.389 ( 18.715 17.887 -7.920) 27.073 ======================= Grid point 179 (83/140) ======================= q-point: ( 0.44 0.11 -0.67) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.899 ( 2.031 -2.661 7.701) 8.398 2.002 ( 5.244 -10.496 0.624) 11.750 2.087 ( 0.536 -4.134 1.250) 4.353 2.300 ( 1.609 -10.905 -3.755) 11.645 2.361 ( -6.222 -11.090 -11.170) 16.925 2.623 ( 6.899 -0.081 -3.398) 7.691 2.704 ( -6.778 -0.176 -7.445) 10.069 2.813 ( -5.354 -1.790 0.184) 5.648 2.895 ( 3.892 0.794 -2.751) 4.832 3.027 ( 0.316 -5.520 1.128) 5.643 3.071 ( 1.270 -0.520 8.812) 8.918 3.213 ( -3.379 -2.904 -3.675) 5.775 3.294 ( -2.511 -12.268 3.218) 12.929 3.617 ( -0.189 7.522 1.717) 7.718 3.672 ( -4.906 -1.150 1.894) 5.383 3.892 ( -2.566 2.809 6.703) 7.708 4.029 ( 5.704 -8.075 3.037) 10.342 4.320 ( 4.244 -5.163 5.686) 8.775 4.344 ( 5.584 -7.484 -0.068) 9.338 4.477 ( -1.797 4.480 -5.835) 7.573 4.559 ( -1.689 0.506 -5.341) 5.625 4.680 ( 3.538 -2.869 -4.827) 6.637 4.809 ( -6.197 1.904 -2.041) 6.797 4.981 ( 3.670 4.911 -2.602) 6.661 5.283 ( -1.830 -0.732 0.396) 2.011 5.383 ( 2.718 1.237 0.524) 3.031 5.633 ( 0.153 -6.424 1.781) 6.668 5.702 ( 2.573 0.211 0.246) 2.593 5.845 ( -1.009 -1.244 0.716) 1.754 6.086 ( 4.580 1.437 -0.532) 4.829 6.257 ( -4.846 2.426 -0.311) 5.428 6.435 ( 4.176 2.207 -0.841) 4.797 6.543 ( -3.623 3.178 -0.350) 4.832 6.836 ( -2.264 -0.659 1.018) 2.568 7.027 ( 5.856 3.087 2.461) 7.062 7.121 ( -3.116 1.816 0.777) 3.689 7.308 ( -6.035 1.153 8.321) 10.343 7.540 ( -7.617 -2.141 -0.556) 7.932 7.819 ( 10.743 0.039 -0.782) 10.772 7.866 ( -1.971 2.005 -1.152) 3.038 8.904 ( -6.582 -2.329 5.095) 8.643 9.190 ( -5.261 -9.330 1.419) 10.805 9.345 ( 1.097 -5.427 1.233) 5.672 9.397 ( -2.715 -4.283 -0.331) 5.082 9.605 ( -0.496 1.948 -1.217) 2.350 9.658 ( 0.124 -10.337 4.462) 11.259 10.120 ( -7.720 3.740 4.364) 9.624 10.382 ( 1.667 -1.056 -1.822) 2.686 10.454 ( -1.760 3.064 -4.882) 6.027 10.891 ( -0.481 -0.012 -11.418) 11.429 11.167 ( 2.227 -2.907 -7.546) 8.387 11.304 ( 13.354 3.251 -2.868) 14.040 11.439 ( 5.099 -5.685 5.480) 9.399 11.551 ( 1.685 -2.725 2.444) 4.030 11.811 ( 2.505 2.256 0.901) 3.489 11.943 ( -0.840 0.580 -4.498) 4.612 12.022 ( -5.861 -0.906 0.449) 5.948 12.239 ( 3.737 -2.282 3.977) 5.916 12.426 ( 3.049 1.756 -8.737) 9.419 12.530 ( 9.048 3.742 6.927) 11.993 12.632 ( 1.976 2.583 2.491) 4.097 12.788 ( -0.735 0.132 -3.197) 3.283 13.061 ( -19.225 4.243 0.215) 19.689 13.509 ( -8.039 9.900 -3.328) 13.180 14.970 ( -0.177 0.314 -0.063) 0.365 15.132 ( -4.079 -2.041 5.439) 7.099 15.286 ( 2.449 -0.806 -0.311) 2.597 15.499 ( -3.910 6.122 -2.895) 7.820 15.599 ( -4.199 -2.560 1.149) 5.050 15.785 ( 5.996 2.238 -5.308) 8.314 15.850 ( 2.868 -0.991 -1.546) 3.405 15.879 ( 2.637 1.897 1.295) 3.497 16.044 ( 1.521 -2.497 2.763) 4.023 16.414 ( -3.074 -0.516 1.164) 3.328 16.697 ( -3.501 -2.262 1.861) 4.565 16.959 ( -9.880 -7.457 3.773) 12.940 17.524 ( 14.619 10.259 3.625) 18.223 18.139 ( 4.805 8.255 -0.968) 9.601 18.433 ( -2.717 -1.858 3.933) 5.128 18.758 ( 3.107 -0.057 -4.316) 5.319 25.951 ( 0.398 -2.384 1.880) 3.063 25.964 ( 0.444 -1.398 -0.286) 1.494 26.129 ( -2.147 -0.365 -1.156) 2.465 26.166 ( -0.521 -1.343 1.340) 1.967 26.269 ( -1.814 4.401 -3.932) 6.174 26.546 ( 1.575 -1.683 -4.630) 5.172 26.859 ( 0.228 -1.839 2.114) 2.811 26.931 ( 3.314 -0.427 10.074) 10.614 27.436 ( -3.211 0.654 -11.661) 12.112 27.914 ( 1.199 8.483 9.993) 13.163 28.313 ( -5.769 -2.124 -3.047) 6.861 28.570 ( -2.480 -4.880 -0.135) 5.476 28.966 ( -3.684 -5.600 -3.464) 7.546 29.013 ( -2.703 -11.979 2.620) 12.556 29.585 ( 4.216 -1.976 4.992) 6.826 30.156 ( 12.081 18.932 -6.444) 23.365 ======================= Grid point 180 (84/140) ======================= q-point: (-0.44 0.11 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.899 ( -5.191 4.512 8.329) 10.802 2.109 ( 2.374 3.477 4.304) 6.021 2.213 ( 1.093 -9.305 -0.871) 9.409 2.417 ( -6.397 -4.832 -6.608) 10.389 2.440 ( 4.678 -3.647 -3.401) 6.837 2.524 ( -1.186 7.558 -5.170) 9.233 2.705 ( 4.295 -2.139 -2.663) 5.488 2.807 ( -2.369 -4.410 -2.227) 5.479 2.926 ( -1.571 -1.516 0.404) 2.221 3.026 ( 3.504 5.357 2.071) 6.728 3.119 ( -0.820 -1.660 -0.813) 2.022 3.282 ( -4.351 -7.997 1.867) 9.293 3.470 ( -2.618 -7.282 3.800) 8.621 3.527 ( 2.436 5.142 3.653) 6.762 3.708 ( 2.090 -3.530 -0.175) 4.106 3.830 ( -3.053 4.121 4.975) 7.145 4.187 ( 1.360 -5.993 0.419) 6.159 4.258 ( -7.388 6.089 -4.745) 10.685 4.459 ( 7.046 -1.561 7.031) 10.076 4.484 ( -2.129 4.198 -2.556) 5.357 4.562 ( 6.240 -4.106 0.002) 7.470 4.662 ( -4.539 1.828 -1.298) 5.062 4.754 ( 0.555 0.076 -7.932) 7.952 4.977 ( 5.466 -1.634 -1.716) 5.957 5.243 ( -5.290 -1.796 -5.487) 7.830 5.399 ( 3.047 2.012 2.192) 4.259 5.690 ( -0.543 -0.076 -1.020) 1.158 5.730 ( 3.573 -1.463 1.774) 4.249 5.921 ( -0.237 -3.959 2.542) 4.711 6.073 ( 1.279 2.196 0.778) 2.657 6.216 ( -1.479 0.135 -0.662) 1.626 6.441 ( -1.595 2.188 1.289) 2.999 6.476 ( 3.093 0.669 0.079) 3.166 6.859 ( -2.440 -3.676 -0.443) 4.434 6.977 ( -0.959 3.055 -0.717) 3.281 7.121 ( 2.171 0.433 3.000) 3.728 7.320 ( -6.217 -3.385 8.097) 10.755 7.529 ( -4.256 -2.193 -0.102) 4.789 7.739 ( 0.483 5.497 -5.447) 7.753 7.933 ( 5.342 -1.862 -1.575) 5.873 8.914 ( -6.345 -1.797 8.613) 10.848 9.283 ( 2.057 -3.349 -2.362) 4.585 9.407 ( -0.814 -2.767 -0.041) 2.884 9.464 ( 3.281 -1.735 0.232) 3.719 9.563 ( 1.930 0.526 1.622) 2.576 9.870 ( -5.767 -10.400 1.396) 11.974 10.074 ( -3.718 -0.788 8.170) 9.011 10.292 ( -1.091 8.656 -1.354) 8.829 10.453 ( 2.483 -3.192 -2.334) 4.669 10.844 ( -0.215 -1.152 -10.471) 10.536 11.175 ( 1.996 1.043 -4.022) 4.609 11.254 ( 9.523 8.168 -3.678) 13.074 11.545 ( -1.900 0.997 2.849) 3.567 11.638 ( 2.272 -0.823 2.420) 3.419 11.784 ( 1.681 0.340 4.518) 4.833 11.931 ( -1.172 -2.187 -7.232) 7.646 12.019 ( -2.705 -2.724 1.772) 4.228 12.279 ( 0.663 2.772 0.994) 3.018 12.378 ( 2.412 0.276 -5.817) 6.303 12.544 ( -0.125 1.681 2.093) 2.688 12.634 ( 5.190 3.559 1.145) 6.397 12.753 ( -7.135 2.423 -4.073) 8.565 12.960 ( 1.940 -6.735 1.935) 7.271 13.330 ( -6.292 2.345 0.231) 6.719 14.967 ( -0.791 0.446 0.074) 0.911 15.178 ( -3.496 -3.819 3.607) 6.310 15.338 ( -4.008 -1.188 -3.349) 5.356 15.347 ( 2.033 3.396 1.022) 4.088 15.625 ( -1.159 -2.450 0.093) 2.712 15.757 ( 5.815 3.399 -3.762) 7.715 15.870 ( 2.136 1.252 0.208) 2.484 15.881 ( 3.120 1.063 0.274) 3.307 16.116 ( 2.180 -2.459 1.117) 3.471 16.401 ( -5.047 -0.941 1.741) 5.421 16.723 ( -1.754 -1.912 2.802) 3.819 17.011 ( -9.844 -6.485 2.186) 11.989 17.476 ( 10.590 9.440 3.946) 14.725 18.025 ( 0.479 5.471 -4.124) 6.868 18.468 ( -2.268 -2.131 4.112) 5.157 18.754 ( 2.513 0.506 -4.619) 5.282 25.961 ( -1.519 0.246 1.275) 1.998 26.023 ( 1.672 -2.350 1.666) 3.331 26.094 ( -2.207 1.259 -0.679) 2.630 26.170 ( -1.139 2.494 -2.000) 3.394 26.201 ( 0.796 -0.796 -0.050) 1.127 26.560 ( 1.713 -1.018 -4.399) 4.829 26.891 ( -0.491 -1.237 0.346) 1.375 27.029 ( 2.952 -1.666 11.853) 12.329 27.327 ( -2.825 1.987 -13.332) 13.772 27.862 ( -2.043 1.126 4.547) 5.111 28.317 ( 1.174 -0.830 1.501) 2.079 28.623 ( -0.184 -2.879 0.480) 2.925 29.018 ( 0.196 -3.268 -1.758) 3.716 29.213 ( -3.189 -11.922 3.122) 12.730 29.597 ( 0.839 5.819 0.853) 5.941 29.915 ( 4.706 12.556 -4.280) 14.075 ======================= Grid point 181 (85/140) ======================= q-point: (-0.33 0.11 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.783 ( -10.943 7.438 12.620) 18.285 2.018 ( 0.996 12.183 8.812) 15.069 2.291 ( -4.527 2.000 -8.440) 9.784 2.324 ( 1.024 2.855 -7.834) 8.401 2.436 ( 0.536 1.874 5.917) 6.230 2.485 ( 5.117 2.438 0.956) 5.748 2.720 ( 3.360 2.895 -0.083) 4.436 2.880 ( 2.444 1.785 -5.781) 6.525 2.907 ( -0.554 -3.948 -0.494) 4.017 3.008 ( 0.555 -0.336 3.302) 3.365 3.138 ( 0.001 -1.429 -0.925) 1.702 3.382 ( -2.882 -4.870 0.359) 5.671 3.479 ( 3.080 5.579 3.132) 7.101 3.522 ( -0.844 0.392 2.070) 2.269 3.755 ( -4.819 4.394 6.968) 9.544 3.797 ( 2.584 -3.234 -3.435) 5.379 4.085 ( -5.161 4.563 -2.150) 7.216 4.283 ( -2.573 -0.101 1.045) 2.779 4.375 ( -3.743 -1.478 1.499) 4.294 4.559 ( 8.334 0.517 5.466) 9.980 4.574 ( -3.678 3.664 0.431) 5.209 4.633 ( 3.499 -0.483 -7.132) 7.959 4.704 ( -0.114 0.697 -4.737) 4.789 5.063 ( 6.412 -2.546 -2.121) 7.218 5.231 ( -4.489 -4.071 -5.471) 8.165 5.380 ( 2.272 3.253 0.154) 3.971 5.674 ( 0.594 0.019 -1.142) 1.287 5.759 ( 0.677 2.759 1.690) 3.306 5.960 ( -0.029 -0.855 -0.629) 1.062 6.042 ( -0.196 3.748 0.964) 3.875 6.198 ( -3.888 -1.128 2.602) 4.813 6.414 ( 3.552 0.583 -1.485) 3.894 6.528 ( 3.419 -1.924 3.024) 4.953 6.824 ( -4.141 3.571 0.029) 5.468 7.024 ( 0.086 -7.714 -2.655) 8.159 7.117 ( -0.461 2.569 1.697) 3.113 7.398 ( -5.966 -6.752 4.290) 9.979 7.537 ( -2.305 -1.569 -1.484) 3.159 7.666 ( 2.775 0.289 -1.668) 3.251 7.953 ( 0.899 -0.114 -6.213) 6.278 8.965 ( -2.700 -2.312 9.887) 10.506 9.321 ( 5.362 -0.831 -4.099) 6.800 9.411 ( 2.104 2.706 -0.324) 3.443 9.529 ( 2.482 -0.450 -0.871) 2.669 9.609 ( 3.288 -2.788 1.010) 4.428 9.896 ( -10.950 0.182 0.699) 10.974 10.061 ( 1.624 5.038 5.727) 7.799 10.240 ( 0.452 -1.403 9.109) 9.228 10.523 ( 2.673 -2.960 -0.490) 4.018 10.820 ( 1.552 -1.295 -9.856) 10.062 11.120 ( 0.229 5.032 -0.079) 5.037 11.189 ( 8.410 5.860 -1.120) 10.311 11.422 ( -6.992 7.112 1.493) 10.085 11.627 ( -1.490 1.950 -0.762) 2.570 11.836 ( 2.457 0.260 -1.580) 2.933 11.919 ( -2.189 -0.330 -3.618) 4.242 12.056 ( 0.215 -1.497 2.836) 3.214 12.221 ( -1.473 3.081 2.403) 4.176 12.336 ( -3.031 1.950 -6.487) 7.421 12.520 ( -2.192 -0.871 -1.188) 2.641 12.567 ( 0.508 2.055 -5.045) 5.471 12.740 ( -0.123 -5.321 -1.361) 5.493 13.230 ( 11.506 -13.344 4.264) 18.128 13.338 ( -1.985 -5.007 5.342) 7.586 14.937 ( -1.508 1.857 1.858) 3.029 15.167 ( -5.370 2.797 2.075) 6.400 15.306 ( 1.380 -3.479 -2.177) 4.330 15.417 ( -2.842 -5.650 -2.031) 6.642 15.657 ( 0.933 -0.409 1.570) 1.872 15.737 ( 6.661 2.981 -0.818) 7.343 15.846 ( 2.447 3.374 0.289) 4.178 15.889 ( 1.958 0.171 -0.716) 2.092 16.172 ( 5.105 -1.282 -1.598) 5.501 16.387 ( -7.570 -2.014 2.261) 8.153 16.750 ( 1.269 0.354 1.957) 2.359 17.056 ( -12.084 -7.747 1.580) 14.441 17.410 ( 6.627 8.214 4.117) 11.329 17.931 ( -2.933 1.655 -5.872) 6.769 18.505 ( -1.966 -1.981 2.612) 3.823 18.736 ( 2.557 1.076 -5.145) 5.845 25.942 ( -1.867 1.260 1.873) 2.929 26.023 ( -0.604 2.554 -1.139) 2.861 26.098 ( 0.330 -1.214 2.408) 2.717 26.135 ( 0.231 0.495 2.946) 2.996 26.225 ( 0.823 -0.973 -1.017) 1.631 26.561 ( 1.625 -0.208 -4.617) 4.900 26.897 ( -1.188 -0.655 -1.459) 1.993 27.134 ( 1.444 -1.130 4.382) 4.750 27.215 ( -1.348 1.045 -4.587) 4.894 27.878 ( -4.785 -4.802 -1.734) 6.998 28.369 ( 5.075 0.081 5.824) 7.726 28.687 ( 6.304 -2.028 1.294) 6.747 29.053 ( 2.972 -0.154 -0.337) 2.995 29.344 ( 0.205 2.960 -0.609) 3.029 29.452 ( -5.219 0.829 0.142) 5.287 29.768 ( -3.788 4.722 -3.002) 6.757 ======================= Grid point 182 (86/140) ======================= q-point: (-0.22 0.11 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.609 ( -14.928 9.586 17.412) 24.858 1.815 ( 0.286 17.740 11.047) 20.900 2.113 ( -0.858 9.381 -3.452) 10.033 2.250 ( 0.455 2.469 -7.728) 8.125 2.364 ( 5.183 11.971 8.539) 15.591 2.519 ( 8.841 4.601 -0.613) 9.986 2.673 ( -2.601 4.123 3.496) 5.999 2.815 ( 4.120 3.927 -0.641) 5.728 2.976 ( 3.037 -2.565 -2.306) 4.596 3.023 ( -1.702 0.712 1.386) 2.308 3.129 ( -1.025 4.410 0.504) 4.555 3.319 ( 2.010 7.529 -0.943) 7.849 3.419 ( 0.361 4.408 -2.330) 4.999 3.504 ( -7.989 7.774 3.655) 11.732 3.670 ( -1.367 -3.419 3.877) 5.347 3.842 ( 1.348 -2.971 -3.228) 4.590 4.016 ( -3.383 0.596 1.704) 3.835 4.171 ( -8.759 4.733 -0.340) 9.962 4.460 ( 2.971 3.470 -1.033) 4.684 4.493 ( -0.835 -5.908 -2.916) 6.641 4.622 ( 5.880 2.478 -0.137) 6.383 4.673 ( 6.734 -3.111 1.736) 7.618 4.689 ( -2.992 -2.339 -1.057) 3.942 5.114 ( 4.438 -0.919 -6.388) 7.833 5.240 ( -5.223 -3.163 -2.429) 6.572 5.327 ( 3.573 4.825 -0.622) 6.036 5.645 ( -3.489 9.074 1.150) 9.789 5.717 ( 1.195 -3.838 -0.802) 4.099 5.933 ( 1.602 4.236 -1.346) 4.725 6.014 ( -1.387 -4.709 -2.514) 5.515 6.249 ( -0.177 -4.011 4.372) 5.935 6.427 ( 1.060 -0.446 -1.713) 2.063 6.626 ( 4.922 -2.955 5.185) 7.735 6.740 ( -0.677 3.924 2.463) 4.682 7.026 ( -7.150 4.518 2.149) 8.727 7.132 ( 0.496 -5.830 -8.104) 9.996 7.449 ( -3.860 -2.746 -1.143) 4.874 7.554 ( -2.836 -5.112 -2.748) 6.460 7.772 ( 5.584 -6.468 2.856) 9.010 7.916 ( -1.733 -0.138 -5.553) 5.818 8.991 ( 0.585 4.157 5.711) 7.088 9.323 ( 2.981 9.136 -1.173) 9.681 9.366 ( 0.404 1.140 -3.186) 3.408 9.482 ( 0.563 1.954 -0.011) 2.034 9.695 ( -0.306 4.818 -3.483) 5.953 9.725 ( -1.335 -1.381 -2.923) 3.497 10.168 ( -1.701 -6.797 16.007) 17.473 10.282 ( 1.294 2.922 10.411) 10.890 10.567 ( -0.709 -0.907 -0.337) 1.200 10.813 ( 5.896 0.237 -9.400) 11.099 11.030 ( 0.539 5.865 2.748) 6.499 11.181 ( 1.459 0.955 4.106) 4.461 11.292 ( 2.431 4.424 -2.589) 5.673 11.553 ( -0.716 3.887 -3.716) 5.425 11.780 ( -2.682 3.175 -2.817) 5.021 11.871 ( -1.522 1.985 -1.560) 2.948 12.102 ( 0.085 -2.614 0.604) 2.684 12.175 ( -4.512 1.677 2.203) 5.294 12.276 ( 2.298 0.877 -0.828) 2.596 12.491 ( -4.396 -2.389 -10.181) 11.344 12.600 ( 3.011 -3.520 1.734) 4.946 12.844 ( 1.855 -6.446 -2.440) 7.137 13.447 ( -2.223 -6.548 9.092) 11.423 13.613 ( 11.927 -15.919 2.031) 19.995 14.934 ( -0.953 -1.914 4.092) 4.617 15.097 ( -5.572 0.859 1.839) 5.930 15.371 ( 3.694 -1.944 -3.595) 5.508 15.428 ( -6.565 -0.973 -2.455) 7.076 15.662 ( -0.314 0.331 2.138) 2.187 15.755 ( 6.545 1.947 1.990) 7.112 15.814 ( 1.469 1.577 -0.903) 2.337 15.904 ( 1.127 -1.427 -2.135) 2.805 16.231 ( 10.626 0.728 -2.700) 10.988 16.372 ( -9.008 -2.942 2.156) 9.718 16.750 ( 4.867 2.851 1.702) 5.892 17.073 ( -15.384 -5.607 -0.815) 16.394 17.370 ( 1.994 3.170 7.225) 8.138 17.857 ( -3.986 0.175 -7.540) 8.531 18.519 ( -2.671 -0.702 0.553) 2.817 18.711 ( 3.487 1.352 -5.708) 6.824 25.911 ( -1.624 1.711 1.781) 2.956 25.967 ( 0.192 2.894 -0.921) 3.043 26.122 ( -0.368 -0.233 3.481) 3.508 26.178 ( 0.493 -0.919 6.072) 6.161 26.233 ( 0.961 -0.211 -0.348) 1.043 26.551 ( 2.008 0.386 -4.349) 4.805 26.878 ( -1.848 0.159 -3.140) 3.647 27.046 ( -3.310 2.731 -12.429) 13.149 27.315 ( 3.787 -3.616 13.679) 14.647 27.914 ( -8.109 -7.203 -5.984) 12.387 28.427 ( 1.807 0.207 5.792) 6.071 28.792 ( 11.005 0.408 -4.338) 11.836 29.103 ( 9.950 0.486 6.818) 12.071 29.169 ( 6.827 10.485 0.433) 12.519 29.440 ( -10.133 2.175 -4.790) 11.417 29.674 ( -10.912 -3.991 -0.331) 11.623 ======================= Grid point 183 (87/140) ======================= q-point: (-0.11 0.11 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.406 ( -16.241 10.767 21.487) 29.007 1.569 ( 2.615 18.211 13.591) 22.873 1.954 ( 2.859 10.320 1.769) 10.853 2.172 ( 1.857 2.956 -9.328) 9.960 2.256 ( 8.188 13.263 16.174) 22.462 2.424 ( 11.069 13.653 -1.085) 17.610 2.537 ( -3.907 7.065 -5.547) 9.795 2.815 ( 3.114 7.684 10.284) 13.210 2.914 ( -2.747 9.985 2.589) 10.675 2.973 ( -0.111 5.278 0.685) 5.323 3.040 ( -0.845 -0.928 -4.668) 4.833 3.165 ( -5.291 11.248 3.959) 13.046 3.309 ( 1.089 2.593 -6.549) 7.127 3.382 ( -1.130 -0.341 -5.127) 5.261 3.784 ( -3.056 -5.037 4.373) 7.337 3.889 ( 0.669 -0.739 -1.788) 2.047 3.995 ( -3.332 0.303 2.501) 4.177 4.060 ( -3.699 -3.460 -2.850) 5.812 4.392 ( -1.009 3.136 -3.801) 5.030 4.579 ( 6.539 2.182 -10.801) 12.814 4.614 ( 2.383 -2.578 6.295) 7.207 4.706 ( -5.307 -3.749 1.922) 6.776 4.807 ( 6.531 -1.343 6.132) 9.059 5.129 ( 3.289 -3.258 -8.927) 10.056 5.204 ( -7.986 0.125 -1.552) 8.136 5.314 ( 7.419 1.562 -0.071) 7.581 5.445 ( -4.112 9.980 1.433) 10.889 5.708 ( -1.024 4.379 -7.041) 8.354 5.971 ( 1.981 -7.000 2.671) 7.750 6.131 ( 1.179 -10.383 -2.606) 10.770 6.346 ( 0.660 -4.422 2.860) 5.308 6.449 ( -0.536 -3.391 -0.477) 3.466 6.705 ( 10.187 4.942 5.063) 12.403 6.753 ( -1.948 -5.064 6.175) 8.220 6.875 ( -10.296 5.085 0.549) 11.496 7.168 ( 3.240 -2.506 -8.839) 9.742 7.452 ( -1.905 -0.907 -0.163) 2.116 7.598 ( -4.073 -4.451 -5.822) 8.384 7.896 ( -4.463 -2.332 0.432) 5.054 7.938 ( 4.700 -6.043 1.135) 7.740 8.894 ( 1.173 10.046 4.369) 11.017 9.126 ( 0.284 11.610 -6.802) 13.459 9.235 ( -2.316 8.512 -1.193) 8.902 9.410 ( -1.962 8.277 -7.140) 11.105 9.637 ( -2.386 -4.200 4.980) 6.937 9.789 ( 2.314 -0.041 -2.386) 3.324 10.255 ( -3.555 -1.834 12.978) 13.581 10.367 ( -3.439 -4.494 9.217) 10.815 10.548 ( -1.739 1.056 0.704) 2.153 10.802 ( 9.952 3.376 -8.525) 13.532 10.977 ( 2.813 4.049 5.196) 7.163 11.163 ( -4.492 0.929 -1.070) 4.710 11.304 ( 7.005 0.530 0.125) 7.026 11.500 ( 7.068 -0.103 -7.102) 10.020 11.689 ( -4.224 4.298 4.118) 7.299 11.859 ( 1.732 -2.535 -3.481) 4.642 12.110 ( -3.882 1.487 3.694) 5.561 12.173 ( 1.439 -2.003 1.622) 2.952 12.293 ( 5.277 0.346 -3.304) 6.235 12.442 ( -5.227 -2.530 -11.010) 12.447 12.715 ( 0.322 -5.818 5.773) 8.202 12.950 ( 3.706 -4.946 -3.370) 7.039 13.558 ( -7.239 -3.869 12.554) 14.999 13.950 ( 7.777 -13.875 -4.443) 16.515 15.038 ( -3.971 -5.989 6.790) 9.886 15.079 ( -1.444 -3.985 0.942) 4.342 15.305 ( -6.977 3.992 -2.120) 8.313 15.391 ( 4.871 4.567 -2.546) 7.146 15.694 ( -0.860 -3.762 0.446) 3.885 15.768 ( 6.659 3.493 1.584) 7.684 15.831 ( -1.629 -4.946 -1.184) 5.340 15.933 ( -0.283 -3.032 -2.961) 4.248 16.243 ( -0.135 2.625 0.765) 2.737 16.388 ( 1.983 -1.808 -2.806) 3.883 16.782 ( 11.356 1.905 4.339) 12.305 16.984 ( -13.458 0.921 -3.398) 13.911 17.380 ( -13.486 -2.586 10.116) 17.055 17.796 ( 5.814 2.081 -8.266) 10.318 18.488 ( -4.070 1.388 0.407) 4.319 18.693 ( 4.846 1.258 -5.739) 7.616 25.882 ( -1.113 1.249 1.584) 2.304 25.923 ( 1.112 2.565 -0.347) 2.818 26.125 ( -1.372 1.007 2.207) 2.787 26.169 ( -0.926 2.484 0.469) 2.692 26.303 ( 1.697 -3.245 8.400) 9.163 26.545 ( 3.207 0.337 -2.717) 4.217 26.832 ( -2.536 1.197 -4.417) 5.232 26.916 ( -3.353 2.426 -9.588) 10.443 27.491 ( 5.489 -4.656 13.638) 15.421 27.919 ( -10.907 -5.662 -7.485) 14.389 28.448 ( -1.695 -0.224 3.888) 4.248 28.716 ( 0.958 7.351 -8.800) 11.506 29.040 ( 1.858 9.460 0.251) 9.644 29.142 ( -7.355 10.717 -3.056) 13.353 29.493 ( 28.398 -11.194 8.437) 31.669 29.690 ( -11.373 -7.297 -1.016) 13.550 ======================= Grid point 186 (88/140) ======================= q-point: ( 0.22 0.22 -0.67) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.263 ( -3.047 -0.000 -12.082) 12.460 1.684 ( -0.068 -0.000 -0.928) 0.931 1.689 ( 13.623 0.000 10.233) 17.038 1.833 ( -4.363 -0.000 -7.961) 9.078 2.073 ( 0.343 0.000 -10.305) 10.310 2.386 ( -6.561 -0.000 14.736) 16.131 2.440 ( 3.124 0.000 -5.229) 6.091 2.616 ( 6.370 0.000 -13.951) 15.337 2.862 ( -3.556 -0.000 11.732) 12.259 2.882 ( 0.442 0.000 11.548) 11.556 2.936 ( 8.105 0.000 -1.658) 8.273 3.184 ( 2.187 0.000 -5.199) 5.640 3.187 ( -2.390 -0.000 -5.980) 6.440 3.476 ( 13.883 0.000 4.977) 14.749 3.765 ( -4.719 -0.000 -2.567) 5.372 3.804 ( -1.480 -0.000 6.203) 6.377 4.075 ( -7.486 -0.000 -1.297) 7.597 4.082 ( 1.946 0.000 7.692) 7.934 4.262 ( -7.620 -0.000 -0.541) 7.639 4.319 ( -1.829 -0.000 -3.535) 3.980 4.616 ( 0.039 0.000 2.283) 2.283 4.751 ( -1.220 -0.000 -15.601) 15.649 4.898 ( -5.430 -0.000 7.527) 9.282 5.166 ( 6.932 0.000 0.119) 6.933 5.221 ( -1.276 -0.000 -8.859) 8.950 5.271 ( 3.851 0.000 5.577) 6.777 5.444 ( 2.230 0.000 2.552) 3.389 5.678 ( 12.050 0.000 0.267) 12.053 6.177 ( -9.156 -0.000 -6.055) 10.977 6.177 ( -2.213 -0.000 2.045) 3.013 6.468 ( -3.839 -0.000 3.352) 5.096 6.624 ( 1.494 0.000 7.496) 7.644 6.646 ( 4.409 0.000 -4.536) 6.326 6.842 ( 0.917 0.000 -1.642) 1.880 6.891 ( 1.270 0.000 -0.827) 1.515 7.305 ( 0.194 0.000 -1.845) 1.856 7.476 ( -4.661 -0.000 6.432) 7.944 7.640 ( 11.397 0.000 0.659) 11.416 7.688 ( -16.002 -0.000 -3.140) 16.308 7.865 ( -5.800 -0.000 -2.014) 6.140 8.642 ( -5.849 -0.000 -5.446) 7.992 8.859 ( 0.692 0.000 6.328) 6.366 9.025 ( -1.386 -0.000 1.658) 2.161 9.163 ( 5.818 0.000 10.410) 11.926 9.425 ( -17.734 -0.000 0.203) 17.735 9.735 ( 3.438 0.000 -0.698) 3.508 10.196 ( -3.873 -0.000 -4.753) 6.131 10.499 ( -0.350 -0.000 -0.538) 0.642 10.573 ( -2.876 -0.000 -1.328) 3.168 10.798 ( -2.145 -0.000 -12.735) 12.914 11.080 ( 5.854 0.000 -5.204) 7.832 11.098 ( 3.009 0.000 4.680) 5.564 11.246 ( 3.914 0.000 4.805) 6.198 11.618 ( 7.061 0.000 -7.757) 10.490 11.808 ( 3.342 0.000 11.008) 11.504 11.882 ( -1.790 -0.000 -4.795) 5.118 12.127 ( 0.037 0.000 -5.322) 5.322 12.191 ( -0.741 -0.000 -2.960) 3.051 12.333 ( 5.100 0.000 -2.424) 5.647 12.597 ( 10.272 0.000 7.086) 12.479 12.712 ( -8.653 -0.000 3.381) 9.290 12.979 ( -4.496 -0.000 -12.191) 12.994 13.298 ( -23.727 -0.000 11.668) 26.441 13.944 ( -5.679 -0.000 -2.023) 6.028 15.013 ( -0.024 -0.000 1.629) 1.629 15.178 ( -3.672 -0.000 1.117) 3.838 15.305 ( 2.379 0.000 0.998) 2.580 15.619 ( 8.247 0.000 -1.162) 8.328 15.670 ( -12.643 -0.000 5.278) 13.701 15.703 ( 4.206 0.000 -5.594) 6.999 15.887 ( 3.460 0.000 -4.704) 5.839 15.984 ( -3.890 -0.000 -3.274) 5.084 16.180 ( -2.565 -0.000 6.477) 6.966 16.307 ( 1.859 0.000 -2.356) 3.001 16.552 ( -2.550 -0.000 -0.794) 2.670 16.655 ( -8.329 -0.000 5.770) 10.132 17.796 ( 20.826 0.000 -4.529) 21.313 18.249 ( 2.264 0.000 10.828) 11.062 18.472 ( 6.477 0.000 4.430) 7.847 18.734 ( 3.703 0.000 -3.432) 5.049 25.857 ( -0.047 -0.000 -0.215) 0.221 25.901 ( 1.355 0.000 -0.574) 1.472 26.064 ( -1.165 -0.000 1.984) 2.301 26.114 ( -0.860 -0.000 0.718) 1.120 26.447 ( -2.508 -0.000 -1.037) 2.714 26.495 ( -0.889 -0.000 -5.495) 5.566 26.816 ( 2.166 0.000 5.076) 5.519 26.845 ( 2.433 0.000 2.570) 3.539 27.536 ( -6.978 -0.000 -7.379) 10.156 28.100 ( 7.491 0.000 10.980) 13.292 28.341 ( -5.374 -0.000 8.625) 10.162 28.493 ( -6.114 -0.000 6.977) 9.277 28.553 ( 1.069 0.000 -1.070) 1.513 28.878 ( -20.455 -0.000 -14.741) 25.214 29.384 ( 11.974 0.000 4.613) 12.832 30.743 ( 20.972 0.000 -14.018) 25.225 ======================= Grid point 187 (89/140) ======================= q-point: ( 0.33 0.22 -0.67) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.368 ( -1.170 -18.700 -10.583) 21.518 1.767 ( 1.590 -12.902 -5.446) 14.094 1.814 ( -3.697 -10.804 -18.502) 21.742 1.884 ( 11.566 -3.119 7.040) 13.894 2.109 ( 3.584 -1.335 6.197) 7.282 2.458 ( -7.631 -10.753 -1.999) 13.336 2.490 ( 4.274 -2.339 1.843) 5.209 2.668 ( -0.361 -7.995 -2.500) 8.384 2.818 ( -7.475 1.809 3.870) 8.610 2.972 ( 1.873 -1.872 3.836) 4.661 3.000 ( 7.376 -1.046 -2.029) 7.721 3.123 ( 1.480 2.062 2.976) 3.911 3.195 ( -0.995 -0.345 -7.252) 7.328 3.592 ( 2.827 -2.015 1.274) 3.698 3.763 ( 5.367 -3.254 0.164) 6.278 3.889 ( 0.067 -1.734 8.169) 8.351 3.974 ( -2.918 1.803 -0.383) 3.452 4.076 ( -7.158 3.803 1.427) 8.230 4.197 ( 0.573 -3.260 7.067) 7.804 4.401 ( -5.751 -8.309 -4.121) 10.913 4.575 ( 1.191 4.323 -2.676) 5.222 4.698 ( 4.259 -0.344 -11.899) 12.643 4.881 ( -5.583 1.327 4.399) 7.231 5.153 ( -0.546 1.977 -4.817) 5.236 5.224 ( 2.397 -3.727 -4.270) 6.154 5.378 ( 4.175 -3.052 9.691) 10.984 5.438 ( 0.276 3.116 2.501) 4.005 5.761 ( 11.533 1.602 -0.641) 11.662 6.020 ( -7.066 6.769 -2.774) 10.171 6.155 ( 0.926 1.922 0.878) 2.307 6.394 ( -5.955 5.018 0.075) 7.787 6.602 ( 3.740 5.368 -3.237) 7.300 6.643 ( 2.875 2.563 3.121) 4.958 6.820 ( -2.092 -0.445 -1.852) 2.829 7.019 ( 0.907 -8.707 2.767) 9.181 7.201 ( 0.866 8.659 -1.408) 8.815 7.458 ( -5.896 1.266 6.323) 8.737 7.508 ( -11.343 3.645 1.961) 12.074 7.803 ( 4.793 -5.565 -1.539) 7.504 7.812 ( -1.198 0.089 -2.289) 2.585 8.691 ( -5.107 -11.900 -3.887) 13.520 8.904 ( -0.576 -1.023 9.080) 9.156 9.072 ( -1.699 -4.616 3.341) 5.946 9.279 ( 2.784 -2.752 9.395) 10.178 9.342 ( -12.551 -5.245 1.598) 13.696 9.739 ( 1.858 1.865 -0.241) 2.644 10.199 ( -3.395 -6.519 -6.582) 9.867 10.386 ( -3.987 8.688 -2.405) 9.857 10.533 ( 0.363 0.946 -5.309) 5.405 10.780 ( -3.551 -7.035 -17.014) 18.750 11.100 ( 6.320 0.466 -3.901) 7.442 11.188 ( 5.234 -3.785 5.554) 8.518 11.321 ( 6.238 -1.276 6.946) 9.423 11.612 ( 6.468 2.953 -6.769) 9.817 11.866 ( 2.396 0.182 2.912) 3.775 11.897 ( -0.063 -3.070 0.535) 3.117 12.069 ( -1.450 2.952 -3.499) 4.802 12.182 ( 1.187 -0.159 1.606) 2.004 12.378 ( 2.418 -3.324 -5.305) 6.711 12.654 ( -3.127 0.986 1.657) 3.674 12.696 ( 4.210 0.848 6.596) 7.871 12.844 ( -5.591 2.533 -13.226) 14.581 13.162 ( -20.055 2.177 8.731) 21.981 13.839 ( -4.855 6.343 -3.000) 8.533 15.016 ( -0.892 0.427 3.550) 3.685 15.144 ( -3.265 2.197 1.959) 4.396 15.325 ( -0.120 -0.592 -3.692) 3.741 15.581 ( -3.322 5.156 4.155) 7.408 15.599 ( -0.586 1.466 2.205) 2.711 15.754 ( 2.209 -2.790 -2.257) 4.214 15.858 ( 4.655 2.172 -8.428) 9.870 15.982 ( -0.022 -2.021 -3.231) 3.811 16.082 ( 1.750 8.148 5.837) 10.174 16.385 ( -0.247 -3.109 0.948) 3.260 16.571 ( -2.823 -4.068 1.659) 5.222 16.694 ( -5.836 -6.734 4.606) 10.031 17.860 ( 17.481 7.506 -1.305) 19.069 18.322 ( 0.765 -1.195 9.480) 9.586 18.484 ( 2.900 6.012 4.067) 7.816 18.748 ( 3.094 -0.420 -3.662) 4.813 25.873 ( 0.517 -1.622 0.443) 1.759 25.918 ( 1.215 -1.069 -0.938) 1.871 26.075 ( -1.344 -1.403 0.935) 2.156 26.121 ( -1.617 -1.322 0.947) 2.294 26.392 ( -2.619 2.349 -4.131) 5.426 26.481 ( -0.057 -1.501 -4.167) 4.430 26.835 ( 1.154 0.872 3.315) 3.617 26.906 ( 2.616 -1.687 5.970) 6.733 27.446 ( -5.347 0.330 -8.135) 9.741 28.198 ( 2.907 -1.700 6.635) 7.440 28.322 ( -8.339 11.234 -1.052) 14.030 28.392 ( -2.448 -4.085 6.709) 8.227 28.650 ( -1.561 -7.353 2.074) 7.798 28.767 ( -7.391 -6.542 -5.721) 11.409 29.513 ( 8.844 -1.209 8.106) 12.058 30.722 ( 16.135 10.797 -13.971) 23.919 ======================= Grid point 188 (90/140) ======================= q-point: ( 0.44 0.22 -0.67) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.687 ( 1.066 -20.422 -1.066) 20.478 1.892 ( -3.159 -13.840 -16.224) 21.557 2.017 ( 4.824 -6.584 -2.825) 8.637 2.090 ( 10.679 -10.560 2.358) 15.203 2.174 ( -0.525 -2.462 4.089) 4.802 2.543 ( -8.794 -6.936 -3.302) 11.677 2.588 ( 2.972 -6.569 -5.128) 8.848 2.744 ( -7.989 -1.323 0.150) 8.100 2.856 ( -0.698 -11.018 4.547) 11.940 2.971 ( 5.643 4.835 -4.818) 8.856 3.093 ( 0.596 -8.094 0.481) 8.130 3.126 ( -3.729 -0.187 -8.681) 9.450 3.181 ( 3.322 0.261 12.683) 13.114 3.602 ( -7.055 -1.380 2.229) 7.526 3.755 ( -0.963 6.803 2.937) 7.472 3.955 ( 0.196 -4.080 1.525) 4.360 3.980 ( 2.655 2.407 8.201) 8.950 4.152 ( 4.044 -13.564 -3.426) 14.562 4.315 ( 2.307 -5.773 3.483) 7.126 4.423 ( -8.153 -3.067 -6.465) 10.847 4.516 ( 2.676 1.245 -5.642) 6.367 4.708 ( 8.964 -0.402 -7.198) 11.504 4.795 ( -5.084 4.744 1.207) 7.058 5.074 ( -1.536 4.004 -2.509) 4.969 5.304 ( 2.146 -0.361 0.565) 2.248 5.362 ( -4.669 -0.604 0.931) 4.799 5.528 ( 1.033 -5.245 6.536) 8.444 5.796 ( 9.676 3.830 -0.414) 10.415 5.868 ( -1.304 4.346 -0.472) 4.562 6.149 ( 4.424 2.048 -1.069) 4.991 6.266 ( -5.197 3.090 0.288) 6.053 6.517 ( 1.795 5.173 -1.222) 5.611 6.601 ( 1.288 4.515 -0.415) 4.714 6.796 ( -4.348 -0.620 -1.275) 4.573 7.132 ( 0.968 -0.573 1.895) 2.204 7.148 ( 3.819 1.539 5.680) 7.015 7.341 ( -7.752 5.103 5.505) 10.790 7.428 ( -9.633 -1.083 1.556) 9.818 7.826 ( -2.469 -2.769 -2.478) 4.462 7.882 ( 6.454 -0.269 -2.387) 6.886 8.828 ( -4.666 -7.105 1.244) 8.591 9.012 ( -0.335 -7.670 9.478) 12.197 9.177 ( -4.096 -9.452 0.902) 10.341 9.339 ( -5.493 -4.224 4.000) 8.001 9.467 ( 1.808 -8.100 7.525) 11.202 9.705 ( 0.900 2.840 0.040) 2.979 10.187 ( -4.511 7.882 -1.056) 9.143 10.276 ( -0.976 -7.194 -6.488) 9.737 10.478 ( 0.468 2.359 -7.337) 7.721 10.772 ( -2.348 -4.584 -17.526) 18.267 11.135 ( 6.332 -1.044 -3.813) 7.465 11.354 ( 7.149 -5.938 6.071) 11.100 11.457 ( 7.726 -3.734 4.117) 9.518 11.565 ( 3.737 2.965 -3.052) 5.663 11.879 ( 2.344 2.067 1.428) 3.436 11.923 ( -1.768 -0.843 -4.560) 4.963 11.989 ( -2.506 3.036 1.341) 4.159 12.243 ( 2.907 -2.737 4.451) 5.979 12.403 ( 0.586 -0.850 -7.901) 7.968 12.616 ( -4.591 -2.390 -3.928) 6.498 12.721 ( -1.436 2.991 -3.011) 4.481 12.748 ( 2.680 -0.633 3.608) 4.539 12.990 ( -14.245 5.969 4.639) 16.127 13.623 ( -6.012 11.710 -3.879) 13.723 15.002 ( -1.471 2.587 3.199) 4.369 15.101 ( -3.400 -0.041 4.228) 5.426 15.292 ( 1.130 1.198 -6.570) 6.773 15.493 ( -3.977 2.719 1.493) 5.044 15.605 ( -1.505 0.121 2.522) 2.939 15.803 ( 2.148 1.735 -8.073) 8.533 15.821 ( 2.469 -3.316 -0.324) 4.147 15.978 ( 5.106 2.912 -2.450) 6.368 16.066 ( 3.592 0.731 6.654) 7.597 16.402 ( -1.286 0.184 1.098) 1.701 16.627 ( -4.313 -3.645 3.657) 6.728 16.797 ( -5.109 -7.191 3.452) 9.472 17.833 ( 14.819 10.507 2.186) 18.298 18.333 ( 0.530 9.561 5.003) 10.804 18.414 ( -1.493 -0.202 3.813) 4.100 18.756 ( 2.478 -0.225 -4.166) 4.853 25.921 ( 0.824 -2.614 1.378) 3.068 25.944 ( 1.000 -1.422 -0.347) 1.773 26.090 ( -1.854 -1.455 -0.773) 2.480 26.137 ( -1.943 -1.675 0.724) 2.666 26.301 ( -1.614 3.402 -4.726) 6.043 26.497 ( 0.691 -2.217 -4.001) 4.626 26.850 ( -0.044 -0.402 2.422) 2.456 26.988 ( 2.121 -1.562 8.359) 8.764 27.360 ( -3.766 0.415 -10.197) 10.878 28.045 ( -10.878 7.101 -8.598) 15.579 28.285 ( 4.790 0.370 9.698) 10.823 28.488 ( -0.304 -4.578 4.949) 6.749 28.789 ( -2.809 -9.567 1.867) 10.144 28.859 ( 0.440 -7.609 1.439) 7.757 29.622 ( 3.831 -0.656 7.980) 8.876 30.517 ( 11.270 17.536 -12.761) 24.441 ======================= Grid point 189 (91/140) ======================= q-point: ( 0.56 0.22 -0.67) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.964 ( -1.778 -2.102 8.004) 8.464 2.010 ( -1.654 -10.763 -5.961) 12.414 2.128 ( 3.595 -9.209 -2.484) 10.193 2.230 ( 0.887 -4.743 2.218) 5.310 2.340 ( 3.734 -8.717 -8.030) 12.426 2.567 ( -1.949 -2.290 0.919) 3.145 2.662 ( -0.178 -4.339 -4.698) 6.398 2.717 ( -2.195 -1.373 -3.812) 4.608 2.897 ( -0.400 1.491 -2.229) 2.711 3.017 ( -0.438 -4.424 -1.335) 4.642 3.117 ( -3.591 -7.235 -1.003) 8.140 3.216 ( 2.665 5.331 6.642) 8.924 3.287 ( -0.999 -11.983 3.104) 12.419 3.586 ( -3.863 -1.467 2.782) 4.981 3.700 ( 1.457 1.399 4.234) 4.692 3.926 ( -1.449 5.115 6.749) 8.592 4.073 ( -1.393 -6.024 1.952) 6.484 4.282 ( -4.404 4.623 -10.346) 12.158 4.398 ( -1.751 -7.715 -3.185) 8.528 4.453 ( 4.866 -6.438 -4.166) 9.082 4.546 ( 6.039 -4.739 -1.498) 7.821 4.684 ( -6.265 3.391 2.322) 7.493 4.753 ( 8.954 1.745 -4.939) 10.373 4.994 ( 0.659 1.806 -3.849) 4.302 5.216 ( -3.554 4.896 3.296) 6.889 5.432 ( -1.314 -3.193 2.095) 4.039 5.616 ( -3.021 -4.490 -0.823) 5.474 5.791 ( 6.623 2.738 2.680) 7.652 5.864 ( 2.636 -1.525 -4.021) 5.044 6.139 ( 2.655 1.838 3.461) 4.734 6.218 ( -1.956 1.298 1.489) 2.780 6.471 ( 0.471 1.672 0.968) 1.989 6.546 ( 3.861 3.707 0.827) 5.416 6.776 ( -3.300 -2.547 -2.026) 4.634 7.057 ( -3.809 6.930 2.197) 8.207 7.178 ( 3.777 1.397 3.324) 5.222 7.293 ( -6.425 0.782 8.250) 10.486 7.424 ( -4.773 -5.017 0.571) 6.948 7.783 ( -2.145 2.987 -5.462) 6.584 7.916 ( 2.709 -1.236 -4.794) 5.643 8.886 ( -4.112 -2.686 7.232) 8.743 9.201 ( 1.859 -7.569 4.840) 9.174 9.321 ( -2.797 -9.003 0.973) 9.478 9.401 ( -0.059 -3.831 4.709) 6.071 9.613 ( 1.517 -1.374 0.785) 2.193 9.717 ( 1.221 -4.938 3.746) 6.317 10.066 ( -4.879 1.763 5.149) 7.310 10.357 ( -1.884 -2.658 -5.618) 6.494 10.399 ( 2.499 0.796 -4.175) 4.930 10.739 ( -0.208 -3.178 -16.516) 16.820 11.189 ( 6.329 -1.116 -3.356) 7.250 11.436 ( 7.218 6.397 -1.864) 9.823 11.537 ( 1.190 -2.806 2.095) 3.699 11.664 ( 6.476 -4.671 4.063) 8.959 11.835 ( -2.881 2.872 -0.173) 4.072 11.868 ( 1.029 1.476 -3.862) 4.260 11.961 ( -3.888 -0.809 2.815) 4.868 12.304 ( -1.002 1.565 -1.495) 2.385 12.351 ( 0.989 -1.107 -7.158) 7.311 12.618 ( -2.226 1.262 2.470) 3.557 12.670 ( -4.296 -0.397 -1.125) 4.459 12.800 ( -8.606 4.135 -1.308) 9.636 12.854 ( 10.289 -3.458 3.882) 11.528 13.354 ( -7.578 9.499 -2.765) 12.462 14.974 ( -0.471 0.677 1.741) 1.927 15.116 ( -4.007 -1.857 3.891) 5.886 15.259 ( -0.108 -0.567 -4.956) 4.989 15.424 ( -2.397 3.179 -1.929) 4.424 15.598 ( 0.290 0.117 2.329) 2.350 15.773 ( 0.672 -1.068 -6.711) 6.829 15.886 ( 2.528 -1.472 0.678) 3.003 15.960 ( 4.990 2.876 -0.953) 5.838 16.130 ( 4.298 -0.469 5.214) 6.774 16.380 ( -3.140 1.183 1.816) 3.816 16.669 ( -4.383 -3.295 5.299) 7.625 16.876 ( -4.138 -4.983 1.433) 6.634 17.758 ( 10.080 11.813 3.800) 15.987 18.148 ( -1.183 10.529 -2.010) 10.784 18.449 ( -1.386 -1.243 5.846) 6.136 18.754 ( 2.099 0.051 -4.667) 5.117 25.956 ( -0.514 -0.626 1.390) 1.609 26.000 ( 1.960 -3.061 1.715) 4.019 26.082 ( -2.132 -0.102 -1.221) 2.459 26.151 ( -1.637 -1.507 -1.170) 2.514 26.224 ( -0.064 2.465 -1.685) 2.987 26.519 ( 0.908 -2.104 -5.042) 5.539 26.865 ( -1.090 -0.852 0.577) 1.499 27.076 ( 1.406 -1.828 9.420) 9.699 27.269 ( -2.632 1.142 -10.594) 10.976 27.851 ( -7.647 2.756 -6.113) 10.171 28.367 ( 4.606 -0.109 9.122) 10.219 28.586 ( 2.581 -3.712 3.369) 5.638 28.928 ( 0.022 -7.322 1.002) 7.391 29.026 ( -0.134 -9.535 4.090) 10.377 29.661 ( -0.571 1.560 4.697) 4.983 30.205 ( 5.833 19.385 -11.304) 23.186 ======================= Grid point 190 (92/140) ======================= q-point: (-0.33 0.22 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.893 ( -7.948 6.735 11.732) 15.690 2.134 ( -0.299 -5.132 -3.808) 6.398 2.247 ( 0.729 3.499 1.218) 3.775 2.327 ( 0.865 -5.447 -0.315) 5.524 2.385 ( 1.250 -3.444 -5.907) 6.951 2.595 ( 6.668 1.656 1.743) 7.088 2.695 ( -3.714 -4.640 -2.916) 6.620 2.797 ( 4.982 -6.736 -1.688) 8.546 2.874 ( -3.826 -0.224 -1.302) 4.048 3.068 ( 2.626 -2.099 -1.058) 3.524 3.143 ( 1.165 4.782 2.761) 5.643 3.227 ( -2.852 -7.351 -0.765) 7.922 3.464 ( -1.323 -7.333 3.627) 8.288 3.607 ( -0.355 1.512 6.009) 6.207 3.737 ( 1.820 -2.615 -2.605) 4.116 3.846 ( -2.300 6.259 4.706) 8.161 4.102 ( -5.069 4.180 -3.715) 7.548 4.175 ( -3.837 -5.645 1.380) 6.964 4.408 ( -1.768 0.578 -2.655) 3.241 4.516 ( 0.761 -2.276 -10.109) 10.390 4.611 ( -2.616 2.282 3.789) 5.139 4.680 ( 4.639 -1.541 2.053) 5.302 4.736 ( 5.812 4.012 -1.982) 7.335 5.003 ( 1.490 -5.364 -11.506) 12.782 5.181 ( 1.378 1.054 7.304) 7.507 5.445 ( 0.269 1.353 1.470) 2.016 5.637 ( -2.969 -2.577 -3.609) 5.337 5.817 ( 1.794 0.996 0.420) 2.095 5.894 ( 2.044 -2.404 -3.192) 4.489 6.120 ( -2.892 3.812 0.223) 4.790 6.208 ( 0.664 1.102 8.267) 8.367 6.444 ( 0.246 1.806 -0.450) 1.877 6.554 ( 2.980 0.224 4.144) 5.109 6.832 ( 2.584 -4.769 -1.927) 5.756 6.951 ( -0.594 3.356 0.323) 3.423 7.159 ( -3.114 2.826 1.354) 4.418 7.292 ( -5.571 -2.914 5.423) 8.303 7.483 ( -1.622 -2.771 2.097) 3.835 7.683 ( 0.133 2.780 -5.549) 6.208 7.905 ( -1.513 -0.763 -7.741) 7.924 8.951 ( -2.007 -3.216 9.673) 10.389 9.306 ( 2.915 -3.659 -5.110) 6.928 9.435 ( 3.025 -1.934 5.297) 6.400 9.492 ( -0.340 -3.030 2.521) 3.956 9.645 ( 3.594 -1.157 1.701) 4.141 9.794 ( -6.158 -2.359 3.823) 7.622 10.114 ( -2.617 -3.603 7.304) 8.555 10.268 ( -0.240 2.635 0.411) 2.677 10.478 ( 1.253 -4.263 -0.644) 4.489 10.733 ( 4.724 -3.946 -15.367) 16.554 11.217 ( 4.820 2.421 -0.335) 5.404 11.360 ( 5.541 7.421 -0.037) 9.262 11.488 ( -4.350 5.672 -1.586) 7.322 11.694 ( 1.419 5.437 2.858) 6.304 11.831 ( -2.551 -3.172 -8.242) 9.192 11.848 ( -0.139 -0.645 1.543) 1.678 12.010 ( -0.050 -4.456 2.574) 5.146 12.219 ( -2.666 0.805 -8.563) 9.005 12.348 ( -1.877 1.602 2.911) 3.816 12.531 ( -3.502 5.664 1.227) 6.771 12.643 ( 0.159 3.167 -3.022) 4.380 12.684 ( 2.179 2.333 -2.076) 3.807 13.098 ( 8.274 -12.591 3.280) 15.419 13.241 ( -5.927 -3.686 1.500) 7.139 14.976 ( 0.556 0.984 2.384) 2.638 15.126 ( -5.538 -1.859 1.478) 6.026 15.260 ( -0.741 -2.061 -3.521) 4.147 15.346 ( -0.578 1.754 -2.598) 3.188 15.641 ( 1.130 -2.577 1.764) 3.321 15.770 ( 0.902 -0.807 -4.050) 4.227 15.910 ( 1.502 1.049 0.600) 1.928 15.946 ( 3.929 2.593 -0.963) 4.805 16.198 ( 5.305 -0.955 3.562) 6.461 16.334 ( -5.024 1.307 1.690) 5.459 16.727 ( -3.562 -3.606 6.328) 8.107 16.917 ( -3.148 -3.038 -0.313) 4.386 17.630 ( 2.271 11.228 4.943) 12.476 17.970 ( 0.861 7.279 -6.581) 9.851 18.485 ( -1.569 -0.976 5.222) 5.539 18.743 ( 2.402 0.424 -5.208) 5.751 25.958 ( -0.989 0.748 2.350) 2.657 26.048 ( -0.488 1.423 -1.172) 1.907 26.078 ( 0.519 -2.791 2.470) 3.763 26.151 ( -0.367 -0.446 0.527) 0.782 26.208 ( 0.215 -0.448 -0.085) 0.504 26.530 ( 1.061 -1.597 -6.310) 6.595 26.867 ( -1.391 -0.601 -0.655) 1.651 27.111 ( -2.622 0.505 -7.753) 8.200 27.231 ( 1.448 -0.967 8.152) 8.336 27.764 ( -5.484 -1.484 -5.436) 7.863 28.441 ( 2.330 0.148 8.835) 9.138 28.702 ( 8.237 -3.968 1.439) 9.255 29.049 ( 3.503 -4.229 2.916) 6.217 29.194 ( -2.637 -9.195 2.470) 9.879 29.590 ( -2.400 7.427 0.567) 7.826 29.878 ( -0.510 14.681 -8.850) 17.150 ======================= Grid point 191 (93/140) ======================= q-point: (-0.22 0.22 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( -9.619 9.020 14.563) 19.646 2.091 ( -1.258 9.888 3.565) 10.586 2.166 ( -0.472 1.750 -6.111) 6.374 2.320 ( 7.113 4.685 -4.067) 9.438 2.501 ( -0.708 -4.439 5.242) 6.905 2.608 ( 7.546 4.544 2.380) 9.124 2.718 ( -1.957 -0.806 -1.835) 2.802 2.841 ( -1.682 -1.925 -2.281) 3.426 2.933 ( 4.014 -3.741 -0.743) 5.537 3.061 ( 1.766 3.114 3.759) 5.191 3.166 ( 3.289 -0.825 0.582) 3.440 3.301 ( -4.206 -5.223 -4.922) 8.318 3.525 ( -2.058 4.286 3.642) 5.989 3.573 ( 1.325 1.939 4.569) 5.137 3.713 ( -4.021 7.361 0.505) 8.402 3.767 ( -0.121 -2.652 -5.150) 5.794 4.028 ( -3.236 2.272 4.288) 5.832 4.204 ( -7.295 0.173 2.509) 7.716 4.359 ( -0.859 -0.198 0.030) 0.882 4.531 ( 3.280 0.534 -12.082) 12.531 4.598 ( 1.240 -3.726 6.127) 7.277 4.676 ( -0.163 1.532 -3.174) 3.528 4.735 ( 6.134 1.768 1.231) 6.501 5.042 ( 0.453 -4.594 -13.069) 13.860 5.228 ( 2.993 1.460 7.344) 8.064 5.421 ( 2.630 3.034 -0.382) 4.033 5.643 ( -3.538 -2.359 -1.298) 4.446 5.775 ( 0.066 4.005 0.185) 4.010 5.924 ( 0.020 -1.471 -2.771) 3.137 6.002 ( -3.217 4.941 -1.313) 6.041 6.254 ( 2.400 -0.277 7.574) 7.950 6.413 ( -1.689 0.487 -2.580) 3.122 6.614 ( 0.111 -2.617 6.362) 6.880 6.883 ( 7.983 4.845 4.575) 10.399 6.975 ( 0.733 -6.523 -5.549) 8.595 7.050 ( -7.288 4.178 -2.941) 8.900 7.346 ( -4.282 -4.996 2.290) 6.967 7.488 ( -1.011 0.217 -1.538) 1.853 7.699 ( 1.283 -5.132 0.488) 5.312 7.863 ( -2.163 -0.896 -6.553) 6.959 9.047 ( -0.230 -2.655 8.817) 9.211 9.341 ( 2.406 -0.476 -5.884) 6.375 9.480 ( 3.806 3.360 1.925) 5.430 9.499 ( -2.760 -0.039 0.237) 2.771 9.674 ( 1.563 0.611 0.072) 1.679 9.749 ( -6.393 3.458 0.311) 7.275 10.140 ( -4.251 -2.076 11.232) 12.188 10.338 ( 1.447 -2.931 6.301) 7.098 10.524 ( -1.875 -2.072 -0.586) 2.855 10.802 ( 11.936 -3.976 -12.028) 17.405 11.181 ( 4.093 6.327 3.334) 8.240 11.232 ( -8.548 6.126 2.219) 10.748 11.405 ( 9.651 4.510 -1.094) 10.709 11.595 ( -1.721 4.781 -3.654) 6.259 11.793 ( -0.157 1.545 -4.972) 5.209 11.854 ( -4.459 -0.449 -1.022) 4.596 12.064 ( -0.335 -1.805 -0.344) 1.868 12.173 ( -0.991 -0.015 -2.803) 2.973 12.326 ( 0.815 1.831 5.144) 5.521 12.425 ( -2.510 3.071 -4.829) 6.249 12.582 ( 1.518 0.296 -1.134) 1.917 12.731 ( 2.137 -5.147 -3.500) 6.581 13.326 ( -4.753 -8.990 5.681) 11.648 13.427 ( 6.602 -15.182 1.633) 16.636 14.968 ( 1.154 2.262 4.857) 5.481 15.089 ( -4.369 1.557 -0.264) 4.646 15.295 ( -1.490 -4.118 -2.015) 4.821 15.347 ( -0.044 -3.552 -3.324) 4.865 15.688 ( 1.293 -0.110 2.117) 2.484 15.770 ( -0.146 -0.371 -1.725) 1.771 15.887 ( 0.676 2.265 -0.088) 2.365 15.921 ( 3.033 2.538 -2.078) 4.468 16.255 ( -10.737 -2.089 3.678) 11.540 16.314 ( 10.911 0.030 -0.749) 10.937 16.787 ( -2.540 -2.739 5.931) 7.010 16.929 ( -2.112 -1.326 -1.373) 2.847 17.477 ( -6.848 7.844 6.760) 12.414 17.864 ( 6.291 3.637 -9.283) 11.789 18.502 ( -2.563 -0.133 3.659) 4.469 18.729 ( 3.477 0.727 -5.540) 6.580 25.940 ( -1.044 1.789 2.290) 3.087 26.007 ( 0.072 2.132 -1.211) 2.453 26.127 ( -0.248 -0.997 3.116) 3.281 26.193 ( 0.717 -1.930 6.363) 6.687 26.218 ( -0.138 -0.995 -1.509) 1.813 26.533 ( 1.990 -1.308 -6.598) 7.015 26.854 ( -1.470 0.305 -1.388) 2.045 27.004 ( -3.326 2.423 -11.019) 11.762 27.348 ( 2.578 -3.418 13.413) 14.080 27.744 ( -4.817 -3.740 -5.836) 8.441 28.477 ( -0.952 1.107 7.809) 7.944 28.831 ( 8.934 -1.850 -6.017) 10.929 29.185 ( 8.594 -5.020 8.150) 12.864 29.307 ( -3.363 -5.759 -0.039) 6.669 29.403 ( 0.243 11.547 0.099) 11.550 29.623 ( -7.229 7.809 -7.118) 12.802 ======================= Grid point 192 (94/140) ======================= q-point: (-0.11 0.22 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.594 ( -7.417 10.549 16.729) 21.123 1.910 ( 2.126 13.256 5.986) 14.700 2.071 ( -0.541 6.262 -5.109) 8.100 2.272 ( 8.795 6.103 -2.889) 11.088 2.502 ( -2.402 4.706 3.538) 6.359 2.589 ( 4.651 4.991 0.126) 6.823 2.672 ( 2.985 5.826 1.188) 6.653 2.889 ( -0.514 -3.375 -0.271) 3.424 2.960 ( -0.444 1.617 -0.980) 1.942 3.060 ( 0.869 1.837 5.383) 5.753 3.169 ( 4.206 5.889 3.243) 7.930 3.263 ( -5.704 -0.664 -9.357) 10.979 3.341 ( -7.380 12.167 1.269) 14.287 3.483 ( 5.657 11.488 1.261) 12.867 3.704 ( 0.678 -3.426 1.787) 3.923 3.810 ( -0.559 -6.519 -3.318) 7.337 3.969 ( -6.205 2.701 4.496) 8.125 4.105 ( -3.072 6.207 6.636) 9.592 4.388 ( -3.332 -1.768 -7.169) 8.101 4.495 ( 2.160 -1.219 -0.332) 2.503 4.642 ( 1.315 0.618 -5.313) 5.508 4.728 ( 6.777 -1.807 3.615) 7.890 4.798 ( 3.935 -5.114 1.557) 6.638 5.025 ( -2.370 -2.298 -13.113) 13.522 5.217 ( -1.147 4.379 5.457) 7.090 5.398 ( 6.112 2.238 -3.304) 7.300 5.580 ( -4.826 6.147 3.410) 8.526 5.734 ( -0.096 3.040 -0.767) 3.137 5.928 ( 0.953 -1.431 -0.626) 1.829 5.962 ( -0.864 -5.087 -4.465) 6.824 6.327 ( 2.582 -1.990 5.318) 6.238 6.390 ( -1.629 -1.717 -2.551) 3.480 6.705 ( -0.744 -4.136 8.563) 9.539 6.841 ( -8.646 4.064 -0.442) 9.564 6.920 ( 6.204 5.530 0.610) 8.333 7.070 ( 4.487 -5.177 -7.747) 10.342 7.400 ( -4.076 -4.262 1.054) 5.991 7.487 ( -0.412 -1.828 -1.276) 2.267 7.791 ( -5.410 -4.299 -0.149) 6.912 7.882 ( 2.687 -4.741 -0.876) 5.520 9.067 ( -0.472 5.378 5.078) 7.411 9.246 ( -1.255 7.499 -6.654) 10.104 9.388 ( -4.108 7.749 0.946) 8.822 9.486 ( 3.250 4.142 1.143) 5.387 9.610 ( -5.007 3.688 0.513) 6.239 9.722 ( 0.092 -4.965 -3.550) 6.104 10.218 ( -8.781 -3.687 14.146) 17.053 10.378 ( -1.559 0.662 5.534) 5.788 10.533 ( -0.694 -0.982 -1.191) 1.693 10.901 ( 16.099 -0.027 -9.537) 18.712 11.101 ( -3.407 2.857 2.089) 4.913 11.137 ( 0.390 4.055 3.945) 5.671 11.399 ( 3.989 4.902 -2.465) 6.783 11.511 ( 4.433 1.040 -7.916) 9.132 11.749 ( -0.444 3.317 2.136) 3.970 11.821 ( 1.489 -1.799 -2.204) 3.211 12.110 ( 0.055 -2.442 3.193) 4.020 12.160 ( -0.858 -0.521 0.333) 1.058 12.321 ( 0.363 2.619 -4.284) 5.035 12.359 ( 2.533 -0.268 -3.578) 4.392 12.640 ( -1.480 -5.210 3.482) 6.439 12.834 ( 1.922 -7.158 -4.965) 8.921 13.453 ( -8.577 -7.402 8.158) 13.961 13.724 ( 2.178 -14.773 -2.493) 15.140 14.986 ( -2.111 -0.904 6.479) 6.874 15.049 ( 1.317 -0.208 1.012) 1.674 15.277 ( -6.796 0.814 -1.415) 6.989 15.445 ( 6.866 -4.305 -2.903) 8.608 15.681 ( -0.579 2.223 3.095) 3.854 15.766 ( -1.144 -0.937 -0.873) 1.718 15.857 ( 2.135 2.120 -1.032) 3.181 15.894 ( 1.172 0.667 -3.812) 4.044 16.192 ( -12.887 -1.303 1.119) 13.001 16.406 ( 7.670 -0.357 -1.113) 7.759 16.834 ( -5.943 -2.333 2.004) 6.691 16.941 ( 8.506 0.502 1.743) 8.698 17.327 ( -14.677 3.589 7.238) 16.753 17.863 ( 13.115 0.497 -7.460) 15.097 18.484 ( -3.508 1.012 2.004) 4.165 18.720 ( 4.609 0.821 -5.383) 7.134 25.910 ( -0.786 1.953 1.892) 2.831 25.969 ( 1.026 2.167 -1.100) 2.638 26.143 ( -1.156 0.466 3.248) 3.479 26.197 ( -1.168 1.318 0.041) 1.761 26.293 ( 0.696 -3.766 7.145) 8.106 26.546 ( 3.788 -1.222 -5.464) 6.760 26.820 ( -1.759 1.348 -1.760) 2.830 26.886 ( -2.620 2.613 -8.297) 9.085 27.511 ( 3.434 -5.109 13.914) 15.215 27.743 ( -5.260 -3.901 -6.302) 9.088 28.471 ( -3.052 1.735 6.491) 7.380 28.785 ( 1.070 5.545 -11.010) 12.373 29.216 ( -7.853 10.740 -1.950) 13.447 29.273 ( 3.626 6.185 2.588) 7.622 29.391 ( -7.900 -3.718 -0.358) 8.738 29.593 ( 19.142 -11.823 1.501) 22.549 ======================= Grid point 196 (95/140) ======================= q-point: ( 0.33 0.33 -0.67) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.123 ( 2.989 0.000 -13.049) 13.387 1.542 ( -4.362 -0.000 -9.660) 10.600 1.613 ( 2.137 0.000 -21.309) 21.416 2.034 ( 16.019 0.000 8.170) 17.982 2.198 ( 5.879 0.000 8.149) 10.048 2.284 ( -8.125 -0.000 -1.346) 8.236 2.535 ( 0.849 0.000 7.902) 7.947 2.537 ( -3.336 -0.000 -5.842) 6.728 2.745 ( -12.356 -0.000 -3.192) 12.762 2.970 ( 0.512 0.000 -0.370) 0.631 3.086 ( 7.641 0.000 6.598) 10.095 3.161 ( -3.036 -0.000 -1.307) 3.305 3.183 ( 8.016 0.000 -2.503) 8.398 3.645 ( 10.012 0.000 -4.993) 11.188 3.665 ( -4.606 -0.000 -1.983) 5.015 3.925 ( 0.579 0.000 6.243) 6.270 3.963 ( -6.261 -0.000 0.610) 6.291 4.101 ( -2.983 -0.000 0.353) 3.004 4.220 ( -0.131 -0.000 5.585) 5.587 4.236 ( -5.815 -0.000 1.107) 5.919 4.639 ( 8.014 0.000 -17.606) 19.344 4.644 ( -2.080 -0.000 4.810) 5.241 4.862 ( -6.797 -0.000 5.168) 8.539 5.155 ( 0.976 0.000 -2.105) 2.320 5.172 ( 0.401 0.000 -5.436) 5.451 5.431 ( 3.419 0.000 8.620) 9.273 5.490 ( 1.386 0.000 1.483) 2.030 5.870 ( 11.943 0.000 -0.799) 11.970 6.023 ( -5.178 -0.000 -0.859) 5.248 6.166 ( -0.502 -0.000 -0.446) 0.671 6.411 ( -4.894 -0.000 0.248) 4.901 6.654 ( 3.676 0.000 -6.343) 7.331 6.711 ( -1.515 -0.000 5.855) 6.048 6.785 ( -3.738 -0.000 -2.736) 4.633 6.947 ( 5.069 0.000 0.610) 5.106 7.307 ( -0.109 -0.000 -0.002) 0.109 7.393 ( -9.118 -0.000 3.761) 9.863 7.510 ( -7.126 -0.000 5.321) 8.893 7.682 ( -4.915 -0.000 0.083) 4.916 7.880 ( 8.992 0.000 -3.633) 9.698 8.525 ( -2.383 -0.000 -2.941) 3.785 8.956 ( -0.134 -0.000 12.949) 12.950 9.069 ( -0.833 -0.000 9.382) 9.419 9.149 ( -15.773 -0.000 -1.470) 15.841 9.365 ( 6.221 0.000 9.128) 11.046 9.770 ( 2.938 0.000 -2.906) 4.132 10.051 ( -5.960 -0.000 -7.697) 9.735 10.436 ( -3.178 -0.000 -10.683) 11.146 10.475 ( -3.739 -0.000 -6.922) 7.867 10.617 ( 0.064 0.000 -12.317) 12.317 11.166 ( 9.503 0.000 -2.619) 9.858 11.191 ( 2.871 0.000 3.834) 4.790 11.398 ( 4.566 0.000 9.363) 10.417 11.660 ( 7.783 0.000 -8.501) 11.525 11.814 ( -1.421 -0.000 -2.654) 3.011 11.964 ( 3.894 0.000 7.674) 8.605 12.071 ( -0.339 -0.000 -2.552) 2.575 12.201 ( 0.862 0.000 2.626) 2.763 12.297 ( -5.803 -0.000 -6.425) 8.658 12.622 ( -6.364 -0.000 1.952) 6.657 12.673 ( -4.907 -0.000 -13.366) 14.238 12.803 ( -2.370 -0.000 -1.882) 3.026 13.138 ( -5.857 -0.000 11.699) 13.083 13.850 ( -3.537 -0.000 -3.358) 4.877 15.034 ( 0.233 0.000 1.949) 1.963 15.131 ( -2.796 -0.000 0.461) 2.833 15.342 ( 2.894 0.000 0.146) 2.898 15.526 ( -12.439 -0.000 7.005) 14.276 15.717 ( 5.420 0.000 -0.723) 5.468 15.734 ( 1.988 0.000 -2.430) 3.140 15.884 ( 2.301 0.000 -5.822) 6.260 15.924 ( 1.954 0.000 -4.049) 4.495 16.223 ( 0.963 0.000 4.876) 4.970 16.331 ( 0.640 0.000 2.167) 2.260 16.533 ( -1.130 -0.000 1.990) 2.289 16.621 ( -3.145 -0.000 3.659) 4.825 18.056 ( 16.780 0.000 -1.139) 16.819 18.352 ( 0.709 0.000 8.229) 8.260 18.583 ( -2.627 -0.000 7.834) 8.263 18.747 ( 2.218 0.000 -3.451) 4.102 25.864 ( 0.814 0.000 0.442) 0.927 25.915 ( 1.692 0.000 -1.270) 2.115 26.057 ( -1.755 -0.000 0.797) 1.928 26.096 ( -2.207 -0.000 0.351) 2.234 26.370 ( -3.184 -0.000 -4.348) 5.389 26.450 ( 0.616 0.000 -3.496) 3.549 26.873 ( 0.089 0.000 2.497) 2.499 26.922 ( 1.766 0.000 4.952) 5.257 27.374 ( -4.756 -0.000 -6.495) 8.050 28.103 ( -9.693 -0.000 -13.793) 16.858 28.389 ( -0.398 -0.000 8.306) 8.316 28.486 ( -5.493 -0.000 11.027) 12.320 28.539 ( 3.616 0.000 -0.998) 3.752 28.675 ( 1.895 0.000 3.668) 4.128 29.617 ( 6.099 0.000 12.186) 13.627 30.854 ( 13.489 0.000 -16.889) 21.615 ======================= Grid point 197 (96/140) ======================= q-point: ( 0.44 0.33 -0.67) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.296 ( 2.192 -20.714 -6.471) 21.811 1.630 ( 7.277 -8.620 -14.519) 18.386 1.678 ( -0.107 -19.764 -9.245) 21.820 2.172 ( 2.595 -1.936 4.099) 5.223 2.223 ( 6.942 2.749 5.277) 9.143 2.334 ( -3.515 -7.813 -0.110) 8.568 2.480 ( -2.785 -2.243 -4.894) 6.061 2.612 ( -11.772 -4.121 -2.703) 12.762 2.709 ( -0.590 -7.616 6.447) 9.996 2.984 ( 1.038 -2.095 -2.069) 3.122 3.080 ( -2.897 2.532 -4.871) 6.207 3.142 ( 6.809 5.785 -1.019) 8.993 3.245 ( 2.557 -2.241 8.028) 8.719 3.573 ( -2.454 2.428 0.618) 3.507 3.810 ( 4.626 -4.002 -4.803) 7.777 3.901 ( -5.345 -1.204 1.159) 5.601 3.961 ( -1.425 -6.572 0.380) 6.735 4.074 ( 1.424 1.817 5.015) 5.521 4.224 ( -2.915 -3.773 -0.995) 4.870 4.299 ( -1.611 -3.476 -0.144) 3.834 4.562 ( 4.261 4.226 -6.257) 8.670 4.697 ( 0.669 -3.224 -1.985) 3.845 4.831 ( -2.768 1.282 1.505) 3.401 5.101 ( -1.613 3.637 -2.004) 4.455 5.208 ( -0.503 -4.719 -0.038) 4.746 5.460 ( 1.595 5.545 2.381) 6.242 5.514 ( 1.566 -2.161 5.508) 6.120 5.920 ( 9.302 2.432 -4.764) 10.730 5.946 ( -1.439 4.794 1.645) 5.269 6.179 ( 1.601 -1.219 -1.493) 2.505 6.309 ( -3.098 5.862 0.771) 6.675 6.614 ( 0.823 5.131 -2.622) 5.821 6.668 ( 0.372 2.195 -1.299) 2.578 6.754 ( -4.936 0.285 0.267) 4.951 7.049 ( 0.478 -6.223 1.425) 6.402 7.262 ( 3.666 2.930 2.850) 5.491 7.360 ( -6.248 2.471 3.571) 7.609 7.433 ( -7.189 4.572 7.419) 11.297 7.717 ( -2.428 -5.658 -1.751) 6.401 7.914 ( 5.370 0.648 -3.679) 6.542 8.619 ( 0.283 -11.110 -1.134) 11.171 9.022 ( -10.952 -2.635 6.340) 12.927 9.030 ( 1.351 -1.005 9.644) 9.790 9.209 ( -4.480 -8.145 9.219) 13.092 9.457 ( 4.159 -1.502 8.315) 9.418 9.746 ( 0.330 2.255 -1.955) 3.003 10.076 ( -0.786 -9.768 -9.831) 13.881 10.266 ( -2.962 6.325 -9.321) 11.647 10.448 ( -1.946 -1.584 -11.357) 11.631 10.592 ( 0.039 -2.836 -12.571) 12.887 11.180 ( 5.277 1.555 0.342) 5.513 11.319 ( 5.935 -6.243 1.881) 8.817 11.483 ( 4.097 -1.355 8.473) 9.509 11.643 ( 5.894 3.362 -7.306) 9.971 11.826 ( -1.129 -2.744 -1.811) 3.476 11.980 ( -0.282 3.302 3.086) 4.528 12.043 ( 0.939 2.777 -0.225) 2.940 12.221 ( -0.165 -3.373 -0.758) 3.461 12.297 ( -5.001 -6.093 -0.019) 7.883 12.515 ( -4.999 1.993 -12.230) 13.362 12.624 ( -6.587 -2.499 -3.230) 7.750 12.762 ( -4.630 0.292 -0.416) 4.658 13.136 ( 3.841 6.756 10.982) 13.454 13.737 ( -3.861 7.712 -4.573) 9.762 15.033 ( -1.440 0.941 3.245) 3.672 15.118 ( -1.770 0.894 1.578) 2.534 15.310 ( 1.471 3.754 -1.282) 4.230 15.519 ( -5.093 -2.426 4.179) 7.021 15.627 ( -1.019 7.391 -0.276) 7.466 15.777 ( 2.676 -2.869 -1.885) 4.353 15.832 ( 1.605 3.014 -5.765) 6.700 15.989 ( 4.093 -3.068 -3.354) 6.117 16.183 ( 3.250 4.769 5.607) 8.046 16.394 ( 0.078 -1.942 1.323) 2.351 16.561 ( -2.301 -2.727 4.101) 5.436 16.667 ( -3.039 -5.708 2.894) 7.084 18.117 ( 15.368 7.351 1.838) 17.134 18.410 ( 0.934 -1.022 7.004) 7.140 18.508 ( -6.888 7.653 5.722) 11.779 18.748 ( 1.695 -0.304 -3.913) 4.275 25.893 ( 1.164 -2.007 1.071) 2.555 25.931 ( 1.554 -0.957 -0.838) 2.009 26.051 ( -2.154 -0.896 -0.420) 2.370 26.091 ( -2.687 -1.468 -0.176) 3.067 26.309 ( -2.406 1.744 -3.920) 4.919 26.452 ( 0.993 -1.355 -3.818) 4.171 26.866 ( -0.624 0.959 1.855) 2.180 26.988 ( 0.536 -3.004 4.963) 5.827 27.303 ( -3.546 0.944 -5.890) 6.939 27.937 ( -10.036 0.571 -17.625) 20.291 28.410 ( 0.803 2.291 5.872) 6.354 28.481 ( 1.922 -0.480 11.196) 11.370 28.643 ( -1.759 -6.921 3.212) 7.830 28.788 ( 5.590 -4.850 5.749) 9.372 29.705 ( 1.815 1.248 13.349) 13.530 30.771 ( 10.552 10.563 -17.428) 22.949 ======================= Grid point 198 (97/140) ======================= q-point: ( 0.56 0.33 -0.67) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.672 ( -2.183 -22.558 -3.836) 22.986 1.830 ( 8.735 -12.140 -0.587) 14.968 1.982 ( 1.674 -16.816 -11.454) 20.415 2.181 ( -2.360 -0.584 5.422) 5.942 2.267 ( 0.792 0.663 1.851) 2.120 2.460 ( -5.556 -9.121 -3.962) 11.391 2.493 ( -2.266 -6.605 -0.717) 7.019 2.636 ( -0.693 -6.085 -2.369) 6.567 2.899 ( -0.518 -8.378 4.969) 9.755 2.978 ( -0.242 3.862 -8.287) 9.146 3.002 ( -1.302 0.493 -1.993) 2.431 3.111 ( 1.530 -4.569 -0.095) 4.819 3.354 ( 3.771 -1.216 8.743) 9.599 3.526 ( -2.615 0.401 -0.082) 2.647 3.782 ( -0.630 3.978 5.012) 6.429 3.932 ( -6.822 -5.401 6.048) 10.596 4.060 ( -1.117 2.925 3.135) 4.431 4.189 ( 4.680 -13.323 -7.287) 15.890 4.236 ( -4.730 -0.970 -7.288) 8.742 4.345 ( 4.387 -5.388 -5.966) 9.157 4.532 ( 5.909 0.483 -2.388) 6.392 4.686 ( -8.434 0.904 0.876) 8.528 4.834 ( 8.447 0.484 -2.275) 8.761 5.006 ( -4.247 3.619 -1.065) 5.681 5.309 ( -2.689 -7.057 3.114) 8.168 5.363 ( 2.140 8.442 4.708) 9.900 5.559 ( -1.149 -0.888 0.437) 1.517 5.875 ( 3.766 3.191 -9.854) 11.021 5.906 ( 4.096 3.079 2.828) 5.853 6.179 ( 0.788 0.654 -4.826) 4.934 6.260 ( -0.391 1.881 10.671) 10.843 6.528 ( 1.150 3.749 0.565) 3.962 6.648 ( 4.404 3.209 0.747) 5.500 6.705 ( -4.428 -0.972 -1.804) 4.879 7.111 ( -4.474 0.175 2.336) 5.050 7.213 ( -3.929 2.222 -1.965) 4.923 7.322 ( -4.599 3.355 8.101) 9.901 7.385 ( 4.572 -0.059 6.857) 8.241 7.754 ( -1.271 -1.291 -4.334) 4.697 7.898 ( -0.234 0.934 -5.594) 5.677 8.798 ( -0.540 -7.937 2.494) 8.337 9.068 ( -5.152 -9.694 -4.315) 11.795 9.188 ( 1.528 -7.286 19.959) 21.302 9.361 ( -1.260 -6.080 9.939) 11.719 9.577 ( 3.051 -4.563 5.133) 7.515 9.703 ( -1.902 0.719 0.609) 2.123 10.105 ( -3.268 3.622 -4.000) 6.309 10.215 ( 1.628 -7.275 -6.207) 9.700 10.394 ( 0.816 -0.244 -11.089) 11.122 10.582 ( 1.575 -4.496 -17.734) 18.363 11.214 ( 4.667 -0.402 0.877) 4.765 11.470 ( 2.972 -5.619 -0.154) 6.358 11.576 ( 3.997 3.538 -1.797) 5.632 11.608 ( 2.277 -4.456 0.740) 5.059 11.829 ( -2.548 -0.195 -1.117) 2.789 11.931 ( -0.587 3.005 3.040) 4.315 11.994 ( 0.779 4.163 2.409) 4.873 12.259 ( -5.960 -1.002 -9.266) 11.063 12.335 ( 2.392 -0.922 2.057) 3.287 12.480 ( -4.355 -8.806 -4.877) 10.968 12.605 ( -4.486 -2.791 -1.240) 5.427 12.729 ( -3.153 -0.438 -0.816) 3.286 13.078 ( 7.652 10.131 8.103) 15.061 13.495 ( -4.851 13.224 -5.050) 14.963 15.000 ( -3.555 2.271 3.886) 5.736 15.102 ( -1.116 0.568 3.567) 3.780 15.272 ( 4.200 2.243 -4.827) 6.780 15.442 ( -2.950 4.781 -0.994) 5.705 15.608 ( -1.483 -2.263 2.436) 3.640 15.738 ( -0.071 2.537 -6.575) 7.047 15.863 ( 1.456 -3.293 1.093) 3.763 16.013 ( 3.844 1.016 -4.480) 5.990 16.204 ( 4.060 0.873 7.120) 8.243 16.400 ( -0.144 1.417 0.813) 1.640 16.612 ( -3.290 -2.982 5.745) 7.261 16.764 ( -2.685 -6.309 1.400) 6.998 18.065 ( 9.539 12.650 4.336) 16.426 18.310 ( -5.104 10.763 1.174) 11.970 18.460 ( 0.330 -0.533 6.171) 6.203 18.743 ( 1.555 -0.207 -4.671) 4.927 25.945 ( 0.564 -1.636 1.673) 2.407 25.970 ( 1.580 -2.690 0.805) 3.222 26.048 ( -1.905 -1.208 -1.357) 2.633 26.097 ( -2.573 -2.001 -1.007) 3.411 26.248 ( -1.245 1.804 -1.579) 2.702 26.465 ( 1.365 -1.775 -5.945) 6.353 26.857 ( -0.868 0.257 1.407) 1.673 27.061 ( -1.245 -3.020 1.740) 3.701 27.241 ( -1.393 0.986 -1.691) 2.403 27.779 ( -6.874 1.006 -12.537) 14.333 28.432 ( 0.473 -0.178 7.638) 7.654 28.576 ( 4.526 -2.916 3.790) 6.584 28.794 ( -0.667 -9.266 6.141) 11.137 28.943 ( 4.721 -5.385 4.622) 8.523 29.726 ( -1.882 3.240 10.557) 11.202 30.506 ( 6.184 17.928 -16.591) 25.197 ======================= Grid point 199 (98/140) ======================= q-point: (-0.33 -0.67 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.901 ( -5.276 -8.392 3.940) 10.668 2.063 ( -2.309 0.419 1.515) 2.793 2.141 ( 3.866 -12.836 3.190) 13.780 2.209 ( -4.521 -7.059 -7.677) 11.367 2.353 ( 7.048 -4.131 2.447) 8.528 2.489 ( -8.625 -9.680 -8.240) 15.362 2.639 ( 3.074 -3.936 1.807) 5.311 2.743 ( 5.681 -5.318 -0.541) 7.801 2.846 ( -1.330 2.433 -3.120) 4.174 3.010 ( 1.478 -4.214 -1.287) 4.648 3.086 ( -1.327 -7.745 0.695) 7.889 3.194 ( -2.555 -2.410 -1.786) 3.941 3.415 ( 6.682 0.456 6.711) 9.481 3.562 ( -2.721 -5.549 1.242) 6.304 3.745 ( -0.683 2.695 3.869) 4.764 3.958 ( -3.374 4.411 5.250) 7.642 4.046 ( -6.855 -5.130 3.119) 9.112 4.120 ( -2.975 3.555 -6.766) 8.202 4.328 ( 3.868 -5.868 -8.627) 11.128 4.450 ( 3.848 -3.593 -6.400) 8.288 4.602 ( -6.351 -1.243 -0.927) 6.538 4.652 ( 4.799 -5.099 1.811) 7.233 4.856 ( 3.698 2.138 -4.113) 5.929 4.915 ( -0.933 3.372 -0.673) 3.563 5.302 ( 6.007 4.479 6.884) 10.175 5.416 ( -2.901 -5.117 4.623) 7.481 5.544 ( -2.551 -1.093 -4.500) 5.287 5.794 ( 0.867 1.303 -11.593) 11.698 5.942 ( 5.296 0.465 5.277) 7.491 6.126 ( -3.861 1.685 -3.692) 5.602 6.291 ( -0.396 1.450 11.414) 11.513 6.484 ( -0.499 3.401 0.808) 3.531 6.617 ( -0.373 2.791 3.235) 4.289 6.749 ( 4.917 -4.783 -3.206) 7.572 7.040 ( -0.815 3.846 3.166) 5.048 7.164 ( -2.154 1.197 -3.030) 3.905 7.268 ( -5.824 1.416 8.345) 10.274 7.479 ( 4.482 -0.697 6.010) 7.530 7.701 ( -0.401 2.669 -6.308) 6.861 7.837 ( -3.639 -0.014 -7.759) 8.570 8.914 ( -0.909 -4.591 6.665) 8.144 9.181 ( -0.468 -8.504 -6.296) 10.591 9.445 ( 1.661 -8.160 17.091) 19.012 9.465 ( -0.073 -0.981 7.508) 7.572 9.632 ( 0.316 -0.760 -0.648) 1.047 9.754 ( -0.037 -3.643 3.078) 4.769 10.059 ( -3.006 -2.453 2.549) 4.642 10.245 ( -6.057 -2.050 -2.722) 6.950 10.413 ( 3.826 -3.456 -4.695) 6.973 10.617 ( 9.248 -6.018 -18.775) 21.777 11.263 ( 3.055 -0.472 1.269) 3.341 11.469 ( -5.013 4.302 -4.502) 7.994 11.549 ( 6.401 2.014 0.937) 6.776 11.685 ( -5.311 -5.071 -6.408) 9.746 11.822 ( 3.242 2.727 3.080) 5.237 11.864 ( -1.362 4.831 -0.563) 5.051 11.980 ( 0.815 -1.319 4.160) 4.439 12.158 ( -3.192 0.387 -8.023) 8.643 12.372 ( -1.722 0.357 4.218) 4.570 12.554 ( -1.502 -2.337 -1.745) 3.281 12.650 ( 1.427 -2.197 -0.357) 2.644 12.723 ( -1.155 -1.053 -1.074) 1.897 13.055 ( 7.804 0.978 4.209) 8.921 13.221 ( -5.021 8.966 -3.708) 10.924 14.977 ( -2.657 -1.009 3.144) 4.237 15.100 ( -1.298 0.904 2.920) 3.321 15.238 ( 2.308 1.888 -3.082) 4.289 15.368 ( -0.825 1.914 -3.904) 4.426 15.631 ( 1.307 -0.317 1.654) 2.132 15.706 ( -1.826 -2.703 -4.297) 5.395 15.912 ( -1.065 -1.295 0.745) 1.835 15.998 ( 3.221 1.645 -2.863) 4.612 16.245 ( 0.002 0.995 5.745) 5.830 16.371 ( 3.185 2.523 0.187) 4.068 16.673 ( -3.261 -3.313 7.481) 8.808 16.843 ( -1.011 -4.540 -0.472) 4.675 17.877 ( -2.913 14.696 5.569) 15.984 18.111 ( 2.499 10.460 -3.709) 11.376 18.497 ( 0.024 -0.085 5.560) 5.560 18.736 ( 2.121 -0.209 -5.286) 5.699 25.972 ( -0.218 -0.199 2.776) 2.791 26.033 ( -1.550 -2.031 0.367) 2.581 26.055 ( 1.486 -1.725 0.364) 2.306 26.112 ( -1.416 -2.489 -0.970) 3.024 26.216 ( -0.937 0.827 0.837) 1.504 26.474 ( 2.268 -1.768 -8.298) 8.782 26.858 ( -0.458 0.020 1.623) 1.687 27.050 ( -3.447 -0.045 -7.956) 8.671 27.268 ( 1.239 -1.444 9.942) 10.122 27.680 ( -4.078 -0.447 -8.472) 9.413 28.481 ( -1.245 -0.981 7.529) 7.694 28.689 ( 6.258 -4.657 -0.688) 7.831 28.992 ( 3.639 -8.476 6.098) 11.058 29.081 ( 1.839 -5.413 3.197) 6.550 29.671 ( -4.288 5.245 6.193) 9.178 30.130 ( 1.049 19.768 -13.916) 24.198 ======================= Grid point 200 (99/140) ======================= q-point: (-0.22 -0.67 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.885 ( -8.240 6.094 12.840) 16.429 2.104 ( -1.144 -5.101 -0.407) 5.244 2.170 ( -2.903 0.163 -5.088) 5.860 2.398 ( 1.184 -8.404 1.947) 8.707 2.427 ( 7.259 1.243 -1.253) 7.471 2.584 ( -1.964 -9.255 -6.159) 11.289 2.718 ( 4.810 -0.622 2.585) 5.496 2.800 ( -0.635 -0.423 -3.332) 3.418 2.885 ( 2.054 -4.660 4.208) 6.606 3.105 ( 1.373 -2.726 -2.427) 3.900 3.169 ( 0.939 0.105 0.295) 0.989 3.173 ( -0.259 -4.498 -3.074) 5.455 3.496 ( -2.418 -1.912 5.009) 5.881 3.621 ( -1.554 -1.095 3.228) 3.746 3.712 ( -2.501 0.943 -1.389) 3.012 3.839 ( 3.323 6.231 -2.096) 7.366 4.062 ( -6.574 0.407 5.112) 8.338 4.097 ( -3.172 -4.296 2.704) 5.986 4.411 ( 3.074 0.455 -1.994) 3.693 4.461 ( 5.712 -2.279 -9.342) 11.185 4.590 ( -4.537 -2.924 4.757) 7.195 4.695 ( -1.993 3.055 -0.855) 3.746 4.823 ( 3.781 2.816 -3.228) 5.713 4.897 ( 1.341 -3.807 -7.020) 8.097 5.352 ( 7.989 2.674 7.505) 11.283 5.460 ( 0.793 0.561 -0.340) 1.030 5.546 ( -4.096 -4.478 -1.805) 6.331 5.748 ( 0.063 -1.618 -7.563) 7.734 5.960 ( -2.854 2.922 2.000) 4.548 6.051 ( 0.933 2.809 -0.460) 2.995 6.318 ( -0.010 0.796 8.551) 8.588 6.407 ( -3.309 3.098 -1.412) 4.748 6.601 ( -3.506 -0.937 4.923) 6.116 6.863 ( 4.420 -5.261 -5.591) 8.859 6.988 ( -4.216 3.862 0.732) 5.764 7.126 ( 9.498 4.280 0.920) 10.458 7.269 ( -5.167 -1.732 6.531) 8.507 7.513 ( 2.400 2.012 1.173) 3.344 7.652 ( 0.103 -0.799 -0.997) 1.282 7.783 ( -3.412 -1.797 -7.324) 8.277 9.016 ( -0.759 -4.097 7.563) 8.635 9.275 ( 2.537 -5.480 -7.204) 9.400 9.460 ( -5.815 0.596 1.683) 6.083 9.581 ( 2.369 2.330 5.657) 6.560 9.657 ( -3.986 -2.563 3.515) 5.900 9.798 ( 3.063 1.202 3.806) 5.031 10.102 ( -5.020 -3.566 3.369) 7.019 10.277 ( -3.746 -5.617 3.468) 7.590 10.467 ( 1.305 -3.020 -3.225) 4.607 10.745 ( 14.250 -6.916 -13.523) 20.827 11.240 ( -8.801 3.761 0.052) 9.571 11.324 ( -0.207 5.239 1.389) 5.424 11.568 ( 9.893 4.048 2.572) 10.995 11.617 ( -4.632 2.723 -10.145) 11.480 11.791 ( -0.682 0.934 2.478) 2.735 11.823 ( 0.399 0.844 -1.395) 1.679 12.041 ( 1.765 -1.880 -0.424) 2.613 12.126 ( -0.307 -1.494 -4.570) 4.817 12.360 ( -4.743 0.306 7.184) 8.614 12.500 ( 0.037 6.297 0.320) 6.305 12.643 ( 1.698 5.155 -2.263) 5.880 12.708 ( 6.018 0.932 -4.102) 7.342 13.140 ( -7.016 -8.245 1.659) 10.953 13.247 ( 5.182 -10.648 0.680) 11.861 15.023 ( 0.482 -2.878 3.463) 4.529 15.073 ( -1.770 2.288 1.793) 3.403 15.227 ( -1.385 -1.261 -1.769) 2.577 15.319 ( 2.798 1.476 -3.542) 4.749 15.681 ( 1.602 -2.698 1.557) 3.503 15.729 ( -0.948 -2.962 -3.328) 4.555 15.900 ( -3.428 0.458 0.298) 3.471 15.969 ( 1.018 2.798 -1.946) 3.558 16.207 ( -6.908 2.308 3.377) 8.028 16.398 ( 9.206 0.672 -0.200) 9.232 16.735 ( -4.134 -2.812 7.203) 8.768 16.906 ( 2.709 -3.016 -0.759) 4.125 17.614 ( -10.150 12.764 5.419) 17.185 17.970 ( 6.829 7.093 -6.216) 11.644 18.511 ( -1.470 0.777 4.361) 4.667 18.734 ( 3.298 -0.115 -5.391) 6.321 25.974 ( -0.490 1.245 2.868) 3.165 26.023 ( -0.990 0.643 -0.896) 1.482 26.113 ( 0.199 -2.194 1.944) 2.938 26.161 ( 0.182 -3.685 0.958) 3.812 26.209 ( -1.699 -0.108 2.400) 2.943 26.485 ( 4.171 -1.869 -8.802) 9.918 26.859 ( -0.230 0.759 1.911) 2.069 26.966 ( -3.205 1.588 -7.846) 8.622 27.376 ( 2.126 -2.889 12.611) 13.111 27.638 ( -2.609 -1.994 -7.210) 7.922 28.510 ( -3.324 -0.103 7.132) 7.869 28.808 ( 6.206 -4.260 -6.244) 9.780 29.145 ( -0.667 -3.705 2.774) 4.676 29.227 ( 7.094 -8.298 2.906) 11.297 29.547 ( -4.835 7.477 3.287) 9.492 29.760 ( -1.925 15.878 -8.179) 17.964 ======================= Grid point 201 (100/140) ======================= q-point: (-0.11 0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.780 ( -3.807 7.242 12.494) 14.934 2.084 ( -1.823 4.674 1.222) 5.164 2.147 ( 1.981 2.977 -1.166) 3.761 2.424 ( 8.514 4.050 -2.283) 9.701 2.481 ( -3.179 -1.538 -1.983) 4.050 2.674 ( -0.932 -4.259 -3.142) 5.374 2.748 ( 6.327 3.250 3.583) 7.964 2.824 ( 2.817 -2.601 -1.737) 4.210 2.958 ( -3.333 -1.421 4.206) 5.552 3.063 ( -6.359 -1.058 -7.207) 9.669 3.181 ( -1.132 2.598 -1.353) 3.140 3.231 ( 4.045 -2.061 -0.976) 4.643 3.463 ( -5.986 4.534 2.578) 7.940 3.610 ( -2.864 1.529 0.175) 3.251 3.673 ( -0.706 -2.481 0.866) 2.721 3.825 ( 9.367 5.008 2.660) 10.950 4.003 ( -6.901 2.934 5.201) 9.126 4.168 ( -0.588 -1.513 5.347) 5.588 4.364 ( 2.646 3.629 -0.064) 4.492 4.496 ( 1.936 -1.451 -5.843) 6.324 4.617 ( -2.962 0.561 -3.485) 4.607 4.709 ( 3.811 -6.417 5.804) 9.455 4.797 ( 3.806 0.673 -2.658) 4.691 4.916 ( -0.663 -1.615 -10.312) 10.459 5.346 ( 2.154 6.696 4.612) 8.411 5.434 ( 2.289 1.018 -7.088) 7.518 5.582 ( -2.893 -2.394 3.344) 5.029 5.776 ( 0.781 -0.827 -0.226) 1.160 5.869 ( -4.267 1.316 -0.791) 4.535 6.008 ( 3.938 5.197 0.077) 6.521 6.337 ( -1.965 -0.755 -1.941) 2.863 6.356 ( 0.058 0.335 3.998) 4.012 6.643 ( -7.009 -4.741 6.525) 10.686 6.851 ( -4.687 5.527 -1.287) 7.360 6.925 ( 3.182 -2.619 -8.112) 9.099 7.152 ( 9.329 4.349 3.477) 10.865 7.294 ( -5.806 -3.054 4.388) 7.893 7.510 ( 6.275 0.983 -0.558) 6.376 7.694 ( -3.355 -3.022 1.908) 4.902 7.800 ( 0.602 -5.268 -3.012) 6.098 9.091 ( -4.625 -1.584 5.262) 7.183 9.294 ( -0.688 1.934 -4.205) 4.679 9.416 ( -2.281 -0.432 -1.499) 2.764 9.547 ( -1.434 0.974 -0.487) 1.800 9.621 ( -5.464 3.248 1.065) 6.445 9.780 ( 4.935 7.620 3.109) 9.596 10.165 ( -5.649 -3.476 11.308) 13.110 10.328 ( -5.430 -4.243 -0.741) 6.931 10.509 ( 1.031 -1.783 -2.534) 3.266 10.915 ( 14.019 -6.054 -10.472) 18.516 11.090 ( -6.958 2.969 -0.435) 7.577 11.282 ( 1.716 4.066 4.893) 6.589 11.469 ( -1.020 6.040 -8.870) 10.780 11.578 ( 6.937 4.397 0.219) 8.216 11.761 ( -3.122 -0.538 -1.832) 3.660 11.855 ( 7.022 0.861 4.686) 8.486 12.074 ( -0.004 -2.433 0.830) 2.571 12.136 ( 0.386 -1.001 -2.790) 2.989 12.353 ( -1.441 1.758 -0.472) 2.322 12.418 ( 3.060 3.452 3.862) 6.015 12.571 ( -0.552 -0.003 -2.422) 2.484 12.751 ( 4.983 -2.411 -3.733) 6.677 13.258 ( -9.922 -10.107 3.387) 14.562 13.480 ( 0.167 -13.144 -1.370) 13.216 15.018 ( -1.491 2.993 1.033) 3.499 15.086 ( 3.336 -0.030 4.588) 5.673 15.229 ( -2.751 -1.099 -0.375) 2.986 15.367 ( 3.889 -5.858 -1.591) 7.209 15.726 ( -0.212 0.405 -0.048) 0.459 15.752 ( 1.682 -1.325 -0.252) 2.157 15.872 ( -2.191 -0.676 -0.808) 2.431 15.897 ( -3.136 2.966 -3.407) 5.499 16.119 ( -6.890 2.744 2.116) 7.712 16.450 ( 4.444 0.325 -0.616) 4.499 16.766 ( -4.252 -1.634 2.748) 5.320 17.009 ( 10.186 -3.728 2.553) 11.143 17.353 ( -14.179 9.632 5.241) 17.924 17.933 ( 10.079 1.235 -6.023) 11.806 18.492 ( -2.963 1.510 3.087) 4.538 18.737 ( 4.140 0.145 -5.014) 6.503 25.953 ( -0.169 2.252 2.349) 3.259 25.997 ( -0.072 1.217 -1.088) 1.634 26.148 ( -0.751 -0.980 2.586) 2.865 26.193 ( -0.884 -0.035 -1.287) 1.562 26.250 ( -2.060 -4.301 4.823) 6.783 26.520 ( 6.096 -2.017 -7.087) 9.563 26.839 ( -1.102 2.060 1.424) 2.736 26.884 ( -1.219 2.280 -3.678) 4.496 27.522 ( 3.146 -4.217 13.230) 14.237 27.624 ( -2.618 -2.892 -7.603) 8.545 28.500 ( -5.270 1.139 5.998) 8.065 28.809 ( 1.082 2.765 -11.818) 12.185 29.168 ( -6.493 -2.109 -0.766) 6.870 29.365 ( -7.625 8.689 -2.645) 11.859 29.462 ( 7.205 -0.924 0.138) 7.265 29.570 ( 11.115 -1.674 5.311) 12.432 ======================= Grid point 206 (101/140) ======================= q-point: ( 0.44 0.44 -0.67) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.117 ( 7.523 0.000 -5.678) 9.425 1.414 ( -2.307 -0.000 -8.774) 9.072 1.594 ( 14.226 0.000 -5.605) 15.291 2.098 ( -6.640 -0.000 -3.571) 7.539 2.247 ( -4.303 -0.000 -2.902) 5.190 2.335 ( -1.276 -0.000 0.740) 1.475 2.421 ( -5.949 -0.000 -3.637) 6.973 2.475 ( -0.126 -0.000 1.412) 1.417 2.680 ( 1.566 0.000 8.548) 8.690 2.981 ( 4.174 0.000 -2.193) 4.715 3.068 ( -5.607 -0.000 -2.222) 6.031 3.237 ( 1.140 0.000 5.918) 6.027 3.251 ( 0.762 0.000 -0.629) 0.988 3.641 ( 5.809 0.000 -1.905) 6.113 3.731 ( 7.414 0.000 -9.511) 12.060 3.801 ( -13.406 -0.000 0.171) 13.408 3.918 ( -1.200 -0.000 3.448) 3.651 4.088 ( 0.148 0.000 -4.913) 4.915 4.186 ( -3.137 -0.000 3.038) 4.367 4.289 ( 1.561 0.000 5.065) 5.300 4.604 ( -9.461 -0.000 4.648) 10.541 4.650 ( 11.602 0.000 -11.625) 16.424 4.838 ( -1.909 -0.000 5.562) 5.881 5.098 ( -2.321 -0.000 -5.538) 6.005 5.196 ( 1.159 0.000 5.317) 5.442 5.525 ( 0.748 0.000 3.999) 4.069 5.546 ( 3.825 0.000 2.142) 4.384 5.946 ( 2.993 0.000 -11.026) 11.425 5.996 ( 0.478 0.000 1.648) 1.716 6.166 ( 0.193 0.000 -0.465) 0.504 6.355 ( -1.494 -0.000 1.732) 2.287 6.645 ( 3.638 0.000 -7.326) 8.180 6.680 ( -6.928 -0.000 3.957) 7.979 6.716 ( -1.312 -0.000 -0.859) 1.568 7.024 ( 3.816 0.000 2.177) 4.393 7.264 ( -5.299 -0.000 -0.868) 5.369 7.429 ( 1.145 0.000 9.368) 9.438 7.477 ( -3.492 -0.000 7.897) 8.635 7.626 ( -0.387 -0.000 -1.415) 1.467 7.938 ( 3.254 0.000 -5.493) 6.384 8.539 ( 5.540 0.000 1.156) 5.660 8.899 ( -13.092 -0.000 -3.014) 13.434 9.103 ( -1.119 -0.000 17.690) 17.725 9.161 ( -2.434 -0.000 13.955) 14.166 9.525 ( 3.028 0.000 8.066) 8.616 9.782 ( 4.068 0.000 -4.774) 6.272 9.891 ( -1.631 -0.000 -11.228) 11.346 10.226 ( -1.333 -0.000 -20.438) 20.481 10.355 ( -1.751 -0.000 -6.613) 6.841 10.543 ( -0.325 -0.000 -6.912) 6.920 11.244 ( -0.579 -0.000 2.481) 2.548 11.296 ( 7.994 0.000 -1.032) 8.060 11.537 ( 1.106 0.000 6.306) 6.403 11.670 ( 4.314 0.000 -8.952) 9.937 11.814 ( 2.505 0.000 1.939) 3.168 11.966 ( -11.995 -0.000 -0.132) 11.996 12.086 ( 3.898 0.000 0.134) 3.901 12.151 ( 0.359 0.000 -0.683) 0.772 12.241 ( 0.720 0.000 0.996) 1.229 12.429 ( -6.738 -0.000 -15.440) 16.846 12.554 ( -4.982 -0.000 3.120) 5.878 12.734 ( -1.183 -0.000 -1.432) 1.858 13.293 ( 6.075 0.000 10.342) 11.995 13.751 ( -3.765 -0.000 -5.401) 6.584 15.051 ( -0.672 -0.000 1.894) 2.009 15.116 ( 0.584 0.000 0.301) 0.657 15.397 ( 2.182 0.000 1.719) 2.777 15.438 ( -7.271 -0.000 7.232) 10.255 15.704 ( -0.422 -0.000 -3.227) 3.254 15.764 ( 3.596 0.000 -6.035) 7.026 15.860 ( -0.295 -0.000 0.108) 0.314 15.952 ( 4.450 0.000 -2.716) 5.214 16.292 ( 2.360 0.000 2.766) 3.636 16.359 ( -0.043 -0.000 2.309) 2.310 16.546 ( -1.042 -0.000 3.713) 3.856 16.609 ( -2.438 -0.000 2.465) 3.467 18.318 ( 15.781 0.000 2.966) 16.058 18.447 ( 2.193 0.000 6.160) 6.538 18.527 ( -12.779 -0.000 6.249) 14.225 18.738 ( 1.649 0.000 -4.014) 4.340 25.891 ( 1.623 0.000 1.177) 2.005 25.929 ( 1.427 0.000 -1.175) 1.849 26.021 ( -2.805 -0.000 -0.628) 2.875 26.054 ( -2.578 -0.000 -0.725) 2.678 26.285 ( -2.787 -0.000 -2.567) 3.790 26.431 ( 1.275 0.000 -4.115) 4.308 26.877 ( -1.346 -0.000 1.587) 2.081 26.977 ( -0.018 -0.000 2.718) 2.718 27.267 ( -3.233 -0.000 -2.042) 3.824 27.784 ( -6.308 -0.000 -18.288) 19.345 28.437 ( -0.442 -0.000 2.788) 2.823 28.567 ( 0.994 0.000 -1.738) 2.002 28.571 ( -2.059 -0.000 16.879) 17.004 28.839 ( 8.521 0.000 5.801) 10.308 29.800 ( -1.377 -0.000 17.741) 17.794 30.852 ( 10.002 0.000 -20.114) 22.463 ======================= Grid point 207 (102/140) ======================= q-point: (-0.44 -0.56 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.296 ( 2.971 -16.907 -1.756) 17.256 1.569 ( -1.736 -20.371 -11.615) 23.514 1.775 ( 15.237 -6.749 3.593) 17.048 2.101 ( -4.946 -7.386 0.612) 8.911 2.186 ( -17.440 -3.268 -8.098) 19.505 2.271 ( -4.581 -5.040 -0.929) 6.874 2.462 ( 5.571 -0.071 1.911) 5.890 2.506 ( -1.284 -4.279 -1.612) 4.749 2.802 ( 1.929 -6.163 8.653) 10.797 2.939 ( -4.803 3.181 -2.357) 6.225 3.060 ( 6.470 -1.929 -2.926) 7.359 3.141 ( -2.066 6.861 -5.307) 8.916 3.338 ( 0.782 -3.837 7.430) 8.399 3.582 ( 2.504 4.022 -4.436) 6.490 3.754 ( -11.118 -6.171 2.736) 13.007 3.833 ( -0.096 -2.630 1.807) 3.192 4.008 ( 5.075 -7.741 -1.665) 9.405 4.090 ( 2.635 -2.519 -5.223) 6.369 4.142 ( -4.700 1.681 1.021) 5.095 4.326 ( 3.376 -0.011 -0.628) 3.434 4.573 ( -8.796 -2.739 2.435) 9.529 4.646 ( 7.380 4.588 -3.742) 9.461 4.869 ( 2.801 -0.792 1.116) 3.117 5.033 ( -2.065 2.483 -3.890) 5.056 5.246 ( -0.312 -2.024 8.557) 8.799 5.525 ( 1.821 4.109 1.914) 4.885 5.557 ( 1.297 1.430 1.469) 2.426 5.882 ( 0.277 1.661 -15.038) 15.132 5.987 ( 2.571 2.260 2.755) 4.394 6.152 ( -1.635 -0.078 -4.933) 5.197 6.349 ( -0.091 2.142 8.859) 9.115 6.597 ( 0.628 3.085 -1.854) 3.654 6.653 ( -4.546 -0.430 -0.324) 4.578 6.716 ( 3.863 0.714 0.502) 3.960 7.082 ( 1.897 -1.245 2.651) 3.490 7.196 ( -6.706 1.342 -1.839) 7.082 7.403 ( -4.775 5.172 6.992) 9.922 7.494 ( 7.363 1.855 8.463) 11.370 7.691 ( 0.553 -4.087 -1.259) 4.312 7.894 ( -0.897 2.581 -6.685) 7.222 8.685 ( 6.464 -7.791 2.539) 10.437 8.845 ( -8.279 -7.090 -3.849) 11.560 9.206 ( -2.131 -3.389 21.340) 21.712 9.282 ( -2.067 -7.060 13.004) 14.940 9.583 ( 2.596 -1.073 7.007) 7.549 9.708 ( -1.474 2.889 -3.487) 4.762 9.994 ( 1.880 -7.965 -11.477) 14.096 10.147 ( 5.206 -3.859 -15.312) 16.627 10.303 ( -1.512 0.513 -8.456) 8.606 10.494 ( 0.045 0.191 -10.184) 10.186 11.238 ( -1.070 -0.259 3.025) 3.219 11.392 ( 3.184 -4.797 -2.127) 6.137 11.549 ( -4.078 -1.359 -0.383) 4.316 11.640 ( 2.586 2.178 -5.996) 6.884 11.822 ( -1.497 0.918 5.727) 5.990 11.941 ( -3.761 -2.477 5.046) 6.763 12.095 ( 4.772 3.522 0.724) 5.975 12.155 ( -3.469 -1.220 -5.022) 6.225 12.296 ( -1.945 -5.443 -7.554) 9.512 12.324 ( 1.938 -1.718 -5.074) 5.697 12.545 ( -3.738 -0.696 4.478) 5.874 12.722 ( 1.003 0.777 -1.730) 2.145 13.324 ( 5.503 6.896 8.574) 12.302 13.622 ( -3.853 8.136 -6.317) 10.997 15.029 ( -2.969 2.313 3.037) 4.836 15.130 ( 1.317 0.241 1.361) 1.909 15.336 ( 1.169 3.880 1.903) 4.477 15.507 ( -1.024 -2.575 1.616) 3.208 15.588 ( -1.502 7.869 -1.760) 8.202 15.757 ( 1.412 0.928 -6.972) 7.174 15.839 ( 0.184 -0.043 2.771) 2.777 16.013 ( 3.652 -1.782 -4.785) 6.278 16.280 ( 2.018 1.806 5.035) 5.717 16.410 ( 0.663 -1.594 0.243) 1.744 16.575 ( -1.455 -2.053 4.697) 5.329 16.647 ( -2.469 -5.127 1.838) 5.980 18.336 ( -3.132 9.954 5.135) 11.630 18.431 ( 2.729 5.275 2.983) 6.646 18.494 ( 2.309 -0.126 5.232) 5.720 18.730 ( 1.743 0.183 -4.542) 4.869 25.930 ( 1.684 -1.944 1.517) 2.986 25.945 ( 0.595 -1.427 -0.438) 1.607 26.003 ( -2.683 -1.064 -0.797) 2.994 26.044 ( -1.889 -1.312 -0.996) 2.506 26.249 ( -2.306 0.755 -0.493) 2.476 26.427 ( 1.867 -0.921 -5.877) 6.235 26.870 ( -0.767 0.662 2.514) 2.711 27.002 ( -1.387 -2.044 -1.061) 2.689 27.243 ( -1.868 -0.118 2.955) 3.498 27.667 ( -4.134 -0.620 -14.661) 15.245 28.448 ( -1.180 -0.428 3.999) 4.192 28.574 ( 1.721 -1.659 -0.595) 2.463 28.697 ( -0.566 -6.246 12.424) 13.917 28.945 ( 7.073 -2.446 2.244) 7.813 29.839 ( -3.743 3.690 17.869) 18.626 30.722 ( 7.520 11.472 -20.979) 25.066 ======================= Grid point 208 (103/140) ======================= q-point: (-0.33 -0.56 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.637 ( -1.313 -19.738 1.328) 19.826 1.813 ( -3.149 -17.326 -10.695) 20.603 2.030 ( 1.986 -7.645 6.069) 9.961 2.115 ( -16.692 -9.276 -3.753) 19.462 2.213 ( 1.174 -1.876 3.293) 3.967 2.342 ( 4.564 -6.706 2.104) 8.380 2.539 ( -1.334 -6.478 0.621) 6.643 2.623 ( 1.044 -11.060 -4.844) 12.119 2.870 ( -1.922 0.286 -3.245) 3.782 2.959 ( 0.066 -6.585 4.125) 7.771 2.995 ( 2.172 4.748 -2.169) 5.654 3.150 ( 5.968 -3.132 -2.742) 7.276 3.439 ( -0.510 -4.993 2.923) 5.808 3.541 ( 4.584 2.564 -0.874) 5.324 3.824 ( -10.867 -9.236 4.758) 15.035 3.844 ( -0.737 3.102 6.310) 7.070 4.033 ( -5.507 2.715 5.204) 8.049 4.092 ( -2.063 -0.873 -7.918) 8.228 4.220 ( 6.780 -6.069 -5.696) 10.735 4.382 ( 5.871 -5.241 -4.654) 9.144 4.521 ( -7.999 -0.279 -4.242) 9.059 4.656 ( 6.578 0.708 4.185) 7.828 4.856 ( -4.274 2.413 -1.084) 5.026 5.002 ( 5.771 1.214 -1.741) 6.149 5.342 ( -0.388 -4.230 8.695) 9.677 5.464 ( 4.057 5.397 2.624) 7.244 5.525 ( -0.426 2.251 -2.037) 3.065 5.772 ( 0.284 2.085 -14.182) 14.337 6.004 ( 2.652 0.654 3.645) 4.555 6.095 ( -3.958 1.130 -4.584) 6.161 6.350 ( -3.414 1.677 8.773) 9.562 6.551 ( 0.631 3.292 -0.222) 3.359 6.617 ( -5.548 -0.394 0.726) 5.609 6.761 ( 7.367 0.319 -0.548) 7.394 7.087 ( -0.500 1.742 3.571) 4.005 7.154 ( 0.609 -0.697 -2.069) 2.266 7.323 ( -3.461 3.944 8.192) 9.728 7.568 ( 6.593 1.311 6.869) 9.611 7.706 ( 0.870 1.007 -4.761) 4.943 7.789 ( -4.389 2.743 -6.620) 8.403 8.846 ( 0.438 -6.855 4.154) 8.027 8.978 ( 1.397 -11.358 -4.183) 12.184 9.390 ( -2.813 -6.880 17.290) 18.820 9.457 ( -1.528 -6.876 13.327) 15.073 9.641 ( 1.008 1.745 -1.772) 2.683 9.700 ( 1.266 -5.053 6.877) 8.627 9.960 ( -5.434 -2.262 -12.329) 13.662 10.183 ( -4.274 2.051 1.477) 4.965 10.352 ( 8.616 -6.479 -11.169) 15.523 10.492 ( 10.185 -6.818 -17.405) 21.287 11.262 ( -3.067 -1.573 3.162) 4.678 11.434 ( -1.665 -0.730 -6.011) 6.280 11.532 ( -8.609 -3.565 -2.668) 9.693 11.611 ( 3.645 0.457 -0.699) 3.739 11.863 ( 0.007 -1.854 7.018) 7.259 11.927 ( -3.031 3.479 0.306) 4.624 12.048 ( 3.325 5.603 0.167) 6.517 12.115 ( 0.273 -0.547 -4.175) 4.219 12.320 ( -5.439 -5.127 -1.985) 7.734 12.466 ( 8.098 -8.192 -2.864) 11.870 12.575 ( -2.213 -3.099 4.176) 5.651 12.709 ( 1.615 0.648 -1.204) 2.116 13.251 ( 4.624 9.984 6.241) 12.649 13.374 ( -2.610 13.064 -6.694) 14.910 14.971 ( -4.711 2.011 4.466) 6.796 15.139 ( 1.506 1.343 2.683) 3.357 15.321 ( 5.582 3.049 -2.053) 6.684 15.378 ( -2.112 5.986 -3.958) 7.481 15.598 ( -2.498 -3.983 1.753) 5.018 15.693 ( 0.750 3.274 -2.762) 4.348 15.875 ( -1.516 -1.826 1.131) 2.629 16.019 ( 2.962 0.128 -5.015) 5.826 16.289 ( -1.173 2.015 4.065) 4.687 16.431 ( 4.254 0.177 -0.532) 4.291 16.634 ( -2.437 -3.108 6.607) 7.697 16.741 ( -0.348 -6.271 0.387) 6.292 18.088 ( -11.823 12.761 3.618) 17.768 18.334 ( 5.178 12.411 2.520) 13.682 18.539 ( 3.975 0.855 3.598) 5.429 18.719 ( 1.754 -0.372 -5.338) 5.631 25.970 ( -1.282 -1.392 1.354) 2.327 25.987 ( 0.579 -2.450 0.907) 2.676 26.019 ( -0.937 -2.767 0.166) 2.926 26.058 ( -0.393 -1.997 -0.653) 2.138 26.221 ( -2.141 0.684 1.024) 2.470 26.435 ( 4.326 -1.263 -7.633) 8.864 26.873 ( -0.039 0.382 3.672) 3.692 26.988 ( -2.512 -0.217 -5.766) 6.293 27.292 ( 0.169 -2.398 9.894) 10.182 27.594 ( -2.449 -1.110 -10.598) 10.933 28.473 ( -2.320 -1.322 4.911) 5.590 28.636 ( 2.591 -4.463 -2.718) 5.833 28.893 ( 2.372 -9.591 8.524) 13.049 29.044 ( 4.075 -3.340 -0.622) 5.306 29.794 ( -4.687 7.105 14.899) 17.159 30.393 ( 2.024 18.912 -19.115) 26.965 ======================= Grid point 209 (104/140) ======================= q-point: (-0.22 -0.56 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.899 ( -4.721 -12.682 3.625) 14.010 1.971 ( -13.066 0.829 6.719) 14.716 2.017 ( -3.027 -9.672 -4.112) 10.937 2.233 ( -4.816 -13.930 -1.337) 14.800 2.397 ( 7.697 -8.369 2.534) 11.649 2.460 ( 5.046 -1.940 -3.700) 6.551 2.671 ( -0.076 -8.272 0.911) 8.322 2.745 ( -0.123 -4.560 -7.502) 8.780 2.862 ( 1.197 -1.162 3.447) 3.829 3.013 ( 2.281 -5.034 -4.666) 7.233 3.079 ( -0.748 -5.768 2.120) 6.191 3.211 ( 5.837 1.266 0.935) 6.045 3.495 ( -2.736 -1.888 -2.779) 4.332 3.584 ( 4.878 -2.566 3.029) 6.289 3.776 ( -1.254 7.098 5.162) 8.866 3.886 ( -9.879 -3.089 2.219) 10.586 3.972 ( 0.741 -0.062 -0.718) 1.034 4.083 ( -0.174 -2.200 3.290) 3.961 4.328 ( -2.224 -6.242 -3.133) 7.330 4.481 ( 6.455 -0.781 -5.961) 8.821 4.493 ( -0.891 -4.692 1.601) 5.037 4.732 ( 2.049 -0.863 1.561) 2.716 4.750 ( -5.483 1.126 -3.941) 6.845 4.986 ( 5.289 5.546 -2.147) 7.959 5.440 ( -0.945 -2.533 -1.969) 3.345 5.463 ( 0.263 -0.774 4.724) 4.794 5.503 ( 9.122 1.668 2.870) 9.707 5.694 ( 0.315 -0.196 -9.199) 9.206 5.961 ( -7.173 2.936 -2.371) 8.105 6.077 ( 1.310 -1.334 1.418) 2.346 6.342 ( -4.313 -0.005 7.479) 8.633 6.464 ( -2.337 5.581 -0.916) 6.119 6.572 ( -5.974 0.490 0.434) 6.009 6.820 ( 6.448 -2.389 -2.844) 7.442 7.050 ( 0.323 5.498 2.065) 5.882 7.187 ( 0.376 -1.590 -0.156) 1.641 7.330 ( 5.717 1.261 9.745) 11.369 7.597 ( 3.765 3.507 2.640) 5.783 7.656 ( -0.053 1.616 -1.543) 2.235 7.697 ( -3.107 -0.008 -6.036) 6.789 8.980 ( 0.485 -4.920 5.812) 7.630 9.146 ( 3.792 -8.358 -4.871) 10.390 9.444 ( -6.595 0.936 2.658) 7.172 9.594 ( -3.365 -2.914 1.258) 4.626 9.642 ( -0.591 0.298 10.991) 11.011 9.831 ( 4.015 -3.237 4.967) 7.160 9.950 ( -5.291 -8.411 -5.534) 11.374 10.163 ( -5.513 -3.976 2.746) 7.331 10.415 ( 3.806 -2.869 -5.782) 7.493 10.678 ( 16.981 -7.555 -13.511) 22.978 11.209 ( -9.973 2.409 -2.953) 10.676 11.388 ( -2.553 2.464 2.677) 4.445 11.504 ( -6.766 -3.818 -4.906) 9.189 11.677 ( 6.702 -2.196 0.368) 7.062 11.837 ( -0.901 4.605 0.436) 4.712 11.895 ( 2.556 3.627 0.788) 4.507 11.993 ( -1.570 -1.057 0.450) 1.945 12.125 ( 4.581 0.595 -3.482) 5.785 12.337 ( -5.802 -1.971 3.154) 6.892 12.578 ( 0.275 1.971 2.615) 3.286 12.686 ( 4.690 -6.334 -0.653) 7.908 12.732 ( 3.683 -1.912 -0.229) 4.156 13.076 ( -3.489 9.990 -3.922) 11.285 13.221 ( 5.385 2.647 1.233) 6.125 14.968 ( -2.327 -2.709 4.761) 5.952 15.115 ( -0.860 2.568 -0.668) 2.789 15.246 ( 0.413 3.702 2.179) 4.316 15.358 ( 5.283 0.423 -4.729) 7.103 15.639 ( -2.609 -2.771 -2.003) 4.301 15.669 ( 1.651 -0.959 1.091) 2.199 15.872 ( -4.056 -0.168 0.545) 4.096 16.005 ( 0.523 1.680 -2.889) 3.383 16.231 ( -3.278 3.364 1.391) 4.899 16.467 ( 5.997 0.422 -0.964) 6.089 16.695 ( -3.407 -2.884 5.947) 7.436 16.856 ( 4.107 -5.434 0.726) 6.850 17.781 ( -12.744 13.844 3.560) 19.151 18.151 ( 2.769 11.887 -0.479) 12.215 18.550 ( 1.345 2.074 2.440) 3.473 18.723 ( 2.937 -0.970 -5.294) 6.131 25.983 ( -2.244 -1.042 1.412) 2.849 26.019 ( 0.366 0.052 1.412) 1.459 26.064 ( -1.264 -3.540 -0.410) 3.781 26.105 ( -0.001 -3.184 1.307) 3.442 26.204 ( -1.502 0.199 1.050) 1.843 26.466 ( 7.370 -1.232 -7.101) 10.308 26.884 ( -0.636 0.610 3.358) 3.472 26.937 ( -1.335 0.870 -3.846) 4.163 27.402 ( 1.278 -3.220 11.328) 11.846 27.559 ( -0.353 -1.368 -7.657) 7.786 28.494 ( -4.303 -1.106 4.671) 6.446 28.730 ( 3.397 -5.622 -5.550) 8.600 29.102 ( 1.466 -3.465 -0.354) 3.779 29.126 ( 3.916 -9.360 0.434) 10.155 29.681 ( -4.717 9.160 11.163) 15.191 29.986 ( -2.207 17.752 -12.117) 21.606 ======================= Grid point 210 (105/140) ======================= q-point: (-0.11 -0.56 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.879 ( -7.269 2.576 9.333) 12.107 2.037 ( -6.626 -7.307 0.193) 9.866 2.153 ( 1.659 -4.803 4.440) 6.748 2.403 ( -0.967 -6.628 0.002) 6.699 2.483 ( 5.512 -0.996 -8.592) 10.256 2.555 ( 1.865 -5.394 -1.552) 5.915 2.769 ( -1.171 -4.728 -5.050) 7.016 2.792 ( 3.274 -3.468 1.080) 4.891 2.921 ( -2.623 -2.523 4.960) 6.152 3.017 ( -0.209 3.718 -8.201) 9.007 3.185 ( 1.417 -4.172 0.465) 4.431 3.221 ( 3.088 0.629 1.585) 3.527 3.481 ( -1.075 0.513 1.555) 1.959 3.600 ( -6.386 3.135 0.497) 7.131 3.696 ( 2.836 2.008 1.381) 3.739 3.879 ( -6.864 -2.116 3.608) 8.038 4.033 ( 8.223 -1.008 0.680) 8.312 4.168 ( 2.955 -2.903 7.748) 8.786 4.371 ( -5.683 -5.903 -3.758) 9.014 4.484 ( 2.110 2.986 2.542) 4.453 4.608 ( -3.530 3.577 -2.847) 5.776 4.640 ( 3.764 -6.492 2.451) 7.894 4.797 ( 0.904 -2.731 -7.000) 7.568 4.912 ( 4.060 4.639 -2.145) 6.527 5.404 ( -0.069 0.253 -8.558) 8.562 5.485 ( -1.036 4.387 -0.566) 4.543 5.562 ( 5.866 -0.595 4.765) 7.581 5.744 ( 2.394 -4.630 2.279) 5.689 5.848 ( -6.305 1.336 -1.991) 6.745 6.099 ( 0.602 1.068 0.385) 1.285 6.311 ( -4.225 2.258 -0.766) 4.852 6.394 ( -0.233 1.164 4.075) 4.244 6.532 ( -7.294 -2.088 0.834) 7.633 6.895 ( 6.048 -2.050 -4.213) 7.650 6.945 ( 1.183 7.322 0.707) 7.450 7.183 ( -5.449 -0.962 -0.348) 5.544 7.370 ( 3.148 6.095 9.446) 11.674 7.570 ( 4.920 0.734 -4.218) 6.522 7.683 ( 2.964 0.049 0.531) 3.012 7.696 ( 0.680 -4.808 2.457) 5.442 9.050 ( -4.832 -1.296 5.553) 7.474 9.268 ( 4.953 -4.792 -6.041) 9.164 9.370 ( -3.707 1.679 0.791) 4.146 9.544 ( -5.277 1.244 -3.630) 6.525 9.644 ( -3.838 2.348 3.125) 5.478 9.919 ( 3.510 0.087 6.406) 7.305 10.092 ( -1.348 -8.606 6.025) 10.592 10.197 ( -6.524 -3.293 -1.126) 7.394 10.460 ( 2.687 -2.202 -4.848) 5.965 10.853 ( 12.042 -6.331 -9.902) 16.826 11.075 ( -6.445 1.665 -1.690) 6.868 11.316 ( -5.558 2.217 0.252) 5.989 11.516 ( 1.359 -0.474 -2.349) 2.756 11.718 ( -3.914 2.725 -2.185) 5.246 11.729 ( 4.000 5.308 2.157) 6.988 11.921 ( 5.777 -2.790 4.087) 7.606 12.040 ( 0.088 -2.500 -0.416) 2.536 12.122 ( 3.292 0.132 -2.913) 4.397 12.340 ( -2.311 -0.634 3.565) 4.295 12.523 ( -1.063 4.342 2.922) 5.341 12.652 ( 2.752 7.730 -2.162) 8.485 12.803 ( 10.613 4.061 -3.640) 11.932 13.010 ( -9.819 -9.599 -0.751) 13.752 13.305 ( 1.501 -6.843 0.626) 7.033 15.028 ( -1.605 -0.247 -0.562) 1.718 15.105 ( 0.892 -4.841 3.956) 6.315 15.216 ( 0.737 2.751 3.582) 4.576 15.365 ( 5.828 1.392 -2.541) 6.508 15.665 ( -2.256 -4.299 -2.485) 5.454 15.727 ( 1.883 -2.679 -0.742) 3.358 15.834 ( -4.849 0.575 1.480) 5.103 15.930 ( -2.763 4.064 -2.108) 5.347 16.159 ( -1.292 3.499 0.241) 3.738 16.483 ( 1.820 1.131 -0.767) 2.276 16.731 ( -2.579 -1.536 2.743) 4.066 17.008 ( 9.000 -5.868 2.301) 10.988 17.467 ( -13.808 12.843 4.382) 19.360 18.017 ( 4.045 5.181 -3.285) 7.348 18.520 ( -1.388 2.443 2.130) 3.526 18.739 ( 3.549 -0.705 -4.794) 6.007 25.984 ( -1.860 -0.158 1.451) 2.364 26.012 ( 0.497 1.590 0.808) 1.852 26.110 ( -1.529 -3.007 -0.074) 3.374 26.165 ( -1.789 -3.978 0.794) 4.434 26.198 ( -0.338 0.330 0.499) 0.687 26.518 ( 7.891 -1.198 -5.191) 9.521 26.864 ( -1.347 1.196 0.774) 1.961 26.916 ( 0.809 1.814 2.899) 3.514 27.503 ( -1.650 -4.207 -3.192) 5.532 27.575 ( 4.425 -0.886 7.071) 8.389 28.481 ( -6.670 0.014 2.835) 7.248 28.776 ( 0.937 -0.939 -10.577) 10.660 29.111 ( -2.416 -0.636 -2.491) 3.528 29.328 ( 3.796 -8.825 -3.034) 10.075 29.529 ( -3.229 8.840 5.198) 10.751 29.724 ( 2.045 7.773 1.806) 8.238 ======================= Grid point 216 (106/140) ======================= q-point: (-0.44 -0.44 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.211 ( 7.210 0.000 -0.622) 7.237 1.260 ( -7.168 -0.000 -9.166) 11.636 1.888 ( 17.666 0.000 9.772) 20.188 1.899 ( -22.078 -0.000 -10.594) 24.488 2.045 ( -4.187 -0.000 -0.794) 4.261 2.129 ( -2.550 -0.000 -5.009) 5.620 2.472 ( -2.693 -0.000 0.054) 2.694 2.503 ( 0.340 0.000 1.115) 1.166 2.811 ( 1.808 0.000 8.955) 9.135 2.941 ( -11.401 -0.000 1.442) 11.492 3.027 ( 3.333 0.000 -6.835) 7.604 3.180 ( 2.026 0.000 -1.935) 2.802 3.342 ( 1.014 0.000 6.294) 6.375 3.538 ( -8.320 -0.000 -5.511) 9.979 3.747 ( 3.887 0.000 4.674) 6.079 3.753 ( 1.510 0.000 -6.533) 6.706 3.987 ( 5.753 0.000 1.266) 5.890 4.027 ( -0.885 -0.000 -3.677) 3.782 4.194 ( 0.677 0.000 2.359) 2.454 4.351 ( 1.866 0.000 1.683) 2.513 4.470 ( -8.964 -0.000 -0.887) 9.007 4.758 ( 10.288 0.000 -2.699) 10.636 4.889 ( 0.145 0.000 6.198) 6.200 5.012 ( -0.388 -0.000 -6.423) 6.435 5.284 ( -1.091 -0.000 12.224) 12.273 5.539 ( -1.394 -0.000 0.317) 1.430 5.625 ( 3.573 0.000 0.583) 3.620 5.803 ( -2.897 -0.000 -15.297) 15.568 6.037 ( 2.551 0.000 0.358) 2.576 6.110 ( -1.748 -0.000 -4.944) 5.244 6.401 ( -1.884 -0.000 7.337) 7.575 6.608 ( 0.774 0.000 -6.651) 6.696 6.618 ( -4.808 -0.000 4.182) 6.372 6.761 ( 6.366 0.000 0.465) 6.383 7.116 ( 2.222 0.000 4.865) 5.348 7.138 ( -7.534 -0.000 -2.471) 7.929 7.473 ( 1.155 0.000 5.114) 5.242 7.614 ( 2.434 0.000 10.613) 10.889 7.639 ( 3.332 0.000 -1.393) 3.611 7.876 ( -1.571 -0.000 -8.690) 8.830 8.686 ( -8.642 -0.000 -5.076) 10.023 8.706 ( 11.323 0.000 4.259) 12.098 9.251 ( -3.945 -0.000 19.616) 20.009 9.267 ( -2.018 -0.000 14.411) 14.551 9.611 ( -2.997 -0.000 8.944) 9.433 9.802 ( 7.739 0.000 -15.030) 16.906 9.818 ( 5.068 0.000 -2.448) 5.628 10.021 ( 2.893 0.000 -22.669) 22.853 10.316 ( 0.953 0.000 -0.301) 0.999 10.435 ( -3.397 -0.000 -8.837) 9.468 11.212 ( -6.383 -0.000 1.784) 6.628 11.359 ( 1.629 0.000 -2.042) 2.613 11.480 ( -8.364 -0.000 -1.634) 8.522 11.656 ( 4.219 0.000 -5.318) 6.788 11.865 ( -8.428 -0.000 8.728) 12.133 11.903 ( 2.089 0.000 6.292) 6.630 12.081 ( -3.455 -0.000 -8.029) 8.740 12.168 ( 0.502 0.000 1.397) 1.485 12.227 ( 5.425 0.000 -7.376) 9.157 12.291 ( 3.887 0.000 -5.245) 6.528 12.554 ( -0.836 -0.000 7.291) 7.339 12.736 ( 2.667 0.000 -2.418) 3.600 13.459 ( 2.787 0.000 8.309) 8.764 13.631 ( -3.301 -0.000 -6.967) 7.710 15.050 ( -1.444 -0.000 1.846) 2.343 15.143 ( 2.280 0.000 -0.500) 2.334 15.420 ( -3.377 -0.000 4.644) 5.743 15.439 ( -1.177 -0.000 5.433) 5.559 15.700 ( 4.984 0.000 -4.296) 6.580 15.709 ( -0.303 -0.000 -7.992) 7.998 15.878 ( -0.705 -0.000 2.588) 2.682 15.991 ( 4.426 0.000 -3.375) 5.566 16.335 ( 0.327 0.000 1.569) 1.603 16.375 ( 0.192 0.000 0.807) 0.829 16.571 ( -0.094 -0.000 3.580) 3.581 16.594 ( -2.588 -0.000 2.398) 3.528 18.333 ( -16.956 -0.000 2.952) 17.211 18.530 ( 1.077 0.000 4.895) 5.012 18.576 ( 10.263 0.000 1.644) 10.394 18.755 ( 8.261 0.000 -2.316) 8.579 25.925 ( 0.393 0.000 -0.542) 0.670 25.927 ( -0.705 -0.000 -0.966) 1.195 25.979 ( -1.207 -0.000 2.118) 2.438 26.019 ( -0.242 -0.000 -0.888) 0.920 26.241 ( -2.115 -0.000 1.661) 2.689 26.401 ( 1.321 0.000 -5.792) 5.941 26.887 ( -0.268 -0.000 3.753) 3.763 26.971 ( -0.976 -0.000 -1.747) 2.001 27.240 ( -2.545 -0.000 5.594) 6.146 27.565 ( -2.278 -0.000 -13.456) 13.648 28.451 ( -1.426 -0.000 3.416) 3.702 28.553 ( 0.189 0.000 -2.375) 2.383 28.703 ( -0.635 -0.000 12.401) 12.417 28.979 ( 6.224 0.000 -2.235) 6.614 29.938 ( -5.290 -0.000 21.459) 22.101 30.777 ( 8.323 0.000 -24.433) 25.812 ======================= Grid point 217 (107/140) ======================= q-point: (-0.33 -0.44 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.290 ( -7.138 -16.497 -1.851) 18.070 1.436 ( 1.523 -16.985 -6.317) 18.185 1.721 ( -23.587 -9.758 -11.950) 28.185 2.037 ( 4.270 -0.799 9.764) 10.687 2.192 ( 5.691 -11.411 8.188) 15.154 2.221 ( 3.620 -8.569 -0.351) 9.309 2.439 ( -4.743 -2.494 -2.683) 5.992 2.478 ( -4.169 0.031 -0.569) 4.207 2.835 ( -8.645 0.143 2.821) 9.094 2.892 ( -0.689 -3.875 4.862) 6.256 3.032 ( -0.322 -2.638 -6.581) 7.097 3.190 ( 9.868 4.129 -3.114) 11.141 3.413 ( -0.488 -3.490 5.719) 6.717 3.478 ( -5.176 -3.470 -2.755) 6.814 3.707 ( 1.375 1.150 -1.731) 2.492 3.870 ( 0.882 -4.663 6.230) 7.832 4.005 ( -1.628 -0.898 -1.630) 2.472 4.122 ( 4.250 -5.201 0.145) 6.718 4.149 ( 3.540 3.890 0.240) 5.265 4.358 ( -1.798 0.193 0.072) 1.809 4.426 ( -1.516 -1.804 -7.197) 7.573 4.782 ( 4.630 4.011 2.950) 6.799 4.885 ( -1.492 3.529 3.977) 5.522 5.013 ( 5.440 -2.178 -5.586) 8.096 5.349 ( -0.997 -1.480 13.236) 13.356 5.510 ( -1.769 1.599 -1.892) 3.044 5.612 ( 2.809 3.815 -1.501) 4.970 5.705 ( -2.718 -0.460 -13.736) 14.010 6.048 ( 1.953 1.156 0.735) 2.385 6.067 ( -1.980 0.981 -3.696) 4.307 6.390 ( -4.230 2.136 6.306) 7.888 6.565 ( -1.335 0.863 -5.648) 5.867 6.601 ( -2.789 1.387 4.012) 5.079 6.824 ( 6.729 0.185 0.257) 6.736 7.082 ( -3.852 -1.765 -0.774) 4.307 7.154 ( -0.071 -0.642 4.580) 4.625 7.437 ( 2.475 7.022 4.315) 8.605 7.667 ( 3.293 0.723 7.554) 8.272 7.697 ( 2.591 -1.726 -2.723) 4.136 7.789 ( -1.805 3.118 -7.117) 7.977 8.684 ( -4.418 -8.797 -3.243) 10.364 8.873 ( 9.943 -5.844 3.283) 11.991 9.349 ( -4.195 -3.931 15.452) 16.487 9.377 ( -2.392 -6.276 12.790) 14.446 9.636 ( -3.747 -1.286 3.282) 5.145 9.719 ( 7.506 1.491 1.128) 7.735 9.854 ( -1.886 1.219 -13.607) 13.791 10.167 ( 15.300 -16.917 -17.858) 28.968 10.242 ( -2.455 5.929 1.792) 6.663 10.404 ( 2.101 -2.493 -7.930) 8.574 11.184 ( -9.119 -2.687 2.073) 9.730 11.374 ( -1.882 -2.074 -3.056) 4.146 11.418 ( -8.029 -1.095 0.276) 8.108 11.652 ( 4.664 1.752 -2.652) 5.644 11.821 ( -9.562 -1.036 2.675) 9.984 11.958 ( 0.522 -0.839 5.971) 6.052 12.079 ( 2.560 -2.675 -1.690) 4.070 12.166 ( -4.020 -2.738 -0.328) 4.875 12.186 ( 2.675 5.130 -5.218) 7.791 12.376 ( 6.066 -6.244 -3.955) 9.562 12.599 ( 3.595 0.349 7.175) 8.032 12.736 ( 2.907 0.935 -2.460) 3.921 13.455 ( 0.989 6.367 7.705) 10.044 13.506 ( -1.219 7.911 -7.633) 11.060 15.012 ( -2.760 3.501 3.630) 5.749 15.170 ( 2.392 -0.879 -0.360) 2.573 15.369 ( -0.232 2.680 2.072) 3.395 15.490 ( -1.660 1.628 -1.829) 2.958 15.569 ( 0.284 5.773 1.184) 5.900 15.731 ( 2.724 1.135 -4.024) 4.990 15.860 ( -1.341 0.631 2.934) 3.287 16.008 ( 2.960 -0.022 -6.618) 7.250 16.336 ( 0.405 1.918 2.186) 2.937 16.415 ( 0.998 -3.860 -1.667) 4.321 16.592 ( -3.105 -1.825 3.992) 5.377 16.652 ( 1.732 -5.595 2.598) 6.408 18.151 ( -16.225 6.579 1.322) 17.558 18.523 ( -2.049 4.246 5.680) 7.382 18.634 ( 6.598 -0.337 -2.054) 6.918 18.765 ( 10.554 7.803 -2.080) 13.289 25.922 ( -2.191 -1.524 -1.020) 2.858 25.940 ( -1.333 -2.810 -1.073) 3.290 26.004 ( 1.279 -0.501 3.844) 4.082 26.033 ( 1.223 -1.345 0.205) 1.829 26.225 ( -2.307 1.220 2.713) 3.764 26.409 ( 3.862 -2.252 -5.718) 7.258 26.903 ( 0.138 0.604 4.543) 4.585 26.952 ( -0.936 0.105 -3.053) 3.195 27.286 ( -1.559 -2.987 9.940) 10.496 27.505 ( -0.935 -1.597 -10.276) 10.441 28.460 ( -2.139 -0.541 3.776) 4.373 28.567 ( 0.589 -2.902 -2.944) 4.176 28.805 ( 0.088 -6.307 7.862) 10.080 29.015 ( 3.884 -1.827 -5.491) 6.970 29.955 ( -5.682 5.279 20.564) 21.978 30.589 ( 4.095 13.321 -25.429) 28.998 ======================= Grid point 218 (108/140) ======================= q-point: (-0.22 -0.44 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.529 ( -12.941 -19.289 -3.179) 23.445 1.691 ( -8.780 -17.968 0.929) 20.020 1.854 ( -3.559 -21.558 -3.946) 22.203 2.032 ( -7.085 3.441 9.969) 12.705 2.379 ( 4.852 -5.415 2.104) 7.569 2.441 ( 2.739 -6.145 5.303) 8.567 2.469 ( -3.966 -6.551 -3.859) 8.575 2.579 ( 2.624 -12.896 -2.881) 13.472 2.846 ( 0.352 -3.697 -0.486) 3.746 2.967 ( -0.532 -3.732 0.368) 3.788 3.026 ( 0.206 1.090 1.797) 2.112 3.230 ( 7.426 -5.252 -4.940) 10.351 3.431 ( -1.227 1.412 -0.413) 1.916 3.569 ( -4.001 -7.880 1.383) 8.945 3.713 ( -2.898 -2.626 2.376) 4.576 3.924 ( -0.627 5.325 1.643) 5.608 4.001 ( 2.523 -1.283 2.601) 3.844 4.085 ( 0.484 2.027 7.428) 7.715 4.237 ( -2.405 -0.762 0.098) 2.525 4.391 ( 3.535 -8.701 -5.632) 10.951 4.450 ( 6.072 -3.008 -7.362) 10.006 4.725 ( -2.918 3.157 -0.820) 4.376 4.824 ( -0.685 6.116 6.942) 9.277 5.065 ( 5.984 0.220 -4.461) 7.467 5.412 ( 0.206 0.127 -0.693) 0.734 5.473 ( -1.791 0.010 4.308) 4.666 5.576 ( 3.147 -1.440 -3.583) 4.982 5.658 ( 2.227 0.590 -5.315) 5.793 5.956 ( -5.515 4.718 -3.724) 8.157 6.071 ( 0.626 -0.186 1.206) 1.371 6.349 ( -4.821 1.429 6.308) 8.067 6.499 ( -2.837 2.574 -5.604) 6.788 6.559 ( -3.365 2.220 2.438) 4.711 6.840 ( 4.202 0.510 -1.095) 4.372 7.121 ( -4.366 -1.718 3.710) 5.981 7.190 ( 3.671 1.132 1.333) 4.067 7.394 ( 5.469 0.523 2.352) 5.977 7.676 ( -2.372 2.121 1.232) 3.412 7.694 ( 1.194 4.058 -0.822) 4.309 7.721 ( 6.793 1.892 -0.183) 7.054 8.852 ( 0.156 -12.165 -0.274) 12.169 9.056 ( 6.570 -6.003 1.979) 9.117 9.400 ( -5.967 -1.505 2.846) 6.780 9.508 ( -4.021 -4.868 2.977) 6.981 9.704 ( 0.559 -1.482 12.002) 12.106 9.748 ( -3.243 -3.707 -10.659) 11.742 9.823 ( 4.162 -3.049 4.015) 6.538 10.116 ( -4.345 2.455 1.232) 5.140 10.374 ( 5.525 -3.056 -5.521) 8.387 10.595 ( 19.593 -12.564 -13.061) 26.689 11.137 ( -11.280 0.109 -2.131) 11.480 11.369 ( -5.664 -3.392 0.531) 6.623 11.388 ( -6.867 -0.241 1.833) 7.111 11.672 ( 4.500 -1.701 -3.223) 5.791 11.798 ( -5.162 -3.227 -0.442) 6.104 12.000 ( 2.228 2.474 7.856) 8.532 12.052 ( -1.312 7.264 -4.983) 8.906 12.137 ( 3.882 -1.589 -4.208) 5.942 12.233 ( -2.545 -6.937 5.440) 9.175 12.511 ( -2.178 -7.712 -2.155) 8.298 12.660 ( 6.902 0.130 3.955) 7.956 12.750 ( 4.483 -0.511 0.220) 4.518 13.283 ( 3.576 13.831 -7.115) 15.960 13.372 ( 1.441 7.880 5.908) 9.954 14.966 ( -2.046 1.342 6.378) 6.831 15.167 ( -0.646 4.487 -1.344) 4.729 15.320 ( 0.739 2.192 -3.190) 3.941 15.379 ( 2.526 2.563 0.080) 3.600 15.589 ( -0.574 -1.407 2.606) 3.017 15.697 ( 1.213 2.180 -0.805) 2.621 15.847 ( -2.863 0.512 0.965) 3.064 15.999 ( 0.830 -0.488 -5.195) 5.283 16.275 ( -1.806 3.930 -0.850) 4.408 16.486 ( 4.074 -2.140 -2.680) 5.326 16.629 ( -4.857 -3.730 4.278) 7.471 16.807 ( 6.533 -6.624 2.897) 9.744 17.889 ( -14.806 10.198 0.565) 17.987 18.383 ( -4.985 12.664 6.121) 14.923 18.651 ( 7.782 6.752 -2.378) 10.574 18.696 ( 2.183 -0.966 -5.650) 6.133 25.934 ( -2.523 -2.249 -0.070) 3.381 25.983 ( -1.707 -3.897 -1.148) 4.406 26.036 ( 1.304 -0.304 2.444) 2.787 26.075 ( 0.250 -1.346 2.890) 3.198 26.202 ( -1.339 0.316 1.027) 1.717 26.473 ( 8.268 -2.186 -5.203) 10.011 26.895 ( -1.266 0.998 0.112) 1.615 26.949 ( 1.157 0.334 3.717) 3.908 27.374 ( -2.423 -3.506 2.946) 5.181 27.529 ( 5.003 -2.860 1.814) 6.042 28.467 ( -3.713 -0.525 3.298) 4.994 28.629 ( 1.487 -5.306 -4.618) 7.190 28.980 ( 1.568 -10.110 1.149) 10.295 29.045 ( 1.357 -2.708 -6.606) 7.267 29.877 ( -5.489 9.480 16.989) 20.215 30.190 ( -3.793 17.903 -19.642) 26.846 ======================= Grid point 219 (109/140) ======================= q-point: (-0.11 -0.44 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.736 ( -9.902 -16.886 0.618) 19.585 1.833 ( -15.283 -6.145 9.381) 18.956 2.095 ( 2.933 -8.079 10.215) 13.350 2.192 ( 2.133 -17.266 -2.021) 17.514 2.423 ( 1.092 -2.586 -8.727) 9.167 2.517 ( -3.788 -2.449 0.580) 4.548 2.600 ( 0.692 -8.060 -3.561) 8.839 2.760 ( 6.157 -5.471 -2.175) 8.519 2.893 ( 0.132 -1.033 1.413) 1.756 3.011 ( 1.486 -2.281 -1.296) 3.015 3.116 ( 1.934 -7.108 3.108) 7.995 3.311 ( 2.566 5.878 -0.000) 6.414 3.417 ( 0.128 -7.296 -4.778) 8.722 3.614 ( -3.761 1.201 2.108) 4.476 3.759 ( -10.106 -4.260 5.513) 12.275 3.800 ( 2.780 4.917 -1.307) 5.797 4.087 ( 8.344 -1.184 3.308) 9.054 4.154 ( -2.715 -5.845 5.614) 8.547 4.226 ( -0.243 -0.766 4.070) 4.149 4.517 ( 0.789 -2.467 -1.584) 3.036 4.574 ( 6.386 -8.673 -3.145) 11.220 4.642 ( -0.319 2.926 -4.953) 5.762 4.735 ( -3.563 3.831 1.786) 5.529 5.033 ( 4.724 5.334 -3.126) 7.781 5.379 ( 0.824 0.890 -6.697) 6.806 5.474 ( -3.830 -0.706 -0.929) 4.004 5.653 ( 2.721 -0.546 0.401) 2.805 5.695 ( 5.913 -3.466 2.416) 7.267 5.817 ( -4.703 2.480 -2.264) 5.779 6.080 ( -1.579 -0.938 -0.136) 1.842 6.322 ( -6.058 1.621 5.118) 8.095 6.403 ( -1.320 1.656 -3.488) 4.080 6.510 ( -1.281 2.082 0.104) 2.447 6.886 ( 3.561 -2.100 -1.904) 4.551 7.099 ( -3.771 1.705 2.778) 4.984 7.133 ( 0.445 5.713 0.017) 5.731 7.499 ( 4.374 -1.540 2.561) 5.297 7.601 ( -2.409 5.098 3.483) 6.628 7.629 ( 1.524 1.015 -5.672) 5.960 7.787 ( 10.118 0.011 4.853) 11.222 9.012 ( -2.491 -3.961 3.102) 5.614 9.185 ( 3.671 -5.332 -1.299) 6.603 9.394 ( -0.807 -0.683 1.708) 2.009 9.489 ( -3.778 0.936 -5.671) 6.878 9.663 ( -0.515 1.440 -2.850) 3.234 9.894 ( 0.184 -5.478 0.187) 5.484 9.942 ( -1.291 -9.303 11.271) 14.671 10.113 ( -4.228 -2.469 3.702) 6.138 10.450 ( 6.960 -2.034 -3.347) 7.987 10.811 ( 12.620 -4.295 -9.906) 16.608 11.027 ( -6.506 0.043 -2.482) 6.963 11.304 ( -8.106 2.553 -0.906) 8.547 11.425 ( -6.199 -6.154 3.799) 9.526 11.712 ( 0.716 -1.437 -5.127) 5.372 11.840 ( 0.454 0.893 -0.332) 1.055 11.900 ( -1.080 0.825 -1.454) 1.991 12.027 ( 1.079 -0.091 7.165) 7.246 12.139 ( 2.243 0.963 -5.352) 5.882 12.353 ( 4.292 -1.565 4.245) 6.236 12.537 ( -6.089 -1.417 -0.385) 6.264 12.735 ( 0.888 -0.724 -0.765) 1.377 12.813 ( 0.331 -3.310 1.693) 3.732 13.063 ( 12.423 14.298 -4.607) 19.493 13.309 ( 2.327 3.647 4.564) 6.289 15.015 ( -0.563 -1.201 5.109) 5.278 15.047 ( -2.608 0.400 -0.632) 2.713 15.327 ( 3.252 3.787 6.044) 7.839 15.395 ( 5.520 -2.500 -5.776) 8.372 15.594 ( -1.883 -0.115 0.234) 1.901 15.697 ( 1.374 -1.401 -0.826) 2.129 15.817 ( -3.570 0.419 1.394) 3.855 15.957 ( -2.124 2.688 -2.994) 4.550 16.200 ( -0.293 2.589 -2.533) 3.634 16.505 ( 0.297 0.861 -0.971) 1.331 16.681 ( -2.025 -3.679 1.574) 4.485 16.994 ( 10.051 -6.071 2.928) 12.102 17.585 ( -15.419 12.249 1.858) 19.779 18.145 ( -4.506 10.577 1.307) 11.571 18.576 ( 1.186 4.152 -1.579) 4.597 18.722 ( 3.024 -1.535 -4.712) 5.805 25.952 ( -2.482 -1.789 0.751) 3.151 26.022 ( -1.592 -2.617 -0.983) 3.217 26.061 ( 1.006 -0.431 1.683) 2.008 26.102 ( -2.379 -1.608 2.787) 4.002 26.208 ( 1.348 -0.262 -0.268) 1.399 26.539 ( 7.505 -0.957 -5.223) 9.194 26.880 ( 0.680 0.620 1.376) 1.655 26.974 ( 1.100 1.208 6.750) 6.945 27.392 ( -2.983 -3.266 -7.644) 8.832 27.665 ( 9.420 -0.752 12.331) 15.536 28.441 ( -5.978 0.471 0.504) 6.018 28.696 ( 1.111 -3.728 -7.861) 8.771 29.056 ( -0.454 -2.185 -5.869) 6.279 29.166 ( 1.977 -10.690 -3.675) 11.476 29.716 ( -5.781 12.207 8.815) 16.129 29.852 ( -3.755 8.495 -3.709) 10.001 ======================= Grid point 226 (110/140) ======================= q-point: (-0.33 -0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.006 ( -14.094 -0.000 -6.477) 15.511 1.305 ( -1.400 -0.000 -2.123) 2.543 1.361 ( -20.980 -0.000 -10.421) 23.426 2.097 ( 1.541 0.000 -0.537) 1.632 2.099 ( 1.434 0.000 8.392) 8.514 2.239 ( 8.446 0.000 10.156) 13.209 2.389 ( -18.113 -0.000 2.968) 18.355 2.427 ( 3.647 0.000 -2.254) 4.287 2.748 ( -15.084 -0.000 8.919) 17.524 2.877 ( -0.833 -0.000 2.805) 2.926 2.953 ( 0.069 0.000 -8.865) 8.866 3.280 ( 9.153 0.000 -1.911) 9.350 3.392 ( -1.285 -0.000 3.902) 4.108 3.467 ( 1.366 0.000 -4.086) 4.308 3.718 ( 2.606 0.000 -3.850) 4.650 3.848 ( 0.927 0.000 8.367) 8.419 4.015 ( 2.696 0.000 -0.706) 2.787 4.090 ( 7.378 0.000 -1.243) 7.482 4.249 ( 3.602 0.000 1.604) 3.943 4.285 ( -10.323 -0.000 -0.483) 10.334 4.415 ( 5.963 0.000 -5.721) 8.263 4.844 ( -1.640 -0.000 1.843) 2.467 4.949 ( -0.472 -0.000 5.952) 5.970 5.013 ( 10.251 0.000 -6.381) 12.074 5.391 ( -4.318 -0.000 16.994) 17.534 5.495 ( -1.371 -0.000 -6.074) 6.227 5.583 ( -6.245 -0.000 -12.084) 13.602 5.662 ( 2.297 0.000 -1.883) 2.971 6.056 ( -0.543 -0.000 -2.097) 2.167 6.082 ( 3.447 0.000 0.315) 3.462 6.409 ( -3.712 -0.000 5.791) 6.879 6.534 ( -1.463 -0.000 -6.980) 7.131 6.625 ( -1.758 -0.000 5.949) 6.203 6.867 ( 5.162 0.000 -0.783) 5.222 7.015 ( -4.736 -0.000 -2.438) 5.327 7.154 ( -4.219 -0.000 6.068) 7.390 7.598 ( 7.204 0.000 4.660) 8.580 7.652 ( 0.088 0.000 -5.959) 5.960 7.704 ( -1.167 -0.000 5.573) 5.694 7.787 ( 3.896 0.000 -6.389) 7.483 8.549 ( -2.476 -0.000 -3.945) 4.658 8.930 ( 9.862 0.000 4.369) 10.787 9.354 ( -4.301 -0.000 11.831) 12.588 9.371 ( -0.059 -0.000 9.404) 9.404 9.617 ( -1.565 -0.000 3.089) 3.463 9.808 ( 0.389 0.000 -12.226) 12.232 9.857 ( 10.194 0.000 -2.186) 10.425 9.963 ( 12.303 0.000 -9.332) 15.441 10.306 ( -1.684 -0.000 -5.396) 5.652 10.352 ( 0.001 0.000 4.480) 4.480 11.086 ( -11.089 -0.000 1.683) 11.216 11.320 ( -2.916 -0.000 -2.364) 3.754 11.364 ( -6.583 -0.000 2.600) 7.078 11.697 ( 4.465 0.000 -4.157) 6.100 11.727 ( -11.213 -0.000 0.761) 11.239 11.963 ( -2.169 -0.000 6.623) 6.969 12.067 ( 2.942 0.000 0.559) 2.995 12.117 ( -1.962 -0.000 0.813) 2.123 12.262 ( 0.669 0.000 -2.832) 2.910 12.324 ( 4.734 0.000 -4.500) 6.532 12.683 ( 6.826 0.000 7.095) 9.846 12.752 ( 3.113 0.000 -3.438) 4.638 13.540 ( 2.564 0.000 -7.864) 8.272 13.543 ( -2.779 -0.000 9.271) 9.679 15.059 ( 0.378 0.000 2.481) 2.509 15.154 ( 0.716 0.000 -2.741) 2.833 15.409 ( -5.105 -0.000 7.724) 9.259 15.463 ( -0.074 -0.000 -2.244) 2.245 15.644 ( -0.783 -0.000 -0.363) 0.863 15.755 ( 6.355 0.000 -3.990) 7.504 15.861 ( -3.223 -0.000 -0.341) 3.241 16.036 ( 7.343 0.000 -5.613) 9.243 16.342 ( -1.152 -0.000 1.864) 2.191 16.381 ( 0.975 0.000 -1.566) 1.845 16.564 ( -4.424 -0.000 2.037) 4.870 16.623 ( 3.034 0.000 2.722) 4.076 18.077 ( -17.197 -0.000 0.133) 17.197 18.569 ( -2.036 -0.000 4.425) 4.870 18.623 ( 2.537 0.000 -5.169) 5.758 18.972 ( 16.084 0.000 -2.820) 16.329 25.886 ( -2.469 -0.000 -0.749) 2.580 25.894 ( -1.695 -0.000 -0.909) 1.923 26.031 ( 1.590 0.000 0.389) 1.637 26.042 ( 3.190 0.000 4.223) 5.293 26.257 ( -0.694 -0.000 6.558) 6.594 26.370 ( 1.693 0.000 -4.753) 5.046 26.936 ( -0.260 -0.000 -2.114) 2.130 26.938 ( 0.762 0.000 4.762) 4.823 27.301 ( -1.077 -0.000 14.531) 14.570 27.430 ( -0.912 -0.000 -9.028) 9.074 28.457 ( -2.417 -0.000 3.505) 4.257 28.532 ( 0.453 0.000 -2.674) 2.712 28.774 ( -1.477 -0.000 4.718) 4.944 28.992 ( 3.032 0.000 -8.501) 9.025 30.058 ( -6.783 -0.000 21.280) 22.334 30.605 ( 3.632 0.000 -32.204) 32.408 ======================= Grid point 227 (111/140) ======================= q-point: (-0.22 -0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.076 ( -14.662 -19.070 0.907) 24.072 1.239 ( -20.081 -19.498 -4.254) 28.311 1.520 ( 5.429 -15.694 1.700) 16.693 2.061 ( -18.366 3.868 11.171) 21.841 2.219 ( 1.350 -10.010 -1.354) 10.191 2.330 ( -6.802 -4.232 3.842) 8.885 2.367 ( 3.346 -10.697 -2.868) 11.570 2.509 ( 8.338 -0.349 7.804) 11.426 2.745 ( -6.483 -5.708 5.111) 10.037 2.899 ( -0.604 -2.580 1.327) 2.964 2.973 ( -0.161 -6.092 -5.540) 8.236 3.276 ( 4.543 7.776 -4.525) 10.079 3.397 ( -2.470 -5.771 2.679) 6.825 3.461 ( 0.587 0.607 -2.071) 2.237 3.725 ( 1.894 0.524 0.740) 2.100 3.964 ( -0.628 -3.723 3.486) 5.139 4.010 ( 4.638 1.074 4.346) 6.447 4.169 ( -3.892 2.841 0.517) 4.846 4.212 ( 7.669 -5.059 -1.835) 9.369 4.292 ( 2.457 -0.987 -1.384) 2.988 4.434 ( 5.763 -0.240 -5.188) 7.758 4.766 ( -3.503 5.262 -1.332) 6.460 4.956 ( -1.831 3.212 7.946) 8.764 5.078 ( 8.637 -0.972 -4.011) 9.573 5.403 ( -2.391 1.055 -8.993) 9.365 5.466 ( -4.267 -2.598 7.687) 9.168 5.501 ( -4.166 -0.057 -3.208) 5.258 5.676 ( 3.624 -0.712 -2.897) 4.694 6.003 ( -1.028 5.014 -1.682) 5.388 6.104 ( 2.900 1.546 1.852) 3.772 6.380 ( -3.153 2.723 3.937) 5.732 6.488 ( -1.330 0.989 -3.283) 3.678 6.600 ( -2.790 3.412 4.186) 6.078 6.878 ( 1.145 1.579 -1.461) 2.437 7.032 ( -5.083 -5.333 0.160) 7.369 7.162 ( -2.742 -3.265 2.977) 5.200 7.539 ( 7.781 6.736 -1.071) 10.347 7.676 ( -4.073 -0.224 2.445) 4.755 7.742 ( 3.466 -0.344 0.432) 3.509 7.797 ( 7.213 0.781 -3.837) 8.208 8.637 ( 1.561 -11.584 -1.172) 11.748 9.036 ( 5.471 -3.388 2.098) 6.768 9.343 ( -5.162 -0.065 -1.849) 5.484 9.436 ( -1.024 -2.415 4.928) 5.583 9.663 ( 2.117 -2.609 2.113) 3.969 9.714 ( -0.002 0.898 -6.151) 6.216 9.884 ( 5.514 2.178 8.522) 10.381 10.171 ( 2.855 2.328 -2.194) 4.288 10.322 ( 10.726 -8.992 -3.157) 14.348 10.442 ( 8.660 -10.718 -2.837) 14.068 11.024 ( -11.437 -1.632 0.649) 11.571 11.297 ( -4.665 -1.082 -0.428) 4.808 11.333 ( -6.198 -0.518 3.187) 6.989 11.636 ( -5.210 0.148 -3.949) 6.540 11.719 ( -3.111 -2.826 -1.407) 4.432 12.032 ( -1.531 -2.828 5.002) 5.946 12.088 ( 0.339 1.099 3.640) 3.817 12.132 ( 2.116 -0.854 -0.026) 2.282 12.207 ( 1.858 1.109 3.502) 4.116 12.384 ( 0.728 -4.516 -5.138) 6.879 12.739 ( 4.278 1.574 1.639) 4.843 12.779 ( 4.680 -0.751 0.826) 4.811 13.476 ( 7.243 7.458 -5.537) 11.779 13.524 ( -1.178 4.865 8.649) 9.993 15.034 ( 0.288 3.563 5.426) 6.498 15.182 ( 1.307 -2.419 -2.817) 3.937 15.351 ( -2.053 5.086 -3.181) 6.341 15.440 ( -3.117 1.330 2.563) 4.249 15.619 ( 1.275 2.241 3.430) 4.291 15.739 ( 1.480 2.780 -2.533) 4.042 15.859 ( -1.536 -0.047 1.983) 2.509 15.986 ( 3.636 3.850 -7.194) 8.933 16.326 ( -1.112 4.473 -3.081) 5.544 16.428 ( 3.201 -6.166 -1.570) 7.122 16.557 ( -5.619 -2.185 3.275) 6.861 16.748 ( 7.117 -7.861 2.256) 10.841 17.898 ( -15.717 5.162 -1.173) 16.584 18.515 ( -5.662 5.597 5.378) 9.608 18.649 ( 2.465 -2.516 -4.957) 6.081 18.903 ( 7.871 14.839 -9.121) 19.114 25.880 ( -2.263 -1.624 0.113) 2.788 25.905 ( -1.409 -2.875 -0.994) 3.353 26.050 ( 1.610 -0.337 1.273) 2.080 26.095 ( 2.828 -0.513 3.918) 4.859 26.222 ( -2.470 3.639 3.735) 5.770 26.450 ( 6.576 -5.292 -3.411) 9.104 26.912 ( 0.387 1.332 -0.266) 1.412 26.981 ( 1.170 -1.014 5.065) 5.296 27.325 ( -2.502 1.191 0.252) 2.783 27.528 ( 8.157 -8.046 13.217) 17.492 28.451 ( -3.439 0.116 2.577) 4.299 28.545 ( 0.697 -2.754 -3.453) 4.471 28.835 ( -1.109 -6.870 -0.183) 6.962 28.981 ( 2.152 -1.547 -9.267) 9.639 30.050 ( -7.603 5.927 18.516) 20.875 30.306 ( -6.330 13.683 -31.388) 34.821 ======================= Grid point 228 (112/140) ======================= q-point: (-0.11 -0.33 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.340 ( -9.889 -21.537 9.041) 25.365 1.549 ( -11.739 -20.824 7.560) 25.072 1.885 ( 4.745 -19.294 1.680) 19.940 1.978 ( -16.038 -8.316 12.959) 22.233 2.327 ( -1.340 -4.957 -6.989) 8.672 2.381 ( 0.791 -4.505 -6.692) 8.106 2.565 ( 3.546 -2.946 5.096) 6.872 2.647 ( 3.619 -10.978 0.065) 11.560 2.859 ( 0.482 -6.194 2.359) 6.645 2.980 ( 1.354 -4.816 1.253) 5.157 3.031 ( -0.932 -2.126 0.975) 2.518 3.246 ( 1.528 -6.933 -5.330) 8.877 3.410 ( -0.147 3.920 -2.252) 4.524 3.499 ( -6.354 -7.549 3.794) 10.572 3.730 ( -0.611 1.566 3.504) 3.886 3.886 ( -0.475 5.899 -2.244) 6.329 4.084 ( -3.625 -0.117 1.225) 3.828 4.181 ( 7.399 -1.587 7.676) 10.780 4.304 ( 7.635 0.648 6.139) 9.818 4.375 ( -0.542 -6.953 -7.951) 10.576 4.489 ( 5.097 -4.548 -1.600) 7.016 4.659 ( 0.861 2.646 -6.687) 7.243 4.862 ( -4.298 8.981 7.305) 12.349 5.112 ( 5.174 1.680 -3.875) 6.679 5.334 ( -2.615 -2.010 -9.488) 10.045 5.440 ( -3.096 1.584 -0.905) 3.594 5.568 ( -3.106 -6.895 3.413) 8.297 5.724 ( 6.238 -1.897 -3.381) 7.344 5.868 ( -1.216 7.301 -0.606) 7.426 6.087 ( 0.786 2.544 0.794) 2.779 6.334 ( -3.165 2.109 3.676) 5.289 6.426 ( -0.429 3.499 -2.746) 4.468 6.545 ( -1.524 2.224 2.702) 3.817 6.863 ( -1.291 -0.189 -1.302) 1.843 7.022 ( -8.047 -2.255 2.150) 8.629 7.241 ( 1.556 -1.142 -1.106) 2.224 7.534 ( 10.550 2.499 1.545) 10.951 7.621 ( -4.526 1.992 -0.979) 5.041 7.733 ( 2.160 5.320 0.464) 5.760 7.858 ( 8.573 -2.019 -0.477) 8.820 8.874 ( 1.080 -11.940 1.247) 12.053 9.135 ( 1.464 -3.827 -0.139) 4.100 9.338 ( -0.433 -5.531 -2.265) 5.993 9.447 ( -0.769 0.724 -3.835) 3.978 9.647 ( 0.790 -1.285 -5.011) 5.233 9.807 ( 0.495 -3.519 -2.077) 4.116 9.935 ( 1.966 -0.875 16.168) 16.311 10.122 ( -0.613 3.758 8.041) 8.897 10.449 ( 7.366 -3.249 -0.586) 8.072 10.769 ( 17.086 -9.956 -11.961) 23.111 10.953 ( -8.342 -0.589 -0.538) 8.380 11.270 ( -8.759 1.772 2.058) 9.170 11.304 ( -6.703 -3.334 2.048) 7.762 11.608 ( -3.962 -4.386 -6.851) 9.048 11.768 ( -2.087 -5.761 1.066) 6.220 11.951 ( -3.727 5.755 -2.803) 7.407 12.092 ( 0.551 1.863 5.615) 5.941 12.150 ( 3.042 0.481 -1.653) 3.495 12.373 ( 1.735 -6.727 11.543) 13.473 12.410 ( 1.013 -2.264 -7.740) 8.128 12.739 ( 0.148 1.805 -0.459) 1.869 12.822 ( 3.417 -0.523 -0.429) 3.483 13.381 ( 13.366 10.398 -1.695) 17.019 13.465 ( 3.572 7.983 8.467) 12.173 15.041 ( 1.264 0.540 8.167) 8.282 15.097 ( -3.396 8.259 -2.080) 9.169 15.323 ( 3.360 -5.102 -5.707) 8.360 15.426 ( 1.535 1.553 5.876) 6.268 15.608 ( -2.109 1.204 1.338) 2.773 15.702 ( 1.440 1.480 -1.702) 2.676 15.819 ( -1.966 2.343 1.963) 3.634 15.955 ( 0.775 0.256 -4.898) 4.966 16.223 ( -1.088 3.268 -4.799) 5.907 16.504 ( 0.868 -0.701 -2.391) 2.639 16.597 ( -2.475 -5.187 2.820) 6.402 16.973 ( 10.618 -8.069 2.293) 13.532 17.650 ( -15.082 9.332 -1.326) 17.785 18.301 ( -13.653 13.520 5.667) 20.033 18.651 ( 1.088 4.416 -8.635) 9.760 18.701 ( 2.982 1.045 -5.278) 6.151 25.901 ( -2.030 -2.301 0.757) 3.160 25.945 ( -1.430 -3.474 -1.149) 3.928 26.075 ( 1.280 -0.305 1.606) 2.076 26.117 ( -0.796 1.955 6.457) 6.794 26.199 ( 0.306 -1.314 -0.282) 1.378 26.540 ( 5.822 -1.968 -6.281) 8.787 26.906 ( 1.737 0.504 0.226) 1.822 27.039 ( 2.187 -0.184 8.239) 8.526 27.286 ( -3.181 -1.105 -6.042) 6.917 27.821 ( 17.484 -1.921 18.359) 25.425 28.410 ( -5.471 1.273 -1.501) 5.814 28.602 ( 1.821 -4.759 -4.757) 6.971 28.964 ( 0.069 -8.985 -5.154) 10.359 28.991 ( 1.072 -3.801 -6.867) 7.922 29.863 ( -12.519 10.309 -13.001) 20.785 29.943 ( -8.453 9.046 9.833) 15.811 ======================= Grid point 236 (113/140) ======================= q-point: (-0.22 -0.22 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.760 ( -13.800 -0.000 5.752) 14.951 0.875 ( -20.717 -0.000 9.422) 22.758 1.445 ( 6.539 0.000 3.842) 7.584 1.956 ( -34.810 -0.000 15.999) 38.310 2.124 ( 0.868 0.000 -1.072) 1.380 2.272 ( 3.767 0.000 -6.218) 7.271 2.278 ( 0.763 0.000 3.701) 3.779 2.634 ( 8.268 0.000 10.557) 13.410 2.666 ( -6.420 -0.000 6.665) 9.255 2.871 ( 0.293 0.000 -8.780) 8.785 2.884 ( -0.854 -0.000 2.900) 3.023 3.355 ( -3.079 -0.000 1.730) 3.532 3.397 ( 5.503 0.000 -4.834) 7.325 3.410 ( 0.068 0.000 -8.806) 8.807 3.756 ( -0.086 -0.000 5.273) 5.273 3.935 ( -0.210 -0.000 7.583) 7.586 4.073 ( 1.286 0.000 -3.031) 3.293 4.162 ( 0.084 0.000 0.628) 0.634 4.201 ( 9.298 0.000 -2.907) 9.742 4.324 ( 4.057 0.000 0.215) 4.063 4.466 ( 7.009 0.000 -3.628) 7.893 4.794 ( -3.311 -0.000 -1.208) 3.525 4.982 ( -2.433 -0.000 5.039) 5.596 5.109 ( 4.046 0.000 -3.120) 5.110 5.320 ( -0.187 -0.000 -16.162) 16.163 5.452 ( -7.778 -0.000 12.262) 14.521 5.477 ( -3.247 -0.000 -0.045) 3.248 5.668 ( 2.462 0.000 -4.405) 5.047 6.053 ( 1.324 0.000 0.542) 1.431 6.176 ( 5.613 0.000 4.325) 7.086 6.422 ( -2.382 -0.000 5.987) 6.443 6.478 ( 2.261 0.000 -1.229) 2.574 6.659 ( -2.514 -0.000 7.283) 7.705 6.861 ( -4.004 -0.000 -4.366) 5.924 6.907 ( -5.086 -0.000 -3.027) 5.918 7.121 ( -6.984 -0.000 5.884) 9.132 7.631 ( 7.640 0.000 -3.025) 8.217 7.641 ( -7.452 -0.000 2.736) 7.938 7.801 ( 9.969 0.000 1.152) 10.035 7.819 ( 4.749 0.000 -6.677) 8.194 8.540 ( 3.570 0.000 -0.421) 3.595 9.039 ( 0.691 0.000 0.008) 0.691 9.284 ( -6.348 -0.000 -6.823) 9.319 9.441 ( 1.287 0.000 0.701) 1.465 9.671 ( 0.835 0.000 4.435) 4.513 9.714 ( 5.687 0.000 -13.191) 14.365 10.086 ( 10.314 0.000 -3.537) 10.904 10.119 ( 16.428 0.000 15.428) 22.537 10.338 ( 5.332 0.000 5.333) 7.541 10.387 ( -1.114 -0.000 4.654) 4.786 10.933 ( -9.361 -0.000 1.790) 9.530 11.248 ( -2.920 -0.000 -1.997) 3.538 11.311 ( -5.585 -0.000 5.546) 7.871 11.595 ( -7.368 -0.000 -10.157) 12.548 11.607 ( -7.624 -0.000 5.297) 9.283 12.038 ( -2.151 -0.000 6.163) 6.527 12.117 ( 3.451 0.000 -0.755) 3.533 12.139 ( -0.225 -0.000 4.739) 4.744 12.282 ( 5.940 0.000 10.364) 11.946 12.315 ( 0.975 0.000 -7.378) 7.443 12.786 ( 5.328 0.000 -1.954) 5.675 12.801 ( 0.093 0.000 1.319) 1.322 13.572 ( -7.078 -0.000 13.127) 14.913 13.623 ( 17.823 0.000 -4.596) 18.407 15.120 ( -0.770 -0.000 -2.908) 3.009 15.132 ( 5.275 0.000 4.453) 6.903 15.384 ( -3.158 -0.000 -5.572) 6.405 15.407 ( -4.720 -0.000 6.603) 8.116 15.643 ( -4.506 -0.000 -1.137) 4.647 15.804 ( 4.310 0.000 -3.276) 5.414 15.806 ( -0.677 -0.000 2.521) 2.610 16.106 ( 9.113 0.000 -7.242) 11.640 16.346 ( -0.601 -0.000 1.477) 1.595 16.375 ( 1.294 0.000 -3.110) 3.368 16.488 ( -7.229 -0.000 1.673) 7.420 16.730 ( 8.158 0.000 1.184) 8.243 17.812 ( -14.682 -0.000 -2.295) 14.860 18.554 ( -5.549 -0.000 4.809) 7.342 18.613 ( 3.930 0.000 -6.349) 7.467 19.023 ( -0.546 -0.000 -21.482) 21.488 25.852 ( -1.791 -0.000 0.827) 1.972 25.865 ( -0.990 -0.000 -0.527) 1.122 26.066 ( 1.529 0.000 1.409) 2.079 26.120 ( 2.377 0.000 1.352) 2.735 26.337 ( 1.332 0.000 5.568) 5.725 26.371 ( 2.723 0.000 -1.610) 3.163 26.931 ( 0.920 0.000 -0.803) 1.222 26.975 ( -1.043 -0.000 1.211) 1.598 27.370 ( 1.569 0.000 -2.795) 3.205 27.611 ( 16.120 0.000 34.390) 37.981 28.436 ( -3.944 -0.000 1.874) 4.367 28.516 ( 1.000 0.000 -2.958) 3.123 28.752 ( -2.239 -0.000 -2.342) 3.240 28.941 ( 3.198 0.000 -9.939) 10.441 30.122 ( -9.934 -0.000 16.992) 19.683 30.169 ( -15.870 -0.000 -41.362) 44.302 ======================= Grid point 237 (114/140) ======================= q-point: (-0.11 -0.22 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.014 ( -7.612 -17.402 19.355) 27.118 1.062 ( -3.141 -29.372 15.408) 33.317 1.644 ( 0.457 -14.692 8.451) 16.955 1.770 ( -28.301 -1.812 18.350) 33.778 2.189 ( 4.189 -6.712 -11.309) 13.802 2.312 ( 1.482 -2.509 -4.228) 5.135 2.410 ( 2.712 -13.134 -1.830) 13.535 2.630 ( -2.766 1.155 8.361) 8.882 2.772 ( 0.643 -4.332 6.990) 8.248 2.907 ( -2.135 -5.897 -1.742) 6.509 2.933 ( 2.327 -5.621 1.005) 6.166 3.248 ( -1.880 6.057 -3.545) 7.266 3.376 ( -2.258 -1.824 -2.398) 3.765 3.439 ( 2.619 -0.898 -5.714) 6.349 3.771 ( -1.414 0.972 7.410) 7.606 3.966 ( -0.369 3.096 -0.740) 3.204 4.040 ( -2.258 -1.804 -1.078) 3.085 4.190 ( 2.581 -1.300 1.676) 3.341 4.307 ( 8.550 -3.091 -3.071) 9.596 4.371 ( 5.197 -2.017 0.443) 5.593 4.498 ( 6.869 0.902 -0.087) 6.928 4.700 ( -0.931 5.191 -3.964) 6.598 4.966 ( -5.090 2.895 5.950) 8.349 5.135 ( -0.745 -2.359 -0.961) 2.654 5.249 ( 4.032 2.288 -13.666) 14.431 5.437 ( -7.196 -0.439 2.732) 7.710 5.447 ( -4.260 -2.033 0.421) 4.739 5.694 ( 3.696 -3.163 -5.485) 7.331 6.011 ( 1.732 7.196 1.944) 7.653 6.189 ( 4.723 5.520 2.605) 7.718 6.379 ( -0.393 3.292 2.861) 4.379 6.490 ( 1.351 3.637 2.573) 4.656 6.579 ( -5.018 3.519 3.303) 6.962 6.853 ( -1.743 0.591 -1.746) 2.536 6.923 ( -8.201 -4.401 4.085) 10.164 7.147 ( -0.596 -6.766 -0.760) 6.835 7.587 ( -6.843 0.116 -1.079) 6.928 7.710 ( 13.268 2.140 2.419) 13.655 7.807 ( 2.939 1.845 -6.722) 7.565 7.863 ( 6.243 -1.095 0.443) 6.354 8.687 ( 2.648 -11.351 1.481) 11.750 9.061 ( -0.516 -3.871 -3.343) 5.141 9.211 ( -3.160 -3.190 -7.299) 8.569 9.442 ( -1.018 -1.072 -3.208) 3.532 9.659 ( 4.037 4.351 -4.155) 7.245 9.735 ( -0.378 -4.801 1.178) 4.958 10.066 ( 5.848 4.976 9.930) 12.552 10.293 ( 5.352 6.671 10.069) 13.211 10.457 ( 5.442 -2.573 2.832) 6.653 10.605 ( 16.596 -17.769 -5.625) 24.956 10.889 ( -6.202 -0.545 2.217) 6.609 11.227 ( -3.654 -1.101 -0.869) 3.915 11.271 ( -6.239 3.120 4.668) 8.393 11.486 ( -4.926 -1.436 -6.437) 8.231 11.644 ( -6.054 -5.649 4.718) 9.530 11.990 ( -3.972 3.397 -1.691) 5.493 12.138 ( 2.092 0.815 0.730) 2.361 12.165 ( 0.111 -1.084 1.764) 2.073 12.284 ( -2.066 -1.154 -5.077) 5.601 12.466 ( 12.611 -2.469 13.495) 18.635 12.759 ( -3.502 2.282 -3.349) 5.356 12.838 ( 6.088 -1.101 -0.516) 6.208 13.545 ( -4.807 3.872 12.634) 14.061 13.729 ( 23.187 6.086 -0.521) 23.978 15.106 ( 1.143 0.662 1.960) 2.364 15.199 ( 3.592 2.464 2.553) 5.049 15.271 ( -1.941 3.014 -4.172) 5.501 15.452 ( -0.045 -2.906 5.415) 6.146 15.561 ( -9.856 -0.456 -2.966) 10.303 15.766 ( 3.376 3.789 -0.107) 5.076 15.879 ( 1.925 -0.179 3.460) 3.963 15.991 ( 4.385 8.943 -5.247) 11.258 16.253 ( -2.549 4.884 -5.155) 7.545 16.465 ( 1.336 -3.555 -3.872) 5.424 16.503 ( -2.055 -5.453 4.487) 7.355 16.906 ( 9.893 -9.705 1.069) 13.900 17.653 ( -11.623 4.980 -3.498) 13.120 18.426 ( -16.905 11.916 5.112) 21.306 18.631 ( 2.167 -0.802 -8.156) 8.477 18.727 ( -9.490 5.963 -17.444) 20.734 25.859 ( -1.227 -1.475 1.368) 2.356 25.881 ( -0.677 -2.434 -0.561) 2.588 26.087 ( 1.207 -0.380 1.567) 2.015 26.158 ( 1.265 -2.234 0.055) 2.568 26.232 ( -1.557 7.100 6.994) 10.087 26.496 ( 4.066 -4.590 -5.005) 7.915 26.918 ( 0.349 0.540 -2.052) 2.151 27.014 ( -1.381 -4.918 -1.245) 5.258 27.320 ( 2.202 5.606 3.933) 7.194 28.073 ( 32.723 -4.747 28.790) 43.843 28.380 ( -6.358 2.586 -3.058) 7.514 28.531 ( 2.390 -3.074 -2.479) 4.616 28.788 ( -0.750 -7.002 -3.268) 7.763 28.936 ( 4.089 -1.495 -8.019) 9.124 29.735 ( -27.076 4.403 -27.826) 39.074 30.060 ( -11.932 5.817 12.998) 18.578 ======================= Grid point 246 (115/140) ======================= q-point: (-0.11 -0.11 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.770 ( -2.033 -0.000 21.993) 22.087 1.047 ( 5.603 0.000 36.908) 37.330 1.510 ( -22.199 -0.000 24.444) 33.020 1.686 ( -5.415 -0.000 10.788) 12.071 2.088 ( 3.596 0.000 -10.673) 11.263 2.260 ( 0.212 0.000 -8.374) 8.377 2.322 ( 6.259 0.000 -2.920) 6.907 2.640 ( -7.566 -0.000 8.065) 11.058 2.783 ( 0.079 0.000 -5.845) 5.846 2.803 ( -0.661 -0.000 8.186) 8.213 2.934 ( 0.894 0.000 7.781) 7.832 3.252 ( -6.367 -0.000 -6.050) 8.783 3.327 ( 2.129 0.000 -10.308) 10.525 3.425 ( 2.770 0.000 -4.455) 5.246 3.807 ( -2.756 -0.000 9.726) 10.109 3.975 ( -1.532 -0.000 2.597) 3.015 4.004 ( -1.018 -0.000 -5.569) 5.661 4.248 ( 4.256 0.000 1.966) 4.689 4.312 ( 8.721 0.000 -5.910) 10.535 4.367 ( 3.576 0.000 -1.281) 3.799 4.584 ( 9.072 0.000 2.208) 9.336 4.717 ( -3.877 -0.000 -4.409) 5.871 4.968 ( -5.731 -0.000 4.124) 7.061 5.085 ( 1.076 0.000 1.251) 1.651 5.276 ( 6.508 0.000 -9.164) 11.240 5.362 ( -10.079 -0.000 -0.327) 10.084 5.407 ( -5.318 -0.000 -2.129) 5.729 5.649 ( 1.481 0.000 -6.466) 6.633 6.107 ( 2.538 0.000 3.588) 4.395 6.298 ( 7.996 0.000 -0.734) 8.029 6.441 ( -2.546 -0.000 5.430) 5.997 6.552 ( 0.346 0.000 0.477) 0.589 6.677 ( -4.759 -0.000 6.887) 8.371 6.746 ( -1.637 -0.000 -2.756) 3.205 6.883 ( 5.808 0.000 3.307) 6.683 7.060 ( -8.233 -0.000 5.923) 10.142 7.522 ( -6.406 -0.000 -1.697) 6.627 7.761 ( -1.246 -0.000 -7.614) 7.716 7.840 ( 14.800 0.000 2.032) 14.939 7.951 ( 6.719 0.000 1.530) 6.891 8.604 ( 1.855 0.000 1.901) 2.656 8.990 ( -2.480 -0.000 -4.728) 5.339 9.120 ( -3.525 -0.000 -6.684) 7.556 9.382 ( -3.176 -0.000 -7.983) 8.592 9.680 ( -1.907 -0.000 1.411) 2.372 9.726 ( 4.918 0.000 -5.092) 7.080 10.251 ( 14.006 0.000 -0.634) 14.020 10.424 ( 1.026 0.000 4.257) 4.379 10.478 ( 2.110 0.000 6.647) 6.974 10.531 ( 9.173 0.000 9.145) 12.952 10.868 ( -1.954 -0.000 4.301) 4.724 11.195 ( -1.952 -0.000 -3.023) 3.598 11.300 ( -3.629 -0.000 7.241) 8.099 11.424 ( 4.056 0.000 -7.265) 8.320 11.581 ( -5.450 -0.000 9.117) 10.622 11.976 ( -4.225 -0.000 -2.352) 4.836 12.153 ( -0.106 -0.000 -0.050) 0.117 12.165 ( -1.114 -0.000 2.688) 2.910 12.240 ( 3.600 0.000 -9.724) 10.369 12.626 ( 8.910 0.000 12.604) 15.435 12.728 ( -2.320 -0.000 -1.894) 2.995 12.883 ( 7.723 0.000 0.157) 7.725 13.591 ( -9.666 -0.000 17.353) 19.864 13.990 ( 29.974 0.000 -4.261) 30.275 15.092 ( 0.661 0.000 -1.910) 2.021 15.272 ( 2.813 0.000 -1.582) 3.227 15.310 ( -2.955 -0.000 -2.078) 3.613 15.378 ( -5.242 -0.000 3.146) 6.114 15.489 ( -3.250 -0.000 4.089) 5.223 15.825 ( 2.773 0.000 -3.816) 4.717 15.915 ( 5.510 0.000 7.090) 8.979 16.154 ( 4.452 0.000 -5.563) 7.125 16.287 ( -5.850 -0.000 -4.944) 7.659 16.365 ( 3.111 0.000 -5.503) 6.321 16.472 ( 3.837 0.000 6.795) 7.804 16.869 ( 5.266 0.000 1.378) 5.443 17.612 ( -3.493 -0.000 -5.116) 6.195 18.406 ( -44.490 -0.000 -24.199) 50.645 18.498 ( -7.834 -0.000 5.575) 9.615 18.628 ( 4.864 0.000 -5.884) 7.635 25.850 ( -0.316 -0.000 1.886) 1.912 25.854 ( -0.075 -0.000 0.005) 0.075 26.098 ( 0.837 0.000 1.039) 1.335 26.133 ( -1.076 -0.000 -1.047) 1.502 26.370 ( -1.018 -0.000 2.623) 2.814 26.427 ( 4.174 0.000 1.880) 4.578 26.913 ( -4.461 -0.000 -3.993) 5.987 26.918 ( -0.598 -0.000 -3.009) 3.068 27.436 ( 5.371 0.000 4.469) 6.987 28.278 ( 0.599 0.000 -4.352) 4.393 28.505 ( 1.545 0.000 -3.086) 3.451 28.513 ( 19.264 0.000 10.907) 22.137 28.790 ( 26.152 0.000 16.504) 30.924 28.923 ( 6.477 0.000 -8.146) 10.407 29.339 ( -42.038 -0.000 -21.365) 47.156 30.061 ( -15.557 -0.000 10.235) 18.622 ======================= Grid point 247 (116/140) ======================= q-point: ( 0.00 0.00 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 70 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.507 ( -5.847 -0.000 -17.733) 18.672 1.507 ( 5.847 0.000 17.733) 18.672 1.722 ( 19.263 0.000 -21.184) 28.633 1.722 ( -19.263 -0.000 21.184) 28.633 2.151 ( -9.206 -0.000 -8.454) 12.499 2.151 ( 9.206 0.000 8.454) 12.499 2.587 ( -13.183 -0.000 -25.009) 28.271 2.587 ( 13.183 0.000 25.009) 28.271 2.703 ( 7.825 0.000 -6.939) 10.459 2.703 ( -7.825 -0.000 6.939) 10.459 3.059 ( 5.810 0.000 -11.671) 13.037 3.059 ( -5.810 -0.000 11.671) 13.037 3.272 ( -2.427 -0.000 -8.690) 9.022 3.272 ( 2.427 0.000 8.690) 9.022 3.862 ( -0.256 -0.000 -1.014) 1.046 3.862 ( 0.256 0.000 1.014) 1.046 4.108 ( 4.576 0.000 -12.606) 13.411 4.108 ( -4.576 -0.000 12.606) 13.411 4.346 ( -3.541 -0.000 -0.783) 3.627 4.346 ( 3.541 0.000 0.783) 3.627 4.806 ( -12.386 -0.000 -4.592) 13.210 4.806 ( 12.386 0.000 4.592) 13.210 4.972 ( -3.138 -0.000 -13.071) 13.442 4.972 ( 3.138 0.000 13.071) 13.442 5.224 ( 1.188 0.000 -0.736) 1.397 5.224 ( -1.188 -0.000 0.736) 1.397 5.409 ( -3.474 -0.000 -7.323) 8.105 5.409 ( 3.474 0.000 7.323) 8.105 6.296 ( 3.023 0.000 -7.011) 7.635 6.296 ( -3.023 -0.000 7.011) 7.635 6.524 ( 3.095 0.000 -2.894) 4.237 6.524 ( -3.095 -0.000 2.894) 4.237 6.673 ( -4.364 -0.000 -0.032) 4.364 6.673 ( 4.364 0.000 0.032) 4.364 7.072 ( 11.446 0.000 -3.906) 12.094 7.072 ( -11.446 -0.000 3.906) 12.094 7.498 ( -2.010 -0.000 -4.631) 5.048 7.498 ( 2.010 0.000 4.631) 5.048 8.041 ( -1.593 -0.000 0.492) 1.667 8.041 ( 1.593 0.000 -0.492) 1.667 8.763 ( -3.119 -0.000 -6.341) 7.066 8.763 ( 3.119 0.000 6.341) 7.066 9.073 ( -1.167 -0.000 -5.490) 5.612 9.073 ( 1.167 0.000 5.490) 5.612 9.709 ( -1.399 -0.000 -0.255) 1.422 9.709 ( 1.399 0.000 0.255) 1.422 10.455 ( -10.799 -0.000 0.964) 10.842 10.455 ( 10.799 0.000 -0.964) 10.842 10.616 ( -4.028 -0.000 0.244) 4.035 10.616 ( 4.028 0.000 -0.244) 4.035 11.040 ( -1.261 -0.000 -5.049) 5.205 11.040 ( 1.261 0.000 5.049) 5.205 11.393 ( 9.549 0.000 -4.927) 10.745 11.393 ( -9.549 -0.000 4.927) 10.745 11.792 ( 3.507 0.000 -9.086) 9.740 11.792 ( -3.507 -0.000 9.086) 9.740 12.160 ( -4.144 -0.000 -0.628) 4.192 12.160 ( 4.144 0.000 0.628) 4.192 12.311 ( -6.496 -0.000 -7.403) 9.849 12.311 ( 6.496 0.000 7.403) 9.849 12.971 ( 5.408 0.000 -3.667) 6.534 12.971 ( -5.408 -0.000 3.667) 6.534 13.951 ( 11.356 0.000 -16.438) 19.979 13.951 ( -11.356 -0.000 16.438) 19.979 15.101 ( -6.997 -0.000 0.722) 7.035 15.101 ( 6.997 0.000 -0.722) 7.035 15.320 ( -6.537 -0.000 0.189) 6.540 15.320 ( 6.537 0.000 -0.189) 6.540 15.736 ( -3.419 -0.000 -2.633) 4.315 15.736 ( 3.419 0.000 2.633) 4.315 16.097 ( 7.521 0.000 -2.672) 7.982 16.097 ( -7.521 -0.000 2.672) 7.982 16.198 ( -1.982 -0.000 -6.383) 6.684 16.198 ( 1.982 0.000 6.383) 6.684 16.807 ( -14.464 -0.000 -1.996) 14.601 16.807 ( 14.464 0.000 1.996) 14.601 17.616 ( -27.013 -0.000 4.115) 27.325 17.616 ( 27.013 0.000 -4.115) 27.325 18.550 ( 7.434 0.000 -6.081) 9.604 18.550 ( -7.434 -0.000 6.081) 9.604 25.872 ( -0.690 -0.000 -0.364) 0.781 25.872 ( 0.690 0.000 0.364) 0.781 26.102 ( 1.220 0.000 -1.164) 1.686 26.102 ( -1.220 -0.000 1.164) 1.686 26.508 ( 0.876 0.000 -4.494) 4.578 26.508 ( -0.876 -0.000 4.494) 4.578 26.780 ( 0.809 0.000 -3.329) 3.426 26.780 ( -0.809 -0.000 3.329) 3.426 27.808 ( -9.704 -0.000 -11.433) 14.996 27.808 ( 9.704 0.000 11.433) 14.996 28.483 ( -3.306 -0.000 -0.069) 3.307 28.483 ( 3.306 0.000 0.069) 3.307 28.866 ( 17.016 0.000 -7.328) 18.527 28.866 ( -17.016 -0.000 7.328) 18.527 29.832 ( -34.578 -0.000 -1.039) 34.593 29.832 ( 34.578 0.000 1.039) 34.593 ======================= Grid point 249 (117/140) ======================= q-point: ( 0.11 0.00 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.488 ( -3.421 -12.869 -18.375) 22.693 1.640 ( 0.396 -4.436 5.035) 6.722 1.785 ( -3.617 -7.179 12.139) 14.559 1.882 ( 16.278 -7.137 -1.082) 17.806 2.106 ( -9.594 -9.149 -9.921) 16.558 2.293 ( 1.956 -7.058 -0.977) 7.388 2.443 ( -4.124 -7.987 -20.159) 22.072 2.733 ( -2.864 -8.942 -0.175) 9.391 2.774 ( 3.665 -4.217 6.776) 8.782 2.900 ( 8.302 -7.275 11.928) 16.252 3.046 ( 4.195 0.151 -11.186) 11.947 3.085 ( -5.448 -1.787 12.354) 13.619 3.205 ( -1.199 -0.260 -8.703) 8.789 3.325 ( 3.866 0.019 6.448) 7.518 3.859 ( -3.230 -0.194 2.798) 4.278 3.888 ( 1.135 -1.541 2.605) 3.232 4.037 ( 0.032 4.677 -5.815) 7.462 4.099 ( 1.888 3.472 3.773) 5.464 4.334 ( -6.360 -2.101 4.460) 8.047 4.395 ( 4.142 -2.235 -1.864) 5.062 4.668 ( -9.492 2.919 -3.511) 10.533 4.863 ( -4.289 -0.123 -7.749) 8.858 4.898 ( 9.263 3.957 -0.629) 10.092 5.026 ( -1.741 1.781 8.823) 9.168 5.221 ( -0.993 -0.902 -0.247) 1.364 5.267 ( 4.068 -1.846 2.371) 5.057 5.390 ( -0.109 -3.918 -6.094) 7.246 5.511 ( 3.758 -3.789 7.087) 8.872 6.184 ( -0.706 8.686 -6.791) 11.048 6.217 ( -3.890 8.017 4.804) 10.123 6.476 ( 0.916 4.567 -0.997) 4.763 6.494 ( 1.621 3.411 0.208) 3.782 6.652 ( -5.856 -1.377 -2.743) 6.611 6.793 ( 6.760 -5.346 1.683) 8.781 7.002 ( -4.312 0.287 1.148) 4.471 7.085 ( 6.946 5.286 -2.834) 9.177 7.481 ( 0.503 -0.509 -1.965) 2.091 7.544 ( 1.549 0.050 6.882) 7.054 7.963 ( -8.501 4.477 0.412) 9.617 8.006 ( -1.613 2.000 -2.076) 3.303 8.791 ( -1.273 -8.095 -4.867) 9.530 8.878 ( 2.288 -6.960 5.422) 9.114 9.110 ( -0.729 -6.803 -2.210) 7.190 9.173 ( 1.216 -6.143 7.782) 9.989 9.715 ( -2.504 -1.251 0.183) 2.805 9.728 ( -1.610 -1.591 -0.477) 2.314 10.363 ( -9.213 -0.951 -2.403) 9.569 10.473 ( 0.804 2.601 1.146) 2.954 10.579 ( -4.455 1.240 -0.236) 4.630 10.708 ( 12.571 -2.672 -4.163) 13.509 11.012 ( -0.895 -1.045 -5.816) 5.976 11.085 ( 1.703 -1.571 4.634) 5.181 11.308 ( -10.697 2.431 2.387) 11.226 11.423 ( 6.370 0.437 -3.985) 7.527 11.786 ( 3.698 0.142 -5.066) 6.273 11.816 ( 1.661 0.184 4.093) 4.421 12.146 ( -3.567 -1.810 0.436) 4.024 12.211 ( 1.606 -0.668 -2.253) 2.846 12.220 ( -1.091 0.612 -4.191) 4.373 12.385 ( 7.658 2.753 9.561) 12.555 12.902 ( -5.611 3.690 -0.930) 6.779 12.944 ( 0.188 3.293 -3.011) 4.466 13.864 ( -13.335 5.322 6.598) 15.802 13.905 ( 1.443 4.256 -7.185) 8.475 15.091 ( -5.112 -2.008 2.754) 6.144 15.176 ( 5.985 0.507 -0.676) 6.044 15.273 ( -0.412 0.077 -0.955) 1.043 15.352 ( 7.146 1.146 1.008) 7.307 15.687 ( -4.842 -0.712 -2.761) 5.619 15.751 ( 2.137 1.367 -0.219) 2.546 15.942 ( -6.411 8.079 2.190) 10.543 16.024 ( 4.682 8.851 0.999) 10.063 16.180 ( -10.072 -2.445 -2.491) 10.660 16.324 ( 5.154 -4.491 2.348) 7.228 16.716 ( -11.740 -3.617 -4.860) 13.211 16.954 ( 6.662 -5.566 2.683) 9.086 17.470 ( -12.512 2.036 5.456) 13.801 17.826 ( 30.378 2.414 0.721) 30.483 18.528 ( -6.530 -0.544 5.286) 8.419 18.585 ( 6.756 -0.682 -4.663) 8.237 25.877 ( -0.733 -1.361 0.002) 1.546 25.888 ( 0.812 -1.106 -0.586) 1.492 26.114 ( -1.093 -1.656 0.859) 2.162 26.126 ( 1.155 -2.023 -0.065) 2.331 26.468 ( -1.099 1.861 -6.537) 6.885 26.504 ( -1.653 0.432 0.962) 1.961 26.784 ( 1.782 -0.113 1.128) 2.112 26.811 ( 2.043 -0.610 5.514) 5.912 27.666 ( -8.403 1.807 -10.733) 13.751 27.927 ( 10.149 2.488 12.367) 16.191 28.477 ( -2.160 -1.961 -1.121) 3.125 28.523 ( -0.005 -1.812 3.766) 4.179 28.840 ( -12.356 -6.219 5.362) 14.836 29.046 ( 17.933 -6.806 -0.535) 19.189 29.484 ( -34.368 4.567 -8.610) 35.723 30.008 ( 28.444 7.504 -3.537) 29.629 ======================= Grid point 250 (118/140) ======================= q-point: ( 0.22 0.00 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.667 ( 0.711 -16.677 -10.353) 19.642 1.755 ( 2.509 -6.633 -0.492) 7.109 1.965 ( 3.569 -7.266 6.804) 10.575 2.105 ( 11.612 -5.775 0.333) 12.973 2.182 ( -9.609 -12.340 -6.083) 16.781 2.379 ( -6.264 -13.810 -19.315) 24.556 2.607 ( 7.068 -9.932 0.539) 12.202 2.859 ( -5.086 -5.773 -7.344) 10.636 2.906 ( 1.225 -1.321 8.606) 8.792 2.968 ( -2.587 -3.562 -5.149) 6.774 3.046 ( -0.681 -4.026 1.667) 4.410 3.179 ( -0.784 -4.224 3.245) 5.384 3.229 ( -1.742 -4.346 3.854) 6.065 3.473 ( 13.125 -8.268 1.607) 15.596 3.819 ( -4.175 4.284 4.016) 7.205 3.860 ( 0.584 6.489 -3.486) 7.389 4.015 ( -1.257 -4.223 4.923) 6.606 4.111 ( 5.719 -2.193 0.035) 6.125 4.353 ( -6.340 -1.089 9.832) 11.749 4.426 ( 2.665 0.878 -3.984) 4.873 4.579 ( -4.470 -2.401 -3.574) 6.207 4.747 ( -9.332 2.090 -7.580) 12.203 4.889 ( 10.797 6.814 -1.132) 12.817 4.996 ( -3.196 2.015 5.232) 6.454 5.237 ( -1.463 -2.618 0.038) 3.000 5.323 ( 6.968 1.825 0.268) 7.208 5.508 ( 0.462 -10.175 -0.181) 10.187 5.637 ( 0.140 -4.912 5.836) 7.629 5.969 ( -2.911 9.485 -4.564) 10.921 6.084 ( -0.078 6.887 2.941) 7.489 6.388 ( 2.492 5.533 -2.957) 6.751 6.440 ( -2.190 3.309 0.119) 3.970 6.625 ( -4.630 -2.490 -2.941) 6.024 6.845 ( 1.455 2.029 -3.891) 4.623 7.022 ( 2.897 1.999 -0.579) 3.567 7.075 ( 5.423 -2.250 6.611) 8.841 7.475 ( 1.203 2.591 1.873) 3.416 7.577 ( 2.183 1.632 5.847) 6.452 7.811 ( -9.651 3.595 0.200) 10.301 7.946 ( -1.038 2.733 -2.208) 3.664 8.912 ( -1.280 -7.952 -1.628) 8.217 9.080 ( 0.019 -12.719 2.491) 12.961 9.231 ( -0.494 -7.418 1.745) 7.636 9.360 ( -0.251 -10.218 5.672) 11.689 9.654 ( -5.816 2.717 -1.835) 6.677 9.721 ( -2.072 2.161 1.939) 3.566 10.345 ( -3.694 -4.085 -5.237) 7.600 10.400 ( -5.084 3.903 -1.916) 6.690 10.520 ( -5.317 0.838 1.662) 5.633 10.792 ( 8.940 0.278 -7.028) 11.375 11.021 ( 1.744 -3.574 -5.544) 6.822 11.146 ( -3.530 -0.617 1.417) 3.854 11.240 ( 2.546 -1.900 2.164) 3.844 11.461 ( 3.799 -2.116 -0.931) 4.448 11.785 ( 2.378 1.575 1.057) 3.042 11.861 ( 5.352 -1.668 -2.676) 6.212 12.133 ( -4.952 1.180 0.568) 5.123 12.169 ( -0.307 -1.323 1.274) 1.862 12.274 ( 5.602 -1.605 -5.017) 7.689 12.436 ( 7.692 4.104 10.771) 13.857 12.753 ( -3.921 6.363 -6.635) 9.994 12.869 ( -2.790 3.341 1.353) 4.558 13.651 ( -17.371 8.051 3.341) 19.435 13.759 ( -1.470 8.483 -7.614) 11.493 15.039 ( -1.906 5.168 0.142) 5.511 15.184 ( 4.504 0.598 -0.711) 4.599 15.256 ( -3.816 0.335 2.929) 4.822 15.467 ( 10.163 -2.670 0.600) 10.525 15.673 ( -5.241 -2.708 -1.761) 6.156 15.734 ( 0.709 0.432 -3.913) 4.000 15.811 ( -2.674 3.358 1.818) 4.662 15.925 ( 0.385 5.645 1.343) 5.815 16.112 ( -9.318 -0.474 0.642) 9.352 16.418 ( 2.965 -1.740 1.727) 3.847 16.698 ( -4.348 -3.840 -4.142) 7.128 17.101 ( -2.664 -7.478 4.581) 9.165 17.383 ( 1.264 6.215 3.652) 7.319 17.970 ( 23.085 6.733 2.236) 24.151 18.521 ( -5.086 -1.308 4.347) 6.818 18.628 ( 5.108 -0.899 -2.860) 5.923 25.906 ( -0.322 -2.214 0.814) 2.380 25.915 ( 1.169 -1.783 -1.269) 2.481 26.138 ( -1.169 -1.672 -0.490) 2.098 26.173 ( 0.096 -2.072 1.197) 2.395 26.363 ( -2.203 3.900 -8.669) 9.758 26.496 ( -0.567 -0.389 0.166) 0.708 26.824 ( 1.593 -1.311 3.720) 4.254 26.882 ( 3.538 -1.003 8.679) 9.426 27.517 ( -6.144 2.463 -11.373) 13.159 27.983 ( 9.196 7.229 11.577) 16.457 28.474 ( -4.652 -1.272 -4.556) 6.634 28.579 ( -5.191 -3.951 6.603) 9.282 28.923 ( -7.303 -10.496 1.384) 12.862 29.141 ( -22.119 1.435 -10.939) 24.718 29.323 ( 13.848 -7.921 5.825) 16.984 30.005 ( 20.950 12.563 -4.969) 24.929 ======================= Grid point 251 (119/140) ======================= q-point: ( 0.33 0.00 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.879 ( 4.361 -5.127 -2.325) 7.121 1.923 ( 2.216 -15.784 -6.835) 17.342 2.123 ( 1.927 -3.768 8.237) 9.260 2.234 ( 5.069 -5.211 -5.313) 9.004 2.341 ( -1.495 -11.444 -0.154) 11.542 2.467 ( -2.837 -9.111 -12.563) 15.776 2.743 ( -6.601 2.931 -8.573) 11.210 2.782 ( 4.247 -3.652 -0.703) 5.645 2.914 ( -1.725 0.272 3.503) 3.914 3.043 ( -1.029 -2.513 -0.342) 2.737 3.117 ( 0.462 -0.034 4.601) 4.624 3.259 ( -3.687 -7.389 0.197) 8.260 3.365 ( -1.889 -10.748 4.371) 11.756 3.606 ( 2.158 6.611 -1.013) 7.028 3.767 ( -3.690 2.179 3.333) 5.429 3.827 ( 10.807 -6.513 -5.040) 13.588 4.040 ( -2.537 0.170 3.075) 3.990 4.282 ( 6.302 -7.935 3.259) 10.644 4.373 ( -0.253 0.327 10.325) 10.334 4.414 ( -0.254 -0.464 -4.130) 4.164 4.566 ( -5.885 1.743 -3.443) 7.037 4.622 ( -3.724 -2.429 -7.322) 8.566 4.842 ( 8.056 4.948 -4.609) 10.517 4.961 ( -5.968 2.098 7.046) 9.469 5.298 ( -0.434 -2.738 -0.367) 2.796 5.314 ( 5.281 2.664 0.350) 5.925 5.650 ( -1.166 -3.775 0.619) 3.999 5.708 ( -0.399 -2.119 1.453) 2.600 5.874 ( -2.586 -3.495 0.690) 4.402 6.029 ( 3.086 2.467 1.689) 4.296 6.311 ( 2.387 4.798 -1.650) 5.607 6.372 ( -3.397 0.211 -1.041) 3.559 6.589 ( -4.609 1.282 -3.934) 6.194 6.830 ( 4.597 -0.534 -1.407) 4.838 7.023 ( -0.203 2.231 7.431) 7.762 7.139 ( 1.729 0.945 -0.999) 2.208 7.456 ( -1.533 0.850 7.120) 7.332 7.575 ( 3.727 2.909 -0.538) 4.758 7.714 ( -2.458 2.596 -1.520) 3.885 7.888 ( -0.805 1.843 1.217) 2.351 9.008 ( -2.429 -5.478 0.302) 6.000 9.280 ( -3.999 -10.257 -0.453) 11.018 9.328 ( 1.571 2.055 2.478) 3.582 9.436 ( -4.732 -3.485 -1.489) 6.063 9.632 ( -3.356 3.051 0.607) 4.576 9.716 ( 0.971 -10.019 6.065) 11.752 10.245 ( -4.493 5.158 -6.394) 9.363 10.368 ( -1.819 -3.020 -5.908) 6.880 10.475 ( -6.558 1.696 3.699) 7.718 10.788 ( 2.953 0.647 -6.262) 6.954 11.092 ( -0.354 -5.883 -6.869) 9.051 11.111 ( 4.777 3.232 1.276) 5.907 11.381 ( 7.400 -6.219 1.757) 9.825 11.548 ( 1.987 -4.235 2.782) 5.442 11.788 ( 2.031 0.948 2.262) 3.185 11.908 ( 1.315 -1.725 -2.771) 3.519 12.094 ( -2.878 -0.061 -0.628) 2.947 12.220 ( 2.989 -1.750 5.510) 6.508 12.297 ( 3.851 0.256 -6.565) 7.616 12.477 ( 6.726 3.206 9.527) 12.094 12.611 ( -0.926 3.605 -4.423) 5.780 12.800 ( -1.169 3.871 1.547) 4.330 13.363 ( -18.006 10.026 -0.479) 20.614 13.545 ( -2.979 9.173 -6.991) 11.912 14.965 ( 0.350 1.692 -1.072) 2.034 15.202 ( 3.769 0.067 -1.433) 4.033 15.265 ( -2.890 -1.766 4.838) 5.906 15.513 ( 3.878 5.406 1.317) 6.783 15.659 ( -7.092 -3.072 -4.847) 9.123 15.688 ( -0.177 0.762 -3.709) 3.791 15.816 ( 1.827 -0.999 1.348) 2.481 15.868 ( -0.646 1.505 1.152) 2.002 16.088 ( -3.427 -1.375 3.449) 5.052 16.456 ( 0.707 -0.369 1.234) 1.469 16.717 ( -1.349 -2.474 -2.137) 3.536 17.200 ( -13.332 -8.606 3.270) 16.202 17.318 ( 14.161 9.537 2.653) 17.278 17.992 ( 12.999 7.302 0.839) 14.933 18.531 ( -3.281 -1.208 3.521) 4.962 18.663 ( 3.245 -0.673 -1.782) 3.763 25.947 ( 1.114 -1.886 -0.828) 2.342 25.959 ( 0.557 -2.799 1.346) 3.156 26.139 ( -1.238 -0.203 -2.041) 2.396 26.199 ( -1.095 -0.589 1.704) 2.110 26.241 ( -1.532 3.538 -7.394) 8.339 26.508 ( 0.178 -0.791 0.627) 1.025 26.873 ( 1.075 -1.012 2.749) 3.121 26.982 ( 3.373 -1.625 11.431) 12.029 27.378 ( -4.160 2.269 -12.607) 13.468 27.952 ( 5.626 8.363 8.857) 13.418 28.399 ( -9.823 -1.188 -6.977) 12.107 28.623 ( -4.248 -2.764 2.722) 5.753 29.014 ( -7.137 -2.872 -4.054) 8.696 29.089 ( -3.761 -12.903 1.856) 13.568 29.539 ( 8.105 -2.867 5.325) 10.113 29.893 ( 13.587 12.519 -4.521) 19.020 ======================= Grid point 252 (120/140) ======================= q-point: ( 0.44 0.00 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.956 ( 1.847 -1.913 -1.395) 3.002 2.123 ( 2.966 -7.739 -6.202) 10.352 2.204 ( -2.119 -1.747 8.256) 8.701 2.330 ( 4.383 -2.175 -2.525) 5.506 2.435 ( -2.611 -0.980 -1.809) 3.324 2.522 ( 1.953 -2.604 -4.186) 5.303 2.644 ( -4.290 -1.342 -1.710) 4.810 2.823 ( -1.029 -1.205 0.022) 1.585 2.942 ( 2.089 -1.205 0.809) 2.544 3.010 ( -1.003 3.376 -0.463) 3.552 3.124 ( 0.006 0.374 1.048) 1.113 3.367 ( -4.135 -7.100 0.980) 8.275 3.490 ( 3.344 4.697 0.625) 5.799 3.528 ( -0.880 -3.768 1.240) 4.063 3.717 ( -2.330 1.534 1.823) 3.333 3.892 ( 1.004 0.620 -3.326) 3.529 4.115 ( 3.486 -3.470 2.341) 5.447 4.320 ( -1.478 3.271 -3.398) 4.943 4.418 ( 3.764 -2.583 1.240) 4.731 4.486 ( -1.273 1.654 2.212) 3.041 4.503 ( -0.947 -4.671 3.184) 5.731 4.632 ( -0.346 -2.329 -5.251) 5.755 4.827 ( 7.182 0.224 -6.526) 9.707 4.893 ( -8.248 3.107 7.267) 11.424 5.258 ( 0.276 1.956 -0.879) 2.162 5.371 ( 1.610 -1.117 0.860) 2.140 5.678 ( 2.430 -0.946 0.979) 2.785 5.729 ( -3.222 -0.718 -0.390) 3.324 5.948 ( -0.974 -3.537 0.719) 3.738 6.038 ( 1.122 0.012 0.174) 1.136 6.244 ( -0.827 2.373 -0.025) 2.513 6.405 ( 3.924 -3.164 0.527) 5.068 6.500 ( -4.328 2.587 -2.934) 5.834 6.888 ( 1.549 -2.575 0.596) 3.064 6.975 ( 0.454 5.728 3.290) 6.621 7.125 ( -1.260 -0.841 -0.981) 1.805 7.484 ( -3.627 -1.599 6.622) 7.718 7.546 ( 3.352 2.374 -2.613) 4.868 7.647 ( 1.456 2.537 -3.992) 4.949 7.893 ( 0.043 -0.438 2.646) 2.683 9.066 ( -1.714 -2.779 1.026) 3.422 9.214 ( -1.545 3.668 -2.468) 4.683 9.397 ( 2.520 -1.850 1.107) 3.316 9.452 ( -4.740 -0.803 -0.220) 4.812 9.588 ( -1.024 -0.345 1.100) 1.542 9.953 ( -0.447 -11.217 4.165) 11.974 10.124 ( 1.323 4.518 -4.175) 6.293 10.347 ( 0.351 1.753 -7.564) 7.773 10.407 ( -5.453 1.012 5.681) 7.939 10.775 ( 0.598 -0.081 -2.327) 2.404 11.092 ( 0.639 0.247 -1.485) 1.636 11.151 ( 2.067 -0.978 -1.110) 2.542 11.542 ( 5.155 -4.456 0.230) 6.818 11.628 ( 0.912 -1.704 2.157) 2.896 11.801 ( 0.414 0.199 2.025) 2.076 11.907 ( -1.775 -0.060 -1.403) 2.263 12.074 ( -1.338 -0.103 -0.644) 1.489 12.267 ( 1.067 1.510 -1.776) 2.564 12.308 ( 1.594 -2.425 1.047) 3.085 12.539 ( 2.768 -1.239 4.166) 5.153 12.576 ( 3.875 2.265 0.707) 4.544 12.756 ( 2.475 0.848 0.122) 2.619 13.064 ( -12.634 7.546 -2.573) 14.939 13.383 ( -1.881 3.741 -2.799) 5.036 14.966 ( 0.681 -0.773 -0.519) 1.154 15.243 ( -0.826 -3.956 0.502) 4.072 15.294 ( 3.996 1.322 0.090) 4.210 15.402 ( -3.299 5.549 1.460) 6.619 15.631 ( -2.724 -0.902 -2.813) 4.018 15.683 ( 0.457 -0.137 -0.638) 0.797 15.845 ( 1.241 -0.762 -0.436) 1.521 15.861 ( -0.362 0.312 1.018) 1.125 16.113 ( -0.484 -0.907 1.643) 1.938 16.462 ( 0.059 0.150 0.463) 0.490 16.734 ( -0.498 -1.023 -0.477) 1.234 17.203 ( -6.228 -1.516 0.492) 6.429 17.326 ( 6.921 2.250 1.596) 7.451 17.968 ( 4.083 3.000 0.099) 5.068 18.539 ( -1.207 -0.348 1.346) 1.841 18.683 ( 1.136 -0.263 -0.637) 1.328 25.975 ( 0.566 -0.855 -0.388) 1.096 26.020 ( 0.817 -2.296 1.665) 2.951 26.110 ( -1.074 0.990 -1.909) 2.404 26.161 ( -0.478 1.540 -2.923) 3.338 26.200 ( -0.686 0.103 0.783) 1.046 26.523 ( 0.168 -0.348 0.336) 0.512 26.898 ( 0.360 -0.264 0.947) 1.047 27.094 ( 2.604 -1.735 10.830) 11.273 27.252 ( -2.779 1.895 -11.289) 11.779 27.906 ( 1.618 3.368 3.365) 5.029 28.331 ( -4.215 -0.771 -3.171) 5.331 28.638 ( -1.242 -0.803 0.412) 1.535 29.017 ( -1.632 -1.616 -0.648) 2.387 29.295 ( -3.042 -11.650 2.883) 12.381 29.550 ( 4.988 8.033 -1.054) 9.514 29.816 ( 4.266 2.691 -0.515) 5.070 ======================= Grid point 258 (121/140) ======================= q-point: ( 0.11 0.11 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.200 ( -5.843 -0.000 -20.893) 21.695 1.611 ( 2.685 0.000 -12.526) 12.810 1.755 ( -4.484 -0.000 20.572) 21.055 1.844 ( -11.480 -0.000 -19.252) 22.415 1.962 ( 15.643 0.000 4.103) 16.172 2.218 ( 5.364 0.000 -22.720) 23.345 2.323 ( 5.559 0.000 0.752) 5.610 2.624 ( -7.038 -0.000 7.711) 10.440 2.780 ( 7.849 0.000 -5.153) 9.389 2.966 ( 0.949 0.000 3.216) 3.353 3.071 ( 11.060 0.000 3.720) 11.669 3.083 ( -6.885 -0.000 10.695) 12.720 3.140 ( -0.944 -0.000 -8.229) 8.283 3.370 ( 2.737 0.000 2.466) 3.684 3.844 ( -3.911 -0.000 3.172) 5.036 3.898 ( -0.538 -0.000 7.820) 7.839 4.064 ( 4.067 0.000 -9.983) 10.780 4.164 ( -2.505 -0.000 9.258) 9.591 4.286 ( -2.022 -0.000 -1.609) 2.584 4.361 ( -4.138 -0.000 0.031) 4.138 4.649 ( -2.349 -0.000 0.854) 2.499 4.723 ( -9.823 -0.000 -11.955) 15.473 5.032 ( 9.404 0.000 -1.045) 9.462 5.067 ( -5.105 -0.000 10.700) 11.855 5.175 ( -3.176 -0.000 -6.469) 7.206 5.276 ( 5.267 0.000 6.889) 8.672 5.398 ( 5.738 0.000 -0.049) 5.738 5.544 ( 5.368 0.000 3.871) 6.618 6.211 ( -3.615 -0.000 -7.137) 8.000 6.261 ( -5.769 -0.000 2.713) 6.375 6.526 ( 0.024 0.000 2.623) 2.623 6.542 ( 3.458 0.000 -4.530) 5.699 6.669 ( 0.380 0.000 4.165) 4.182 6.765 ( 5.889 0.000 -1.989) 6.216 6.932 ( -7.700 -0.000 -0.579) 7.721 7.187 ( 8.769 0.000 -6.738) 11.059 7.492 ( 5.678 0.000 0.888) 5.747 7.588 ( 0.196 0.000 8.472) 8.474 7.902 ( -14.091 -0.000 -2.864) 14.379 7.977 ( -7.229 -0.000 -1.069) 7.307 8.667 ( -2.873 -0.000 -4.557) 5.387 8.877 ( 3.349 0.000 6.031) 6.899 9.040 ( 0.149 0.000 0.917) 0.929 9.192 ( 3.672 0.000 10.299) 10.934 9.669 ( -8.827 -0.000 1.046) 8.889 9.694 ( 1.210 0.000 -0.286) 1.243 10.261 ( -10.492 -0.000 -1.089) 10.548 10.494 ( -0.439 -0.000 -2.215) 2.258 10.586 ( -0.842 -0.000 -3.446) 3.548 10.701 ( 3.336 0.000 -7.928) 8.602 10.973 ( 0.695 0.000 -5.940) 5.980 11.114 ( 2.085 0.000 5.011) 5.427 11.284 ( -5.744 -0.000 5.538) 7.979 11.441 ( 5.424 0.000 -7.100) 8.935 11.776 ( 4.855 0.000 -9.962) 11.082 11.868 ( 1.616 0.000 8.382) 8.537 12.121 ( -0.860 -0.000 1.754) 1.954 12.181 ( -3.172 -0.000 -3.312) 4.586 12.222 ( 4.543 0.000 -2.732) 5.301 12.524 ( 8.929 0.000 9.746) 13.218 12.874 ( -8.752 -0.000 1.342) 8.855 12.929 ( -2.999 -0.000 -10.392) 10.816 13.813 ( -25.005 -0.000 12.773) 28.079 13.902 ( 3.141 0.000 -13.579) 13.937 15.050 ( -2.111 -0.000 2.334) 3.148 15.228 ( 2.011 0.000 2.088) 2.899 15.269 ( 2.791 0.000 1.483) 3.161 15.436 ( 9.287 0.000 -2.578) 9.638 15.618 ( -3.369 -0.000 -6.982) 7.752 15.773 ( -0.578 -0.000 0.971) 1.130 16.012 ( -10.025 -0.000 7.800) 12.702 16.047 ( -8.013 -0.000 -4.815) 9.349 16.216 ( 7.785 0.000 -0.103) 7.786 16.265 ( -0.349 -0.000 5.101) 5.113 16.581 ( -6.454 -0.000 -4.494) 7.865 16.871 ( -9.138 -0.000 1.415) 9.247 17.516 ( 8.498 0.000 4.218) 9.488 18.121 ( 30.015 0.000 8.327) 31.148 18.506 ( -5.430 -0.000 6.287) 8.307 18.608 ( 6.884 0.000 -5.398) 8.748 25.858 ( -0.397 -0.000 -0.364) 0.539 25.880 ( 0.530 0.000 -0.866) 1.015 26.098 ( -1.024 -0.000 1.128) 1.524 26.117 ( 1.129 0.000 0.283) 1.164 26.451 ( -0.406 -0.000 -5.461) 5.476 26.480 ( -3.685 -0.000 -2.070) 4.226 26.825 ( 4.005 0.000 3.573) 5.368 26.838 ( 1.469 0.000 5.049) 5.258 27.571 ( -7.669 -0.000 -8.793) 11.668 28.084 ( 9.206 0.000 12.438) 15.474 28.446 ( -2.786 -0.000 2.771) 3.930 28.532 ( 1.437 0.000 1.000) 1.751 28.739 ( -11.190 -0.000 10.581) 15.400 29.126 ( -0.045 -0.000 -2.804) 2.804 29.194 ( -14.100 -0.000 -10.529) 17.597 30.254 ( 25.026 0.000 -9.470) 26.757 ======================= Grid point 259 (122/140) ======================= q-point: ( 0.22 0.11 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.277 ( -0.725 -20.426 -14.423) 25.016 1.594 ( -1.208 -9.767 -24.049) 25.984 1.793 ( -7.005 -12.365 -6.257) 15.528 1.906 ( -3.055 -7.535 11.720) 14.264 2.133 ( 6.888 -2.835 9.763) 12.280 2.196 ( 18.088 -0.589 -19.113) 26.321 2.448 ( 2.798 -10.807 -5.152) 12.295 2.695 ( -2.403 -7.287 6.398) 9.990 2.859 ( 4.458 -4.988 -4.032) 7.811 2.922 ( -3.120 0.770 -5.976) 6.785 3.020 ( -3.937 1.413 -0.889) 4.276 3.143 ( -0.933 -0.464 2.803) 2.991 3.220 ( 2.576 -2.048 11.158) 11.634 3.439 ( 8.064 -5.168 -2.486) 9.895 3.825 ( -5.154 0.114 2.729) 5.833 3.950 ( 0.671 1.155 3.396) 3.649 4.000 ( 0.708 2.247 0.984) 2.554 4.152 ( 0.231 2.377 1.539) 2.841 4.303 ( -4.486 -3.824 6.293) 8.622 4.374 ( -1.474 -4.730 -5.797) 7.626 4.558 ( -5.483 3.396 -3.646) 7.408 4.651 ( -3.930 0.727 -3.111) 5.065 5.032 ( -6.408 3.900 8.117) 11.053 5.060 ( 7.149 2.696 -3.396) 8.361 5.162 ( -0.453 -3.949 -4.183) 5.770 5.402 ( 6.572 -4.114 7.966) 11.116 5.427 ( 3.839 1.486 1.028) 4.243 5.614 ( 4.067 -1.609 1.822) 4.738 6.078 ( -4.359 7.761 -4.888) 10.155 6.186 ( -3.267 4.742 1.920) 6.070 6.469 ( -2.307 5.714 -4.844) 7.838 6.509 ( 1.877 4.405 0.565) 4.821 6.613 ( 2.989 3.151 -0.057) 4.344 6.835 ( -0.432 -1.961 -0.190) 2.017 7.004 ( 2.679 -8.664 -1.560) 9.202 7.139 ( 3.787 5.957 -1.593) 7.236 7.543 ( 4.767 1.383 2.996) 5.798 7.637 ( 0.133 0.382 7.691) 7.702 7.774 ( -12.122 1.184 -2.066) 12.354 7.901 ( -7.165 -1.106 -2.610) 7.706 8.731 ( -3.048 -11.147 -2.978) 11.934 8.959 ( 1.637 -3.373 6.238) 7.278 9.105 ( 0.416 -5.487 2.840) 6.192 9.304 ( 3.896 -3.409 9.601) 10.907 9.600 ( -12.457 -0.850 1.789) 12.614 9.725 ( 0.827 -1.204 1.190) 1.884 10.207 ( -5.757 -3.365 -5.434) 8.603 10.436 ( -3.472 4.558 -3.052) 6.492 10.506 ( -4.590 2.371 -3.469) 6.223 10.709 ( -4.378 -6.312 -11.837) 14.111 10.965 ( 3.759 -0.378 -5.376) 6.570 11.172 ( 3.723 -1.914 4.531) 6.169 11.282 ( 4.716 2.404 5.394) 7.557 11.455 ( 4.754 -0.801 -5.235) 7.116 11.788 ( 4.339 -2.646 -8.543) 9.941 11.901 ( 2.657 2.455 6.130) 7.118 12.111 ( -4.770 0.552 1.835) 5.140 12.175 ( 2.245 -0.805 2.417) 3.396 12.257 ( 4.845 -1.882 -5.312) 7.432 12.614 ( 8.181 2.641 8.151) 11.846 12.765 ( -6.359 4.177 -8.118) 11.126 12.844 ( -7.056 -0.802 -3.539) 7.934 13.616 ( -25.220 4.731 7.005) 26.599 13.818 ( -0.111 4.706 -10.340) 11.361 15.072 ( -1.606 -1.513 3.322) 3.988 15.205 ( -1.163 2.456 2.268) 3.539 15.290 ( 0.196 2.128 -4.110) 4.632 15.498 ( 8.027 -1.877 1.459) 8.372 15.589 ( 2.152 -0.465 -5.941) 6.336 15.761 ( -0.326 1.175 -0.606) 1.361 15.866 ( -7.815 6.279 5.241) 11.312 15.987 ( -4.791 1.854 -5.415) 7.464 16.130 ( 1.148 6.321 6.870) 9.406 16.396 ( 0.740 -4.014 2.651) 4.867 16.581 ( -0.722 -4.864 -3.279) 5.910 16.885 ( -12.151 -9.054 3.259) 15.500 17.589 ( 15.156 4.953 2.588) 16.153 18.318 ( 21.181 7.272 11.220) 25.048 18.495 ( -3.736 0.446 5.080) 6.321 18.639 ( 5.243 -0.628 -3.742) 6.472 25.872 ( 0.057 -1.798 0.268) 1.819 25.890 ( 0.874 -1.272 -1.396) 2.081 26.103 ( -1.237 -1.050 0.248) 1.641 26.144 ( 0.020 -1.886 0.975) 2.123 26.373 ( -1.542 3.849 -7.160) 8.274 26.466 ( -1.905 -1.580 -1.235) 2.766 26.850 ( 1.671 0.552 4.321) 4.665 26.920 ( 3.363 -2.658 6.504) 7.789 27.455 ( -6.168 2.122 -8.872) 11.012 28.204 ( 8.028 0.967 11.429) 14.000 28.419 ( -7.656 3.650 -3.532) 9.188 28.508 ( -6.405 -0.586 1.758) 6.667 28.748 ( -6.466 -5.287 5.241) 9.860 28.888 ( -18.951 -4.701 -10.044) 21.957 29.389 ( 18.935 -3.347 9.622) 21.502 30.306 ( 19.660 8.055 -11.827) 24.316 ======================= Grid point 260 (123/140) ======================= q-point: ( 0.33 0.11 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.596 ( 4.130 -18.982 -10.235) 21.957 1.735 ( 2.359 -18.079 -15.135) 23.695 1.987 ( -3.869 -15.586 -7.761) 17.836 2.056 ( -1.876 -7.369 11.246) 13.576 2.227 ( 0.861 -1.189 7.057) 7.208 2.333 ( 18.024 -6.213 -13.567) 23.399 2.622 ( -4.768 -9.426 -2.801) 10.928 2.764 ( 1.413 0.533 -8.509) 8.642 2.886 ( -3.034 -3.692 1.197) 4.926 2.952 ( -2.198 -3.354 3.637) 5.414 3.071 ( 1.925 -9.346 -1.486) 9.657 3.146 ( -3.902 -2.824 1.262) 4.980 3.283 ( -0.928 0.640 10.076) 10.139 3.628 ( 9.008 -7.740 -5.960) 13.288 3.783 ( -4.615 0.750 1.355) 4.868 3.842 ( 2.318 5.750 -1.379) 6.351 4.062 ( 0.786 0.765 4.340) 4.476 4.192 ( -1.170 -7.304 7.246) 10.355 4.367 ( -3.888 -1.801 -6.509) 7.793 4.382 ( -0.005 -3.085 0.836) 3.196 4.504 ( -5.798 -3.459 -3.409) 7.563 4.570 ( 1.730 4.428 -1.969) 5.146 4.929 ( -5.236 5.714 3.688) 8.583 5.025 ( 2.482 4.159 -1.187) 4.986 5.254 ( 4.054 -4.731 0.307) 6.238 5.413 ( 1.224 2.798 1.293) 3.317 5.572 ( 4.154 -6.114 5.389) 9.147 5.669 ( 0.598 -1.930 0.460) 2.072 5.888 ( -2.265 7.246 -2.304) 7.933 6.104 ( 0.639 3.824 -0.091) 3.878 6.352 ( -4.401 2.064 -0.703) 4.912 6.431 ( 4.373 6.122 -1.536) 7.679 6.590 ( 0.128 2.636 -1.692) 3.134 6.844 ( -0.482 -0.446 0.076) 0.661 7.054 ( 4.756 0.649 -0.916) 4.887 7.185 ( 1.530 -1.888 4.486) 5.102 7.515 ( -5.215 5.368 6.266) 9.760 7.574 ( -6.876 0.619 -0.430) 6.917 7.752 ( 4.614 0.261 0.494) 4.647 7.869 ( -4.952 -1.228 -2.558) 5.708 8.894 ( -2.261 -9.649 -0.276) 9.914 9.082 ( -0.866 -7.744 4.602) 9.050 9.247 ( -1.628 -9.597 3.890) 10.483 9.411 ( 0.207 0.766 2.650) 2.766 9.559 ( -4.334 -4.518 4.150) 7.511 9.724 ( -1.336 2.294 3.371) 4.291 10.225 ( -2.441 -6.350 -10.416) 12.441 10.275 ( -5.303 5.968 -4.196) 9.019 10.439 ( -5.646 -0.470 -1.575) 5.881 10.716 ( -6.457 -4.858 -7.722) 11.177 10.993 ( 5.259 -1.534 -4.697) 7.216 11.261 ( 10.440 1.547 3.331) 11.067 11.350 ( 7.276 -3.348 -0.080) 8.010 11.508 ( 2.938 -3.696 1.684) 5.013 11.833 ( 3.335 -2.001 -3.788) 5.430 11.889 ( 1.625 3.011 1.340) 3.674 12.072 ( -4.499 0.619 2.688) 5.277 12.228 ( 2.061 -1.382 0.730) 2.586 12.303 ( 4.931 -0.977 -2.649) 5.682 12.598 ( -3.309 0.684 -9.030) 9.641 12.668 ( 7.022 5.105 6.169) 10.650 12.806 ( -5.058 -0.802 0.411) 5.138 13.346 ( -22.966 7.497 2.400) 24.278 13.639 ( -2.988 9.128 -8.369) 12.739 15.042 ( 0.478 5.695 2.327) 6.171 15.208 ( -4.697 -0.632 0.768) 4.801 15.215 ( 0.966 -0.999 -2.873) 3.192 15.539 ( -3.868 0.527 -3.273) 5.094 15.613 ( 4.980 -0.049 -0.277) 4.988 15.705 ( 0.570 2.666 -3.253) 4.244 15.819 ( -0.717 -0.722 3.882) 4.013 15.909 ( 0.580 2.120 -2.048) 3.004 16.104 ( 0.833 2.060 6.984) 7.329 16.442 ( -1.890 -1.516 2.448) 3.444 16.653 ( 1.309 -3.904 -1.999) 4.578 16.967 ( -11.887 -8.867 3.007) 15.132 17.609 ( 15.935 8.473 2.635) 18.239 18.296 ( 12.044 14.279 4.884) 19.308 18.506 ( -3.162 -1.546 6.203) 7.132 18.667 ( 3.148 -0.527 -2.694) 4.177 25.918 ( 1.207 -2.393 0.042) 2.680 25.923 ( 0.805 -2.520 0.113) 2.648 26.108 ( -1.571 -0.937 -1.225) 2.202 26.176 ( -1.672 -1.738 1.026) 2.621 26.259 ( -0.173 3.900 -7.168) 8.163 26.480 ( -1.457 -1.829 0.016) 2.339 26.876 ( 0.088 -0.436 2.930) 2.963 27.030 ( 3.000 -2.666 8.696) 9.578 27.325 ( -4.149 2.556 -10.089) 11.205 28.143 ( -11.186 8.666 -8.415) 16.463 28.298 ( 1.958 -0.784 5.398) 5.796 28.543 ( -2.768 -4.169 2.594) 5.637 28.877 ( -4.478 -7.705 3.693) 9.646 28.886 ( -2.195 -8.108 1.201) 8.485 29.603 ( 10.601 -1.395 10.469) 14.964 30.192 ( 13.952 13.307 -11.991) 22.705 ======================= Grid point 261 (124/140) ======================= q-point: ( 0.44 0.11 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.853 ( 4.801 -13.181 -9.453) 16.917 1.986 ( 9.302 -8.215 -4.736) 13.283 2.160 ( -7.732 -12.780 3.562) 15.355 2.226 ( 2.368 -7.272 1.548) 7.803 2.283 ( -2.987 -4.139 -0.552) 5.134 2.502 ( 11.223 -4.712 -4.694) 13.046 2.615 ( -3.306 1.105 -1.862) 3.952 2.754 ( -4.784 -3.387 -2.609) 6.416 2.904 ( -0.786 -2.427 0.340) 2.573 3.020 ( -1.337 -1.678 -1.100) 2.411 3.169 ( -3.692 -7.708 -1.892) 8.754 3.227 ( 2.978 4.294 7.225) 8.917 3.359 ( -3.888 -11.613 2.229) 12.448 3.635 ( 1.239 4.211 0.118) 4.391 3.738 ( -2.726 2.598 4.186) 5.631 3.900 ( 7.876 -2.210 -7.405) 11.034 4.084 ( 0.468 -2.512 5.293) 5.877 4.292 ( -5.109 1.983 -8.993) 10.531 4.332 ( -1.156 -6.811 -4.451) 8.218 4.470 ( -3.671 -4.769 3.277) 6.852 4.486 ( -0.201 -4.750 2.916) 5.578 4.585 ( 8.049 0.463 -1.805) 8.261 4.821 ( -4.109 2.776 -1.746) 5.258 4.951 ( -1.170 5.167 2.071) 5.689 5.288 ( -1.750 2.696 2.209) 3.900 5.430 ( 4.911 -0.423 2.614) 5.579 5.671 ( -3.271 -1.448 1.136) 3.753 5.702 ( 4.401 -1.344 0.101) 4.603 5.830 ( -1.890 -3.213 -2.582) 4.535 6.079 ( 3.422 0.776 -0.047) 3.510 6.298 ( -2.359 3.385 4.234) 5.912 6.409 ( 6.554 -0.501 -1.867) 6.833 6.518 ( -0.983 3.518 -1.153) 3.830 6.849 ( -3.943 -1.463 1.111) 4.349 7.104 ( 5.172 2.451 2.659) 6.311 7.133 ( -1.388 5.094 0.458) 5.299 7.471 ( -5.429 -0.872 7.344) 9.175 7.526 ( -6.173 -1.067 0.203) 6.268 7.724 ( 3.937 5.655 -6.761) 9.653 7.859 ( -2.557 -2.193 -1.677) 3.762 9.005 ( -2.384 -5.193 3.824) 6.876 9.205 ( -2.017 -3.754 -1.222) 4.433 9.372 ( 2.749 -0.795 3.352) 4.407 9.407 ( -0.487 -5.098 1.157) 5.251 9.602 ( -1.086 1.854 1.212) 2.467 9.782 ( -0.553 -8.516 7.596) 11.425 10.166 ( 0.022 1.105 -2.297) 2.549 10.269 ( 0.813 -5.279 -11.928) 13.069 10.395 ( -6.910 0.341 1.414) 7.062 10.700 ( -7.539 -3.379 -2.846) 8.738 11.045 ( 5.522 -2.005 -4.225) 7.236 11.287 ( 10.144 5.634 0.590) 11.619 11.493 ( 6.110 -6.092 -1.124) 8.701 11.626 ( 3.007 -3.972 4.417) 6.658 11.836 ( 0.936 3.710 0.164) 3.830 11.869 ( -1.425 -1.918 -0.235) 2.401 12.050 ( -3.469 -0.209 2.630) 4.358 12.220 ( 0.267 0.289 -10.830) 10.837 12.336 ( 0.965 0.047 4.594) 4.694 12.583 ( 2.887 -0.512 -3.659) 4.688 12.688 ( 6.826 1.790 5.056) 8.681 12.789 ( 0.327 0.754 2.450) 2.584 13.039 ( -20.195 7.813 -1.629) 21.714 13.417 ( -4.935 7.342 -5.639) 10.491 14.986 ( 1.602 2.332 1.869) 3.392 15.167 ( -1.948 -1.952 -5.438) 6.097 15.281 ( -3.269 -3.683 4.399) 6.603 15.441 ( -4.504 4.357 -4.304) 7.602 15.607 ( 0.400 0.820 -0.478) 1.030 15.695 ( 2.540 -0.463 -2.053) 3.299 15.850 ( 2.651 -0.449 -0.722) 2.784 15.898 ( 2.436 1.541 2.068) 3.548 16.127 ( 1.892 0.555 4.647) 5.048 16.456 ( -2.853 -0.679 2.978) 4.179 16.708 ( 1.501 -2.309 -0.691) 2.839 17.016 ( -11.203 -6.544 1.177) 13.027 17.584 ( 14.818 10.011 1.951) 17.988 18.135 ( 3.620 12.428 1.035) 12.985 18.534 ( -1.596 -0.629 4.651) 4.957 18.680 ( 1.365 -0.364 -2.218) 2.629 25.959 ( 1.125 -1.687 -0.143) 2.032 25.991 ( 1.367 -3.221 1.923) 3.992 26.096 ( -1.551 -0.095 -2.046) 2.569 26.167 ( -1.116 0.845 -2.966) 3.279 26.201 ( 0.310 0.621 -0.226) 0.730 26.497 ( -1.939 -1.679 -0.590) 2.632 26.889 ( -1.205 -0.485 0.579) 1.422 27.120 ( 0.088 -1.274 1.376) 1.877 27.229 ( -0.106 1.135 -1.396) 1.802 27.912 ( -10.031 2.789 -9.882) 14.355 28.359 ( 6.432 1.138 7.587) 10.012 28.601 ( -1.289 -2.983 2.028) 3.830 28.956 ( -1.181 -4.701 3.023) 5.712 29.083 ( -1.487 -11.592 4.238) 12.432 29.688 ( 3.942 3.104 5.455) 7.411 29.985 ( 7.852 13.439 -10.412) 18.726 ======================= Grid point 262 (125/140) ======================= q-point: ( 0.56 0.11 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.979 ( 3.846 -0.508 -1.748) 4.255 2.137 ( 6.308 -5.852 -6.674) 10.889 2.234 ( -4.752 1.211 7.547) 9.001 2.289 ( -5.057 -1.148 -3.569) 6.295 2.394 ( 0.131 -8.794 1.430) 8.910 2.542 ( 1.661 1.041 0.954) 2.180 2.680 ( 5.260 -4.439 2.404) 7.291 2.778 ( -3.919 -4.601 0.576) 6.071 2.932 ( -3.035 0.584 0.377) 3.114 3.009 ( 2.655 -0.329 -2.497) 3.659 3.160 ( 0.642 4.105 3.116) 5.193 3.273 ( -4.753 -7.254 -2.541) 9.037 3.500 ( -1.462 -5.588 -0.538) 5.801 3.594 ( 6.090 5.988 1.729) 8.714 3.710 ( -0.799 -0.000 0.001) 0.799 3.914 ( 1.938 1.078 1.219) 2.531 4.101 ( -3.711 0.714 -5.574) 6.735 4.247 ( -2.824 -3.732 3.484) 5.835 4.387 ( -0.672 -4.785 -10.299) 11.376 4.455 ( -4.618 1.432 0.670) 4.881 4.593 ( 7.492 3.037 0.313) 8.090 4.667 ( 2.301 -3.320 5.585) 6.893 4.768 ( -5.629 -2.826 -1.163) 6.406 4.874 ( 0.912 2.368 -3.277) 4.144 5.251 ( -1.551 1.124 5.601) 5.920 5.446 ( 2.780 3.654 2.518) 5.237 5.646 ( -3.590 -0.674 -3.488) 5.051 5.771 ( 5.535 -0.628 1.976) 5.911 5.868 ( -3.751 -5.077 -5.140) 8.140 6.102 ( 3.564 1.701 0.294) 3.961 6.257 ( 0.862 2.606 4.025) 4.872 6.440 ( -0.703 2.864 -0.811) 3.058 6.512 ( 6.918 -2.671 2.685) 7.886 6.847 ( -5.423 -2.860 -0.046) 6.131 6.969 ( -1.961 6.467 -0.832) 6.809 7.168 ( 4.086 0.649 1.486) 4.396 7.465 ( -7.230 -1.106 6.383) 9.708 7.521 ( -2.145 0.740 -2.969) 3.737 7.630 ( 0.633 1.024 -2.572) 2.840 7.850 ( -1.957 -1.177 -6.740) 7.117 9.084 ( -2.094 -3.223 6.681) 7.708 9.201 ( 2.881 -0.290 -3.799) 4.777 9.401 ( 1.230 2.381 -1.429) 3.037 9.484 ( 4.937 -2.739 2.213) 6.064 9.615 ( 2.064 -0.227 3.510) 4.078 9.939 ( -5.350 -6.314 3.391) 8.944 10.168 ( 3.733 2.819 1.125) 4.811 10.310 ( 2.435 -4.669 -2.353) 5.767 10.371 ( -0.448 -2.903 -3.463) 4.541 10.696 ( -9.667 -4.433 1.424) 10.730 11.092 ( 6.309 0.353 -3.247) 7.105 11.266 ( 6.987 5.225 3.333) 9.339 11.550 ( -3.450 1.057 -2.732) 4.526 11.682 ( 3.004 2.996 2.184) 4.772 11.784 ( -0.523 0.698 -4.133) 4.225 11.903 ( -1.840 -2.207 4.178) 5.071 12.061 ( -1.321 -2.017 2.135) 3.220 12.166 ( -3.378 -2.198 -9.651) 10.458 12.354 ( 1.540 1.145 1.507) 2.440 12.569 ( 1.763 2.414 -0.442) 3.022 12.635 ( -0.778 10.553 -0.463) 10.592 12.733 ( -8.798 3.198 2.073) 9.588 12.992 ( 6.998 -10.815 1.264) 12.943 13.323 ( -3.380 -2.724 -0.884) 4.430 14.988 ( 1.006 0.793 2.134) 2.489 15.192 ( -2.880 -5.124 -3.440) 6.811 15.306 ( -5.690 3.383 -1.199) 6.727 15.316 ( -0.872 -1.001 -1.245) 1.820 15.633 ( 1.832 -2.627 0.869) 3.318 15.716 ( 2.399 -0.442 -0.270) 2.455 15.868 ( 2.982 0.319 -1.412) 3.314 15.891 ( 2.863 3.090 1.591) 4.503 16.144 ( 2.536 1.437 1.504) 3.280 16.449 ( -3.902 -0.142 2.572) 4.675 16.752 ( 2.584 -0.894 0.308) 2.752 17.038 ( -10.618 -6.311 -0.155) 12.353 17.520 ( 12.846 10.621 -0.168) 16.669 17.971 ( -3.586 6.854 -0.122) 7.736 18.551 ( 0.549 0.031 1.998) 2.072 18.677 ( -0.682 0.070 -1.141) 1.331 25.984 ( 0.230 -0.102 0.834) 0.871 26.038 ( 0.136 0.734 -0.795) 1.090 26.093 ( 0.298 -2.320 1.002) 2.544 26.157 ( 0.685 -0.959 0.685) 1.363 26.200 ( 0.646 -0.025 0.176) 0.669 26.497 ( -2.729 -1.363 -2.136) 3.724 26.882 ( -1.519 -0.201 -1.054) 1.860 27.056 ( -2.264 2.072 -10.213) 10.664 27.301 ( 2.827 -2.051 12.077) 12.572 27.790 ( -6.948 -1.528 -9.540) 11.900 28.439 ( 8.874 1.051 7.991) 11.988 28.643 ( 0.402 -1.340 1.604) 2.128 29.037 ( 2.053 -2.291 3.673) 4.791 29.273 ( -3.607 -10.452 2.863) 11.421 29.591 ( 2.253 11.446 -1.589) 11.773 29.810 ( -0.797 5.618 -5.759) 8.084 ======================= Grid point 263 (126/140) ======================= q-point: (-0.33 0.11 0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.949 ( 1.370 4.891 -0.521) 5.106 2.137 ( -3.547 6.300 -4.929) 8.750 2.154 ( 2.237 6.335 -0.019) 6.719 2.239 ( -9.804 0.399 6.486) 11.762 2.499 ( 5.970 2.239 0.046) 6.377 2.575 ( 0.506 -3.010 6.442) 7.129 2.771 ( -2.615 -1.250 2.905) 4.103 2.847 ( 1.471 -3.013 -0.956) 3.487 2.865 ( 2.440 2.660 3.313) 4.900 3.051 ( 4.088 -1.224 -1.257) 4.449 3.138 ( 0.179 1.186 2.199) 2.504 3.309 ( -3.569 -2.569 -6.715) 8.027 3.511 ( 3.167 5.752 -1.349) 6.703 3.562 ( 4.513 1.118 3.304) 5.704 3.720 ( 0.298 -2.304 -3.188) 3.944 3.863 ( -11.068 4.560 0.552) 11.983 4.065 ( 4.921 0.199 0.369) 4.939 4.309 ( 0.014 -2.332 -2.719) 3.583 4.343 ( -5.519 5.767 -2.678) 8.420 4.395 ( -3.296 -2.606 -2.944) 5.130 4.615 ( 7.662 0.337 0.588) 7.692 4.693 ( -1.441 0.460 6.070) 6.255 4.759 ( -6.154 0.781 5.753) 8.460 4.893 ( 2.712 -4.823 -11.082) 12.386 5.278 ( -0.032 -0.319 7.244) 7.251 5.391 ( 1.575 5.351 0.036) 5.578 5.639 ( 0.427 -2.584 -2.227) 3.437 5.786 ( 0.958 3.496 0.539) 3.665 5.889 ( -1.013 -2.690 -3.985) 4.913 6.030 ( -1.906 6.416 -1.825) 6.938 6.270 ( 1.500 -0.549 3.902) 4.216 6.402 ( 1.346 1.143 -0.500) 1.835 6.640 ( 7.345 -2.470 7.172) 10.559 6.840 ( -1.693 2.161 1.577) 3.166 6.904 ( -1.090 -3.396 -7.785) 8.563 7.157 ( -3.240 2.548 1.610) 4.425 7.431 ( -2.244 1.352 -5.965) 6.515 7.475 ( -4.673 -2.884 1.105) 5.601 7.689 ( 2.064 -4.119 2.868) 5.427 7.827 ( -1.503 -2.396 -5.735) 6.394 9.126 ( 2.507 2.476 4.739) 5.906 9.249 ( 0.884 -4.243 -2.242) 4.880 9.399 ( 4.196 0.511 -0.094) 4.228 9.518 ( 2.458 2.354 0.659) 3.467 9.634 ( 4.063 1.842 0.904) 4.552 9.848 ( -7.156 8.403 -3.987) 11.735 10.237 ( 5.494 -4.036 8.326) 10.761 10.402 ( -0.015 -2.190 2.524) 3.341 10.453 ( 9.603 -5.117 -7.821) 13.400 10.706 ( -12.801 -4.694 5.782) 14.810 11.098 ( 6.279 2.865 -1.302) 7.023 11.259 ( 6.548 4.822 6.624) 10.488 11.414 ( -8.676 5.954 -2.591) 10.837 11.603 ( -1.873 5.788 -1.554) 6.279 11.760 ( -0.584 -0.111 -2.617) 2.684 11.917 ( -3.765 0.364 -0.004) 3.783 12.097 ( -1.942 -1.475 1.431) 2.827 12.147 ( -1.935 -3.593 -6.546) 7.714 12.328 ( 0.675 3.877 1.739) 4.302 12.441 ( -3.520 6.517 -1.154) 7.496 12.575 ( 2.064 -2.349 0.449) 3.159 12.710 ( -3.337 -3.923 -0.642) 5.190 13.285 ( 11.432 -12.801 0.819) 17.182 13.428 ( -0.771 -9.471 3.765) 10.221 14.983 ( 0.985 1.710 2.744) 3.380 15.177 ( -6.558 1.726 -2.132) 7.109 15.256 ( 1.900 -2.092 -2.557) 3.811 15.362 ( -3.805 -6.313 -1.923) 7.618 15.694 ( 0.901 -0.981 2.204) 2.575 15.750 ( 2.207 -1.185 0.901) 2.662 15.853 ( 2.998 4.217 0.917) 5.255 15.873 ( 2.146 0.980 -0.778) 2.484 16.147 ( 6.816 1.751 -0.978) 7.105 16.428 ( -5.719 -0.587 1.641) 5.978 16.778 ( 4.128 1.029 0.925) 4.354 17.059 ( -12.218 -6.393 -1.630) 13.886 17.446 ( 14.077 8.859 -1.997) 16.752 17.847 ( -10.831 1.364 0.134) 10.918 18.562 ( 2.744 0.700 -0.547) 2.884 18.656 ( -2.740 0.598 0.277) 2.818 25.973 ( -0.744 1.511 1.318) 2.138 25.994 ( -0.250 2.521 -1.769) 3.090 26.148 ( 0.906 -1.494 2.380) 2.952 26.195 ( 0.566 -1.201 -1.443) 1.961 26.237 ( 2.908 -2.465 5.953) 7.069 26.483 ( -3.035 -1.391 -3.420) 4.780 26.861 ( -1.307 0.585 -1.708) 2.229 26.950 ( -1.990 2.805 -8.763) 9.414 27.425 ( 3.100 -2.768 12.191) 12.880 27.750 ( -5.369 -4.754 -9.789) 12.135 28.528 ( 7.689 1.391 7.779) 11.025 28.667 ( 2.985 0.355 -1.793) 3.500 29.112 ( 7.201 -0.851 4.884) 8.743 29.325 ( 3.200 8.577 -0.123) 9.155 29.459 ( -6.945 -2.147 0.328) 7.276 29.687 ( -8.813 0.978 -5.295) 10.328 ======================= Grid point 264 (127/140) ======================= q-point: (-0.22 0.11 0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.850 ( 3.313 7.526 -2.689) 8.651 1.928 ( -8.062 10.368 3.729) 13.653 2.049 ( 4.120 8.155 -3.047) 9.631 2.136 ( -9.314 6.287 3.504) 11.771 2.461 ( 9.212 8.218 3.082) 12.724 2.622 ( -5.039 3.997 2.312) 6.835 2.703 ( 1.001 4.017 5.269) 6.701 2.837 ( -2.966 -1.737 -8.141) 8.837 2.993 ( 8.028 -0.930 14.366) 16.483 3.077 ( 2.891 1.400 -1.464) 3.530 3.118 ( 2.562 3.688 0.001) 4.490 3.243 ( -2.915 2.728 -5.612) 6.887 3.374 ( 4.708 12.063 -1.844) 13.080 3.516 ( -10.915 10.607 -2.241) 15.384 3.736 ( -0.447 -4.248 1.795) 4.633 3.770 ( -0.308 -5.082 -2.232) 5.559 4.089 ( 4.054 4.119 -0.035) 5.779 4.162 ( -6.040 7.829 0.169) 9.889 4.338 ( 7.375 -2.808 -8.137) 11.335 4.404 ( -5.932 -1.908 3.392) 7.095 4.654 ( 4.965 0.949 -1.939) 5.414 4.727 ( -8.682 -2.429 3.135) 9.545 4.787 ( 4.762 -3.891 9.532) 11.344 4.925 ( -0.439 -4.210 -9.313) 10.230 5.292 ( -0.486 2.513 3.434) 4.283 5.312 ( 0.463 3.761 -0.694) 3.853 5.676 ( 2.801 5.156 -2.167) 6.255 5.690 ( -1.803 4.508 1.303) 5.027 5.902 ( 1.764 -1.444 0.043) 2.280 5.951 ( -2.916 -4.102 -2.874) 5.796 6.329 ( 1.672 -2.538 3.740) 4.819 6.398 ( -1.462 -1.257 -2.096) 2.848 6.762 ( 9.739 1.735 7.131) 12.195 6.823 ( 0.185 -0.439 5.623) 5.644 6.928 ( 0.366 -4.644 -10.752) 11.717 7.035 ( -12.190 3.619 -1.645) 12.821 7.429 ( 2.134 -2.401 -0.758) 3.301 7.491 ( -3.443 -2.978 -2.812) 5.350 7.800 ( 5.542 -4.709 -0.236) 7.276 7.865 ( -2.989 -5.253 0.187) 6.046 9.090 ( 5.008 7.603 4.121) 9.994 9.219 ( -4.868 6.318 -5.160) 9.499 9.379 ( 6.588 7.091 1.820) 9.848 9.495 ( -3.348 5.372 -0.389) 6.342 9.655 ( 2.096 -0.270 -2.681) 3.414 9.670 ( 0.144 -1.159 0.495) 1.269 10.388 ( 5.359 -3.181 3.558) 7.176 10.433 ( 0.747 0.061 1.686) 1.845 10.546 ( 10.272 -1.285 -6.441) 12.192 10.693 ( -15.467 -2.737 7.173) 17.267 11.092 ( 5.131 3.276 2.313) 6.512 11.228 ( -5.203 5.715 -4.319) 8.854 11.287 ( 7.191 2.936 7.194) 10.587 11.471 ( -6.180 4.045 -3.329) 8.102 11.758 ( 1.090 -0.235 0.256) 1.144 11.842 ( -6.434 1.481 -2.121) 6.935 12.125 ( 1.391 -2.494 2.535) 3.818 12.190 ( -0.347 -3.467 -1.808) 3.925 12.267 ( 0.147 3.203 -0.736) 3.289 12.332 ( -4.496 2.748 -2.659) 5.902 12.692 ( 3.070 -6.672 4.564) 8.647 12.773 ( -1.503 -6.303 -3.553) 7.390 13.577 ( 10.283 -11.568 -2.886) 15.745 13.625 ( -1.886 -11.088 5.956) 12.727 15.003 ( 2.939 -1.360 2.695) 4.213 15.103 ( -6.262 -0.897 -2.028) 6.643 15.302 ( 6.485 -0.419 -3.387) 7.328 15.398 ( -8.087 -2.494 0.724) 8.494 15.710 ( 0.849 0.385 2.689) 2.846 15.760 ( -1.647 0.098 -3.076) 3.491 15.822 ( 3.648 2.506 3.042) 5.370 15.868 ( -0.140 -0.014 -1.251) 1.259 16.208 ( 13.077 0.071 -0.447) 13.085 16.387 ( -8.294 -0.087 0.431) 8.305 16.808 ( 7.277 1.358 3.348) 8.124 17.018 ( -14.108 -2.533 -4.432) 15.003 17.458 ( 18.361 3.208 -2.173) 18.766 17.738 ( -18.424 -1.062 0.738) 18.469 18.565 ( 4.532 1.268 -2.351) 5.261 18.618 ( -4.529 1.031 1.810) 4.985 25.941 ( -0.146 2.110 0.122) 2.118 25.945 ( -0.462 2.215 -0.105) 2.265 26.172 ( 0.622 0.621 1.819) 2.020 26.193 ( 0.304 0.787 -1.824) 2.009 26.358 ( 3.184 -3.930 7.997) 9.463 26.469 ( -2.451 -1.888 -4.031) 5.082 26.826 ( -0.939 1.577 -1.389) 2.302 26.851 ( -1.611 2.598 -5.795) 6.552 27.566 ( 4.757 -3.583 11.176) 12.664 27.753 ( -6.025 -6.010 -10.219) 13.299 28.569 ( 2.236 2.887 7.555) 8.391 28.639 ( 2.980 3.273 -7.560) 8.760 29.177 ( 7.802 10.972 1.415) 13.538 29.289 ( 17.720 -4.167 8.584) 20.126 29.347 ( -9.376 7.513 -4.316) 12.767 29.648 ( -18.670 -10.231 -2.565) 21.444 ======================= Grid point 265 (128/140) ======================= q-point: (-0.11 0.11 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.733 ( 6.743 8.613 -7.277) 13.139 1.733 ( -6.743 8.613 7.277) 13.139 1.935 ( 6.433 9.116 -10.270) 15.164 1.935 ( -6.433 9.116 10.270) 15.164 2.399 ( -9.270 10.990 -6.036) 15.593 2.399 ( 9.270 10.990 6.036) 15.593 2.724 ( -4.897 5.233 -16.786) 18.252 2.724 ( 4.897 5.233 16.786) 18.252 3.006 ( -3.753 11.480 -2.468) 12.328 3.006 ( 3.753 11.480 2.468) 12.328 3.095 ( -0.584 3.251 -13.754) 14.145 3.095 ( 0.584 3.251 13.754) 14.145 3.267 ( -2.277 2.842 -5.664) 6.733 3.267 ( 2.277 2.842 5.664) 6.733 3.852 ( 2.975 -4.493 -2.691) 6.023 3.852 ( -2.975 -4.493 2.691) 6.023 4.034 ( 3.426 2.227 -1.416) 4.325 4.034 ( -3.426 2.227 1.416) 4.325 4.392 ( 6.829 0.499 -6.591) 9.504 4.392 ( -6.829 0.499 6.591) 9.504 4.711 ( -8.116 -3.030 -1.863) 8.861 4.711 ( 8.116 -3.030 1.863) 8.861 4.939 ( -3.062 -3.581 -7.914) 9.210 4.939 ( 3.062 -3.581 7.914) 9.210 5.254 ( 4.338 2.170 -4.308) 6.487 5.254 ( -4.338 2.170 4.308) 6.487 5.556 ( -0.369 8.200 -7.953) 11.429 5.556 ( 0.369 8.200 7.953) 11.429 6.045 ( -0.435 -9.791 -4.813) 10.918 6.045 ( 0.435 -9.791 4.813) 10.918 6.412 ( -1.157 -3.679 -3.054) 4.919 6.412 ( 1.157 -3.679 3.054) 4.919 6.797 ( -9.023 4.316 -3.440) 10.577 6.797 ( 9.023 4.316 3.440) 10.577 6.971 ( 4.831 -4.243 -10.309) 12.150 6.971 ( -4.831 -4.243 10.309) 12.150 7.493 ( -1.352 -1.603 -4.250) 4.739 7.493 ( 1.352 -1.603 4.250) 4.739 7.929 ( -2.134 -5.169 -0.528) 5.617 7.929 ( 2.134 -5.169 0.528) 5.617 8.993 ( -2.745 10.531 -5.807) 12.335 8.993 ( 2.745 10.531 5.807) 12.335 9.283 ( -1.993 10.208 -4.975) 11.529 9.283 ( 1.993 10.208 4.975) 11.529 9.726 ( 2.008 -2.700 -3.890) 5.143 9.726 ( -2.008 -2.700 3.890) 5.143 10.430 ( 0.102 0.492 -3.919) 3.951 10.430 ( -0.102 0.492 3.919) 3.951 10.633 ( 3.234 -0.777 -6.639) 7.425 10.633 ( -3.234 -0.777 6.639) 7.425 11.089 ( -3.034 3.383 -5.380) 7.043 11.089 ( 3.034 3.383 5.380) 7.043 11.360 ( -4.845 -0.056 -4.794) 6.816 11.360 ( 4.845 -0.056 4.794) 6.816 11.785 ( 1.743 -0.322 -4.325) 4.674 11.785 ( -1.743 -0.322 4.325) 4.674 12.214 ( 2.769 -0.182 -2.668) 3.849 12.214 ( -2.769 -0.182 2.668) 3.849 12.242 ( -4.387 -0.662 -7.328) 8.567 12.242 ( 4.387 -0.662 7.328) 8.567 12.851 ( 1.033 -6.304 -6.505) 9.118 12.851 ( -1.033 -6.304 6.505) 9.118 13.794 ( 7.456 -8.611 -10.674) 15.610 13.794 ( -7.456 -8.611 10.674) 15.610 15.099 ( -5.560 -4.139 0.157) 6.933 15.099 ( 5.560 -4.139 -0.157) 6.933 15.322 ( 0.037 3.027 -2.211) 3.748 15.322 ( -0.037 3.027 2.211) 3.748 15.727 ( 1.260 0.358 -3.433) 3.674 15.727 ( -1.260 0.358 3.433) 3.674 15.873 ( -2.101 -3.965 -3.424) 5.644 15.873 ( 2.101 -3.965 3.424) 5.644 16.302 ( -6.475 1.173 -3.653) 7.526 16.302 ( 6.475 1.173 3.653) 7.526 16.891 ( -13.266 1.480 -5.693) 14.512 16.891 ( 13.266 1.480 5.693) 14.512 17.592 ( -6.800 -0.621 -8.063) 10.566 17.592 ( 6.800 -0.621 8.063) 10.566 18.571 ( 5.071 1.137 -6.075) 7.995 18.571 ( -5.071 1.137 6.075) 7.995 25.909 ( 1.124 1.772 -1.093) 2.365 25.909 ( -1.124 1.772 1.093) 2.365 26.157 ( -0.007 2.252 -1.147) 2.527 26.157 ( 0.007 2.252 1.147) 2.527 26.469 ( 0.246 -2.399 -6.678) 7.100 26.469 ( -0.246 -2.399 6.678) 7.100 26.792 ( -0.086 1.298 -1.983) 2.371 26.792 ( 0.086 1.298 1.983) 2.371 27.736 ( -7.678 -4.222 -11.180) 14.205 27.736 ( 7.678 -4.222 11.180) 14.205 28.551 ( 0.985 3.632 -6.990) 7.939 28.551 ( -0.985 3.632 6.990) 7.939 29.077 ( -10.724 10.419 -2.237) 15.118 29.077 ( 10.724 10.419 2.237) 15.118 29.632 ( -25.946 -9.535 -4.540) 28.013 29.632 ( 25.946 -9.535 4.540) 28.013 ======================= Grid point 269 (129/140) ======================= q-point: ( 0.22 0.22 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.974 ( 0.928 0.000 -14.610) 14.639 1.330 ( -0.275 -0.000 -30.751) 30.753 1.564 ( -7.675 -0.000 -7.888) 11.006 1.949 ( 6.245 0.000 13.903) 15.241 2.203 ( 4.489 0.000 9.723) 10.709 2.297 ( 22.684 0.000 -17.585) 28.702 2.303 ( -2.510 -0.000 -6.958) 7.397 2.660 ( -2.276 -0.000 12.619) 12.823 2.842 ( -6.741 -0.000 -9.449) 11.607 2.842 ( 9.073 0.000 -8.133) 12.184 2.977 ( -2.663 -0.000 -6.704) 7.214 3.196 ( 0.228 0.000 11.590) 11.592 3.260 ( -2.261 -0.000 8.763) 9.050 3.428 ( 8.526 0.000 -4.920) 9.844 3.791 ( -6.944 -0.000 2.922) 7.534 3.978 ( 0.593 0.000 5.088) 5.122 4.034 ( -0.966 -0.000 -1.458) 1.749 4.166 ( -5.398 -0.000 0.873) 5.468 4.254 ( 2.440 0.000 -5.158) 5.705 4.290 ( -3.105 -0.000 3.104) 4.391 4.476 ( -7.572 -0.000 -7.725) 10.817 4.707 ( 1.807 0.000 6.868) 7.101 5.040 ( -8.737 -0.000 5.902) 10.544 5.085 ( 3.492 0.000 -5.350) 6.389 5.119 ( 1.789 0.000 0.878) 1.993 5.468 ( 5.043 0.000 9.129) 10.429 5.474 ( 2.710 0.000 0.660) 2.790 5.658 ( 9.052 0.000 -2.795) 9.473 6.087 ( -4.642 -0.000 -3.058) 5.559 6.203 ( -3.772 -0.000 0.932) 3.885 6.506 ( -6.050 -0.000 -0.695) 6.090 6.540 ( 3.045 0.000 -6.003) 6.731 6.758 ( 3.622 0.000 6.185) 7.168 6.779 ( 0.611 0.000 -4.801) 4.840 6.876 ( 2.714 0.000 -0.141) 2.718 7.232 ( 5.689 0.000 -5.126) 7.657 7.606 ( -13.851 -0.000 1.943) 13.987 7.659 ( 11.460 0.000 0.574) 11.474 7.665 ( -5.161 -0.000 5.702) 7.691 7.828 ( -9.263 -0.000 -1.679) 9.414 8.562 ( -5.190 -0.000 -2.648) 5.826 8.990 ( 3.478 0.000 5.423) 6.442 9.119 ( 4.327 0.000 7.618) 8.762 9.360 ( 4.276 0.000 8.437) 9.459 9.483 ( -16.928 -0.000 7.482) 18.508 9.721 ( 1.530 0.000 -1.159) 1.919 10.103 ( -7.718 -0.000 -4.047) 8.715 10.420 ( -8.436 -0.000 -10.254) 13.278 10.479 ( -5.491 -0.000 -7.324) 9.154 10.515 ( -2.260 -0.000 -11.359) 11.582 10.990 ( 8.077 0.000 -3.927) 8.981 11.189 ( 2.227 0.000 4.041) 4.614 11.400 ( 6.708 0.000 9.563) 11.681 11.456 ( 6.661 0.000 -8.594) 10.873 11.745 ( 3.490 0.000 -8.128) 8.845 11.989 ( 3.183 0.000 7.340) 8.000 12.090 ( -3.539 -0.000 1.018) 3.682 12.202 ( 2.867 0.000 3.772) 4.737 12.239 ( 2.770 0.000 -5.906) 6.523 12.636 ( -8.213 -0.000 -16.168) 18.134 12.753 ( -7.836 -0.000 1.412) 7.962 12.768 ( 4.883 0.000 2.169) 5.343 13.497 ( -24.185 -0.000 8.383) 25.597 13.814 ( 1.169 0.000 -10.539) 10.603 15.061 ( -0.260 -0.000 3.022) 3.033 15.193 ( -5.338 -0.000 -0.686) 5.382 15.316 ( 1.317 0.000 1.051) 1.686 15.539 ( 9.049 0.000 -6.391) 11.079 15.629 ( 8.293 0.000 -1.230) 8.384 15.741 ( -5.914 -0.000 2.823) 6.553 15.896 ( -3.672 -0.000 -5.358) 6.496 15.943 ( -8.344 -0.000 8.203) 11.701 16.294 ( -2.097 -0.000 5.112) 5.526 16.324 ( 3.149 0.000 2.698) 4.147 16.524 ( 2.140 0.000 -1.960) 2.902 16.728 ( -8.175 -0.000 1.678) 8.346 17.773 ( 17.601 0.000 1.190) 17.641 18.463 ( -3.091 -0.000 9.627) 10.111 18.637 ( 10.993 0.000 14.360) 18.085 18.651 ( 4.967 0.000 -4.853) 6.944 25.857 ( 0.445 0.000 0.252) 0.512 25.879 ( 1.189 0.000 -1.578) 1.976 26.086 ( -1.386 -0.000 -0.019) 1.386 26.126 ( -0.989 -0.000 0.417) 1.073 26.388 ( -3.799 -0.000 -3.150) 4.935 26.408 ( 0.378 0.000 -3.441) 3.461 26.896 ( 0.371 0.000 2.991) 3.014 26.931 ( 3.160 0.000 4.775) 5.726 27.398 ( -5.345 -0.000 -5.225) 7.474 28.160 ( -14.999 -0.000 -13.291) 20.040 28.450 ( -1.178 -0.000 3.827) 4.004 28.471 ( 0.609 0.000 -4.640) 4.680 28.695 ( -2.239 -0.000 0.074) 2.240 28.714 ( -6.875 -0.000 12.889) 14.608 29.587 ( 17.810 0.000 18.242) 25.494 30.449 ( 16.624 0.000 -16.125) 23.160 ======================= Grid point 270 (130/140) ======================= q-point: ( 0.33 0.22 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.209 ( 3.072 -26.624 -5.786) 27.419 1.339 ( 7.799 -11.908 -20.229) 24.735 1.626 ( -4.513 -16.183 -7.986) 18.602 2.089 ( 8.102 -1.608 10.366) 13.255 2.254 ( -0.341 -1.688 0.426) 1.774 2.339 ( 11.394 -2.438 -3.756) 12.243 2.389 ( -0.576 -7.806 -6.684) 10.293 2.712 ( -6.315 -0.188 -9.687) 11.566 2.786 ( 0.137 -6.766 6.525) 9.401 2.914 ( 5.196 -1.394 -7.432) 9.175 2.958 ( 1.761 -3.919 -2.268) 4.858 3.156 ( -4.083 5.618 6.174) 9.293 3.327 ( -1.124 -2.644 9.600) 10.020 3.533 ( 9.703 -6.346 -7.498) 13.807 3.741 ( -7.103 -0.064 0.393) 7.114 3.948 ( -1.161 4.708 1.490) 5.073 4.070 ( -0.238 -5.782 3.832) 6.940 4.123 ( -5.362 0.051 2.455) 5.898 4.254 ( -1.405 -1.362 -4.718) 5.107 4.333 ( 0.628 -3.082 -3.147) 4.449 4.394 ( -4.493 -0.034 -4.158) 6.122 4.705 ( 3.912 5.041 5.366) 8.338 4.977 ( -10.070 1.974 5.656) 11.717 5.073 ( 1.601 2.043 -4.323) 5.042 5.198 ( 4.031 -5.092 4.069) 7.664 5.466 ( 0.721 2.846 1.601) 3.344 5.559 ( 1.575 -2.564 6.406) 7.078 5.695 ( 9.022 1.348 -6.852) 11.408 5.990 ( -2.675 6.180 -0.447) 6.749 6.156 ( -1.404 2.601 -1.386) 3.265 6.378 ( -3.133 4.745 0.014) 5.686 6.529 ( 2.460 2.399 -4.164) 5.399 6.659 ( 1.697 5.259 -1.594) 5.751 6.829 ( -1.998 0.177 2.509) 3.212 7.037 ( 2.959 -9.337 -0.221) 9.797 7.198 ( 5.067 3.394 -0.191) 6.102 7.516 ( -10.569 1.718 0.681) 10.730 7.615 ( -4.883 4.709 7.424) 10.057 7.768 ( -5.579 -3.326 -1.719) 6.720 7.776 ( 6.354 -1.830 -1.470) 6.774 8.639 ( -3.985 -12.587 -1.389) 13.275 9.046 ( 0.915 -2.266 2.428) 3.445 9.188 ( 2.134 -0.340 9.394) 9.640 9.414 ( -4.169 -2.409 6.259) 7.897 9.489 ( -2.199 -3.680 10.308) 11.164 9.738 ( -0.388 -1.208 0.077) 1.272 10.049 ( -6.264 -4.000 -8.321) 11.157 10.266 ( -9.970 0.600 -9.388) 13.708 10.384 ( -3.106 1.301 -8.353) 9.007 10.512 ( -3.295 -4.614 -8.519) 10.234 11.044 ( 9.873 0.586 -1.729) 10.040 11.271 ( 4.095 -4.750 2.805) 6.870 11.439 ( 8.683 2.728 -3.770) 9.852 11.505 ( 4.386 -1.049 4.513) 6.380 11.773 ( 3.290 -3.267 -5.474) 7.174 12.003 ( 2.239 4.205 5.078) 6.962 12.067 ( -2.849 0.598 2.077) 3.576 12.213 ( -0.003 -0.519 -3.204) 3.246 12.300 ( 3.977 -4.167 1.673) 5.999 12.470 ( -8.397 -0.685 -17.467) 19.392 12.721 ( -6.487 -1.453 0.666) 6.681 12.796 ( 1.838 1.238 1.562) 2.711 13.328 ( -16.074 6.124 8.315) 19.105 13.716 ( -0.686 6.280 -8.999) 10.995 15.091 ( -0.766 -1.235 3.224) 3.536 15.155 ( -4.061 -0.806 -2.467) 4.819 15.276 ( 2.204 6.699 1.473) 7.204 15.552 ( 3.838 2.496 -6.056) 7.592 15.644 ( 0.928 0.983 1.276) 1.858 15.728 ( -1.989 0.767 -2.036) 2.948 15.829 ( -2.538 1.127 6.216) 6.808 15.919 ( 0.656 0.528 -2.649) 2.779 16.218 ( 1.086 5.035 7.221) 8.870 16.406 ( -0.981 -2.420 0.935) 2.774 16.589 ( 2.203 -4.349 -0.035) 4.876 16.758 ( -6.796 -7.661 1.478) 10.347 17.869 ( 17.203 5.485 1.541) 18.122 18.492 ( -2.474 -1.106 6.975) 7.483 18.636 ( 4.828 9.699 5.699) 12.242 18.674 ( 0.747 2.176 2.243) 3.213 25.886 ( 0.960 -2.318 0.891) 2.663 25.895 ( 1.621 -1.431 -1.208) 2.477 26.076 ( -1.799 -0.561 -0.951) 2.111 26.130 ( -2.427 -1.669 -0.284) 2.959 26.298 ( -0.403 3.940 -4.288) 5.837 26.428 ( -1.899 -2.353 -1.113) 3.223 26.892 ( -0.428 0.919 2.001) 2.243 27.014 ( 1.277 -3.912 3.337) 5.298 27.312 ( -3.158 2.980 -3.663) 5.681 27.947 ( -16.876 -2.192 -22.509) 28.218 28.435 ( 4.344 2.924 5.726) 7.759 28.495 ( 0.932 -1.344 1.458) 2.191 28.767 ( -0.403 -5.407 8.327) 9.937 28.781 ( -1.503 -4.914 6.617) 8.378 29.780 ( 10.254 2.867 20.318) 22.939 30.410 ( 12.884 8.050 -17.651) 23.288 ======================= Grid point 271 (131/140) ======================= q-point: ( 0.44 0.22 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.586 ( 7.653 -18.056 -10.479) 22.235 1.706 ( 5.708 -25.198 1.962) 25.910 1.870 ( -0.899 -17.331 -7.657) 18.968 2.189 ( 7.013 0.800 0.456) 7.073 2.284 ( -2.508 -0.215 6.287) 6.772 2.439 ( 5.140 -7.581 -5.078) 10.473 2.537 ( -1.942 -8.854 1.281) 9.154 2.632 ( -5.378 -2.238 -9.338) 11.006 2.879 ( 1.176 0.604 -3.643) 3.875 2.954 ( -0.942 -5.822 2.276) 6.322 3.058 ( -0.451 0.428 -0.360) 0.719 3.119 ( -4.308 -10.837 3.880) 12.290 3.376 ( 1.931 2.980 6.074) 7.036 3.613 ( -5.168 -2.035 -1.297) 5.704 3.783 ( 6.478 -5.180 -2.638) 8.704 3.887 ( 4.006 1.924 -1.178) 4.597 4.102 ( -2.582 0.826 2.420) 3.634 4.202 ( -5.844 -6.609 1.311) 8.919 4.227 ( 1.043 -1.153 -7.531) 7.690 4.332 ( -6.311 -3.324 -0.996) 7.202 4.393 ( 1.856 -3.634 -3.087) 5.117 4.701 ( 8.384 3.304 2.066) 9.245 4.867 ( -8.425 4.743 4.857) 10.820 5.018 ( -0.479 2.951 -2.552) 3.931 5.327 ( 2.413 -1.712 3.193) 4.353 5.430 ( -1.194 0.408 5.100) 5.254 5.613 ( -3.791 -1.431 2.342) 4.680 5.696 ( 4.902 -0.124 -9.751) 10.914 5.886 ( 2.871 5.516 2.816) 6.826 6.110 ( 1.973 0.971 -2.456) 3.297 6.349 ( 0.530 0.816 6.791) 6.860 6.471 ( 3.508 3.690 -3.564) 6.215 6.585 ( 1.941 3.929 -0.909) 4.475 6.803 ( -5.244 0.385 1.852) 5.574 7.153 ( 3.687 -2.263 -0.093) 4.327 7.222 ( 0.803 2.416 0.535) 2.602 7.391 ( -6.473 -0.193 1.193) 6.585 7.537 ( -6.932 4.131 8.129) 11.454 7.755 ( -3.948 -0.073 -4.220) 5.779 7.815 ( 3.339 0.201 -4.631) 5.713 8.837 ( -2.761 -12.429 0.638) 12.748 9.109 ( -3.260 -5.693 -1.912) 6.833 9.302 ( 2.561 -5.309 11.406) 12.839 9.454 ( 3.025 0.676 6.077) 6.822 9.593 ( 0.032 -3.422 3.995) 5.261 9.754 ( -0.595 -0.568 6.242) 6.296 10.067 ( 0.309 -8.077 -15.820) 17.765 10.174 ( -5.145 -0.205 -1.422) 5.342 10.323 ( -4.262 -1.343 -4.828) 6.579 10.519 ( -8.902 -5.998 -5.778) 12.190 11.101 ( 9.776 1.375 0.476) 9.883 11.415 ( 5.267 -5.015 0.015) 7.273 11.441 ( 7.923 1.408 -4.546) 9.242 11.593 ( 2.396 -3.388 4.503) 6.123 11.815 ( 0.853 -1.903 -3.086) 3.725 11.955 ( 1.940 5.478 4.379) 7.276 12.048 ( -3.012 0.777 4.154) 5.190 12.187 ( 0.129 1.180 -10.067) 10.137 12.341 ( -2.067 -0.932 -1.667) 2.815 12.488 ( 1.730 -9.959 -2.931) 10.525 12.691 ( -6.028 -0.606 -0.486) 6.078 12.783 ( -3.724 -1.216 -1.570) 4.221 13.122 ( -6.269 12.376 8.359) 16.196 13.511 ( -3.635 10.577 -7.081) 13.237 15.078 ( -0.594 3.555 2.541) 4.410 15.120 ( -0.176 1.607 -4.523) 4.803 15.226 ( -1.321 -0.587 4.234) 4.474 15.460 ( -2.108 4.310 -4.822) 6.802 15.635 ( 0.042 1.566 -0.796) 1.758 15.687 ( -0.280 0.135 -1.799) 1.825 15.860 ( 1.649 -0.843 2.434) 3.059 15.928 ( 2.491 -0.799 -0.807) 2.738 16.210 ( 3.581 2.791 6.200) 7.684 16.429 ( -2.404 -1.296 2.139) 3.469 16.668 ( 1.168 -3.505 0.255) 3.703 16.838 ( -6.743 -6.767 0.225) 9.556 17.878 ( 15.532 9.428 1.826) 18.261 18.412 ( -1.507 15.675 3.013) 16.033 18.543 ( -1.810 0.205 7.696) 7.909 18.670 ( 1.271 -0.311 -3.611) 3.841 25.936 ( 1.595 -2.149 -0.219) 2.685 25.954 ( 1.617 -3.495 1.622) 4.178 26.066 ( -1.885 -0.655 -1.534) 2.517 26.131 ( -2.893 -1.442 -1.545) 3.583 26.233 ( 1.825 2.363 -1.925) 3.553 26.437 ( -3.548 -1.940 -1.580) 4.341 26.882 ( -0.955 0.444 0.849) 1.352 27.070 ( -1.954 -1.866 -4.700) 5.421 27.264 ( 1.245 0.591 5.191) 5.371 27.773 ( -10.576 -1.203 -16.009) 19.224 28.472 ( 5.087 0.912 6.080) 7.980 28.547 ( 0.050 -3.334 1.508) 3.660 28.883 ( -1.433 -5.460 7.980) 9.775 28.939 ( 1.687 -8.272 4.859) 9.741 29.840 ( 3.591 6.344 14.690) 16.399 30.221 ( 8.572 13.478 -17.034) 23.351 ======================= Grid point 272 (132/140) ======================= q-point: ( 0.56 0.22 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.894 ( 6.828 -13.750 -2.252) 15.517 2.063 ( 3.641 -9.312 -4.545) 10.983 2.131 ( 0.097 -14.015 4.107) 14.605 2.193 ( 3.906 -2.908 -6.837) 8.394 2.295 ( -3.376 0.594 6.073) 6.973 2.545 ( -5.600 -3.746 -7.169) 9.838 2.619 ( 3.269 -4.022 3.119) 6.049 2.675 ( 1.169 -6.578 2.004) 6.976 2.890 ( -2.080 -3.020 1.700) 4.042 2.981 ( -1.022 -1.515 -2.397) 3.014 3.110 ( -1.545 -5.963 -0.885) 6.223 3.247 ( -6.054 -1.124 -2.034) 6.485 3.389 ( 4.492 -3.759 6.744) 8.933 3.615 ( -3.427 -3.328 -0.116) 4.778 3.786 ( 1.850 5.697 3.987) 7.196 3.955 ( 4.374 1.645 -4.520) 6.501 4.041 ( -1.058 -1.110 -8.183) 8.325 4.216 ( -2.964 -1.754 8.476) 9.149 4.250 ( 0.930 -4.186 -10.989) 11.796 4.370 ( -7.238 -5.286 0.744) 8.993 4.547 ( 4.807 -10.312 -0.823) 11.407 4.701 ( 2.000 2.533 -0.557) 3.275 4.776 ( 1.377 4.169 2.146) 4.886 4.932 ( -2.817 4.857 0.001) 5.614 5.317 ( 0.890 2.967 6.284) 7.006 5.497 ( 0.388 -1.944 4.431) 4.854 5.576 ( -5.993 -0.038 -2.986) 6.696 5.689 ( -2.095 -3.677 -9.097) 10.033 5.886 ( 7.499 2.094 4.567) 9.027 6.117 ( 0.788 -0.609 -2.498) 2.690 6.368 ( 2.710 3.827 7.673) 8.992 6.459 ( 2.700 -0.042 -2.638) 3.775 6.565 ( 6.810 1.210 0.857) 6.969 6.765 ( -6.683 -1.058 1.541) 6.940 7.079 ( -2.795 7.842 -0.377) 8.334 7.199 ( -0.006 -0.525 -0.766) 0.929 7.448 ( -2.925 -0.903 1.488) 3.404 7.463 ( -4.696 -0.569 7.431) 8.809 7.665 ( -1.046 3.913 -4.659) 6.173 7.790 ( -0.475 0.162 -7.732) 7.749 8.999 ( -2.162 -7.666 4.486) 9.142 9.148 ( -3.022 -4.036 -5.448) 7.424 9.459 ( 6.414 -1.560 3.737) 7.585 9.513 ( 4.488 0.250 6.606) 7.990 9.633 ( 2.025 -1.357 4.373) 5.007 9.829 ( -3.222 -4.633 5.276) 7.725 10.172 ( 3.277 -6.269 -3.502) 7.893 10.186 ( 3.833 -6.789 -10.579) 13.142 10.304 ( -4.642 -1.894 0.965) 5.106 10.522 ( -12.030 -6.074 -0.922) 13.508 11.161 ( 10.002 0.949 0.869) 10.084 11.431 ( 8.620 4.703 0.847) 9.856 11.495 ( -3.360 -1.921 -4.916) 6.256 11.688 ( 0.907 -4.713 -0.539) 4.829 11.828 ( 0.029 2.032 1.969) 2.829 11.889 ( -0.649 4.018 1.331) 4.283 12.035 ( -2.976 0.022 3.587) 4.661 12.099 ( -0.880 0.958 -9.148) 9.240 12.374 ( 2.784 -1.890 0.443) 3.394 12.613 ( 1.810 0.717 -1.247) 2.312 12.673 ( -7.935 -5.067 0.724) 9.442 12.755 ( -7.698 1.046 -2.592) 8.189 12.962 ( 8.231 5.755 6.434) 11.928 13.284 ( -6.084 5.850 -4.039) 9.357 15.035 ( 0.426 2.318 3.508) 4.226 15.095 ( 0.831 -1.606 -5.321) 5.620 15.252 ( -4.680 -1.282 4.512) 6.626 15.350 ( -2.029 3.741 -5.470) 6.931 15.619 ( 1.496 -0.445 0.441) 1.622 15.691 ( -0.414 -1.635 -1.864) 2.514 15.895 ( 4.050 -0.162 -0.983) 4.171 15.952 ( 0.747 0.313 1.689) 1.873 16.222 ( 5.412 2.738 2.842) 6.698 16.425 ( -5.143 0.043 2.751) 5.833 16.739 ( 1.885 -3.140 1.408) 3.924 16.880 ( -6.142 -4.733 -1.238) 7.853 17.814 ( 12.845 11.834 0.969) 17.492 18.128 ( -5.080 14.540 0.519) 15.411 18.568 ( -0.030 -0.147 4.585) 4.588 18.662 ( -0.230 -0.177 -3.020) 3.034 25.982 ( 1.289 -1.375 0.891) 2.085 26.036 ( 1.924 -2.463 1.521) 3.476 26.054 ( -1.466 -1.208 -1.120) 2.205 26.130 ( -1.666 -1.691 -0.931) 2.550 26.221 ( 2.568 0.771 0.638) 2.756 26.422 ( -4.901 -1.788 -3.607) 6.342 26.874 ( -0.188 0.334 0.854) 0.936 27.018 ( -2.513 0.864 -8.119) 8.543 27.342 ( 2.371 -2.048 10.761) 11.208 27.662 ( -6.276 -1.395 -11.583) 13.247 28.539 ( 6.013 -0.608 4.336) 7.438 28.613 ( -0.538 -3.250 2.451) 4.106 29.011 ( 1.618 -5.165 6.304) 8.309 29.107 ( -0.962 -8.414 3.281) 9.082 29.777 ( 0.019 8.985 7.359) 11.614 29.950 ( 3.645 14.010 -13.714) 19.941 ======================= Grid point 273 (133/140) ======================= q-point: ( 0.67 0.22 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.052 ( 6.515 2.293 -0.289) 6.912 2.162 ( -4.289 0.529 -4.575) 6.294 2.169 ( 0.849 -4.284 1.472) 4.609 2.212 ( -3.471 1.754 0.749) 3.960 2.450 ( 2.570 -10.577 5.598) 12.240 2.552 ( -0.690 -4.423 -5.307) 6.943 2.711 ( -0.414 -2.833 4.461) 5.300 2.782 ( -1.190 -2.326 -2.687) 3.747 2.941 ( 1.332 -2.330 9.645) 10.011 3.029 ( 2.942 -3.908 -5.351) 7.250 3.164 ( -1.289 -0.673 -0.597) 1.572 3.185 ( -3.024 -1.505 -1.733) 3.797 3.535 ( 4.899 -4.440 2.798) 7.180 3.650 ( -3.462 -3.435 -2.120) 5.318 3.707 ( 4.337 6.674 1.071) 8.031 3.830 ( -8.460 3.949 -3.817) 10.086 4.107 ( 7.329 -2.161 1.343) 7.758 4.254 ( -4.222 -3.732 -8.144) 9.904 4.284 ( 0.326 -1.655 5.914) 6.150 4.367 ( -5.063 0.438 -1.592) 5.326 4.684 ( 1.756 -0.815 1.845) 2.674 4.718 ( -0.467 -2.960 0.539) 3.044 4.744 ( 5.163 1.121 -1.617) 5.525 4.822 ( -3.674 3.677 -1.734) 5.480 5.343 ( 3.222 1.137 8.497) 9.158 5.463 ( -3.015 3.634 -2.072) 5.157 5.585 ( 2.006 -3.769 -0.327) 4.282 5.698 ( -6.034 -5.098 -6.434) 10.188 5.939 ( 7.727 2.239 3.680) 8.847 6.076 ( -4.654 2.801 -2.821) 6.121 6.352 ( 4.030 3.840 4.487) 7.150 6.427 ( -0.817 2.491 -2.216) 3.433 6.668 ( 6.558 -3.594 4.117) 8.537 6.765 ( -3.601 -3.724 -1.860) 5.505 6.972 ( 5.213 5.632 1.495) 7.818 7.149 ( -9.512 2.015 -1.441) 9.829 7.409 ( -2.423 1.055 3.248) 4.188 7.449 ( -1.392 1.675 -4.157) 4.692 7.659 ( 1.762 -2.377 4.429) 5.326 7.748 ( -1.382 -1.327 -7.794) 8.027 9.118 ( -1.856 -5.097 6.998) 8.855 9.170 ( 0.437 -3.952 -6.668) 7.763 9.490 ( 8.564 3.489 -0.575) 9.265 9.549 ( -0.899 0.414 3.488) 3.625 9.711 ( 4.489 0.435 3.400) 5.648 9.837 ( -8.078 0.530 -1.519) 8.237 10.258 ( 2.144 -3.631 7.065) 8.228 10.330 ( 3.511 -6.081 -10.062) 12.270 10.377 ( 7.239 -7.430 -0.172) 10.375 10.531 ( -13.374 -6.137 3.258) 15.071 11.222 ( 10.430 2.589 1.092) 10.802 11.406 ( -7.870 3.014 -5.093) 9.847 11.433 ( 8.393 4.859 6.463) 11.654 11.657 ( -9.383 5.066 -5.981) 12.225 11.771 ( 4.130 1.564 2.583) 5.117 11.866 ( -4.379 -0.443 -1.906) 4.796 12.049 ( -0.956 -2.035 1.571) 2.743 12.076 ( 0.214 -1.678 -3.574) 3.954 12.422 ( 5.263 1.911 2.162) 6.003 12.544 ( -6.306 5.919 -2.847) 9.105 12.603 ( 1.492 4.784 1.511) 5.234 12.649 ( -3.328 2.128 -0.085) 3.951 13.144 ( 8.157 -11.734 1.258) 14.346 13.254 ( -5.242 -8.333 -0.053) 9.845 15.038 ( 2.033 0.892 3.191) 3.887 15.114 ( -3.110 -2.232 -3.273) 5.036 15.239 ( -1.073 0.327 0.572) 1.259 15.271 ( -1.920 0.020 -2.534) 3.179 15.676 ( 1.537 -3.014 2.028) 3.944 15.715 ( -0.679 -2.567 -1.908) 3.269 15.913 ( 3.481 1.233 -0.791) 3.777 15.938 ( 0.033 2.419 0.991) 2.615 16.239 ( 8.543 2.082 0.247) 8.796 16.376 ( -8.589 0.475 2.048) 8.842 16.811 ( 3.887 -1.760 1.061) 4.396 16.898 ( -6.316 -3.762 -1.104) 7.434 17.708 ( 11.481 11.149 -0.498) 16.011 17.867 ( -8.971 9.749 0.085) 13.249 18.592 ( 1.853 0.236 2.075) 2.792 18.642 ( -1.903 0.259 -1.691) 2.559 25.999 ( 0.191 0.826 1.537) 1.755 26.019 ( -0.319 1.565 -1.756) 2.374 26.125 ( 1.193 -3.231 1.849) 3.909 26.156 ( -0.886 -2.565 -0.712) 2.806 26.261 ( 4.226 -1.193 4.293) 6.141 26.391 ( -5.258 -2.153 -5.495) 7.904 26.873 ( 0.778 1.013 1.795) 2.203 26.939 ( -2.121 1.898 -6.321) 6.932 27.456 ( 2.372 -2.719 11.035) 11.610 27.605 ( -3.846 -2.710 -10.213) 11.245 28.618 ( 4.785 -0.729 3.741) 6.118 28.664 ( -0.037 -1.776 0.528) 1.853 29.139 ( 5.105 -4.181 3.969) 7.700 29.232 ( -4.612 -7.549 1.238) 8.933 29.615 ( 1.984 12.360 1.560) 12.615 29.704 ( -3.268 9.401 -7.021) 12.181 ======================= Grid point 274 (134/140) ======================= q-point: (-0.22 0.22 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.012 ( 3.693 7.042 -9.469) 12.365 2.012 ( -3.693 7.042 9.469) 12.365 2.187 ( 5.221 3.324 -6.616) 9.060 2.187 ( -5.221 3.324 6.616) 9.060 2.599 ( 2.752 -1.540 -3.163) 4.467 2.599 ( -2.752 -1.540 3.163) 4.467 2.750 ( -0.054 -0.687 -5.347) 5.391 2.750 ( 0.054 -0.687 5.347) 5.391 3.060 ( -0.656 -2.297 -8.496) 8.826 3.060 ( 0.656 -2.297 8.496) 8.826 3.177 ( -3.469 -0.678 -4.257) 5.533 3.177 ( 3.469 -0.678 4.257) 5.533 3.609 ( -4.436 5.943 -3.276) 8.108 3.609 ( 4.436 5.943 3.276) 8.108 3.690 ( -2.965 -0.577 -2.422) 3.872 3.690 ( 2.965 -0.577 2.422) 3.872 4.207 ( -0.060 1.637 -11.223) 11.342 4.207 ( 0.060 1.637 11.223) 11.342 4.317 ( 6.759 -1.212 -8.465) 10.900 4.317 ( -6.759 -1.212 8.465) 10.900 4.697 ( 4.324 1.739 -3.920) 6.090 4.697 ( -4.324 1.739 3.920) 6.090 4.797 ( 0.877 -3.374 -11.462) 11.980 4.797 ( -0.877 -3.374 11.462) 11.980 5.366 ( -1.216 3.203 -5.692) 6.644 5.366 ( 1.216 3.203 5.692) 6.644 5.694 ( -2.358 -2.981 -5.476) 6.666 5.694 ( 2.358 -2.981 5.476) 6.666 5.945 ( -3.896 4.628 -3.262) 6.873 5.945 ( 3.896 4.628 3.262) 6.873 6.361 ( -3.577 1.055 -3.476) 5.098 6.361 ( 3.577 1.055 3.476) 5.098 6.793 ( 0.582 -4.067 -10.743) 11.502 6.793 ( -0.582 -4.067 10.743) 11.502 6.981 ( -12.697 4.280 -4.349) 14.087 6.981 ( 12.697 4.280 4.349) 14.087 7.418 ( 2.031 -1.142 -4.444) 5.017 7.418 ( -2.031 -1.142 4.444) 5.017 7.754 ( -1.052 -4.267 -4.468) 6.267 7.754 ( 1.052 -4.267 4.468) 6.267 9.205 ( 1.366 -1.491 -7.518) 7.785 9.205 ( -1.366 -1.491 7.518) 7.785 9.502 ( -5.947 1.988 0.051) 6.271 9.502 ( 5.947 1.988 -0.051) 6.271 9.710 ( -3.902 5.061 -2.703) 6.938 9.710 ( 3.902 5.061 2.703) 6.938 10.382 ( -1.223 -3.911 -6.339) 7.548 10.382 ( 1.223 -3.911 6.339) 7.548 10.552 ( 11.936 -5.078 -7.722) 15.096 10.552 ( -11.936 -5.078 7.722) 15.096 11.240 ( -9.563 5.180 -2.306) 11.117 11.240 ( 9.563 5.180 2.306) 11.117 11.460 ( -9.198 4.849 -7.125) 12.605 11.460 ( 9.198 4.849 7.125) 12.605 11.801 ( -4.990 0.998 -3.493) 6.172 11.801 ( 4.990 0.998 3.493) 6.172 12.101 ( -0.168 -2.964 -3.889) 4.893 12.101 ( 0.168 -2.964 3.889) 4.893 12.377 ( -3.438 6.519 -1.206) 7.468 12.377 ( 3.438 6.519 1.206) 7.468 12.638 ( 0.203 -4.231 -5.092) 6.623 12.638 ( -0.203 -4.231 5.092) 6.623 13.412 ( 2.705 -12.833 -2.321) 13.319 13.412 ( -2.705 -12.833 2.321) 13.319 15.057 ( -4.362 1.659 -3.549) 5.863 15.057 ( 4.362 1.659 3.549) 5.863 15.288 ( -1.343 -4.076 -1.258) 4.472 15.288 ( 1.343 -4.076 1.258) 4.472 15.732 ( -1.130 -0.958 -2.204) 2.656 15.732 ( 1.130 -0.958 2.204) 2.656 15.892 ( 0.599 2.735 -0.794) 2.910 15.892 ( -0.599 2.735 0.794) 2.910 16.301 ( -11.767 -0.164 1.221) 11.831 16.301 ( 11.767 -0.164 -1.221) 11.831 16.882 ( -5.533 -1.333 -3.114) 6.488 16.882 ( 5.533 -1.333 3.114) 6.488 17.653 ( 1.007 5.629 -9.609) 11.182 17.653 ( -1.007 5.629 9.609) 11.182 18.608 ( 3.351 0.781 -6.276) 7.158 18.608 ( -3.351 0.781 6.276) 7.158 25.979 ( 0.472 2.101 -1.704) 2.746 25.979 ( -0.472 2.101 1.704) 2.746 26.180 ( -0.034 -1.324 -2.322) 2.673 26.180 ( 0.034 -1.324 2.322) 2.673 26.365 ( -1.186 -3.046 -9.791) 10.322 26.365 ( 1.186 -3.046 9.791) 10.322 26.865 ( -1.021 2.315 -3.238) 4.110 26.865 ( 1.021 2.315 3.238) 4.110 27.584 ( -3.341 -3.866 -10.392) 11.580 27.584 ( 3.341 -3.866 10.392) 11.580 28.657 ( 3.417 1.393 -10.011) 10.670 28.657 ( -3.417 1.393 10.011) 10.670 29.293 ( -8.388 -5.429 -1.224) 10.066 29.293 ( 8.388 -5.429 1.224) 10.066 29.477 ( -6.915 8.646 -7.118) 13.162 29.477 ( 6.915 8.646 7.118) 13.162 ======================= Grid point 280 (135/140) ======================= q-point: ( 0.33 0.33 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.965 ( 8.127 0.000 -2.710) 8.567 1.268 ( 18.421 0.000 -8.030) 20.095 1.393 ( -4.934 -0.000 -6.397) 8.078 2.126 ( -0.722 -0.000 -2.249) 2.362 2.245 ( 6.897 0.000 4.644) 8.315 2.263 ( -2.137 -0.000 -4.996) 5.434 2.431 ( 8.551 0.000 -2.035) 8.790 2.559 ( -14.852 -0.000 -11.479) 18.771 2.763 ( -0.254 -0.000 10.380) 10.383 2.918 ( 1.650 0.000 -3.980) 4.308 2.978 ( 18.696 0.000 -11.296) 21.844 3.209 ( -9.387 -0.000 4.468) 10.396 3.317 ( 0.505 0.000 10.340) 10.352 3.515 ( 8.270 0.000 -7.809) 11.374 3.682 ( -8.515 -0.000 1.395) 8.629 3.965 ( -5.025 -0.000 -1.261) 5.181 3.996 ( -3.994 -0.000 2.396) 4.658 4.067 ( -4.600 -0.000 -1.923) 4.985 4.273 ( 1.070 0.000 1.227) 1.628 4.289 ( -0.432 -0.000 -0.145) 0.456 4.377 ( 4.973 0.000 -5.924) 7.734 4.796 ( -0.369 -0.000 8.173) 8.181 4.927 ( -10.278 -0.000 1.776) 10.430 5.059 ( 0.353 0.000 -5.869) 5.880 5.238 ( 4.372 0.000 11.337) 12.151 5.515 ( 2.356 0.000 1.221) 2.654 5.571 ( -0.203 -0.000 5.347) 5.350 5.733 ( 7.882 0.000 -12.899) 15.117 6.025 ( -1.878 -0.000 0.948) 2.104 6.148 ( -2.383 -0.000 -3.724) 4.421 6.420 ( -2.312 -0.000 3.357) 4.076 6.525 ( 3.155 0.000 -6.365) 7.104 6.723 ( -1.277 -0.000 -3.960) 4.161 6.813 ( -3.860 -0.000 4.499) 5.928 6.972 ( 5.108 0.000 1.810) 5.419 7.261 ( 3.098 0.000 -4.362) 5.350 7.505 ( -1.337 -0.000 7.610) 7.727 7.650 ( -7.245 -0.000 7.747) 10.607 7.664 ( -7.733 -0.000 -2.114) 8.017 7.803 ( 7.514 0.000 -4.402) 8.709 8.503 ( 0.122 0.000 0.678) 0.689 9.010 ( -5.857 -0.000 -3.679) 6.917 9.292 ( 3.972 0.000 12.152) 12.785 9.366 ( -5.992 -0.000 16.485) 17.540 9.516 ( 2.319 0.000 6.717) 7.106 9.694 ( -0.432 -0.000 -5.064) 5.082 9.926 ( -9.845 -0.000 -3.223) 10.359 10.092 ( -7.764 -0.000 -19.528) 21.015 10.327 ( -3.114 -0.000 -6.423) 7.138 10.468 ( 1.668 0.000 -6.312) 6.529 11.125 ( 11.469 0.000 -1.882) 11.622 11.263 ( 2.016 0.000 3.434) 3.982 11.479 ( 7.165 0.000 -8.717) 11.284 11.577 ( 2.728 0.000 8.210) 8.651 11.754 ( 5.321 0.000 -2.650) 5.945 12.065 ( -1.001 -0.000 0.883) 1.335 12.066 ( -1.672 -0.000 0.811) 1.858 12.169 ( -3.258 -0.000 -4.913) 5.895 12.263 ( -0.489 -0.000 2.789) 2.832 12.348 ( -2.277 -0.000 -14.347) 14.526 12.671 ( -5.502 -0.000 3.708) 6.634 12.782 ( -5.380 -0.000 -2.864) 6.095 13.360 ( -4.035 -0.000 10.568) 11.312 13.727 ( -0.514 -0.000 -8.717) 8.732 15.089 ( -0.550 -0.000 3.458) 3.501 15.111 ( -1.655 -0.000 -2.399) 2.915 15.381 ( 2.851 0.000 4.021) 4.929 15.582 ( 5.684 0.000 -8.893) 10.554 15.659 ( -8.439 -0.000 5.265) 9.947 15.687 ( -0.094 -0.000 -2.751) 2.752 15.865 ( 4.032 0.000 -1.493) 4.299 15.918 ( -3.912 -0.000 5.891) 7.071 16.316 ( -0.808 -0.000 4.478) 4.551 16.363 ( 0.769 0.000 0.310) 0.829 16.567 ( 2.344 0.000 1.301) 2.681 16.655 ( -2.826 -0.000 -0.172) 2.831 18.065 ( 18.131 0.000 1.170) 18.169 18.502 ( -1.348 -0.000 7.011) 7.139 18.663 ( 2.604 0.000 -4.863) 5.517 18.792 ( -8.692 -0.000 12.452) 15.185 25.877 ( 1.361 0.000 0.845) 1.602 25.891 ( 1.957 0.000 -0.990) 2.194 26.051 ( -2.136 -0.000 -1.232) 2.466 26.090 ( -2.919 -0.000 -1.150) 3.138 26.318 ( -2.879 -0.000 0.040) 2.880 26.377 ( 0.206 0.000 -4.571) 4.576 26.907 ( -0.908 -0.000 1.232) 1.530 26.990 ( 0.402 0.000 0.503) 0.643 27.314 ( -2.648 -0.000 1.607) 3.098 27.698 ( -8.829 -0.000 -23.661) 25.255 28.473 ( -0.537 -0.000 3.278) 3.322 28.515 ( 3.130 0.000 -2.188) 3.819 28.769 ( -3.604 -0.000 14.010) 14.466 28.777 ( 5.137 0.000 3.945) 6.477 29.995 ( 4.412 0.000 26.881) 27.240 30.479 ( 11.282 0.000 -21.052) 23.884 ======================= Grid point 281 (136/140) ======================= q-point: ( 0.44 0.33 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.233 ( 5.623 -20.637 0.462) 21.395 1.493 ( 0.594 -16.457 -7.806) 18.224 1.531 ( 17.624 -12.374 4.006) 21.903 2.176 ( -3.870 -8.817 0.320) 9.634 2.250 ( -2.420 -3.012 -9.945) 10.670 2.348 ( 6.803 -1.783 5.801) 9.117 2.400 ( -10.727 -3.664 -6.517) 13.075 2.493 ( 1.622 -2.513 -3.493) 4.599 2.868 ( -0.030 -5.464 7.103) 8.962 2.928 ( 5.914 1.273 -4.254) 7.395 2.990 ( 1.708 0.801 -3.382) 3.872 3.133 ( -4.381 5.430 1.580) 7.153 3.397 ( 0.629 -4.084 6.023) 7.304 3.541 ( -0.849 -0.584 -5.574) 5.669 3.695 ( 5.627 -6.869 -2.707) 9.283 3.957 ( -0.679 1.841 3.178) 3.735 3.991 ( -9.169 -8.283 -0.733) 12.378 4.052 ( -3.164 -2.095 -2.533) 4.562 4.250 ( 0.862 2.401 -1.130) 2.790 4.276 ( -5.124 0.735 2.838) 5.903 4.411 ( 11.795 0.806 -4.794) 12.758 4.824 ( -3.072 4.168 -1.944) 5.531 4.828 ( -6.442 -1.441 9.112) 11.252 5.026 ( -1.499 0.937 -5.224) 5.515 5.341 ( 2.721 -1.260 12.231) 12.593 5.507 ( 1.901 3.868 2.640) 5.054 5.592 ( -1.839 -0.313 2.041) 2.765 5.689 ( 4.090 1.790 -15.382) 16.016 5.993 ( 0.857 3.053 3.087) 4.426 6.110 ( -0.471 0.105 -4.568) 4.594 6.418 ( 2.048 1.754 7.170) 7.661 6.515 ( 2.349 1.220 -5.096) 5.743 6.654 ( 1.153 3.282 -1.208) 3.683 6.799 ( -5.926 0.807 2.748) 6.582 7.064 ( 1.569 -5.155 0.548) 5.416 7.248 ( -0.494 0.626 -3.697) 3.782 7.455 ( 1.590 6.689 3.569) 7.747 7.584 ( -7.789 2.830 7.357) 11.082 7.694 ( -1.450 -3.062 0.786) 3.478 7.819 ( 2.636 0.407 -6.205) 6.753 8.629 ( 2.846 -10.713 1.973) 11.259 8.951 ( -9.237 -4.184 -4.281) 11.007 9.360 ( 4.445 0.021 12.573) 13.335 9.488 ( 1.512 -3.556 11.927) 12.538 9.564 ( -1.108 -2.150 6.078) 6.541 9.739 ( 2.033 -5.028 -1.070) 5.529 9.860 ( -5.087 -4.288 -10.433) 12.374 10.013 ( -9.023 -6.881 -10.482) 15.448 10.278 ( -0.675 1.115 -3.371) 3.614 10.417 ( -1.374 1.956 -7.004) 7.400 11.201 ( 9.280 0.332 0.965) 9.336 11.339 ( 1.737 -5.005 0.547) 5.326 11.492 ( 7.248 0.143 -6.821) 9.954 11.604 ( -1.095 0.470 3.489) 3.687 11.808 ( 5.624 -0.765 0.712) 5.721 12.039 ( -1.585 0.503 2.838) 3.289 12.060 ( -0.228 0.555 0.918) 1.097 12.150 ( -2.134 -0.370 -4.653) 5.133 12.247 ( -1.772 -1.240 -9.736) 9.974 12.337 ( -3.388 -6.281 1.071) 7.217 12.651 ( -4.616 0.488 3.596) 5.872 12.720 ( -4.737 -0.185 -3.556) 5.926 13.338 ( 2.114 7.846 9.529) 12.523 13.612 ( -2.385 7.373 -7.776) 10.978 15.090 ( 1.387 0.469 -3.021) 3.357 15.114 ( -2.633 -1.177 3.542) 4.568 15.345 ( 2.203 7.746 4.511) 9.231 15.511 ( -1.463 5.710 -5.242) 7.888 15.636 ( -0.846 -0.657 0.117) 1.077 15.674 ( -1.678 -0.189 -2.270) 2.829 15.879 ( -0.401 0.445 5.993) 6.023 15.924 ( 2.772 -0.378 -3.359) 4.372 16.305 ( 1.699 1.869 5.694) 6.230 16.398 ( -0.264 -1.689 -0.637) 1.824 16.619 ( 0.745 -3.131 1.295) 3.469 16.688 ( -2.936 -5.599 -0.813) 6.374 18.154 ( 17.399 6.567 1.222) 18.637 18.531 ( -1.193 0.338 5.127) 5.275 18.655 ( 0.032 0.403 -3.893) 3.914 18.658 ( -9.988 9.506 6.904) 15.420 25.914 ( 1.741 -1.867 0.325) 2.574 25.920 ( 1.822 -2.335 0.534) 3.009 26.033 ( -2.069 -0.584 -1.035) 2.386 26.072 ( -3.086 -1.437 -1.842) 3.871 26.278 ( 0.408 2.163 -0.130) 2.205 26.370 ( -2.405 -1.397 -3.501) 4.472 26.897 ( -0.234 0.979 1.687) 1.965 27.002 ( -1.601 -1.563 -3.737) 4.355 27.307 ( 0.129 0.432 6.265) 6.281 27.582 ( -5.066 -3.336 -17.071) 18.117 28.499 ( -0.506 -1.628 3.957) 4.309 28.526 ( 2.527 -0.621 -2.497) 3.606 28.841 ( -2.246 -3.367 11.734) 12.412 28.870 ( 4.259 -4.502 1.258) 6.324 30.078 ( -0.330 7.015 24.391) 25.382 30.380 ( 8.762 8.150 -21.884) 24.942 ======================= Grid point 282 (137/140) ======================= q-point: ( 0.56 0.33 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 243 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.643 ( 4.325 -20.536 2.830) 21.177 1.760 ( -2.218 -19.164 -8.499) 21.081 1.942 ( 13.987 -15.407 8.994) 22.670 2.218 ( 0.596 -2.323 -10.604) 10.872 2.300 ( -3.733 -4.453 2.104) 6.180 2.338 ( -8.304 -1.263 1.103) 8.472 2.541 ( 2.158 -10.610 0.060) 10.827 2.565 ( 1.198 -6.879 -1.710) 7.189 2.878 ( 3.174 2.584 -1.191) 4.263 2.939 ( -3.106 0.234 -0.514) 3.157 3.047 ( -1.847 -2.118 2.831) 3.989 3.076 ( -2.521 -7.535 -1.017) 8.011 3.456 ( 3.311 0.606 1.863) 3.848 3.523 ( -4.816 -2.547 0.234) 5.453 3.892 ( 4.462 -2.196 5.020) 7.066 3.948 ( 8.460 -3.160 -4.409) 10.050 4.009 ( -1.638 2.493 -9.254) 9.723 4.085 ( -11.459 -8.622 3.566) 14.777 4.212 ( 4.876 -0.114 -5.701) 7.502 4.257 ( -7.534 -1.836 6.288) 9.984 4.501 ( 12.411 -2.120 -0.776) 12.615 4.697 ( -10.423 1.627 -1.213) 10.619 4.867 ( 4.417 1.375 3.497) 5.800 4.961 ( -3.637 2.049 -2.230) 4.733 5.408 ( 3.123 1.895 4.855) 6.076 5.474 ( -2.479 0.715 5.869) 6.411 5.562 ( -2.812 1.887 1.059) 3.548 5.615 ( 1.230 0.871 -12.125) 12.218 5.994 ( 4.401 1.639 4.811) 6.723 6.087 ( -1.236 -0.352 -4.268) 4.457 6.456 ( 1.258 0.453 6.672) 6.804 6.483 ( 2.861 1.811 -3.770) 5.067 6.642 ( 6.123 1.341 -0.371) 6.279 6.737 ( -6.193 1.682 2.413) 6.856 7.131 ( -2.535 -2.045 0.114) 3.259 7.159 ( -3.920 3.811 -3.158) 6.314 7.449 ( 7.450 0.457 -1.408) 7.596 7.505 ( -7.194 3.512 8.246) 11.493 7.696 ( 0.115 2.027 1.101) 2.310 7.768 ( -1.133 1.856 -7.289) 7.606 8.858 ( 2.856 -10.677 3.339) 11.546 8.977 ( -6.637 -7.949 -4.475) 11.281 9.489 ( 5.670 -3.234 7.231) 9.741 9.569 ( 1.815 -1.377 -0.406) 2.314 9.649 ( 0.661 -1.833 12.840) 12.987 9.776 ( -3.883 -1.010 0.982) 4.131 9.971 ( 11.793 -12.772 -19.499) 26.123 10.057 ( -11.967 -9.094 5.188) 15.900 10.260 ( -0.060 -0.481 1.276) 1.365 10.345 ( -5.517 -1.564 -5.766) 8.133 11.268 ( 7.899 0.963 3.746) 8.795 11.402 ( -3.252 -2.603 -4.440) 6.088 11.531 ( 7.116 -0.478 -1.594) 7.308 11.609 ( -2.772 -2.773 -0.346) 3.936 11.864 ( 5.396 1.011 3.775) 6.662 12.002 ( -3.518 6.779 1.317) 7.750 12.046 ( -0.951 1.265 -0.553) 1.677 12.061 ( -1.904 0.030 -4.721) 5.091 12.320 ( 4.639 -7.235 -1.202) 8.678 12.444 ( -8.628 -10.286 -0.967) 13.461 12.630 ( 0.681 0.372 2.099) 2.238 12.688 ( -3.300 -1.239 -2.268) 4.191 13.230 ( 5.127 12.318 7.488) 15.300 13.379 ( -4.892 11.642 -6.396) 14.155 15.076 ( 3.467 1.369 -4.022) 5.484 15.103 ( -4.029 1.720 3.825) 5.815 15.275 ( 1.916 3.901 4.955) 6.591 15.368 ( -2.977 4.785 -5.321) 7.751 15.637 ( 1.714 0.545 -1.331) 2.238 15.659 ( -1.918 -0.399 0.127) 1.963 15.909 ( 2.048 -0.930 1.257) 2.577 15.940 ( -0.306 -1.319 -0.689) 1.519 16.323 ( 4.640 1.989 2.859) 5.802 16.400 ( -3.514 0.075 0.514) 3.552 16.696 ( 1.216 -4.177 2.148) 4.852 16.752 ( -3.122 -5.228 -2.234) 6.486 18.128 ( 14.628 11.791 0.686) 18.801 18.332 ( -10.922 14.611 1.423) 18.297 18.591 ( -0.561 0.022 6.062) 6.088 18.640 ( 0.389 -0.149 -4.925) 4.942 25.966 ( 2.001 -2.321 0.571) 3.117 25.991 ( 0.398 -3.709 0.739) 3.803 26.032 ( -0.323 -0.963 0.089) 1.020 26.071 ( -2.558 -2.151 -1.813) 3.802 26.265 ( 2.810 1.076 1.109) 3.207 26.344 ( -4.265 -0.709 -3.327) 5.456 26.897 ( 1.051 0.663 2.962) 3.212 26.971 ( -2.369 0.132 -5.945) 6.401 27.376 ( 2.108 -2.052 9.999) 10.423 27.528 ( -3.961 -2.628 -12.234) 13.125 28.552 ( 0.463 -2.407 2.636) 3.600 28.561 ( 1.144 -2.964 -0.998) 3.330 28.957 ( -0.208 -5.641 7.617) 9.481 28.991 ( 1.363 -6.556 -0.811) 6.745 30.011 ( -1.985 11.534 18.258) 21.687 30.143 ( 5.117 13.329 -19.452) 24.130 ======================= Grid point 283 (138/140) ======================= q-point: ( 0.67 0.33 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.987 ( -2.174 -13.395 -6.216) 14.926 1.987 ( 2.174 -13.395 6.216) 14.926 2.229 ( 4.088 2.407 -6.377) 7.948 2.229 ( -4.088 2.407 6.377) 7.948 2.333 ( -9.519 -9.910 -6.197) 15.073 2.333 ( 9.519 -9.910 6.197) 15.073 2.694 ( -0.679 -5.459 -4.533) 7.128 2.694 ( 0.679 -5.459 4.533) 7.128 2.923 ( 0.146 -3.910 -7.778) 8.706 2.923 ( -0.146 -3.910 7.778) 8.706 3.130 ( -2.197 -3.272 -3.693) 5.401 3.130 ( 2.197 -3.272 3.693) 5.401 3.527 ( -5.012 -3.410 -4.194) 7.371 3.527 ( 5.012 -3.410 4.194) 7.371 3.860 ( -0.551 6.480 -8.093) 10.383 3.860 ( 0.551 6.480 8.093) 10.383 4.120 ( -5.227 -4.396 -3.141) 7.517 4.120 ( 5.227 -4.396 3.141) 7.517 4.283 ( 2.412 -3.862 -8.149) 9.335 4.283 ( -2.412 -3.862 8.149) 9.335 4.636 ( -0.309 -3.729 -2.282) 4.383 4.636 ( 0.309 -3.729 2.282) 4.383 4.865 ( -0.021 4.567 -3.657) 5.851 4.865 ( 0.021 4.567 3.657) 5.851 5.435 ( -5.264 0.877 -6.477) 8.392 5.435 ( 5.264 0.877 6.477) 8.392 5.569 ( 1.004 -1.583 -10.366) 10.534 5.569 ( -1.004 -1.583 10.366) 10.534 6.042 ( -4.962 0.624 -4.676) 6.847 6.042 ( 4.962 0.624 4.676) 6.847 6.453 ( 0.903 2.596 -4.713) 5.456 6.453 ( -0.903 2.596 4.713) 5.456 6.686 ( -0.779 -0.755 -2.640) 2.854 6.686 ( 0.779 -0.755 2.640) 2.854 7.099 ( -4.305 2.125 -2.682) 5.499 7.099 ( 4.305 2.125 2.682) 5.499 7.454 ( 5.046 1.991 -9.011) 10.518 7.454 ( -5.046 1.991 9.011) 10.518 7.691 ( -2.288 0.931 -6.256) 6.727 7.691 ( 2.288 0.931 6.256) 6.727 9.046 ( -0.277 -6.721 -6.982) 9.695 9.046 ( 0.277 -6.721 6.982) 9.695 9.566 ( 2.125 0.665 -4.357) 4.893 9.566 ( -2.125 0.665 4.357) 4.893 9.755 ( -3.188 -1.987 -7.434) 8.330 9.755 ( 3.188 -1.987 7.434) 8.330 10.178 ( 9.196 -9.033 -14.653) 19.516 10.178 ( -9.196 -9.033 14.653) 19.516 10.338 ( -3.166 -5.353 -6.136) 8.736 10.338 ( 3.166 -5.353 6.136) 8.736 11.340 ( -6.679 0.650 -6.063) 9.044 11.340 ( 6.679 0.650 6.063) 9.044 11.597 ( -8.632 0.777 -3.587) 9.379 11.597 ( 8.632 0.777 3.587) 9.379 11.861 ( -1.859 4.013 -0.683) 4.475 11.861 ( 1.859 4.013 0.683) 4.475 12.041 ( 1.129 -0.294 -3.527) 3.715 12.041 ( -1.129 -0.294 3.527) 3.715 12.478 ( -4.452 -3.104 -4.888) 7.304 12.478 ( 4.452 -3.104 4.888) 7.304 12.680 ( -1.066 -0.399 -2.607) 2.845 12.680 ( 1.066 -0.399 2.607) 2.845 13.140 ( -7.180 4.658 -4.310) 9.583 13.140 ( 7.180 4.658 4.310) 9.583 15.067 ( 2.496 0.364 -5.080) 5.672 15.067 ( -2.496 0.364 5.080) 5.672 15.269 ( -0.716 2.041 -5.239) 5.668 15.269 ( 0.716 2.041 5.239) 5.668 15.656 ( -1.712 -1.536 -1.397) 2.691 15.656 ( 1.712 -1.536 1.397) 2.691 15.944 ( 1.572 -0.324 -2.238) 2.754 15.944 ( -1.572 -0.324 2.238) 2.754 16.340 ( -2.907 1.950 -2.507) 4.305 16.340 ( 2.907 1.950 2.507) 4.305 16.794 ( -0.443 -3.899 -4.443) 5.928 16.794 ( 0.443 -3.899 4.443) 5.928 18.004 ( -2.339 13.892 -5.726) 15.207 18.004 ( 2.339 13.892 5.726) 15.207 18.618 ( 1.715 -0.074 -6.424) 6.649 18.618 ( -1.715 -0.074 6.424) 6.649 26.015 ( -1.265 -0.660 -1.460) 2.041 26.015 ( 1.265 -0.660 1.460) 2.041 26.089 ( -1.662 -3.148 -1.805) 3.991 26.089 ( 1.662 -3.148 1.805) 3.991 26.301 ( -0.117 -0.642 -7.583) 7.611 26.301 ( 0.117 -0.642 7.583) 7.611 26.917 ( -1.892 0.790 -4.742) 5.166 26.917 ( 1.892 0.790 4.742) 5.166 27.486 ( -2.506 -2.316 -10.979) 11.497 27.486 ( 2.506 -2.316 10.979) 11.497 28.614 ( 3.868 -3.064 -5.843) 7.648 28.614 ( -3.868 -3.064 5.843) 7.648 29.092 ( -1.778 -6.299 -2.659) 7.065 29.092 ( 1.778 -6.299 2.659) 7.065 29.858 ( 2.291 13.146 -12.737) 18.447 29.858 ( -2.291 13.146 12.737) 18.447 ======================= Grid point 291 (139/140) ======================= q-point: ( 0.44 0.44 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.120 ( 8.200 0.000 4.717) 9.460 1.269 ( -4.200 -0.000 -5.689) 7.071 1.653 ( 24.294 0.000 10.639) 26.521 2.053 ( -3.933 -0.000 0.156) 3.936 2.125 ( -3.949 -0.000 -7.275) 8.278 2.154 ( -18.389 -0.000 -13.951) 23.083 2.442 ( 7.939 0.000 2.966) 8.475 2.509 ( 0.691 0.000 0.818) 1.071 2.866 ( 1.019 0.000 9.104) 9.161 2.923 ( 2.509 0.000 -3.661) 4.438 3.092 ( 6.994 0.000 -10.350) 12.492 3.110 ( -7.597 -0.000 4.562) 8.861 3.402 ( 0.699 0.000 7.612) 7.644 3.501 ( 1.649 0.000 -10.590) 10.718 3.661 ( 4.926 0.000 3.147) 5.846 3.823 ( -10.373 -0.000 -1.259) 10.449 3.978 ( -1.138 -0.000 2.199) 2.477 4.001 ( -1.156 -0.000 -2.464) 2.722 4.273 ( -4.185 -0.000 5.772) 7.130 4.274 ( 1.907 0.000 -4.349) 4.748 4.508 ( 14.848 0.000 -3.562) 15.269 4.720 ( -15.715 -0.000 3.960) 16.206 4.901 ( 2.950 0.000 3.501) 4.578 4.987 ( -2.075 -0.000 -5.347) 5.735 5.430 ( 2.196 0.000 15.532) 15.687 5.574 ( -2.005 -0.000 -3.239) 3.810 5.578 ( 2.975 0.000 2.159) 3.676 5.654 ( 1.569 0.000 -13.330) 13.422 6.034 ( 0.196 0.000 2.543) 2.550 6.075 ( -0.883 -0.000 -4.357) 4.445 6.482 ( 0.362 0.000 7.146) 7.155 6.521 ( 3.211 0.000 -5.502) 6.371 6.688 ( 1.879 0.000 -2.474) 3.106 6.747 ( -7.315 -0.000 2.255) 7.655 7.078 ( 6.226 0.000 3.283) 7.039 7.211 ( -4.304 -0.000 -4.300) 6.084 7.569 ( 0.262 0.000 -4.245) 4.253 7.571 ( -4.449 -0.000 5.454) 7.038 7.678 ( 2.254 0.000 11.112) 11.338 7.803 ( 0.586 0.000 -8.395) 8.415 8.592 ( 7.832 0.000 4.054) 8.819 8.801 ( -11.806 -0.000 -5.318) 12.948 9.455 ( -0.079 -0.000 13.969) 13.969 9.520 ( 6.739 0.000 2.944) 7.355 9.562 ( -5.470 -0.000 10.883) 12.180 9.644 ( 4.302 0.000 -10.652) 11.487 9.769 ( -7.380 -0.000 2.153) 7.688 9.830 ( -2.898 -0.000 -16.217) 16.474 10.300 ( 2.168 0.000 2.544) 3.343 10.398 ( -1.858 -0.000 -7.483) 7.711 11.262 ( 7.605 0.000 -2.531) 8.015 11.303 ( -1.655 -0.000 3.356) 3.741 11.516 ( 7.034 0.000 -5.574) 8.974 11.592 ( -5.790 -0.000 1.378) 5.952 11.881 ( 9.370 0.000 4.933) 10.589 12.022 ( -0.079 -0.000 1.115) 1.118 12.065 ( 2.056 0.000 -3.675) 4.211 12.101 ( -7.055 -0.000 -1.792) 7.279 12.217 ( -1.841 -0.000 -4.490) 4.853 12.232 ( -4.277 -0.000 0.485) 4.304 12.654 ( -3.258 -0.000 5.743) 6.603 12.676 ( -0.545 -0.000 -4.686) 4.718 13.478 ( 4.055 0.000 8.668) 9.569 13.618 ( -3.063 -0.000 -7.864) 8.439 15.095 ( 1.809 0.000 -2.223) 2.866 15.103 ( -1.929 -0.000 2.979) 3.549 15.465 ( 2.724 0.000 3.726) 4.615 15.538 ( -2.902 -0.000 -2.435) 3.789 15.618 ( -0.025 -0.000 -0.512) 0.513 15.638 ( -1.433 -0.000 -2.174) 2.603 15.915 ( 2.947 0.000 -1.451) 3.284 15.925 ( -1.843 -0.000 3.658) 4.096 16.351 ( 0.222 0.000 2.754) 2.763 16.368 ( 0.410 0.000 -1.119) 1.192 16.602 ( 0.392 0.000 1.508) 1.558 16.621 ( -0.783 -0.000 -1.148) 1.390 18.359 ( 17.873 0.000 0.583) 17.882 18.545 ( -2.311 -0.000 3.841) 4.483 18.639 ( 1.409 0.000 -5.812) 5.980 18.669 ( -15.083 -0.000 6.755) 16.527 25.911 ( 1.464 0.000 0.776) 1.656 25.915 ( 1.409 0.000 -0.106) 1.413 26.009 ( -1.573 -0.000 -0.089) 1.575 26.027 ( -2.316 -0.000 -2.086) 3.117 26.300 ( -1.912 -0.000 3.753) 4.212 26.328 ( 0.813 0.000 -5.990) 6.045 26.918 ( 0.228 0.000 2.674) 2.683 26.963 ( -1.096 -0.000 -3.369) 3.543 27.342 ( -1.025 -0.000 8.763) 8.823 27.449 ( -0.559 -0.000 -14.829) 14.839 28.497 ( -0.487 -0.000 3.186) 3.223 28.517 ( 1.066 0.000 -3.155) 3.330 28.848 ( -3.018 -0.000 10.832) 11.244 28.863 ( 4.641 0.000 -3.577) 5.860 30.253 ( -4.750 -0.000 27.110) 27.523 30.404 ( 8.331 0.000 -24.757) 26.121 ======================= Grid point 292 (140/140) ======================= q-point: ( 0.56 0.44 -0.50) 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 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 8.27e-07 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.365 ( -3.874 -17.275 -8.072) 19.457 1.365 ( 3.874 -17.275 8.072) 19.457 1.948 ( -19.347 -6.182 -12.208) 23.697 1.948 ( 19.347 -6.182 12.208) 23.697 2.190 ( -2.388 -10.757 -5.842) 12.472 2.190 ( 2.388 -10.757 5.842) 12.472 2.490 ( -3.642 0.123 -1.273) 3.860 2.490 ( 3.642 0.123 1.273) 3.860 2.936 ( -1.628 -1.640 -2.904) 3.711 2.936 ( 1.628 -1.640 2.904) 3.711 3.028 ( -4.847 4.134 -3.136) 7.101 3.028 ( 4.847 4.134 3.136) 7.101 3.470 ( -0.351 -1.272 -6.459) 6.592 3.470 ( 0.351 -1.272 6.459) 6.592 3.822 ( -6.688 -9.129 -1.640) 11.435 3.822 ( 6.688 -9.129 1.640) 11.435 3.992 ( -0.885 -0.408 -3.237) 3.380 3.992 ( 0.885 -0.408 3.237) 3.380 4.247 ( 4.580 2.204 -6.267) 8.069 4.247 ( -4.580 2.204 6.267) 8.069 4.607 ( -15.029 0.664 1.155) 15.088 4.607 ( 15.029 0.664 -1.155) 15.088 4.935 ( -2.903 0.791 -5.199) 6.007 4.935 ( 2.903 0.791 5.199) 6.007 5.496 ( -1.119 2.277 -10.625) 10.924 5.496 ( 1.119 2.277 10.625) 10.924 5.597 ( 0.520 1.435 -6.698) 6.870 5.597 ( -0.520 1.435 6.698) 6.870 6.051 ( -1.329 0.053 -4.282) 4.483 6.051 ( 1.329 0.053 4.282) 4.483 6.500 ( 1.668 1.094 -5.959) 6.284 6.500 ( -1.668 1.094 5.959) 6.284 6.704 ( -3.472 0.278 -1.049) 3.637 6.704 ( 3.472 0.278 1.049) 3.637 7.142 ( -5.529 0.590 -3.338) 6.486 7.142 ( 5.529 0.590 3.338) 6.486 7.531 ( 6.756 2.928 -4.855) 8.819 7.531 ( -6.756 2.928 4.855) 8.819 7.749 ( -1.539 0.669 -7.424) 7.612 7.749 ( 1.539 0.669 7.424) 7.612 8.757 ( -8.445 -7.580 -4.393) 12.169 8.757 ( 8.445 -7.580 4.393) 12.169 9.512 ( 1.994 -1.263 -10.751) 11.007 9.512 ( -1.994 -1.263 10.751) 11.007 9.690 ( 1.837 -4.387 -20.523) 21.067 9.690 ( -1.837 -4.387 20.523) 21.067 9.805 ( -4.659 -7.654 -2.815) 9.392 9.805 ( 4.659 -7.654 2.815) 9.392 10.315 ( -1.203 2.743 -6.870) 7.494 10.315 ( 1.203 2.743 6.870) 7.494 11.319 ( 0.115 -2.142 -4.438) 4.929 11.319 ( -0.115 -2.142 4.438) 4.929 11.552 ( 3.203 -0.471 -1.393) 3.525 11.552 ( -3.203 -0.471 1.393) 3.525 11.976 ( -7.312 1.006 -9.138) 11.747 11.976 ( 7.312 1.006 9.138) 11.747 12.065 ( 2.463 0.366 -4.781) 5.390 12.065 ( -2.463 0.366 4.781) 5.390 12.244 ( -2.314 -5.018 -2.012) 5.881 12.244 ( 2.314 -5.018 2.012) 5.881 12.655 ( 1.570 0.397 -5.127) 5.376 12.655 ( -1.570 0.397 5.127) 5.376 13.483 ( -4.276 7.815 -7.734) 11.797 13.483 ( 4.276 7.815 7.734) 11.797 15.100 ( 3.439 0.073 -3.582) 4.966 15.100 ( -3.439 0.073 3.582) 4.966 15.428 ( -0.524 7.097 -6.529) 9.658 15.428 ( 0.524 7.097 6.529) 9.658 15.639 ( 2.892 -1.029 -5.110) 5.961 15.639 ( -2.892 -1.029 5.110) 5.961 15.919 ( 1.488 0.178 -4.761) 4.992 15.919 ( -1.488 0.178 4.761) 4.992 16.373 ( -0.272 -0.529 -3.738) 3.785 16.373 ( 0.272 -0.529 3.738) 3.785 16.645 ( -0.596 -3.723 -2.001) 4.268 16.645 ( 0.596 -3.723 2.001) 4.268 18.425 ( -13.136 7.829 -0.743) 15.310 18.425 ( 13.136 7.829 0.743) 15.310 18.619 ( 1.792 0.433 -6.591) 6.844 18.619 ( -1.792 0.433 6.591) 6.844 25.940 ( -0.617 -2.179 0.016) 2.265 25.940 ( 0.617 -2.179 -0.016) 2.265 26.017 ( -0.651 -1.176 -1.631) 2.113 26.017 ( 0.651 -1.176 1.631) 2.113 26.305 ( 1.347 0.421 -5.497) 5.675 26.305 ( -1.347 0.421 5.497) 5.675 26.935 ( -1.282 0.324 -4.018) 4.230 26.935 ( 1.282 0.324 4.018) 4.230 27.405 ( -0.570 -2.099 -11.666) 11.867 27.405 ( 0.570 -2.099 11.666) 11.867 28.522 ( 1.188 -1.656 -3.551) 4.094 28.522 ( -1.188 -1.656 3.551) 4.094 28.900 ( 2.879 -3.695 -6.802) 8.258 28.900 ( -2.879 -3.695 6.802) 8.258 30.266 ( 5.853 8.188 -24.291) 26.294 30.266 ( -5.853 8.188 24.291) 26.294 =================== End of collection of collisions =================== ----------- Thermal conductivity (W/m-k) with tetrahedron method ----------- # T(K) xx yy zz yz xz xy #ipm 0.0 0.000 0.000 0.000 0.000 0.000 0.000 3/46656 10.0 1795.226 1170.033 1386.656 0.000 -29.404 0.000 3/46656 20.0 240.482 210.248 192.681 0.000 0.035 0.000 3/46656 30.0 89.540 86.406 73.956 0.000 1.033 0.000 3/46656 40.0 48.090 48.281 40.597 0.000 0.750 0.000 3/46656 50.0 31.074 31.793 26.620 0.000 0.561 0.000 3/46656 60.0 22.363 23.104 19.359 0.000 0.446 0.000 3/46656 70.0 17.240 17.900 15.043 0.000 0.370 0.000 3/46656 80.0 13.929 14.499 12.230 0.000 0.315 0.000 3/46656 90.0 11.642 12.130 10.273 0.000 0.273 0.000 3/46656 100.0 9.981 10.400 8.844 0.000 0.240 0.000 3/46656 110.0 8.728 9.089 7.759 0.000 0.213 0.000 3/46656 120.0 7.752 8.066 6.910 0.000 0.192 0.000 3/46656 130.0 6.974 7.248 6.230 0.000 0.173 0.000 3/46656 140.0 6.341 6.581 5.674 0.000 0.158 0.000 3/46656 150.0 5.816 6.028 5.211 0.000 0.145 0.000 3/46656 160.0 5.374 5.561 4.820 0.000 0.133 0.000 3/46656 170.0 4.998 5.164 4.485 0.000 0.124 0.000 3/46656 180.0 4.673 4.820 4.196 0.000 0.115 0.000 3/46656 190.0 4.391 4.521 3.944 0.000 0.108 0.000 3/46656 200.0 4.143 4.259 3.722 0.000 0.102 0.000 3/46656 210.0 3.923 4.026 3.525 0.000 0.096 0.000 3/46656 220.0 3.727 3.819 3.349 0.000 0.091 0.000 3/46656 230.0 3.551 3.633 3.191 0.000 0.087 0.000 3/46656 240.0 3.392 3.465 3.048 0.000 0.083 0.000 3/46656 250.0 3.248 3.312 2.918 0.000 0.080 0.000 3/46656 260.0 3.116 3.173 2.800 0.000 0.077 0.000 3/46656 270.0 2.996 3.046 2.691 0.000 0.074 0.000 3/46656 280.0 2.885 2.930 2.592 0.000 0.071 0.000 3/46656 290.0 2.783 2.822 2.500 0.000 0.069 0.000 3/46656 300.0 2.688 2.722 2.415 0.000 0.067 0.000 3/46656 310.0 2.600 2.630 2.335 0.000 0.065 0.000 3/46656 320.0 2.518 2.544 2.262 0.000 0.064 0.000 3/46656 330.0 2.442 2.464 2.193 0.000 0.062 0.000 3/46656 340.0 2.370 2.389 2.128 0.000 0.061 0.000 3/46656 350.0 2.303 2.318 2.068 0.000 0.060 0.000 3/46656 360.0 2.239 2.252 2.011 0.000 0.058 0.000 3/46656 370.0 2.180 2.190 1.957 0.000 0.057 0.000 3/46656 380.0 2.123 2.131 1.906 0.000 0.056 0.000 3/46656 390.0 2.070 2.075 1.858 0.000 0.055 0.000 3/46656 400.0 2.019 2.022 1.812 0.000 0.054 0.000 3/46656 410.0 1.971 1.972 1.769 0.000 0.053 0.000 3/46656 420.0 1.925 1.925 1.728 0.000 0.052 0.000 3/46656 430.0 1.881 1.880 1.689 0.000 0.052 0.000 3/46656 440.0 1.840 1.837 1.651 0.000 0.051 0.000 3/46656 450.0 1.800 1.796 1.616 0.000 0.050 0.000 3/46656 460.0 1.762 1.757 1.581 0.000 0.049 0.000 3/46656 470.0 1.726 1.719 1.549 0.000 0.049 0.000 3/46656 480.0 1.691 1.683 1.517 0.000 0.048 0.000 3/46656 490.0 1.657 1.649 1.487 0.000 0.047 0.000 3/46656 500.0 1.625 1.616 1.459 0.000 0.047 0.000 3/46656 510.0 1.594 1.584 1.431 0.000 0.046 0.000 3/46656 520.0 1.565 1.554 1.404 0.000 0.045 0.000 3/46656 530.0 1.536 1.525 1.379 0.000 0.045 0.000 3/46656 540.0 1.509 1.497 1.354 0.000 0.044 0.000 3/46656 550.0 1.482 1.470 1.330 0.000 0.044 0.000 3/46656 560.0 1.456 1.444 1.307 0.000 0.043 0.000 3/46656 570.0 1.432 1.418 1.285 0.000 0.043 0.000 3/46656 580.0 1.408 1.394 1.263 0.000 0.042 0.000 3/46656 590.0 1.385 1.371 1.243 0.000 0.042 0.000 3/46656 600.0 1.362 1.348 1.223 0.000 0.041 0.000 3/46656 610.0 1.341 1.326 1.203 0.000 0.041 0.000 3/46656 620.0 1.320 1.305 1.184 0.000 0.040 0.000 3/46656 630.0 1.300 1.284 1.166 0.000 0.040 0.000 3/46656 640.0 1.280 1.264 1.149 0.000 0.039 0.000 3/46656 650.0 1.261 1.245 1.131 0.000 0.039 0.000 3/46656 660.0 1.242 1.226 1.115 0.000 0.038 0.000 3/46656 670.0 1.224 1.208 1.099 0.000 0.038 0.000 3/46656 680.0 1.207 1.191 1.083 0.000 0.037 0.000 3/46656 690.0 1.190 1.174 1.068 0.000 0.037 0.000 3/46656 700.0 1.173 1.157 1.053 0.000 0.037 0.000 3/46656 710.0 1.157 1.141 1.039 0.000 0.036 0.000 3/46656 720.0 1.142 1.125 1.025 0.000 0.036 0.000 3/46656 730.0 1.126 1.110 1.011 0.000 0.035 0.000 3/46656 740.0 1.112 1.095 0.998 0.000 0.035 0.000 3/46656 750.0 1.097 1.081 0.985 0.000 0.035 0.000 3/46656 760.0 1.083 1.067 0.972 0.000 0.034 0.000 3/46656 770.0 1.070 1.053 0.960 0.000 0.034 0.000 3/46656 780.0 1.056 1.039 0.948 0.000 0.034 0.000 3/46656 790.0 1.043 1.026 0.936 0.000 0.033 0.000 3/46656 800.0 1.030 1.014 0.925 0.000 0.033 0.000 3/46656 810.0 1.018 1.001 0.914 0.000 0.033 0.000 3/46656 820.0 1.006 0.989 0.903 0.000 0.032 0.000 3/46656 830.0 0.994 0.977 0.892 0.000 0.032 0.000 3/46656 840.0 0.983 0.966 0.882 0.000 0.032 0.000 3/46656 850.0 0.971 0.955 0.872 0.000 0.031 0.000 3/46656 860.0 0.960 0.944 0.862 0.000 0.031 0.000 3/46656 870.0 0.950 0.933 0.852 0.000 0.031 0.000 3/46656 880.0 0.939 0.922 0.843 0.000 0.031 0.000 3/46656 890.0 0.929 0.912 0.833 0.000 0.030 0.000 3/46656 900.0 0.919 0.902 0.824 0.000 0.030 0.000 3/46656 910.0 0.909 0.892 0.816 0.000 0.030 0.000 3/46656 920.0 0.899 0.883 0.807 0.000 0.029 0.000 3/46656 930.0 0.890 0.873 0.798 0.000 0.029 0.000 3/46656 940.0 0.880 0.864 0.790 0.000 0.029 0.000 3/46656 950.0 0.871 0.855 0.782 0.000 0.029 0.000 3/46656 960.0 0.862 0.846 0.774 0.000 0.028 0.000 3/46656 970.0 0.854 0.837 0.766 0.000 0.028 0.000 3/46656 980.0 0.845 0.829 0.759 0.000 0.028 0.000 3/46656 990.0 0.837 0.821 0.751 0.000 0.028 0.000 3/46656 1000.0 0.829 0.813 0.744 0.000 0.027 0.000 3/46656 Thermal conductivity related properties were written into "kappa-m996.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 02:55:06]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|