----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 05:51:48]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.277012795625350 -7.647467265000000 0.000000000000000 b 3.277012795625350 7.647467265000000 0.000000000000000 c -2.592750940188644 0.000000000000000 5.162226448782766 Atomic positions (fractional): *1 H 0.24501640954373 0.23781704249699 0.57302572650110 1.008 2 H 0.76218295750301 0.75498359045627 0.92697427349890 1.008 3 H 0.75498359045627 0.76218295750301 0.42697427349890 1.008 4 H 0.23781704249699 0.24501640954373 0.07302572650110 1.008 *5 H 0.33539367065778 0.16432408039421 0.74757973497113 1.008 6 H 0.83567591960579 0.66460632934222 0.75242026502887 1.008 7 H 0.66460632934222 0.83567591960579 0.25242026502886 1.008 8 H 0.16432408039421 0.33539367065778 0.24757973497114 1.008 *9 O 0.61546135955580 0.83346284196310 0.94528619161347 15.999 *10 O 0.83397914539007 0.37337572079376 0.09003501339480 15.999 11 O 0.16602085460993 0.62662427920624 0.90996498660520 15.999 12 O 0.37337572079377 0.83397914539007 0.59003501339480 15.999 *13 O 0.14729601706260 0.28253231854403 0.06787969939313 15.999 14 O 0.71746768145597 0.85270398293740 0.43212030060687 15.999 15 O 0.85270398293740 0.71746768145597 0.93212030060687 15.999 16 O 0.28253231854403 0.14729601706260 0.56787969939313 15.999 17 O 0.38453864044420 0.16653715803690 0.05471380838653 15.999 18 O 0.83346284196311 0.61546135955580 0.44528619161347 15.999 19 O 0.62662427920623 0.16602085460993 0.40996498660520 15.999 20 O 0.16653715803689 0.38453864044420 0.55471380838653 15.999 *21 Ca 0.83285953474054 0.16714046525946 0.75000000000000 40.078 22 Ca 0.16714046525946 0.83285953474054 0.25000000000000 40.078 *23 Se 0.66912465765365 0.33087534234635 0.25000000000000 78.960 24 Se 0.33087534234635 0.66912465765365 0.75000000000000 78.960 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.554025591250699 0.000000000000000 0.000000000000000 b 0.000000000000000 15.294934530000001 0.000000000000000 c -2.592750940188644 0.000000000000000 5.162226448782766 Atomic positions (fractional): *1 H 0.24141672602036 0.99640031647663 0.57302572650110 1.008 > 1 2 H 0.75858327397964 0.99640031647663 0.92697427349890 1.008 > 2 3 H 0.25858327397964 0.50359968352337 0.42697427349890 1.008 > 3 4 H 0.74141672602036 0.50359968352337 0.07302572650110 1.008 > 4 *5 H 0.24985887552600 0.91446520486821 0.74757973497113 1.008 > 5 6 H 0.75014112447400 0.91446520486821 0.75242026502887 1.008 > 6 7 H 0.25014112447400 0.58553479513179 0.25242026502886 1.008 > 7 8 H 0.74985887552600 0.58553479513179 0.24757973497114 1.008 > 8 9 H 0.74141672602036 0.49640031647663 0.57302572650110 1.008 > 1 10 H 0.25858327397964 0.49640031647663 0.92697427349890 1.008 > 2 11 H 0.75858327397964 0.00359968352337 0.42697427349890 1.008 > 3 12 H 0.24141672602036 0.00359968352337 0.07302572650110 1.008 > 4 13 H 0.74985887552600 0.41446520486821 0.74757973497113 1.008 > 5 14 H 0.25014112447400 0.41446520486821 0.75242026502887 1.008 > 6 15 H 0.75014112447400 0.08553479513179 0.25242026502886 1.008 > 7 16 H 0.24985887552600 0.08553479513179 0.24757973497114 1.008 > 8 *17 O 0.22446210075945 0.60900074120365 0.94528619161347 15.999 > 9 *18 O 0.60367743309192 0.76969828770185 0.09003501339480 15.999 > 10 19 O 0.89632256690808 0.73030171229815 0.90996498660520 15.999 > 11 20 O 0.10367743309192 0.73030171229815 0.59003501339480 15.999 > 12 *21 O 0.71491416780331 0.56761815074071 0.06787969939313 15.999 > 13 22 O 0.28508583219668 0.56761815074071 0.43212030060687 15.999 > 14 23 O 0.78508583219669 0.93238184925929 0.93212030060687 15.999 > 15 24 O 0.21491416780331 0.93238184925929 0.56787969939313 15.999 > 16 25 O 0.27553789924055 0.89099925879635 0.05471380838653 15.999 > 17 26 O 0.72446210075946 0.89099925879635 0.44528619161347 15.999 > 18 27 O 0.39632256690808 0.76969828770185 0.40996498660520 15.999 > 19 28 O 0.77553789924054 0.60900074120365 0.55471380838653 15.999 > 20 29 O 0.72446210075946 0.10900074120365 0.94528619161347 15.999 > 9 30 O 0.10367743309192 0.26969828770185 0.09003501339480 15.999 > 10 31 O 0.39632256690808 0.23030171229815 0.90996498660520 15.999 > 11 32 O 0.60367743309192 0.23030171229815 0.59003501339480 15.999 > 12 33 O 0.21491416780331 0.06761815074071 0.06787969939313 15.999 > 13 34 O 0.78508583219669 0.06761815074071 0.43212030060687 15.999 > 14 35 O 0.28508583219668 0.43238184925929 0.93212030060687 15.999 > 15 36 O 0.71491416780331 0.43238184925929 0.56787969939313 15.999 > 16 37 O 0.77553789924054 0.39099925879635 0.05471380838653 15.999 > 17 38 O 0.22446210075945 0.39099925879635 0.44528619161347 15.999 > 18 39 O 0.89632256690808 0.26969828770185 0.40996498660520 15.999 > 19 40 O 0.27553789924055 0.10900074120365 0.55471380838653 15.999 > 20 *41 Ca 0.50000000000000 0.66714046525946 0.75000000000000 40.078 > 21 42 Ca 0.00000000000000 0.83285953474054 0.25000000000000 40.078 > 22 43 Ca 0.00000000000000 0.16714046525946 0.75000000000000 40.078 > 21 44 Ca 0.50000000000000 0.33285953474054 0.25000000000000 40.078 > 22 *45 Se 0.50000000000000 0.83087534234635 0.25000000000000 78.960 > 23 46 Se 0.00000000000000 0.66912465765365 0.75000000000000 78.960 > 24 47 Se 0.00000000000000 0.33087534234635 0.25000000000000 78.960 > 23 48 Se 0.50000000000000 0.16912465765365 0.75000000000000 78.960 > 24 -------------------------------- super cell -------------------------------- Lattice vectors: a 6.554025591250699 0.000000000000000 0.000000000000000 b 0.000000000000000 15.294934530000001 0.000000000000000 c -5.185501880377288 0.000000000000000 10.324452897565532 Atomic positions (fractional): *1 H 0.24141672602036 0.99640031647663 0.28651286325055 1.008 > 1 2 H 0.24141672602036 0.99640031647663 0.78651286325055 1.008 > 1 3 H 0.75858327397964 0.99640031647663 0.46348713674945 1.008 > 2 4 H 0.75858327397964 0.99640031647663 0.96348713674945 1.008 > 2 5 H 0.25858327397964 0.50359968352337 0.21348713674945 1.008 > 3 6 H 0.25858327397964 0.50359968352337 0.71348713674945 1.008 > 3 7 H 0.74141672602036 0.50359968352337 0.03651286325055 1.008 > 4 8 H 0.74141672602036 0.50359968352337 0.53651286325055 1.008 > 4 *9 H 0.24985887552600 0.91446520486821 0.37378986748557 1.008 > 5 10 H 0.24985887552600 0.91446520486821 0.87378986748557 1.008 > 5 11 H 0.75014112447400 0.91446520486821 0.37621013251443 1.008 > 6 12 H 0.75014112447400 0.91446520486821 0.87621013251443 1.008 > 6 13 H 0.25014112447400 0.58553479513179 0.12621013251443 1.008 > 7 14 H 0.25014112447400 0.58553479513179 0.62621013251443 1.008 > 7 15 H 0.74985887552600 0.58553479513179 0.12378986748557 1.008 > 8 16 H 0.74985887552600 0.58553479513179 0.62378986748557 1.008 > 8 17 H 0.74141672602036 0.49640031647663 0.28651286325055 1.008 > 1 18 H 0.74141672602036 0.49640031647663 0.78651286325055 1.008 > 1 19 H 0.25858327397964 0.49640031647663 0.46348713674945 1.008 > 2 20 H 0.25858327397964 0.49640031647663 0.96348713674945 1.008 > 2 21 H 0.75858327397964 0.00359968352337 0.21348713674945 1.008 > 3 22 H 0.75858327397964 0.00359968352337 0.71348713674945 1.008 > 3 23 H 0.24141672602036 0.00359968352337 0.03651286325055 1.008 > 4 24 H 0.24141672602036 0.00359968352337 0.53651286325055 1.008 > 4 25 H 0.74985887552600 0.41446520486821 0.37378986748557 1.008 > 5 26 H 0.74985887552600 0.41446520486821 0.87378986748557 1.008 > 5 27 H 0.25014112447400 0.41446520486821 0.37621013251443 1.008 > 6 28 H 0.25014112447400 0.41446520486821 0.87621013251443 1.008 > 6 29 H 0.75014112447400 0.08553479513179 0.12621013251443 1.008 > 7 30 H 0.75014112447400 0.08553479513179 0.62621013251443 1.008 > 7 31 H 0.24985887552600 0.08553479513179 0.12378986748557 1.008 > 8 32 H 0.24985887552600 0.08553479513179 0.62378986748557 1.008 > 8 *33 O 0.22446210075945 0.60900074120365 0.47264309580673 15.999 > 9 34 O 0.22446210075945 0.60900074120365 0.97264309580673 15.999 > 9 *35 O 0.60367743309192 0.76969828770185 0.04501750669740 15.999 > 10 36 O 0.60367743309192 0.76969828770185 0.54501750669740 15.999 > 10 37 O 0.89632256690808 0.73030171229815 0.45498249330260 15.999 > 11 38 O 0.89632256690808 0.73030171229815 0.95498249330260 15.999 > 11 39 O 0.10367743309192 0.73030171229815 0.29501750669740 15.999 > 12 40 O 0.10367743309192 0.73030171229815 0.79501750669740 15.999 > 12 *41 O 0.71491416780331 0.56761815074071 0.03393984969656 15.999 > 13 42 O 0.71491416780331 0.56761815074071 0.53393984969656 15.999 > 13 43 O 0.28508583219668 0.56761815074071 0.21606015030344 15.999 > 14 44 O 0.28508583219668 0.56761815074071 0.71606015030344 15.999 > 14 45 O 0.78508583219669 0.93238184925929 0.46606015030344 15.999 > 15 46 O 0.78508583219669 0.93238184925929 0.96606015030344 15.999 > 15 47 O 0.21491416780331 0.93238184925929 0.28393984969656 15.999 > 16 48 O 0.21491416780331 0.93238184925929 0.78393984969656 15.999 > 16 49 O 0.27553789924055 0.89099925879635 0.02735690419327 15.999 > 17 50 O 0.27553789924055 0.89099925879635 0.52735690419327 15.999 > 17 51 O 0.72446210075946 0.89099925879635 0.22264309580673 15.999 > 18 52 O 0.72446210075946 0.89099925879635 0.72264309580673 15.999 > 18 53 O 0.39632256690808 0.76969828770185 0.20498249330260 15.999 > 19 54 O 0.39632256690808 0.76969828770185 0.70498249330260 15.999 > 19 55 O 0.77553789924054 0.60900074120365 0.27735690419327 15.999 > 20 56 O 0.77553789924054 0.60900074120365 0.77735690419327 15.999 > 20 57 O 0.72446210075946 0.10900074120365 0.47264309580673 15.999 > 9 58 O 0.72446210075946 0.10900074120365 0.97264309580673 15.999 > 9 59 O 0.10367743309192 0.26969828770185 0.04501750669740 15.999 > 10 60 O 0.10367743309192 0.26969828770185 0.54501750669740 15.999 > 10 61 O 0.39632256690808 0.23030171229815 0.45498249330260 15.999 > 11 62 O 0.39632256690808 0.23030171229815 0.95498249330260 15.999 > 11 63 O 0.60367743309192 0.23030171229815 0.29501750669740 15.999 > 12 64 O 0.60367743309192 0.23030171229815 0.79501750669740 15.999 > 12 65 O 0.21491416780331 0.06761815074071 0.03393984969656 15.999 > 13 66 O 0.21491416780331 0.06761815074071 0.53393984969656 15.999 > 13 67 O 0.78508583219669 0.06761815074071 0.21606015030344 15.999 > 14 68 O 0.78508583219669 0.06761815074071 0.71606015030344 15.999 > 14 69 O 0.28508583219668 0.43238184925929 0.46606015030344 15.999 > 15 70 O 0.28508583219668 0.43238184925929 0.96606015030344 15.999 > 15 71 O 0.71491416780331 0.43238184925929 0.28393984969656 15.999 > 16 72 O 0.71491416780331 0.43238184925929 0.78393984969656 15.999 > 16 73 O 0.77553789924054 0.39099925879635 0.02735690419327 15.999 > 17 74 O 0.77553789924054 0.39099925879635 0.52735690419327 15.999 > 17 75 O 0.22446210075945 0.39099925879635 0.22264309580673 15.999 > 18 76 O 0.22446210075945 0.39099925879635 0.72264309580673 15.999 > 18 77 O 0.89632256690808 0.26969828770185 0.20498249330260 15.999 > 19 78 O 0.89632256690808 0.26969828770185 0.70498249330260 15.999 > 19 79 O 0.27553789924055 0.10900074120365 0.27735690419327 15.999 > 20 80 O 0.27553789924055 0.10900074120365 0.77735690419327 15.999 > 20 *81 Ca 0.50000000000000 0.66714046525946 0.37500000000000 40.078 > 21 82 Ca 0.50000000000000 0.66714046525946 0.87500000000000 40.078 > 21 83 Ca 0.00000000000000 0.83285953474054 0.12500000000000 40.078 > 22 84 Ca 0.00000000000000 0.83285953474054 0.62500000000000 40.078 > 22 85 Ca 0.00000000000000 0.16714046525946 0.37500000000000 40.078 > 21 86 Ca 0.00000000000000 0.16714046525946 0.87500000000000 40.078 > 21 87 Ca 0.50000000000000 0.33285953474054 0.12500000000000 40.078 > 22 88 Ca 0.50000000000000 0.33285953474054 0.62500000000000 40.078 > 22 *89 Se 0.50000000000000 0.83087534234635 0.12500000000000 78.960 > 23 90 Se 0.50000000000000 0.83087534234635 0.62500000000000 78.960 > 23 91 Se 0.00000000000000 0.66912465765365 0.37500000000000 78.960 > 24 92 Se 0.00000000000000 0.66912465765365 0.87500000000000 78.960 > 24 93 Se 0.00000000000000 0.33087534234635 0.12500000000000 78.960 > 23 94 Se 0.00000000000000 0.33087534234635 0.62500000000000 78.960 > 23 95 Se 0.50000000000000 0.16912465765365 0.37500000000000 78.960 > 24 96 Se 0.50000000000000 0.16912465765365 0.87500000000000 78.960 > 24 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.8023397 0.0000000 -0.0340058 0.0000000 2.7329291 0.0000000 -0.0340060 0.0000000 2.7229899 -------------------------- Born effective charges -------------------------- 1 H 0.4183325 0.2924753 -0.0060724 0.1704698 1.2831304 -0.0801551 0.0343160 0.0962402 0.2464416 2 H 0.4183325 -0.2924753 -0.0060724 -0.1704698 1.2831304 0.0801551 0.0343160 -0.0962402 0.2464416 3 H 0.4183325 0.2924753 -0.0060724 0.1704698 1.2831304 -0.0801551 0.0343160 0.0962402 0.2464416 4 H 0.4183325 -0.2924753 -0.0060724 -0.1704698 1.2831304 0.0801551 0.0343160 -0.0962402 0.2464416 5 H 0.3694661 0.0403558 -0.0807948 0.1210724 0.3877340 -0.3503750 -0.2499227 -0.3120236 1.1259927 6 H 0.3694661 -0.0403558 -0.0807948 -0.1210724 0.3877340 0.3503750 -0.2499227 0.3120236 1.1259927 7 H 0.3694661 0.0403558 -0.0807948 0.1210724 0.3877340 -0.3503750 -0.2499227 -0.3120236 1.1259927 8 H 0.3694661 -0.0403558 -0.0807948 -0.1210724 0.3877340 0.3503750 -0.2499227 0.3120236 1.1259927 9 O -1.3096471 0.3024671 -0.1582745 0.2853447 -1.5334822 0.4451031 -0.1784347 0.4484625 -1.4720471 10 O -1.6211083 0.3479303 0.3137022 0.3706660 -1.3755278 -0.5204244 0.3107311 -0.5392429 -1.4152029 11 O -1.6211083 0.3479303 0.3137022 0.3706660 -1.3755278 -0.5204244 0.3107311 -0.5392429 -1.4152029 12 O -1.6211083 -0.3479303 0.3137022 -0.3706660 -1.3755278 0.5204244 0.3107311 0.5392429 -1.4152029 13 O -0.9584664 0.2082309 -0.0047735 0.2140363 -1.4274436 -0.0484201 0.0104624 0.0642675 -1.2871287 14 O -0.9584664 -0.2082309 -0.0047735 -0.2140363 -1.4274436 0.0484201 0.0104624 -0.0642675 -1.2871287 15 O -0.9584664 0.2082309 -0.0047735 0.2140363 -1.4274436 -0.0484201 0.0104624 0.0642675 -1.2871287 16 O -0.9584664 -0.2082309 -0.0047735 -0.2140363 -1.4274436 0.0484201 0.0104624 -0.0642675 -1.2871287 17 O -1.3096471 0.3024671 -0.1582745 0.2853447 -1.5334822 0.4451031 -0.1784347 0.4484625 -1.4720471 18 O -1.3096471 -0.3024671 -0.1582745 -0.2853447 -1.5334822 -0.4451031 -0.1784347 -0.4484625 -1.4720471 19 O -1.6211083 -0.3479303 0.3137022 -0.3706660 -1.3755278 0.5204244 0.3107311 0.5392429 -1.4152029 20 O -1.3096471 -0.3024671 -0.1582745 -0.2853447 -1.5334822 -0.4451031 -0.1784347 -0.4484625 -1.4720471 21 Ca 2.7489514 0.0000000 -0.1405011 0.0000000 2.2892212 -0.0000000 0.1025152 0.0000000 2.5184712 22 Ca 2.7489514 0.0000000 -0.1405011 0.0000000 2.2892212 -0.0000000 0.1025152 0.0000000 2.5184712 23 Se 3.4538952 0.0000000 0.0129271 0.0000000 3.0419573 -0.0000000 0.0431806 0.0000000 3.0854176 24 Se 3.4538952 0.0000000 0.0129271 0.0000000 3.0419573 -0.0000000 0.0431806 0.0000000 3.0854176 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 288/288 Permutation basis: 12384/12384 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2704 Number of blocks in projector: 2704 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 584 Use submatrix version of eigh solver. (1) Block: 584 / 584 (2) Block: 250 / 584 (2) 237 eigenvectors found. (2) Block: 500 / 584 (2) 239 eigenvectors found. (2) Block: 584 / 584 (2) 77 eigenvectors found. (2) Complementary block size: 31 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 571 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 568 Use submatrix version of eigh solver. (1) Block: 568 / 568 (2) Block: 250 / 568 (2) 240 eigenvectors found. (2) Block: 500 / 568 (2) 241 eigenvectors found. (2) Block: 568 / 568 (2) 62 eigenvectors found. (2) Complementary block size: 25 (2) Compute compressed projector. (2) Use standard solver. (2) 15 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 568 Use submatrix version of eigh solver. (1) Block: 568 / 568 (2) Block: 250 / 568 (2) 240 eigenvectors found. (2) Block: 500 / 568 (2) 241 eigenvectors found. (2) Block: 568 / 568 (2) 62 eigenvectors found. (2) Complementary block size: 25 (2) Compute compressed projector. (2) Use standard solver. (2) 15 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 328 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 328 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 328 Use standard eigh solver. Tree of FC basis block matrices: - (2704, 2650), data: False |-- (328, 321), data: True |-- (328, 321), data: True |-- (328, 321), data: True |-- (568, 558), data: False |-- (568, 558), data: False |-- (568, 15), data: (568, 25) @ (25, 15) |-- (68, 62), data: True |-- (250, 241), data: True |-- (250, 240), data: True |-- (568, 558), data: False |-- (568, 558), data: False |-- (568, 15), data: (568, 25) @ (25, 15) |-- (68, 62), data: True |-- (250, 241), data: True |-- (250, 240), data: True |-- (584, 571), data: False |-- (584, 571), data: False |-- (584, 18), data: (584, 31) @ (31, 18) |-- (84, 77), data: True |-- (250, 239), data: True |-- (250, 237), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 720 - Time: 0.685 Solver_block: 200 / 720 - Time: 0.569 Solver_block: 300 / 720 - Time: 0.605 Solver_block: 400 / 720 - Time: 0.581 Solver_block: 500 / 720 - Time: 0.619 Solver_block: 600 / 720 - Time: 0.563 Solver_block: 700 / 720 - Time: 0.622 Solver_block: 720 / 720 - Time: 0.232 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 4.703 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) Permutation basis: 288/288 Permutation basis: 12384/12384 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2704 Number of blocks in projector: 2704 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 584 Use submatrix version of eigh solver. (1) Block: 584 / 584 (2) Block: 250 / 584 (2) 237 eigenvectors found. (2) Block: 500 / 584 (2) 239 eigenvectors found. (2) Block: 584 / 584 (2) 77 eigenvectors found. (2) Complementary block size: 31 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 571 eigenvectors found. (1) Complementary block size: 12 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 568 Use submatrix version of eigh solver. (1) Block: 568 / 568 (2) Block: 250 / 568 (2) 240 eigenvectors found. (2) Block: 500 / 568 (2) 241 eigenvectors found. (2) Block: 568 / 568 (2) 62 eigenvectors found. (2) Complementary block size: 25 (2) Compute compressed projector. (2) Use standard solver. (2) 15 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 568 Use submatrix version of eigh solver. (1) Block: 568 / 568 (2) Block: 250 / 568 (2) 240 eigenvectors found. (2) Block: 500 / 568 (2) 241 eigenvectors found. (2) Block: 568 / 568 (2) 62 eigenvectors found. (2) Complementary block size: 25 (2) Compute compressed projector. (2) Use standard solver. (2) 15 eigenvectors found. (1) 558 eigenvectors found. (1) Complementary block size: 10 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 328 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 328 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 328 Use standard eigh solver. Tree of FC basis block matrices: - (2704, 2650), data: False |-- (328, 321), data: True |-- (328, 321), data: True |-- (328, 321), data: True |-- (568, 558), data: False |-- (568, 558), data: False |-- (568, 15), data: (568, 25) @ (25, 15) |-- (68, 62), data: True |-- (250, 241), data: True |-- (250, 240), data: True |-- (568, 558), data: False |-- (568, 558), data: False |-- (568, 15), data: (568, 25) @ (25, 15) |-- (68, 62), data: True |-- (250, 241), data: True |-- (250, 240), data: True |-- (584, 571), data: False |-- (584, 571), data: False |-- (584, 18), data: (584, 31) @ (31, 18) |-- (84, 77), data: True |-- (250, 239), data: True |-- (250, 237), data: True Max drift after symmetrization by symfc projector: 0.00000000 (yy) 0.00000000 (yy) 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 05:52:23]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 05:52:23]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.277012795625350 -7.647467265000000 0.000000000000000 b 3.277012795625350 7.647467265000000 0.000000000000000 c -2.592750940188644 0.000000000000000 5.162226448782766 Atomic positions (fractional): 1 H 0.24501640954373 0.23781704249699 0.57302572650110 1.008 2 H 0.76218295750301 0.75498359045627 0.92697427349890 1.008 3 H 0.75498359045627 0.76218295750301 0.42697427349890 1.008 4 H 0.23781704249699 0.24501640954373 0.07302572650110 1.008 5 H 0.33539367065778 0.16432408039421 0.74757973497113 1.008 6 H 0.83567591960579 0.66460632934222 0.75242026502887 1.008 7 H 0.66460632934222 0.83567591960579 0.25242026502886 1.008 8 H 0.16432408039421 0.33539367065778 0.24757973497114 1.008 9 O 0.61546135955580 0.83346284196310 0.94528619161347 15.999 10 O 0.83397914539007 0.37337572079376 0.09003501339480 15.999 11 O 0.16602085460993 0.62662427920624 0.90996498660520 15.999 12 O 0.37337572079377 0.83397914539007 0.59003501339480 15.999 13 O 0.14729601706260 0.28253231854403 0.06787969939313 15.999 14 O 0.71746768145597 0.85270398293740 0.43212030060687 15.999 15 O 0.85270398293740 0.71746768145597 0.93212030060687 15.999 16 O 0.28253231854403 0.14729601706260 0.56787969939313 15.999 17 O 0.38453864044420 0.16653715803690 0.05471380838653 15.999 18 O 0.83346284196311 0.61546135955580 0.44528619161347 15.999 19 O 0.62662427920623 0.16602085460993 0.40996498660520 15.999 20 O 0.16653715803689 0.38453864044420 0.55471380838653 15.999 21 Ca 0.83285953474054 0.16714046525946 0.75000000000000 40.078 22 Ca 0.16714046525946 0.83285953474054 0.25000000000000 40.078 23 Se 0.66912465765365 0.33087534234635 0.25000000000000 78.960 24 Se 0.33087534234635 0.66912465765365 0.75000000000000 78.960 -------------------------------- supercell --------------------------------- Lattice vectors: a 6.554025591250699 0.000000000000000 0.000000000000000 b 0.000000000000000 15.294934530000001 0.000000000000000 c -5.185501880377288 0.000000000000000 10.324452897565532 Atomic positions (fractional): 1 H 0.24141672602036 0.99640031647663 0.28651286325055 1.008 > 1 2 H 0.24141672602036 0.99640031647663 0.78651286325055 1.008 > 1 3 H 0.75858327397964 0.99640031647663 0.46348713674945 1.008 > 3 4 H 0.75858327397964 0.99640031647663 0.96348713674945 1.008 > 3 5 H 0.25858327397964 0.50359968352337 0.21348713674945 1.008 > 5 6 H 0.25858327397964 0.50359968352337 0.71348713674945 1.008 > 5 7 H 0.74141672602036 0.50359968352337 0.03651286325055 1.008 > 7 8 H 0.74141672602036 0.50359968352337 0.53651286325055 1.008 > 7 9 H 0.24985887552600 0.91446520486821 0.37378986748557 1.008 > 9 10 H 0.24985887552600 0.91446520486821 0.87378986748557 1.008 > 9 11 H 0.75014112447400 0.91446520486821 0.37621013251443 1.008 > 11 12 H 0.75014112447400 0.91446520486821 0.87621013251443 1.008 > 11 13 H 0.25014112447400 0.58553479513179 0.12621013251443 1.008 > 13 14 H 0.25014112447400 0.58553479513179 0.62621013251443 1.008 > 13 15 H 0.74985887552600 0.58553479513179 0.12378986748557 1.008 > 15 16 H 0.74985887552600 0.58553479513179 0.62378986748557 1.008 > 15 17 H 0.74141672602036 0.49640031647663 0.28651286325055 1.008 > 1 18 H 0.74141672602036 0.49640031647663 0.78651286325055 1.008 > 1 19 H 0.25858327397964 0.49640031647663 0.46348713674945 1.008 > 3 20 H 0.25858327397964 0.49640031647663 0.96348713674945 1.008 > 3 21 H 0.75858327397964 0.00359968352337 0.21348713674945 1.008 > 5 22 H 0.75858327397964 0.00359968352337 0.71348713674945 1.008 > 5 23 H 0.24141672602036 0.00359968352337 0.03651286325055 1.008 > 7 24 H 0.24141672602036 0.00359968352337 0.53651286325055 1.008 > 7 25 H 0.74985887552600 0.41446520486821 0.37378986748557 1.008 > 9 26 H 0.74985887552600 0.41446520486821 0.87378986748557 1.008 > 9 27 H 0.25014112447400 0.41446520486821 0.37621013251443 1.008 > 11 28 H 0.25014112447400 0.41446520486821 0.87621013251443 1.008 > 11 29 H 0.75014112447400 0.08553479513179 0.12621013251443 1.008 > 13 30 H 0.75014112447400 0.08553479513179 0.62621013251443 1.008 > 13 31 H 0.24985887552600 0.08553479513179 0.12378986748557 1.008 > 15 32 H 0.24985887552600 0.08553479513179 0.62378986748557 1.008 > 15 33 O 0.22446210075945 0.60900074120365 0.47264309580673 15.999 > 33 34 O 0.22446210075945 0.60900074120365 0.97264309580673 15.999 > 33 35 O 0.60367743309192 0.76969828770185 0.04501750669740 15.999 > 35 36 O 0.60367743309192 0.76969828770185 0.54501750669740 15.999 > 35 37 O 0.89632256690808 0.73030171229815 0.45498249330260 15.999 > 37 38 O 0.89632256690808 0.73030171229815 0.95498249330260 15.999 > 37 39 O 0.10367743309192 0.73030171229815 0.29501750669740 15.999 > 39 40 O 0.10367743309192 0.73030171229815 0.79501750669740 15.999 > 39 41 O 0.71491416780331 0.56761815074071 0.03393984969656 15.999 > 41 42 O 0.71491416780331 0.56761815074071 0.53393984969656 15.999 > 41 43 O 0.28508583219668 0.56761815074071 0.21606015030344 15.999 > 43 44 O 0.28508583219668 0.56761815074071 0.71606015030344 15.999 > 43 45 O 0.78508583219669 0.93238184925929 0.46606015030344 15.999 > 45 46 O 0.78508583219669 0.93238184925929 0.96606015030344 15.999 > 45 47 O 0.21491416780331 0.93238184925929 0.28393984969656 15.999 > 47 48 O 0.21491416780331 0.93238184925929 0.78393984969656 15.999 > 47 49 O 0.27553789924055 0.89099925879635 0.02735690419327 15.999 > 49 50 O 0.27553789924055 0.89099925879635 0.52735690419327 15.999 > 49 51 O 0.72446210075946 0.89099925879635 0.22264309580673 15.999 > 51 52 O 0.72446210075946 0.89099925879635 0.72264309580673 15.999 > 51 53 O 0.39632256690808 0.76969828770185 0.20498249330260 15.999 > 53 54 O 0.39632256690808 0.76969828770185 0.70498249330260 15.999 > 53 55 O 0.77553789924054 0.60900074120365 0.27735690419327 15.999 > 55 56 O 0.77553789924054 0.60900074120365 0.77735690419327 15.999 > 55 57 O 0.72446210075946 0.10900074120365 0.47264309580673 15.999 > 33 58 O 0.72446210075946 0.10900074120365 0.97264309580673 15.999 > 33 59 O 0.10367743309192 0.26969828770185 0.04501750669740 15.999 > 35 60 O 0.10367743309192 0.26969828770185 0.54501750669740 15.999 > 35 61 O 0.39632256690808 0.23030171229815 0.45498249330260 15.999 > 37 62 O 0.39632256690808 0.23030171229815 0.95498249330260 15.999 > 37 63 O 0.60367743309192 0.23030171229815 0.29501750669740 15.999 > 39 64 O 0.60367743309192 0.23030171229815 0.79501750669740 15.999 > 39 65 O 0.21491416780331 0.06761815074071 0.03393984969656 15.999 > 41 66 O 0.21491416780331 0.06761815074071 0.53393984969656 15.999 > 41 67 O 0.78508583219669 0.06761815074071 0.21606015030344 15.999 > 43 68 O 0.78508583219669 0.06761815074071 0.71606015030344 15.999 > 43 69 O 0.28508583219668 0.43238184925929 0.46606015030344 15.999 > 45 70 O 0.28508583219668 0.43238184925929 0.96606015030344 15.999 > 45 71 O 0.71491416780331 0.43238184925929 0.28393984969656 15.999 > 47 72 O 0.71491416780331 0.43238184925929 0.78393984969656 15.999 > 47 73 O 0.77553789924054 0.39099925879635 0.02735690419327 15.999 > 49 74 O 0.77553789924054 0.39099925879635 0.52735690419327 15.999 > 49 75 O 0.22446210075945 0.39099925879635 0.22264309580673 15.999 > 51 76 O 0.22446210075945 0.39099925879635 0.72264309580673 15.999 > 51 77 O 0.89632256690808 0.26969828770185 0.20498249330260 15.999 > 53 78 O 0.89632256690808 0.26969828770185 0.70498249330260 15.999 > 53 79 O 0.27553789924055 0.10900074120365 0.27735690419327 15.999 > 55 80 O 0.27553789924055 0.10900074120365 0.77735690419327 15.999 > 55 81 Ca 0.50000000000000 0.66714046525946 0.37500000000000 40.078 > 81 82 Ca 0.50000000000000 0.66714046525946 0.87500000000000 40.078 > 81 83 Ca 0.00000000000000 0.83285953474054 0.12500000000000 40.078 > 83 84 Ca 0.00000000000000 0.83285953474054 0.62500000000000 40.078 > 83 85 Ca 0.00000000000000 0.16714046525946 0.37500000000000 40.078 > 81 86 Ca 0.00000000000000 0.16714046525946 0.87500000000000 40.078 > 81 87 Ca 0.50000000000000 0.33285953474054 0.12500000000000 40.078 > 83 88 Ca 0.50000000000000 0.33285953474054 0.62500000000000 40.078 > 83 89 Se 0.50000000000000 0.83087534234635 0.12500000000000 78.960 > 89 90 Se 0.50000000000000 0.83087534234635 0.62500000000000 78.960 > 89 91 Se 0.00000000000000 0.66912465765365 0.37500000000000 78.960 > 91 92 Se 0.00000000000000 0.66912465765365 0.87500000000000 78.960 > 91 93 Se 0.00000000000000 0.33087534234635 0.12500000000000 78.960 > 89 94 Se 0.00000000000000 0.33087534234635 0.62500000000000 78.960 > 89 95 Se 0.50000000000000 0.16912465765365 0.37500000000000 78.960 > 91 96 Se 0.50000000000000 0.16912465765365 0.87500000000000 78.960 > 91 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.8023397 0.0000000 -0.0340058 0.0000000 2.7329291 0.0000000 -0.0340060 0.0000000 2.7229899 -------------------------- Born effective charges -------------------------- 1 H 0.4183325 0.2924753 -0.0060724 0.1704698 1.2831304 -0.0801551 0.0343160 0.0962402 0.2464416 2 H 0.4183325 -0.2924753 -0.0060724 -0.1704698 1.2831304 0.0801551 0.0343160 -0.0962402 0.2464416 3 H 0.4183325 0.2924753 -0.0060724 0.1704698 1.2831304 -0.0801551 0.0343160 0.0962402 0.2464416 4 H 0.4183325 -0.2924753 -0.0060724 -0.1704698 1.2831304 0.0801551 0.0343160 -0.0962402 0.2464416 5 H 0.3694661 0.0403558 -0.0807948 0.1210724 0.3877340 -0.3503750 -0.2499227 -0.3120236 1.1259927 6 H 0.3694661 -0.0403558 -0.0807948 -0.1210724 0.3877340 0.3503750 -0.2499227 0.3120236 1.1259927 7 H 0.3694661 0.0403558 -0.0807948 0.1210724 0.3877340 -0.3503750 -0.2499227 -0.3120236 1.1259927 8 H 0.3694661 -0.0403558 -0.0807948 -0.1210724 0.3877340 0.3503750 -0.2499227 0.3120236 1.1259927 9 O -1.3096471 0.3024671 -0.1582745 0.2853447 -1.5334822 0.4451031 -0.1784347 0.4484625 -1.4720471 10 O -1.6211083 0.3479303 0.3137022 0.3706660 -1.3755278 -0.5204244 0.3107311 -0.5392429 -1.4152029 11 O -1.6211083 0.3479303 0.3137022 0.3706660 -1.3755278 -0.5204244 0.3107311 -0.5392429 -1.4152029 12 O -1.6211083 -0.3479303 0.3137022 -0.3706660 -1.3755278 0.5204244 0.3107311 0.5392429 -1.4152029 13 O -0.9584664 0.2082309 -0.0047735 0.2140363 -1.4274436 -0.0484201 0.0104624 0.0642675 -1.2871287 14 O -0.9584664 -0.2082309 -0.0047735 -0.2140363 -1.4274436 0.0484201 0.0104624 -0.0642675 -1.2871287 15 O -0.9584664 0.2082309 -0.0047735 0.2140363 -1.4274436 -0.0484201 0.0104624 0.0642675 -1.2871287 16 O -0.9584664 -0.2082309 -0.0047735 -0.2140363 -1.4274436 0.0484201 0.0104624 -0.0642675 -1.2871287 17 O -1.3096471 0.3024671 -0.1582745 0.2853447 -1.5334822 0.4451031 -0.1784347 0.4484625 -1.4720471 18 O -1.3096471 -0.3024671 -0.1582745 -0.2853447 -1.5334822 -0.4451031 -0.1784347 -0.4484625 -1.4720471 19 O -1.6211083 -0.3479303 0.3137022 -0.3706660 -1.3755278 0.5204244 0.3107311 0.5392429 -1.4152029 20 O -1.3096471 -0.3024671 -0.1582745 -0.2853447 -1.5334822 -0.4451031 -0.1784347 -0.4484625 -1.4720471 21 Ca 2.7489514 0.0000000 -0.1405011 0.0000000 2.2892212 -0.0000000 0.1025152 0.0000000 2.5184712 22 Ca 2.7489514 0.0000000 -0.1405011 0.0000000 2.2892212 -0.0000000 0.1025152 0.0000000 2.5184712 23 Se 3.4538952 0.0000000 0.0129271 0.0000000 3.0419573 -0.0000000 0.0431806 0.0000000 3.0854176 24 Se 3.4538952 0.0000000 0.0129271 0.0000000 3.0419573 -0.0000000 0.0431806 0.0000000 3.0854176 ---------------------------------------------------------------------------- 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] [-0.0045 0.0000 0.0089] [ 0.0045 0.0000 -0.0089] 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] [-0.0045 0.0000 0.0089] [ 0.0045 0.0000 -0.0089] 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] [-0.0045 0.0000 0.0089] [ 0.0045 0.0000 -0.0089] Computing fc3[ 35, 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] [-0.0045 0.0000 0.0089] [ 0.0045 0.0000 -0.0089] Computing fc3[ 41, 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] [-0.0045 0.0000 0.0089] [ 0.0045 0.0000 -0.0089] 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] [-0.0045 0.0000 0.0089] [ 0.0045 0.0000 -0.0089] Computing fc3[ 89, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0045 0.0000 0.0089] [ 0.0045 0.0000 -0.0089] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000055 (yyy) 0.00000055 (yyy) 0.00000055 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000008 (zx) -0.00000008 (zx) 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 05:52:47]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 05:52:47]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.277012795625350 -7.647467265000000 0.000000000000000 b 3.277012795625350 7.647467265000000 0.000000000000000 c -2.592750940188644 0.000000000000000 5.162226448782766 Atomic positions (fractional): 1 H 0.24501640954373 0.23781704249699 0.57302572650110 1.008 2 H 0.76218295750301 0.75498359045627 0.92697427349890 1.008 3 H 0.75498359045627 0.76218295750301 0.42697427349890 1.008 4 H 0.23781704249699 0.24501640954373 0.07302572650110 1.008 5 H 0.33539367065778 0.16432408039421 0.74757973497113 1.008 6 H 0.83567591960579 0.66460632934222 0.75242026502887 1.008 7 H 0.66460632934222 0.83567591960579 0.25242026502886 1.008 8 H 0.16432408039421 0.33539367065778 0.24757973497114 1.008 9 O 0.61546135955580 0.83346284196310 0.94528619161347 15.999 10 O 0.83397914539007 0.37337572079376 0.09003501339480 15.999 11 O 0.16602085460993 0.62662427920624 0.90996498660520 15.999 12 O 0.37337572079377 0.83397914539007 0.59003501339480 15.999 13 O 0.14729601706260 0.28253231854403 0.06787969939313 15.999 14 O 0.71746768145597 0.85270398293740 0.43212030060687 15.999 15 O 0.85270398293740 0.71746768145597 0.93212030060687 15.999 16 O 0.28253231854403 0.14729601706260 0.56787969939313 15.999 17 O 0.38453864044420 0.16653715803690 0.05471380838653 15.999 18 O 0.83346284196311 0.61546135955580 0.44528619161347 15.999 19 O 0.62662427920623 0.16602085460993 0.40996498660520 15.999 20 O 0.16653715803689 0.38453864044420 0.55471380838653 15.999 21 Ca 0.83285953474054 0.16714046525946 0.75000000000000 40.078 22 Ca 0.16714046525946 0.83285953474054 0.25000000000000 40.078 23 Se 0.66912465765365 0.33087534234635 0.25000000000000 78.960 24 Se 0.33087534234635 0.66912465765365 0.75000000000000 78.960 -------------------------------- supercell --------------------------------- Lattice vectors: a 6.554025591250699 0.000000000000000 0.000000000000000 b 0.000000000000000 15.294934530000001 0.000000000000000 c -5.185501880377288 0.000000000000000 10.324452897565532 Atomic positions (fractional): 1 H 0.24141672602036 0.99640031647663 0.28651286325055 1.008 > 1 2 H 0.24141672602036 0.99640031647663 0.78651286325055 1.008 > 1 3 H 0.75858327397964 0.99640031647663 0.46348713674945 1.008 > 3 4 H 0.75858327397964 0.99640031647663 0.96348713674945 1.008 > 3 5 H 0.25858327397964 0.50359968352337 0.21348713674945 1.008 > 5 6 H 0.25858327397964 0.50359968352337 0.71348713674945 1.008 > 5 7 H 0.74141672602036 0.50359968352337 0.03651286325055 1.008 > 7 8 H 0.74141672602036 0.50359968352337 0.53651286325055 1.008 > 7 9 H 0.24985887552600 0.91446520486821 0.37378986748557 1.008 > 9 10 H 0.24985887552600 0.91446520486821 0.87378986748557 1.008 > 9 11 H 0.75014112447400 0.91446520486821 0.37621013251443 1.008 > 11 12 H 0.75014112447400 0.91446520486821 0.87621013251443 1.008 > 11 13 H 0.25014112447400 0.58553479513179 0.12621013251443 1.008 > 13 14 H 0.25014112447400 0.58553479513179 0.62621013251443 1.008 > 13 15 H 0.74985887552600 0.58553479513179 0.12378986748557 1.008 > 15 16 H 0.74985887552600 0.58553479513179 0.62378986748557 1.008 > 15 17 H 0.74141672602036 0.49640031647663 0.28651286325055 1.008 > 1 18 H 0.74141672602036 0.49640031647663 0.78651286325055 1.008 > 1 19 H 0.25858327397964 0.49640031647663 0.46348713674945 1.008 > 3 20 H 0.25858327397964 0.49640031647663 0.96348713674945 1.008 > 3 21 H 0.75858327397964 0.00359968352337 0.21348713674945 1.008 > 5 22 H 0.75858327397964 0.00359968352337 0.71348713674945 1.008 > 5 23 H 0.24141672602036 0.00359968352337 0.03651286325055 1.008 > 7 24 H 0.24141672602036 0.00359968352337 0.53651286325055 1.008 > 7 25 H 0.74985887552600 0.41446520486821 0.37378986748557 1.008 > 9 26 H 0.74985887552600 0.41446520486821 0.87378986748557 1.008 > 9 27 H 0.25014112447400 0.41446520486821 0.37621013251443 1.008 > 11 28 H 0.25014112447400 0.41446520486821 0.87621013251443 1.008 > 11 29 H 0.75014112447400 0.08553479513179 0.12621013251443 1.008 > 13 30 H 0.75014112447400 0.08553479513179 0.62621013251443 1.008 > 13 31 H 0.24985887552600 0.08553479513179 0.12378986748557 1.008 > 15 32 H 0.24985887552600 0.08553479513179 0.62378986748557 1.008 > 15 33 O 0.22446210075945 0.60900074120365 0.47264309580673 15.999 > 33 34 O 0.22446210075945 0.60900074120365 0.97264309580673 15.999 > 33 35 O 0.60367743309192 0.76969828770185 0.04501750669740 15.999 > 35 36 O 0.60367743309192 0.76969828770185 0.54501750669740 15.999 > 35 37 O 0.89632256690808 0.73030171229815 0.45498249330260 15.999 > 37 38 O 0.89632256690808 0.73030171229815 0.95498249330260 15.999 > 37 39 O 0.10367743309192 0.73030171229815 0.29501750669740 15.999 > 39 40 O 0.10367743309192 0.73030171229815 0.79501750669740 15.999 > 39 41 O 0.71491416780331 0.56761815074071 0.03393984969656 15.999 > 41 42 O 0.71491416780331 0.56761815074071 0.53393984969656 15.999 > 41 43 O 0.28508583219668 0.56761815074071 0.21606015030344 15.999 > 43 44 O 0.28508583219668 0.56761815074071 0.71606015030344 15.999 > 43 45 O 0.78508583219669 0.93238184925929 0.46606015030344 15.999 > 45 46 O 0.78508583219669 0.93238184925929 0.96606015030344 15.999 > 45 47 O 0.21491416780331 0.93238184925929 0.28393984969656 15.999 > 47 48 O 0.21491416780331 0.93238184925929 0.78393984969656 15.999 > 47 49 O 0.27553789924055 0.89099925879635 0.02735690419327 15.999 > 49 50 O 0.27553789924055 0.89099925879635 0.52735690419327 15.999 > 49 51 O 0.72446210075946 0.89099925879635 0.22264309580673 15.999 > 51 52 O 0.72446210075946 0.89099925879635 0.72264309580673 15.999 > 51 53 O 0.39632256690808 0.76969828770185 0.20498249330260 15.999 > 53 54 O 0.39632256690808 0.76969828770185 0.70498249330260 15.999 > 53 55 O 0.77553789924054 0.60900074120365 0.27735690419327 15.999 > 55 56 O 0.77553789924054 0.60900074120365 0.77735690419327 15.999 > 55 57 O 0.72446210075946 0.10900074120365 0.47264309580673 15.999 > 33 58 O 0.72446210075946 0.10900074120365 0.97264309580673 15.999 > 33 59 O 0.10367743309192 0.26969828770185 0.04501750669740 15.999 > 35 60 O 0.10367743309192 0.26969828770185 0.54501750669740 15.999 > 35 61 O 0.39632256690808 0.23030171229815 0.45498249330260 15.999 > 37 62 O 0.39632256690808 0.23030171229815 0.95498249330260 15.999 > 37 63 O 0.60367743309192 0.23030171229815 0.29501750669740 15.999 > 39 64 O 0.60367743309192 0.23030171229815 0.79501750669740 15.999 > 39 65 O 0.21491416780331 0.06761815074071 0.03393984969656 15.999 > 41 66 O 0.21491416780331 0.06761815074071 0.53393984969656 15.999 > 41 67 O 0.78508583219669 0.06761815074071 0.21606015030344 15.999 > 43 68 O 0.78508583219669 0.06761815074071 0.71606015030344 15.999 > 43 69 O 0.28508583219668 0.43238184925929 0.46606015030344 15.999 > 45 70 O 0.28508583219668 0.43238184925929 0.96606015030344 15.999 > 45 71 O 0.71491416780331 0.43238184925929 0.28393984969656 15.999 > 47 72 O 0.71491416780331 0.43238184925929 0.78393984969656 15.999 > 47 73 O 0.77553789924054 0.39099925879635 0.02735690419327 15.999 > 49 74 O 0.77553789924054 0.39099925879635 0.52735690419327 15.999 > 49 75 O 0.22446210075945 0.39099925879635 0.22264309580673 15.999 > 51 76 O 0.22446210075945 0.39099925879635 0.72264309580673 15.999 > 51 77 O 0.89632256690808 0.26969828770185 0.20498249330260 15.999 > 53 78 O 0.89632256690808 0.26969828770185 0.70498249330260 15.999 > 53 79 O 0.27553789924055 0.10900074120365 0.27735690419327 15.999 > 55 80 O 0.27553789924055 0.10900074120365 0.77735690419327 15.999 > 55 81 Ca 0.50000000000000 0.66714046525946 0.37500000000000 40.078 > 81 82 Ca 0.50000000000000 0.66714046525946 0.87500000000000 40.078 > 81 83 Ca 0.00000000000000 0.83285953474054 0.12500000000000 40.078 > 83 84 Ca 0.00000000000000 0.83285953474054 0.62500000000000 40.078 > 83 85 Ca 0.00000000000000 0.16714046525946 0.37500000000000 40.078 > 81 86 Ca 0.00000000000000 0.16714046525946 0.87500000000000 40.078 > 81 87 Ca 0.50000000000000 0.33285953474054 0.12500000000000 40.078 > 83 88 Ca 0.50000000000000 0.33285953474054 0.62500000000000 40.078 > 83 89 Se 0.50000000000000 0.83087534234635 0.12500000000000 78.960 > 89 90 Se 0.50000000000000 0.83087534234635 0.62500000000000 78.960 > 89 91 Se 0.00000000000000 0.66912465765365 0.37500000000000 78.960 > 91 92 Se 0.00000000000000 0.66912465765365 0.87500000000000 78.960 > 91 93 Se 0.00000000000000 0.33087534234635 0.12500000000000 78.960 > 89 94 Se 0.00000000000000 0.33087534234635 0.62500000000000 78.960 > 89 95 Se 0.50000000000000 0.16912465765365 0.37500000000000 78.960 > 91 96 Se 0.50000000000000 0.16912465765365 0.87500000000000 78.960 > 91 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.8023397 0.0000000 -0.0340058 0.0000000 2.7329291 0.0000000 -0.0340060 0.0000000 2.7229899 -------------------------- Born effective charges -------------------------- 1 H 0.4183325 0.2924753 -0.0060724 0.1704698 1.2831304 -0.0801551 0.0343160 0.0962402 0.2464416 2 H 0.4183325 -0.2924753 -0.0060724 -0.1704698 1.2831304 0.0801551 0.0343160 -0.0962402 0.2464416 3 H 0.4183325 0.2924753 -0.0060724 0.1704698 1.2831304 -0.0801551 0.0343160 0.0962402 0.2464416 4 H 0.4183325 -0.2924753 -0.0060724 -0.1704698 1.2831304 0.0801551 0.0343160 -0.0962402 0.2464416 5 H 0.3694661 0.0403558 -0.0807948 0.1210724 0.3877340 -0.3503750 -0.2499227 -0.3120236 1.1259927 6 H 0.3694661 -0.0403558 -0.0807948 -0.1210724 0.3877340 0.3503750 -0.2499227 0.3120236 1.1259927 7 H 0.3694661 0.0403558 -0.0807948 0.1210724 0.3877340 -0.3503750 -0.2499227 -0.3120236 1.1259927 8 H 0.3694661 -0.0403558 -0.0807948 -0.1210724 0.3877340 0.3503750 -0.2499227 0.3120236 1.1259927 9 O -1.3096471 0.3024671 -0.1582745 0.2853447 -1.5334822 0.4451031 -0.1784347 0.4484625 -1.4720471 10 O -1.6211083 0.3479303 0.3137022 0.3706660 -1.3755278 -0.5204244 0.3107311 -0.5392429 -1.4152029 11 O -1.6211083 0.3479303 0.3137022 0.3706660 -1.3755278 -0.5204244 0.3107311 -0.5392429 -1.4152029 12 O -1.6211083 -0.3479303 0.3137022 -0.3706660 -1.3755278 0.5204244 0.3107311 0.5392429 -1.4152029 13 O -0.9584664 0.2082309 -0.0047735 0.2140363 -1.4274436 -0.0484201 0.0104624 0.0642675 -1.2871287 14 O -0.9584664 -0.2082309 -0.0047735 -0.2140363 -1.4274436 0.0484201 0.0104624 -0.0642675 -1.2871287 15 O -0.9584664 0.2082309 -0.0047735 0.2140363 -1.4274436 -0.0484201 0.0104624 0.0642675 -1.2871287 16 O -0.9584664 -0.2082309 -0.0047735 -0.2140363 -1.4274436 0.0484201 0.0104624 -0.0642675 -1.2871287 17 O -1.3096471 0.3024671 -0.1582745 0.2853447 -1.5334822 0.4451031 -0.1784347 0.4484625 -1.4720471 18 O -1.3096471 -0.3024671 -0.1582745 -0.2853447 -1.5334822 -0.4451031 -0.1784347 -0.4484625 -1.4720471 19 O -1.6211083 -0.3479303 0.3137022 -0.3706660 -1.3755278 0.5204244 0.3107311 0.5392429 -1.4152029 20 O -1.3096471 -0.3024671 -0.1582745 -0.2853447 -1.5334822 -0.4451031 -0.1784347 -0.4484625 -1.4720471 21 Ca 2.7489514 0.0000000 -0.1405011 0.0000000 2.2892212 -0.0000000 0.1025152 0.0000000 2.5184712 22 Ca 2.7489514 0.0000000 -0.1405011 0.0000000 2.2892212 -0.0000000 0.1025152 0.0000000 2.5184712 23 Se 3.4538952 0.0000000 0.0129271 0.0000000 3.0419573 -0.0000000 0.0431806 0.0000000 3.0854176 24 Se 3.4538952 0.0000000 0.0129271 0.0000000 3.0419573 -0.0000000 0.0431806 0.0000000 3.0854176 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000055 (yyy) 0.00000055 (yyy) 0.00000055 (yyy) Max drift of fc2: 0.00000000 (yy) 0.00000000 (yy) --------------------------- 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 10 ] 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: 0.65, Number of G-points: 299, Lambda: 0.11 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/230) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.292 ( 0.000 0.000 0.000) 0.000 2.658 ( 0.000 0.000 0.000) 0.000 2.676 ( 0.000 0.000 0.000) 0.000 2.991 ( 0.000 0.000 0.000) 0.000 3.068 ( 0.000 0.000 0.000) 0.000 3.311 ( 0.000 0.000 0.000) 0.000 3.395 ( 0.000 0.000 0.000) 0.000 3.482 ( 0.000 0.000 0.000) 0.000 3.798 ( 0.000 0.000 0.000) 0.000 4.291 ( 0.000 0.000 0.000) 0.000 4.380 ( 0.000 0.000 0.000) 0.000 4.448 ( 0.000 0.000 0.000) 0.000 4.914 ( 0.000 0.000 0.000) 0.000 5.005 ( 0.000 0.000 0.000) 0.000 5.309 ( 0.000 0.000 0.000) 0.000 5.374 ( 0.000 0.000 0.000) 0.000 5.437 ( 0.000 0.000 0.000) 0.000 5.453 ( 0.000 0.000 0.000) 0.000 6.157 ( 0.000 0.000 0.000) 0.000 6.200 ( 0.000 0.000 0.000) 0.000 6.516 ( 0.000 0.000 0.000) 0.000 7.241 ( 0.000 0.000 0.000) 0.000 7.242 ( 0.000 0.000 0.000) 0.000 8.738 ( 0.000 0.000 0.000) 0.000 8.821 ( 0.000 0.000 0.000) 0.000 9.607 ( 0.000 0.000 0.000) 0.000 10.084 ( 0.000 0.000 0.000) 0.000 10.437 ( 0.000 0.000 0.000) 0.000 10.662 ( 0.000 0.000 0.000) 0.000 10.721 ( 0.000 0.000 0.000) 0.000 10.842 ( 0.000 0.000 0.000) 0.000 11.374 ( 0.000 0.000 0.000) 0.000 11.514 ( 0.000 0.000 0.000) 0.000 11.852 ( 0.000 0.000 0.000) 0.000 12.021 ( 0.000 0.000 0.000) 0.000 13.215 ( 0.000 0.000 0.000) 0.000 13.741 ( 0.000 0.000 0.000) 0.000 16.586 ( 0.000 0.000 0.000) 0.000 17.941 ( 0.000 0.000 0.000) 0.000 18.901 ( 0.000 0.000 0.000) 0.000 19.367 ( 0.000 0.000 0.000) 0.000 19.437 ( 0.000 0.000 0.000) 0.000 19.897 ( 0.000 0.000 0.000) 0.000 20.184 ( 0.000 0.000 0.000) 0.000 20.277 ( 0.000 0.000 0.000) 0.000 21.293 ( 0.000 0.000 0.000) 0.000 21.447 ( 0.000 0.000 0.000) 0.000 22.096 ( 0.000 0.000 0.000) 0.000 23.019 ( 0.000 0.000 0.000) 0.000 24.243 ( 0.000 0.000 0.000) 0.000 24.489 ( 0.000 0.000 0.000) 0.000 24.610 ( 0.000 0.000 0.000) 0.000 24.667 ( 0.000 0.000 0.000) 0.000 25.547 ( 0.000 0.000 0.000) 0.000 25.698 ( 0.000 0.000 0.000) 0.000 26.040 ( 0.000 0.000 0.000) 0.000 26.054 ( 0.000 0.000 0.000) 0.000 47.105 ( 0.000 0.000 0.000) 0.000 47.317 ( 0.000 0.000 0.000) 0.000 49.288 ( 0.000 0.000 0.000) 0.000 49.440 ( 0.000 0.000 0.000) 0.000 98.636 ( 0.000 0.000 0.000) 0.000 98.776 ( 0.000 0.000 0.000) 0.000 98.822 ( 0.000 0.000 0.000) 0.000 99.107 ( 0.000 0.000 0.000) 0.000 100.399 ( 0.000 0.000 0.000) 0.000 100.722 ( 0.000 0.000 0.000) 0.000 101.112 ( 0.000 0.000 0.000) 0.000 102.276 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/230) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.411 ( 14.100 -8.098 13.482) 21.122 0.584 ( 9.862 -28.121 24.596) 38.639 0.928 ( 42.347 -9.207 13.529) 45.399 2.392 ( 6.439 -2.810 5.943) 9.202 2.645 ( -0.064 2.388 -1.699) 2.931 2.700 ( 1.660 -1.445 -0.389) 2.235 2.934 ( -6.528 0.971 0.742) 6.642 3.100 ( -0.360 -3.582 5.097) 6.240 3.277 ( -3.014 -1.242 4.247) 5.354 3.397 ( -0.229 1.389 -3.881) 4.128 3.764 ( 4.288 6.629 -5.397) 9.563 3.830 ( 3.201 -2.016 -2.719) 4.659 4.264 ( -0.097 2.163 -3.819) 4.390 4.374 ( -1.238 -1.987 -1.257) 2.657 4.722 ( -1.867 1.967 -14.157) 14.415 4.787 ( 13.032 10.409 3.156) 16.975 5.111 ( -17.117 -6.531 -0.888) 18.342 5.230 ( 6.606 6.549 14.844) 17.518 5.385 ( 0.841 -6.212 -7.882) 10.071 5.485 ( 7.083 -0.056 -10.030) 12.279 5.629 ( 9.058 0.550 6.015) 10.887 6.120 ( -1.871 -0.043 -4.187) 4.586 6.540 ( 1.270 0.041 3.098) 3.349 7.112 ( 13.624 28.296 -2.867) 31.536 7.200 ( 1.378 8.337 -5.191) 9.917 7.594 ( 8.094 -6.728 -24.383) 26.558 8.684 ( -0.334 9.496 -0.760) 9.532 8.880 ( -0.869 -11.484 0.167) 11.518 9.661 ( 2.961 -2.466 4.032) 5.577 10.138 ( -0.131 -1.654 3.687) 4.043 10.448 ( 1.095 1.605 -2.014) 2.798 10.603 ( -3.788 -12.639 -11.834) 17.724 10.784 ( 1.124 5.833 9.165) 10.922 11.148 ( -22.170 -6.695 32.911) 40.243 11.361 ( -1.295 -0.014 -0.649) 1.448 11.485 ( -2.399 0.430 -1.273) 2.749 11.830 ( -4.823 -2.882 -0.091) 5.619 11.956 ( -3.659 1.368 -5.451) 6.706 13.502 ( 6.392 6.323 7.200) 11.518 13.760 ( 2.766 0.491 -0.818) 2.926 17.566 ( -26.337 0.684 -13.254) 29.492 17.616 ( 21.231 28.625 -0.137) 35.639 19.106 ( 9.959 0.102 8.783) 13.279 19.478 ( 4.285 -0.671 1.723) 4.667 19.671 ( 4.050 16.306 -13.052) 21.275 19.989 ( 18.956 10.172 -17.471) 27.713 20.277 ( -0.311 -2.483 6.720) 7.171 20.393 ( 15.232 -6.893 -11.713) 20.414 21.314 ( 2.958 -0.001 -1.176) 3.183 21.469 ( 2.745 0.995 0.786) 3.024 22.116 ( -7.925 -11.448 -2.101) 14.081 22.965 ( -6.853 -0.812 0.340) 6.910 24.269 ( -0.821 -5.373 -2.437) 5.957 24.491 ( -0.385 1.252 2.213) 2.572 24.592 ( -2.676 0.071 1.222) 2.943 24.975 ( -9.714 7.074 32.596) 34.741 25.550 ( -4.945 -5.584 0.146) 7.460 26.014 ( -3.672 1.358 0.229) 3.922 26.068 ( 1.395 -1.783 0.651) 2.356 26.832 ( 17.626 0.040 -39.274) 43.048 47.125 ( -2.607 0.898 4.971) 5.685 47.320 ( 0.198 -0.085 0.192) 0.289 49.275 ( -0.583 -0.198 -1.653) 1.764 49.462 ( -0.202 -2.007 1.263) 2.380 98.622 ( -2.554 -0.056 2.153) 3.341 98.793 ( 2.850 0.207 -1.883) 3.422 98.909 ( -12.940 5.166 23.361) 27.200 99.139 ( -2.943 0.169 12.047) 12.403 100.551 ( 2.247 9.797 4.379) 10.964 100.734 ( 0.611 0.198 1.574) 1.700 101.137 ( 2.123 -0.305 1.521) 2.630 102.560 ( -34.300 -77.816 -11.248) 85.781 ======================= Grid point 2 (3/230) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.825 ( 13.926 -8.355 13.872) 21.358 1.156 ( 10.381 -26.281 22.381) 36.047 1.769 ( 36.446 -6.742 11.373) 38.770 2.531 ( -3.429 1.673 -3.548) 5.210 2.602 ( 3.727 1.543 4.332) 5.919 2.746 ( 2.233 -0.747 0.775) 2.478 2.810 ( -6.636 0.961 3.124) 7.398 3.165 ( -2.072 -2.723 3.535) 4.920 3.294 ( -3.046 -0.152 -4.464) 5.406 3.342 ( 2.524 -3.176 4.922) 6.378 3.743 ( 0.128 2.921 1.299) 3.200 3.910 ( 6.744 -1.882 -2.373) 7.393 4.200 ( -1.380 1.965 -4.514) 5.113 4.330 ( -2.623 -5.151 -7.553) 9.511 4.600 ( -3.073 2.419 -6.467) 7.557 4.827 ( -5.369 3.990 1.933) 6.963 5.065 ( 7.634 -0.183 7.789) 10.908 5.284 ( 1.167 1.202 -3.586) 3.958 5.437 ( 3.425 5.221 1.911) 6.530 5.544 ( 5.991 -0.718 -2.616) 6.577 5.814 ( 8.246 2.432 5.698) 10.314 6.045 ( -3.005 -2.897 -4.644) 6.244 6.603 ( 2.202 0.371 4.485) 5.010 7.081 ( -0.289 11.374 -7.517) 13.636 7.112 ( 7.093 14.890 -1.867) 16.599 7.566 ( 1.036 -3.990 -9.038) 9.933 8.619 ( 0.899 8.890 0.947) 8.985 8.938 ( -1.598 -9.957 -0.152) 10.086 9.797 ( 5.022 -2.867 6.386) 8.615 10.189 ( 0.310 -4.307 2.057) 4.783 10.394 ( -1.781 0.560 -7.290) 7.525 10.571 ( -0.187 -8.342 -5.223) 9.844 10.828 ( -0.314 6.503 9.689) 11.674 11.088 ( -12.182 -5.736 11.146) 17.480 11.317 ( -3.117 0.574 0.002) 3.169 11.418 ( -3.047 -0.004 -2.557) 3.978 11.750 ( -5.629 -1.273 -0.424) 5.786 11.816 ( -4.387 1.947 -6.916) 8.419 13.649 ( 7.082 4.204 7.596) 11.204 13.807 ( 4.235 0.538 -1.580) 4.552 16.952 ( -28.396 -0.414 -13.891) 31.614 17.859 ( 20.055 13.622 6.885) 25.202 19.247 ( 1.222 0.017 4.532) 4.694 19.505 ( -4.878 5.258 -2.185) 7.497 19.613 ( 4.689 -1.433 3.463) 6.003 20.040 ( 9.328 5.134 -14.528) 18.012 20.388 ( 3.732 -0.684 8.696) 9.488 20.680 ( 23.123 -3.315 -8.603) 24.893 21.359 ( 2.788 0.155 -0.674) 2.873 21.556 ( 9.282 1.072 -1.848) 9.525 22.016 ( -10.020 -4.514 1.131) 11.048 22.811 ( -12.648 -1.291 0.982) 12.751 24.276 ( 0.566 -1.824 -1.411) 2.374 24.491 ( -0.596 2.428 1.914) 3.148 24.547 ( -4.058 -0.414 2.450) 4.758 25.064 ( 0.913 1.541 12.896) 13.020 25.499 ( -3.877 -2.633 -0.813) 4.757 25.912 ( -6.814 1.505 -0.311) 6.985 26.119 ( 1.791 -1.725 1.393) 2.850 26.785 ( 6.569 -0.018 -19.525) 20.600 47.115 ( -1.507 0.408 1.912) 2.469 47.328 ( 0.280 -0.128 0.268) 0.408 49.249 ( -0.693 -0.205 -1.989) 2.116 49.487 ( 0.334 -0.714 1.796) 1.962 98.595 ( -2.843 -0.029 2.510) 3.793 98.827 ( 2.540 0.767 -1.456) 3.027 98.850 ( -3.842 1.657 3.492) 5.449 99.191 ( -2.528 -0.040 10.758) 11.051 100.556 ( 1.170 3.376 1.280) 3.795 100.763 ( 0.893 0.170 2.330) 2.501 101.214 ( 4.501 -0.169 2.971) 5.396 102.400 ( -23.000 -36.154 -8.667) 43.717 ======================= Grid point 3 (4/230) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.237 ( 13.134 -8.576 14.185) 21.149 1.679 ( 9.275 -22.435 17.555) 29.959 2.334 ( -6.618 4.518 -7.529) 10.996 2.414 ( 22.041 -2.507 7.412) 23.388 2.604 ( -3.103 4.244 1.577) 5.489 2.756 ( -0.351 -0.255 2.348) 2.387 2.851 ( 3.863 1.219 2.921) 4.994 3.033 ( -5.783 5.315 -5.683) 9.695 3.322 ( 0.384 -7.528 0.003) 7.538 3.454 ( 4.647 0.100 1.827) 4.995 3.789 ( 1.484 -2.319 8.189) 8.639 4.016 ( 4.729 -2.505 -1.634) 5.596 4.116 ( -4.043 -0.675 -1.740) 4.453 4.252 ( -3.111 -4.166 -5.594) 7.637 4.415 ( -6.821 3.844 -7.920) 11.137 4.840 ( 2.589 2.047 8.675) 9.282 5.183 ( -1.197 -1.487 0.226) 1.922 5.279 ( 4.209 4.983 -4.688) 8.032 5.514 ( 9.312 -0.024 0.235) 9.315 5.590 ( 2.981 5.066 -0.238) 5.883 5.931 ( 0.903 0.875 1.449) 1.918 6.027 ( 0.912 -5.024 1.453) 5.309 6.673 ( 1.391 0.684 4.875) 5.115 6.909 ( -0.899 13.068 -7.899) 15.296 7.106 ( 3.177 7.176 -1.201) 7.939 7.538 ( -0.447 -2.380 -4.150) 4.805 8.606 ( 2.096 5.846 2.330) 6.633 8.967 ( -1.874 -6.946 -0.510) 7.212 9.956 ( 5.087 -0.719 6.026) 7.918 10.225 ( -0.025 -3.926 -3.402) 5.195 10.304 ( -2.850 -3.401 -2.939) 5.322 10.599 ( 1.680 -2.815 -2.129) 3.908 10.848 ( -2.270 3.778 9.579) 10.544 11.010 ( -5.914 -2.784 -0.608) 6.565 11.265 ( -4.383 -0.027 4.400) 6.211 11.343 ( -1.866 -0.023 -5.152) 5.479 11.664 ( -4.431 -0.108 -1.436) 4.660 11.686 ( -2.913 1.081 -4.238) 5.255 13.787 ( 4.752 3.036 6.657) 8.724 13.860 ( 3.948 -0.014 -2.475) 4.660 16.432 ( -20.136 -0.281 -9.882) 22.432 18.177 ( 17.331 7.183 8.390) 20.551 19.276 ( -0.415 -0.084 2.214) 2.254 19.379 ( -5.584 1.715 0.237) 5.847 19.708 ( 2.272 -0.946 2.416) 3.449 19.991 ( 1.744 2.593 -11.160) 11.589 20.538 ( 4.403 -0.650 7.617) 8.823 21.022 ( 22.520 -1.789 -9.217) 24.398 21.389 ( 1.517 0.360 -0.048) 1.560 21.733 ( 13.770 0.609 -2.918) 14.089 21.872 ( -11.116 -1.799 3.436) 11.773 22.582 ( -16.457 -1.180 1.979) 16.617 24.292 ( 1.467 -0.121 -0.604) 1.591 24.449 ( -2.814 1.516 -0.672) 3.266 24.527 ( -1.843 0.037 3.703) 4.137 25.198 ( 5.220 -0.658 6.687) 8.509 25.452 ( -2.311 -1.589 -1.183) 3.045 25.763 ( -8.621 1.867 -0.648) 8.844 26.168 ( 1.244 -1.294 1.184) 2.151 26.732 ( 2.647 -0.067 -10.916) 11.232 47.103 ( -0.922 0.213 0.810) 1.246 47.335 ( 0.228 -0.110 0.215) 0.332 49.225 ( -0.504 -0.131 -1.462) 1.552 49.511 ( 0.316 -0.293 1.354) 1.421 98.572 ( -2.013 -0.002 1.848) 2.733 98.796 ( -1.870 1.019 0.006) 2.129 98.863 ( 2.299 0.196 -1.325) 2.661 99.232 ( -1.587 -0.107 6.792) 6.975 100.563 ( 0.693 1.259 0.331) 1.475 100.796 ( 0.746 0.052 1.978) 2.115 101.340 ( 6.874 0.750 4.088) 8.033 102.175 ( -18.474 -19.488 -7.700) 27.935 ======================= Grid point 4 (5/230) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.629 ( 11.777 -7.940 13.533) 19.618 1.936 ( -5.601 -0.310 -5.609) 7.933 2.190 ( 0.696 -6.352 3.357) 7.218 2.508 ( -2.449 3.536 0.596) 4.342 2.700 ( 2.209 2.024 2.419) 3.850 2.788 ( 2.759 -1.097 0.629) 3.035 2.875 ( -1.269 0.305 -4.126) 4.327 2.933 ( 3.559 6.027 0.681) 7.032 3.359 ( 1.032 -4.225 -2.506) 5.020 3.506 ( 0.620 1.346 0.742) 1.657 3.943 ( 2.914 -5.883 8.703) 10.901 4.044 ( -4.564 -4.907 5.758) 8.836 4.090 ( 2.559 2.448 -3.984) 5.331 4.197 ( -5.034 0.673 -0.781) 5.139 4.228 ( 0.650 2.807 -9.667) 10.087 4.966 ( 3.255 1.578 8.679) 9.403 5.135 ( -2.468 -3.591 -5.318) 6.875 5.242 ( 1.082 4.540 -3.510) 5.840 5.566 ( 0.198 1.535 -0.475) 1.618 5.727 ( 9.974 0.614 2.310) 10.256 5.893 ( -5.276 -1.739 -0.089) 5.555 6.099 ( 1.436 -1.442 1.131) 2.328 6.698 ( -1.434 2.108 2.290) 3.427 6.779 ( 0.797 4.500 -3.612) 5.825 7.098 ( 0.967 2.297 -0.566) 2.555 7.519 ( -0.291 -0.756 -1.338) 1.564 8.629 ( 1.340 2.042 1.452) 2.841 8.971 ( -0.982 -2.568 -0.403) 2.779 10.048 ( 1.574 1.122 1.665) 2.551 10.209 ( 0.338 -2.357 -2.600) 3.526 10.300 ( -0.954 -2.321 0.845) 2.648 10.620 ( 0.804 -0.429 -0.803) 1.215 10.871 ( -2.290 0.706 9.414) 9.714 10.927 ( -0.737 -0.098 -7.334) 7.372 11.251 ( -4.094 -0.844 8.227) 9.227 11.277 ( 1.431 0.598 -7.959) 8.108 11.585 ( -1.836 0.418 -1.697) 2.534 11.639 ( -0.827 -0.029 -0.478) 0.955 13.869 ( 1.184 1.851 4.632) 5.127 13.891 ( 2.027 -0.823 -3.148) 3.833 16.138 ( -7.264 -0.096 -3.575) 8.097 18.425 ( 7.723 2.419 4.124) 9.083 19.283 ( -0.218 -0.040 0.898) 0.925 19.302 ( -2.585 0.259 0.196) 2.605 19.749 ( 0.595 -0.295 0.772) 1.018 19.909 ( -0.616 0.799 -4.769) 4.874 20.648 ( 1.947 -0.275 3.331) 3.868 21.270 ( 11.931 -0.735 -6.297) 13.511 21.409 ( 1.467 0.079 -0.587) 1.582 21.710 ( -9.186 -0.065 4.811) 10.370 21.978 ( 14.896 0.073 -3.467) 15.294 22.325 ( -15.490 -0.562 2.605) 15.718 24.317 ( 1.717 0.456 0.122) 1.781 24.388 ( -2.432 0.137 -0.680) 2.529 24.530 ( -0.496 0.159 1.453) 1.543 25.343 ( 4.206 -0.967 3.361) 5.470 25.439 ( 1.989 -1.161 -1.060) 2.535 25.594 ( -8.131 1.878 -0.928) 8.397 26.197 ( 0.422 -0.479 0.459) 0.786 26.697 ( 0.716 -0.041 -3.639) 3.709 47.095 ( -0.318 0.069 0.226) 0.396 47.340 ( 0.086 -0.043 0.081) 0.126 49.211 ( -0.181 -0.044 -0.528) 0.560 49.524 ( 0.120 -0.081 0.492) 0.513 98.559 ( -0.718 0.003 0.672) 0.983 98.769 ( -0.546 0.287 -0.279) 0.677 98.882 ( 0.850 0.087 -0.474) 0.977 99.253 ( -0.539 -0.050 2.298) 2.361 100.566 ( 0.240 0.323 0.051) 0.405 100.817 ( 0.285 0.001 0.765) 0.816 101.484 ( 5.726 1.459 3.112) 6.678 101.964 ( -9.815 -7.372 -4.391) 13.037 ======================= Grid point 10 (6/230) ======================= q-point: ( 0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.814 ( 10.440 0.000 24.847) 26.951 0.887 ( 15.959 0.000 22.328) 27.444 1.722 ( 39.180 0.000 11.540) 40.845 2.547 ( -0.219 -0.000 0.217) 0.308 2.617 ( 2.844 0.000 4.246) 5.111 2.740 ( 2.376 0.000 0.435) 2.416 2.813 ( -8.327 -0.000 2.644) 8.737 3.133 ( -0.953 -0.000 7.049) 7.113 3.299 ( -4.624 -0.000 -4.876) 6.720 3.322 ( 2.539 0.000 3.989) 4.728 3.774 ( -0.366 -0.000 0.061) 0.371 3.891 ( 6.697 0.000 -2.281) 7.075 4.235 ( 0.027 0.000 -5.385) 5.385 4.269 ( -4.298 -0.000 -8.362) 9.402 4.618 ( -2.940 -0.000 -7.123) 7.706 4.855 ( -8.406 -0.000 1.846) 8.607 5.065 ( 9.934 0.000 7.532) 12.467 5.293 ( 1.697 0.000 -8.101) 8.277 5.499 ( 5.105 0.000 -10.454) 11.634 5.519 ( 5.429 0.000 15.137) 16.082 5.831 ( 7.624 0.000 5.267) 9.266 6.021 ( -3.190 -0.000 -7.842) 8.466 6.606 ( 2.170 0.000 4.822) 5.288 7.109 ( -2.815 -0.000 -2.472) 3.747 7.370 ( 3.916 0.000 -0.193) 3.921 7.462 ( 3.427 0.000 -20.299) 20.586 8.720 ( -0.593 -0.000 -0.519) 0.788 8.829 ( 0.013 0.000 1.663) 1.663 9.775 ( 5.346 0.000 7.534) 9.238 10.158 ( 0.074 0.000 3.299) 3.300 10.370 ( -3.102 -0.000 -12.659) 13.034 10.524 ( 3.600 0.000 0.070) 3.601 10.896 ( 0.902 0.000 6.295) 6.359 11.027 ( -15.850 -0.000 19.148) 24.857 11.322 ( -2.319 -0.000 -1.337) 2.677 11.418 ( -3.391 -0.000 -2.675) 4.320 11.739 ( -4.826 -0.000 -0.542) 4.856 11.831 ( -4.700 -0.000 -7.064) 8.484 13.683 ( 5.858 0.000 7.279) 9.343 13.811 ( 4.248 0.000 -2.049) 4.716 16.949 ( -28.291 -0.000 -13.875) 31.510 17.969 ( 14.422 0.000 4.728) 15.177 19.247 ( 1.255 0.000 4.306) 4.485 19.554 ( -8.449 -0.000 -3.401) 9.108 19.598 ( 5.508 0.000 3.755) 6.666 20.098 ( 9.062 0.000 -20.021) 21.976 20.382 ( 3.984 0.000 8.821) 9.679 20.643 ( 24.339 0.000 -7.047) 25.339 21.360 ( 3.484 0.000 -1.947) 3.991 21.565 ( 8.757 0.000 -1.396) 8.868 21.976 ( -8.180 -0.000 2.885) 8.674 22.801 ( -12.659 -0.000 1.359) 12.731 24.261 ( 1.548 0.000 -0.604) 1.662 24.512 ( -0.663 -0.000 3.386) 3.451 24.542 ( -4.191 -0.000 0.823) 4.271 25.079 ( -2.175 -0.000 15.326) 15.480 25.476 ( -1.673 -0.000 -2.806) 3.267 25.926 ( -5.902 -0.000 -2.335) 6.347 26.106 ( -0.404 -0.000 6.920) 6.932 26.783 ( 8.841 0.000 -24.336) 25.892 47.118 ( -1.904 -0.000 2.316) 2.998 47.327 ( 0.341 0.000 0.184) 0.388 49.247 ( -0.624 -0.000 -2.008) 2.103 49.481 ( 0.664 0.000 2.010) 2.116 98.594 ( -2.655 -0.000 2.179) 3.434 98.832 ( 3.150 0.000 -1.776) 3.616 98.867 ( -6.835 -0.000 6.195) 9.225 99.191 ( -2.893 -0.000 11.316) 11.680 100.589 ( -0.814 -0.000 0.426) 0.918 100.770 ( 0.247 0.000 3.663) 3.672 101.211 ( 4.645 0.000 2.872) 5.461 102.088 ( -8.124 -0.000 -2.980) 8.653 ======================= Grid point 11 (7/230) ======================= q-point: ( 0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.182 ( 11.505 0.895 21.233) 24.167 1.400 ( 14.307 -13.585 20.290) 28.301 2.384 ( 21.169 -0.016 6.544) 22.158 2.395 ( -3.750 1.569 -3.039) 5.075 2.669 ( -5.083 4.061 3.856) 7.563 2.754 ( 1.931 0.202 1.847) 2.680 2.833 ( 3.194 -2.970 2.401) 4.979 3.115 ( -4.240 5.994 -1.594) 7.513 3.211 ( -1.055 -7.181 1.487) 7.409 3.446 ( 5.168 -0.626 2.826) 5.923 3.795 ( 1.218 1.794 5.446) 5.862 3.961 ( 0.500 -3.486 -3.286) 4.817 4.131 ( -1.298 1.981 -2.648) 3.552 4.197 ( -0.942 -3.091 -5.536) 6.410 4.456 ( -5.480 1.578 -8.794) 10.481 4.858 ( 1.082 0.572 9.359) 9.438 5.158 ( -2.194 -1.166 -1.941) 3.153 5.349 ( 9.033 3.066 -6.502) 11.544 5.511 ( 7.297 -0.104 -3.855) 8.253 5.668 ( 1.639 4.396 7.775) 9.081 5.907 ( -3.556 -3.523 -5.932) 7.762 5.972 ( 4.072 -1.340 3.040) 5.256 6.681 ( 1.265 0.376 5.563) 5.717 7.027 ( -3.107 3.067 -3.254) 5.445 7.259 ( -0.384 11.688 -10.154) 15.488 7.469 ( 1.508 -6.646 -3.612) 7.713 8.686 ( 0.030 4.218 -0.358) 4.233 8.876 ( 0.593 -4.616 1.927) 5.037 9.950 ( 6.150 -0.114 9.047) 10.940 10.189 ( -0.109 -0.673 0.125) 0.693 10.231 ( -2.915 -4.676 -8.237) 9.910 10.595 ( 4.160 0.735 0.468) 4.250 10.904 ( -6.208 3.855 9.888) 12.295 10.964 ( -4.294 -3.499 3.205) 6.399 11.265 ( -4.293 0.034 2.440) 4.938 11.340 ( -2.015 -0.184 -4.345) 4.793 11.662 ( -3.347 -0.076 -0.993) 3.492 11.697 ( -3.967 0.409 -5.459) 6.760 13.820 ( 3.951 1.271 6.051) 7.338 13.859 ( 3.750 -0.015 -3.020) 4.815 16.429 ( -20.029 -0.111 -9.813) 22.303 18.255 ( 13.883 2.950 6.764) 15.722 19.275 ( -0.154 -0.033 1.684) 1.692 19.399 ( -7.070 0.842 -0.307) 7.127 19.697 ( 2.602 -0.464 2.770) 3.829 20.027 ( 1.052 1.792 -13.057) 13.222 20.531 ( 4.365 -0.242 8.139) 9.238 20.998 ( 23.119 -1.107 -8.381) 24.616 21.392 ( 2.126 0.037 -1.687) 2.714 21.743 ( 14.010 0.526 -2.708) 14.279 21.849 ( -10.934 -1.089 4.888) 12.026 22.570 ( -16.412 -0.405 2.742) 16.644 24.290 ( 2.109 -0.079 -0.204) 2.120 24.465 ( -4.433 0.616 -0.304) 4.486 24.527 ( -1.022 0.026 3.200) 3.360 25.192 ( 4.128 -0.238 7.089) 8.207 25.433 ( -0.780 -0.764 -2.800) 3.005 25.784 ( -7.737 0.821 -2.619) 8.210 26.159 ( -1.301 -0.166 8.213) 8.318 26.727 ( 4.623 -0.312 -15.366) 16.049 47.105 ( -1.193 0.116 1.103) 1.629 47.334 ( 0.332 -0.041 0.095) 0.347 49.223 ( -0.415 -0.064 -1.502) 1.559 49.507 ( 0.465 -0.152 1.490) 1.569 98.572 ( -1.646 0.003 1.185) 2.028 98.809 ( -3.129 0.609 1.066) 3.361 98.865 ( 2.133 0.073 -1.043) 2.375 99.231 ( -1.542 -0.067 6.667) 6.843 100.577 ( -0.188 0.618 -0.162) 0.666 100.801 ( 0.177 0.431 3.076) 3.111 101.342 ( 7.022 -0.260 3.936) 8.054 101.955 ( -9.241 -8.763 -3.171) 13.124 ======================= Grid point 12 (8/230) ======================= q-point: ( 0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.553 ( 11.506 -2.231 18.509) 21.908 1.848 ( 8.732 -9.448 10.655) 16.705 2.178 ( -6.967 3.100 -3.342) 8.326 2.564 ( -2.766 3.545 3.468) 5.678 2.731 ( 1.637 1.746 1.951) 3.088 2.770 ( 3.189 -1.333 0.127) 3.458 2.874 ( -1.728 0.024 -1.346) 2.190 3.019 ( -2.509 5.220 -0.385) 5.805 3.296 ( 6.729 -4.015 -1.646) 8.007 3.498 ( -2.298 -2.074 0.549) 3.144 3.879 ( 1.902 -1.763 8.591) 8.974 3.969 ( -0.105 -5.141 5.062) 7.215 4.116 ( 0.549 1.446 -3.939) 4.231 4.182 ( -1.502 -1.263 1.554) 2.503 4.306 ( 2.129 5.085 -11.899) 13.114 4.984 ( 2.679 0.982 10.129) 10.523 5.082 ( -2.611 -3.233 -6.623) 7.819 5.314 ( 2.392 4.411 -11.793) 12.816 5.609 ( -0.876 4.231 2.489) 4.986 5.735 ( 7.782 0.421 2.840) 8.294 5.851 ( -3.416 -4.121 -1.716) 5.621 6.042 ( -0.243 -4.578 0.605) 4.625 6.723 ( -1.351 1.180 5.004) 5.316 6.890 ( -3.035 8.762 -5.442) 10.752 7.111 ( -3.430 -0.392 -5.812) 6.760 7.502 ( 1.685 -1.342 -1.633) 2.703 8.655 ( -0.684 1.388 -1.769) 2.350 8.939 ( 1.966 -1.679 2.460) 3.568 10.067 ( 0.769 1.609 -1.089) 2.089 10.172 ( 2.648 -2.774 1.857) 4.261 10.244 ( -0.796 -3.957 3.122) 5.102 10.650 ( 3.055 3.230 1.003) 4.558 10.873 ( -5.104 -0.356 10.376) 11.569 10.925 ( 0.289 -0.077 -7.942) 7.948 11.239 ( -4.497 -0.738 8.706) 9.826 11.284 ( 0.916 0.281 -6.277) 6.350 11.596 ( -1.757 0.995 -2.243) 3.018 11.632 ( -0.948 -0.874 -1.156) 1.732 13.877 ( 1.510 -0.490 -4.019) 4.321 13.896 ( 0.831 1.207 4.158) 4.409 16.136 ( -7.183 -0.065 -3.451) 7.970 18.454 ( 4.736 1.444 2.535) 5.563 19.282 ( 0.190 -0.056 0.107) 0.225 19.306 ( -2.940 0.259 -0.063) 2.952 19.744 ( 0.795 -0.280 1.288) 1.539 19.923 ( -1.530 1.050 -5.282) 5.599 20.645 ( 1.966 -0.129 4.154) 4.597 21.262 ( 12.963 -0.363 -5.346) 14.027 21.406 ( 1.451 -0.418 -2.170) 2.644 21.710 ( -8.838 -0.027 4.797) 10.056 21.979 ( 14.371 0.069 -2.036) 14.515 22.318 ( -15.331 -0.317 3.498) 15.728 24.326 ( 1.963 0.620 0.314) 2.083 24.387 ( -3.504 -0.192 -0.786) 3.596 24.532 ( -0.648 0.090 1.275) 1.433 25.332 ( 6.249 -0.543 2.241) 6.661 25.421 ( 1.862 -1.088 -2.513) 3.311 25.618 ( -8.046 1.240 -1.997) 8.382 26.199 ( -2.193 0.588 8.226) 8.534 26.691 ( 2.647 -0.651 -8.138) 8.582 47.097 ( -0.547 0.070 0.484) 0.734 47.339 ( 0.222 -0.026 -0.063) 0.232 49.210 ( -0.081 -0.039 -0.601) 0.607 49.523 ( 0.191 -0.073 0.608) 0.642 98.560 ( -0.229 0.050 -0.225) 0.325 98.774 ( -1.213 0.330 0.185) 1.271 98.883 ( 0.548 0.064 -0.109) 0.562 99.252 ( -0.297 -0.105 1.860) 1.887 100.570 ( -0.252 0.156 -0.172) 0.342 100.820 ( -0.183 0.328 1.845) 1.883 101.480 ( 3.051 -1.613 1.402) 3.725 101.886 ( -0.055 -3.124 1.289) 3.380 ======================= Grid point 13 (9/230) ======================= q-point: (-0.56 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.762 ( -10.041 9.236 -9.521) 16.636 1.907 ( 10.766 -2.116 14.855) 18.468 2.262 ( 5.475 -0.113 4.590) 7.145 2.511 ( -1.924 5.343 -0.004) 5.679 2.685 ( -3.973 0.365 -2.597) 4.761 2.796 ( -0.855 -0.790 -1.326) 1.764 2.832 ( -5.729 -4.062 0.124) 7.024 2.886 ( -4.230 -0.962 0.521) 4.369 3.412 ( 1.512 2.714 2.859) 4.222 3.466 ( -1.254 -3.567 -0.435) 3.806 3.996 ( -2.448 -0.979 8.015) 8.438 4.052 ( -1.302 -0.144 -4.852) 5.026 4.095 ( 7.005 1.459 -2.039) 7.440 4.159 ( 1.494 -1.825 4.030) 4.669 4.275 ( 5.144 6.554 -3.444) 9.015 4.934 ( -3.934 -2.859 -10.825) 11.867 5.161 ( 1.501 -0.273 13.350) 13.437 5.218 ( 1.187 1.451 -11.174) 11.330 5.565 ( -2.637 1.414 1.980) 3.588 5.716 ( -9.265 -1.091 -1.817) 9.505 5.906 ( 4.945 0.273 -1.038) 5.060 6.055 ( -1.982 -6.691 -0.738) 7.017 6.696 ( -3.092 2.166 2.035) 4.289 6.766 ( -1.978 1.914 -2.886) 3.988 7.043 ( -3.484 -5.112 -1.901) 6.472 7.523 ( 1.192 -0.030 0.033) 1.193 8.600 ( -2.847 -1.771 -4.275) 5.432 9.008 ( 3.564 2.341 2.928) 5.173 10.032 ( -1.471 -1.101 -2.849) 3.390 10.234 ( -0.085 0.515 3.706) 3.742 10.305 ( 1.553 -0.340 3.854) 4.169 10.672 ( 1.832 5.623 2.601) 6.460 10.856 ( 0.815 -1.127 -10.325) 10.418 10.923 ( 0.989 -0.698 8.312) 8.400 11.261 ( 1.379 0.217 -2.780) 3.111 11.268 ( -0.056 -0.452 5.115) 5.135 11.584 ( 1.863 0.310 0.852) 2.072 11.633 ( 0.791 -0.858 -0.129) 1.174 13.842 ( -1.803 -1.674 -5.807) 6.306 13.904 ( -2.371 0.837 2.808) 3.769 16.139 ( 7.358 0.081 3.716) 8.244 18.389 ( -10.944 -2.298 -5.842) 12.617 19.283 ( 0.658 0.046 -1.571) 1.704 19.299 ( 2.264 -0.142 -0.725) 2.382 19.752 ( -0.434 0.168 -0.199) 0.506 19.903 ( -0.077 -0.056 4.390) 4.391 20.653 ( -1.936 0.331 -2.356) 3.068 21.283 ( -11.740 0.872 7.597) 14.011 21.402 ( -0.765 -0.756 -1.571) 1.904 21.711 ( 9.660 0.089 -4.747) 10.764 21.977 ( -15.594 -0.069 4.884) 16.341 22.333 ( 15.716 0.573 -1.481) 15.796 24.314 ( -2.039 0.050 -0.190) 2.048 24.383 ( 1.731 -0.527 0.835) 1.993 24.528 ( 0.428 -0.147 -1.657) 1.718 25.359 ( -2.663 1.227 -4.701) 5.540 25.447 ( -0.214 -0.234 -1.452) 1.487 25.571 ( 6.935 -1.040 1.174) 7.110 26.213 ( -3.139 1.664 7.617) 8.405 26.690 ( 1.336 -0.872 -1.197) 1.994 47.095 ( 0.079 -0.026 0.066) 0.106 47.340 ( 0.067 0.040 -0.239) 0.251 49.211 ( 0.289 0.023 0.443) 0.529 49.525 ( -0.061 0.044 -0.372) 0.380 98.560 ( 1.259 0.073 -1.706) 2.121 98.766 ( -0.049 -0.067 0.739) 0.744 98.881 ( -1.205 -0.067 0.904) 1.508 99.253 ( 0.809 -0.066 -2.776) 2.892 100.561 ( -0.730 -0.356 -0.218) 0.841 100.820 ( -0.665 0.352 0.417) 0.860 101.446 ( -6.131 -3.167 -3.390) 7.688 102.077 ( 17.411 7.246 8.882) 20.846 ======================= Grid point 14 (10/230) ======================= q-point: (-0.44 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.405 ( -11.823 13.282 -9.582) 20.199 2.002 ( -5.845 20.259 -10.106) 23.382 2.287 ( 4.486 -1.275 9.590) 10.664 2.459 ( -17.424 3.726 -4.082) 18.279 2.545 ( 3.189 -4.063 1.911) 5.507 2.753 ( 1.341 -1.107 -4.264) 4.605 2.811 ( -1.774 -3.462 -4.039) 5.608 2.960 ( 3.421 -4.603 9.250) 10.883 3.410 ( -0.886 3.061 3.934) 5.063 3.441 ( -3.994 -0.151 -0.401) 4.017 3.868 ( -1.914 7.742 -10.918) 13.521 4.026 ( -5.887 -0.477 4.221) 7.259 4.142 ( 3.965 1.774 -0.347) 4.357 4.314 ( 2.918 3.660 6.260) 7.817 4.357 ( 10.881 -2.909 2.928) 11.637 4.793 ( -5.206 -4.473 -8.293) 10.765 5.157 ( 0.387 -3.608 -9.220) 9.908 5.269 ( 0.443 2.595 8.761) 9.148 5.499 ( -11.563 -1.825 -3.455) 12.206 5.548 ( -3.085 -0.681 2.650) 4.124 5.888 ( -5.395 -5.036 -4.531) 8.660 6.073 ( 1.802 0.640 -0.972) 2.146 6.657 ( -2.523 -2.159 -2.598) 4.216 6.738 ( -3.695 -7.180 4.674) 9.330 7.025 ( -2.055 -4.910 -0.056) 5.323 7.546 ( 0.157 -0.768 2.000) 2.148 8.528 ( -3.405 -4.765 -4.554) 7.419 9.065 ( 3.852 6.283 2.400) 7.751 9.967 ( -3.809 0.554 -3.154) 4.976 10.267 ( -0.092 -0.583 5.219) 5.252 10.329 ( 0.757 3.181 -0.150) 3.273 10.685 ( 2.396 7.139 3.176) 8.173 10.800 ( 0.275 -2.107 -7.526) 7.820 11.043 ( 5.960 1.777 5.625) 8.386 11.267 ( 3.820 0.289 -4.870) 6.196 11.337 ( 1.836 -0.917 5.089) 5.487 11.660 ( 3.661 -1.026 3.950) 5.483 11.673 ( 3.657 -0.323 0.484) 3.703 13.740 ( -5.642 -3.240 -7.521) 9.945 13.860 ( -4.362 0.040 1.680) 4.675 16.436 ( 20.301 0.319 9.989) 22.627 18.065 ( -21.528 -7.566 -10.510) 25.122 19.278 ( 0.795 0.136 -2.914) 3.024 19.355 ( 4.258 -1.374 -1.010) 4.586 19.721 ( -1.982 0.813 -1.826) 2.815 19.964 ( -1.557 -1.050 9.557) 9.740 20.549 ( -4.522 0.842 -6.732) 8.153 21.043 ( -22.738 1.055 9.914) 24.828 21.381 ( -0.530 -0.805 -2.275) 2.471 21.728 ( -14.678 0.031 4.087) 15.237 21.894 ( 12.242 1.024 -2.632) 12.563 22.603 ( 16.629 1.569 -0.756) 16.720 24.293 ( -0.736 0.068 1.033) 1.270 24.425 ( 1.040 -1.680 0.969) 2.201 24.526 ( 2.513 -0.015 -4.067) 4.781 25.209 ( -6.293 0.764 -6.446) 9.041 25.473 ( 4.013 1.152 -1.118) 4.322 25.737 ( 9.626 -1.446 -0.338) 9.740 26.197 ( -4.179 2.552 6.837) 8.410 26.725 ( -0.213 -0.957 5.198) 5.289 47.100 ( 0.616 -0.135 -0.379) 0.736 47.337 ( -0.073 0.133 -0.380) 0.409 49.227 ( 0.611 0.107 1.388) 1.520 49.514 ( -0.204 0.208 -1.209) 1.244 98.572 ( 2.535 0.034 -2.909) 3.859 98.784 ( 0.762 -0.558 1.219) 1.542 98.860 ( -2.649 -0.235 1.827) 3.226 99.233 ( 1.693 0.016 -6.990) 7.193 100.545 ( -1.488 -1.096 -0.606) 1.945 100.801 ( -0.983 0.612 -0.660) 1.333 101.322 ( -6.102 -1.559 -3.590) 7.249 102.461 ( 27.164 18.144 12.301) 34.906 ======================= Grid point 15 (11/230) ======================= q-point: (-0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.022 ( -11.822 16.629 -7.094) 21.601 1.524 ( -16.787 20.864 -14.035) 30.234 1.945 ( -22.271 18.681 -10.956) 31.065 2.500 ( 4.918 -3.046 7.444) 9.427 2.596 ( -1.951 1.702 -1.313) 2.902 2.750 ( -2.599 -1.253 -2.709) 3.958 2.785 ( 6.424 -1.403 -2.547) 7.052 3.152 ( 4.709 -4.099 6.273) 8.851 3.332 ( -3.411 4.067 1.329) 5.472 3.413 ( 0.538 5.589 -2.130) 6.005 3.724 ( -0.225 1.329 -7.111) 7.238 3.937 ( -7.049 1.893 3.721) 8.192 4.185 ( 0.920 -0.410 1.866) 2.121 4.392 ( 0.982 3.011 6.591) 7.313 4.553 ( 3.361 -3.698 4.316) 6.603 4.738 ( 0.224 -8.103 -2.982) 8.637 5.073 ( -2.107 0.865 -8.616) 8.912 5.256 ( -2.278 -2.491 -7.705) 8.412 5.374 ( -2.869 -2.923 4.599) 6.158 5.542 ( -4.224 -0.563 6.654) 7.902 5.751 ( -9.066 -6.410 -6.634) 12.934 6.092 ( 2.598 3.043 0.451) 4.026 6.593 ( -3.024 -1.450 -3.204) 4.638 6.772 ( -10.907 -18.202 5.491) 21.919 7.055 ( 1.657 -3.151 2.022) 4.094 7.573 ( -1.335 -2.212 4.039) 4.795 8.495 ( -2.059 -7.888 -2.275) 8.463 9.082 ( 2.947 9.568 1.424) 10.113 9.849 ( -4.171 3.917 -3.633) 6.778 10.276 ( -0.370 7.168 -0.040) 7.178 10.337 ( -0.172 -5.828 1.704) 6.074 10.684 ( 0.797 -0.709 -6.383) 6.472 10.790 ( 2.209 6.981 6.281) 9.647 11.167 ( 8.833 5.006 -1.740) 10.301 11.307 ( 3.568 -0.788 -1.265) 3.867 11.418 ( 4.055 -0.086 0.958) 4.168 11.760 ( 4.403 -1.437 3.072) 5.558 11.788 ( 6.169 -0.342 3.712) 7.208 13.578 ( -8.632 -5.016 -8.340) 13.009 13.795 ( -4.552 -1.004 0.749) 4.721 16.960 ( 28.649 0.627 13.933) 31.864 17.636 ( -27.582 -15.145 -10.534) 33.183 19.247 ( -1.123 0.050 -5.039) 5.163 19.434 ( 2.585 -3.865 0.265) 4.657 19.635 ( -4.708 1.588 -3.180) 5.899 19.992 ( -6.470 -1.477 9.886) 11.907 20.400 ( -3.921 0.953 -8.236) 9.172 20.711 ( -23.418 0.997 8.903) 25.073 21.355 ( -1.120 -0.432 -1.806) 2.169 21.540 ( -10.641 -0.952 3.196) 11.151 22.077 ( 11.678 3.271 0.377) 12.134 22.838 ( 12.787 2.378 -0.058) 13.007 24.304 ( 0.940 1.746 2.603) 3.273 24.450 ( -0.041 -2.950 -0.888) 3.081 24.551 ( 4.077 0.091 -3.572) 5.421 25.047 ( -4.712 -0.620 -9.364) 10.502 25.535 ( 6.109 1.878 -2.174) 6.751 25.895 ( 8.364 -0.647 -0.892) 8.437 26.154 ( -5.073 2.897 6.331) 8.614 26.778 ( -2.761 -1.018 10.969) 11.357 47.109 ( 0.959 -0.252 -1.083) 1.468 47.330 ( -0.143 0.213 -0.426) 0.498 49.252 ( 0.776 0.189 1.919) 2.079 49.497 ( -0.038 0.497 -1.554) 1.632 98.594 ( 3.264 -0.046 -3.442) 4.744 98.811 ( -0.694 -0.989 1.431) 1.873 98.834 ( -1.045 -0.644 0.830) 1.481 99.192 ( 2.156 0.084 -10.064) 10.293 100.514 ( -2.604 -2.246 -1.503) 3.753 100.771 ( -0.906 1.036 -0.887) 1.637 101.214 ( -4.145 -0.215 -2.701) 4.952 102.937 ( 37.769 33.405 15.525) 52.758 ======================= Grid point 16 (12/230) ======================= q-point: (-0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.655 ( -9.666 20.814 -3.232) 23.176 0.912 ( -27.936 14.535 -10.590) 33.224 1.305 ( -12.646 40.192 -14.334) 44.506 2.452 ( -5.996 3.591 -4.162) 8.134 2.608 ( 0.210 -1.323 2.158) 2.539 2.725 ( -0.181 2.031 1.809) 2.726 2.916 ( 7.302 -1.137 0.398) 7.401 3.182 ( 0.385 6.323 -2.109) 6.677 3.312 ( 0.143 2.381 -4.272) 4.893 3.376 ( 1.629 0.895 2.857) 3.409 3.687 ( -5.297 -2.658 0.256) 5.932 3.857 ( -3.614 1.940 3.157) 5.176 4.224 ( 0.109 -3.043 2.937) 4.231 4.388 ( -2.588 -0.908 -0.449) 2.779 4.638 ( -12.948 -7.966 0.243) 15.205 4.684 ( -0.629 -3.995 8.256) 9.193 5.091 ( 3.646 -7.491 -13.222) 15.628 5.201 ( 8.744 1.279 -5.217) 10.262 5.418 ( -0.178 -2.756 2.770) 3.912 5.517 ( -5.683 3.918 12.572) 14.343 5.612 ( -3.104 -1.984 -4.111) 5.520 6.126 ( 1.713 0.886 1.672) 2.553 6.532 ( -2.713 -2.564 -3.509) 5.124 6.664 ( -24.567 -21.970 1.575) 32.995 7.149 ( 2.965 -3.218 3.252) 5.452 7.602 ( -2.959 -3.753 6.367) 7.961 8.537 ( -0.206 -10.305 0.849) 10.342 9.051 ( 1.519 11.542 0.603) 11.657 9.728 ( -2.272 6.266 -2.346) 7.066 10.199 ( -0.791 6.018 -3.438) 6.976 10.395 ( -0.034 -5.229 3.000) 6.029 10.619 ( -2.525 -8.028 -11.871) 14.552 10.874 ( 4.677 13.849 15.877) 21.581 11.241 ( 11.786 4.448 -12.418) 17.689 11.358 ( 1.941 -0.449 0.068) 1.994 11.491 ( 5.027 1.759 -0.674) 5.368 11.871 ( 5.791 0.534 1.239) 5.946 11.933 ( 6.238 -0.327 3.998) 7.417 13.392 ( -10.351 -6.922 -7.460) 14.515 13.743 ( -2.896 -1.718 -0.008) 3.367 17.155 ( -38.559 -25.026 -9.569) 46.954 17.578 ( 28.333 0.932 13.797) 31.528 19.104 ( -9.993 -0.180 -8.832) 13.338 19.464 ( -5.767 -5.278 2.317) 8.154 19.513 ( -5.413 0.202 -0.878) 5.488 19.942 ( -6.686 0.174 5.786) 8.844 20.293 ( 1.024 0.613 -8.212) 8.298 20.440 ( -16.506 0.418 10.172) 19.393 21.318 ( -1.734 0.452 -0.430) 1.843 21.447 ( -3.751 -1.904 0.745) 4.272 22.248 ( 10.208 5.160 4.030) 12.127 22.990 ( 6.977 2.604 0.249) 7.451 24.351 ( 3.576 4.382 5.909) 8.180 24.460 ( 0.519 -2.753 -2.143) 3.527 24.589 ( 2.787 -0.261 -1.866) 3.364 24.891 ( -2.966 -3.091 -16.545) 17.090 25.614 ( 8.140 2.380 -3.846) 9.312 26.006 ( 5.311 0.569 -0.559) 5.370 26.100 ( -4.768 2.491 5.778) 7.894 26.824 ( -6.861 -1.120 16.721) 18.108 47.115 ( 0.936 -0.368 -2.234) 2.450 47.323 ( -0.099 0.244 -0.318) 0.413 49.278 ( 0.573 0.190 1.501) 1.618 49.487 ( 1.003 0.953 -0.717) 1.558 98.621 ( 2.732 -0.146 -2.778) 3.899 98.789 ( -3.025 -0.324 2.816) 4.145 98.851 ( 3.088 -2.081 -7.142) 8.055 99.139 ( 1.613 0.176 -9.061) 9.205 100.460 ( -4.094 -3.016 -2.424) 5.633 100.745 ( -0.446 1.331 -0.387) 1.456 101.142 ( -2.067 0.376 -1.481) 2.571 103.602 ( 62.226 50.266 23.470) 83.364 ======================= Grid point 17 (13/230) ======================= q-point: (-0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.323 ( -0.000 21.741 0.000) 21.741 0.377 ( -0.000 25.440 0.000) 25.440 0.773 ( -0.000 52.611 0.000) 52.611 2.339 ( -0.000 5.389 0.000) 5.389 2.624 ( 0.000 -2.606 -0.000) 2.606 2.709 ( -0.000 3.101 0.000) 3.101 3.007 ( -0.000 2.072 0.000) 2.072 3.124 ( -0.000 7.112 0.000) 7.112 3.280 ( 0.000 -3.409 -0.000) 3.409 3.410 ( -0.000 1.657 0.000) 1.657 3.514 ( -0.000 3.898 0.000) 3.898 3.817 ( -0.000 2.443 0.000) 2.443 4.270 ( 0.000 -2.946 -0.000) 2.946 4.349 ( 0.000 -3.703 -0.000) 3.703 4.458 ( -0.000 0.733 0.000) 0.733 4.858 ( 0.000 -7.212 -0.000) 7.212 4.988 ( 0.000 -2.989 -0.000) 2.989 5.337 ( 0.000 -3.881 -0.000) 3.881 5.432 ( 0.000 -3.447 -0.000) 3.447 5.477 ( -0.000 4.091 0.000) 4.091 5.828 ( 0.000 -2.377 -0.000) 2.377 6.153 ( 0.000 -0.168 -0.000) 0.168 6.183 ( 0.000 -2.340 -0.000) 2.340 6.520 ( -0.000 0.499 0.000) 0.499 7.219 ( 0.000 -2.760 -0.000) 2.760 7.639 ( 0.000 -4.621 -0.000) 4.621 8.636 ( 0.000 -12.255 -0.000) 12.255 8.982 ( -0.000 11.704 0.000) 11.704 9.654 ( -0.000 5.962 0.000) 5.962 10.124 ( -0.000 4.957 0.000) 4.957 10.467 ( 0.000 -2.612 -0.000) 2.612 10.557 ( 0.000 -9.946 -0.000) 9.946 10.946 ( -0.000 10.036 0.000) 10.036 11.313 ( 0.000 -1.913 -0.000) 1.913 11.374 ( -0.000 0.054 0.000) 0.054 11.533 ( -0.000 2.468 0.000) 2.468 11.964 ( 0.000 -3.536 -0.000) 3.536 12.048 ( -0.000 1.906 0.000) 1.906 13.210 ( 0.000 -0.698 -0.000) 0.698 13.729 ( 0.000 -1.577 -0.000) 1.577 16.575 ( 0.000 -1.463 -0.000) 1.463 17.951 ( -0.000 1.016 0.000) 1.016 18.899 ( 0.000 -0.300 -0.000) 0.300 19.374 ( -0.000 0.854 0.000) 0.854 19.449 ( -0.000 1.674 0.000) 1.674 19.904 ( -0.000 1.021 0.000) 1.021 20.283 ( -0.000 0.714 0.000) 0.714 20.337 ( 0.000 -1.611 -0.000) 1.611 21.297 ( -0.000 0.530 0.000) 0.530 21.435 ( 0.000 -1.587 -0.000) 1.587 22.392 ( 0.000 -0.486 -0.000) 0.486 23.035 ( -0.000 2.101 0.000) 2.101 24.465 ( 0.000 -2.898 -0.000) 2.898 24.497 ( 0.000 -0.096 -0.000) 0.096 24.608 ( 0.000 -0.266 -0.000) 0.266 24.692 ( -0.000 2.895 0.000) 2.895 25.693 ( 0.000 -0.708 -0.000) 0.708 26.050 ( -0.000 1.269 0.000) 1.269 26.065 ( -0.000 1.473 0.000) 1.473 26.843 ( 0.000 -0.940 -0.000) 0.940 47.107 ( -0.000 0.235 0.000) 0.235 47.319 ( -0.000 0.199 0.000) 0.199 49.289 ( -0.000 0.117 0.000) 0.117 49.508 ( 0.000 -0.488 -0.000) 0.488 98.634 ( 0.000 -0.192 -0.000) 0.192 98.781 ( 0.000 -0.310 -0.000) 0.310 98.826 ( -0.000 0.527 0.000) 0.527 99.108 ( -0.000 0.245 0.000) 0.245 100.399 ( -0.000 0.020 0.000) 0.020 100.731 ( -0.000 1.100 0.000) 1.100 101.115 ( -0.000 0.405 0.000) 0.405 104.636 ( 0.000 -0.158 -0.000) 0.158 ======================= Grid point 20 (14/230) ======================= q-point: ( 0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.547 ( 9.837 0.000 21.498) 23.642 1.760 ( 14.035 0.000 14.142) 19.924 2.209 ( -8.420 -0.000 -4.517) 9.556 2.594 ( -3.359 -0.000 5.820) 6.720 2.744 ( 0.415 0.000 -7.499) 7.511 2.756 ( 5.067 0.000 4.839) 7.006 2.876 ( -2.065 -0.000 4.535) 4.983 3.063 ( -7.174 -0.000 -0.476) 7.190 3.262 ( 11.855 0.000 -1.313) 11.927 3.476 ( -3.776 -0.000 0.017) 3.776 3.884 ( -0.660 -0.000 1.696) 1.820 3.914 ( 4.052 0.000 9.522) 10.348 4.129 ( -0.533 -0.000 -4.774) 4.804 4.170 ( -0.698 -0.000 3.207) 3.282 4.346 ( 3.443 0.000 -11.388) 11.897 4.993 ( 2.603 0.000 13.342) 13.593 5.055 ( -2.784 -0.000 -10.086) 10.463 5.349 ( 2.835 0.000 -15.169) 15.432 5.660 ( 2.728 0.000 4.876) 5.587 5.736 ( -2.750 -0.000 4.450) 5.231 5.803 ( 3.401 0.000 -4.642) 5.754 6.005 ( -1.582 -0.000 0.398) 1.631 6.732 ( -1.091 -0.000 5.219) 5.332 6.969 ( -2.877 -0.000 -1.444) 3.219 7.100 ( -7.771 -0.000 -12.343) 14.586 7.490 ( 3.243 0.000 -1.151) 3.441 8.666 ( -1.779 -0.000 -3.359) 3.801 8.926 ( 3.428 0.000 3.890) 5.185 10.086 ( -1.584 -0.000 -8.086) 8.240 10.141 ( 5.785 0.000 10.169) 11.699 10.214 ( -0.607 -0.000 3.808) 3.857 10.679 ( 4.416 0.000 0.750) 4.479 10.868 ( -7.017 -0.000 11.666) 13.614 10.924 ( 0.718 0.000 -8.364) 8.395 11.233 ( -4.517 -0.000 8.698) 9.801 11.286 ( 0.671 0.000 -5.503) 5.544 11.609 ( -1.947 -0.000 -2.739) 3.360 11.620 ( -0.784 -0.000 -1.134) 1.378 13.873 ( 1.454 0.000 -4.512) 4.741 13.905 ( 0.536 0.000 4.117) 4.152 16.136 ( -7.152 -0.000 -3.402) 7.920 18.465 ( 3.527 0.000 1.893) 4.002 19.282 ( 0.347 0.000 -0.240) 0.421 19.308 ( -3.087 -0.000 -0.130) 3.090 19.742 ( 0.897 0.000 1.493) 1.742 19.932 ( -2.026 -0.000 -5.552) 5.910 20.644 ( 1.979 0.000 4.470) 4.889 21.260 ( 13.621 0.000 -4.969) 14.499 21.402 ( 1.280 0.000 -2.743) 3.027 21.709 ( -8.708 -0.000 4.775) 9.931 21.980 ( 14.179 0.000 -1.436) 14.251 22.316 ( -15.281 -0.000 3.828) 15.753 24.331 ( 2.377 0.000 0.507) 2.430 24.385 ( -4.227 -0.000 -0.946) 4.332 24.532 ( -0.730 -0.000 1.208) 1.411 25.328 ( 7.243 0.000 1.785) 7.460 25.412 ( 1.529 0.000 -2.933) 3.308 25.627 ( -7.868 -0.000 -2.645) 8.301 26.205 ( -3.410 -0.000 11.650) 12.139 26.685 ( 3.555 0.000 -10.198) 10.800 47.097 ( -0.644 -0.000 0.585) 0.870 47.339 ( 0.275 0.000 -0.120) 0.300 49.210 ( -0.040 -0.000 -0.628) 0.629 49.522 ( 0.225 0.000 0.657) 0.695 98.560 ( -0.031 -0.000 -0.577) 0.577 98.776 ( -1.527 -0.000 0.383) 1.575 98.883 ( 0.430 0.000 0.032) 0.431 99.251 ( -0.200 -0.000 1.683) 1.695 100.571 ( -0.462 -0.000 -0.274) 0.537 100.823 ( -0.462 -0.000 2.263) 2.310 101.462 ( 1.863 0.000 0.587) 1.953 101.866 ( 4.222 0.000 3.765) 5.657 ======================= Grid point 21 (15/230) ======================= q-point: ( 0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.865 ( -6.991 4.040 -6.930) 10.640 1.893 ( 10.882 -0.032 18.438) 21.410 2.224 ( 8.889 -2.480 9.608) 13.322 2.590 ( -2.057 3.001 6.216) 7.203 2.710 ( 0.800 1.554 -5.377) 5.654 2.761 ( -6.117 -0.785 -1.555) 6.360 2.818 ( -12.919 0.429 -3.366) 13.357 2.866 ( -2.794 -1.837 1.095) 3.519 3.404 ( -4.398 -2.289 1.236) 5.110 3.452 ( 6.831 0.937 2.222) 7.245 3.954 ( 1.133 -2.218 7.037) 7.464 4.077 ( -0.065 1.554 3.688) 4.003 4.100 ( 6.996 0.175 0.413) 7.010 4.138 ( -1.407 -1.265 -1.504) 2.417 4.365 ( 6.928 4.170 -6.086) 10.120 4.894 ( -4.128 -1.902 -14.601) 15.292 5.159 ( 2.168 0.138 14.745) 14.905 5.239 ( 1.161 0.826 -15.751) 15.816 5.606 ( -5.009 3.692 1.948) 6.520 5.688 ( -6.920 -2.789 -1.176) 7.553 5.911 ( 1.230 0.898 -1.502) 2.139 5.955 ( -0.199 -5.433 -0.011) 5.437 6.726 ( -4.081 1.120 3.872) 5.736 6.830 ( -5.657 5.958 -7.754) 11.297 6.956 ( -3.478 -6.278 -1.804) 7.400 7.521 ( 1.456 -0.134 -1.003) 1.774 8.581 ( -3.545 -0.701 -5.829) 6.858 9.033 ( 5.002 0.968 4.375) 6.716 10.018 ( -1.156 -0.653 -3.995) 4.210 10.226 ( -1.211 -0.732 2.985) 3.303 10.311 ( 3.133 0.595 9.728) 10.238 10.747 ( 4.017 3.497 0.427) 5.343 10.844 ( 0.510 -0.435 -11.070) 11.090 10.907 ( -0.172 -1.155 11.390) 11.450 11.256 ( -3.011 -0.335 10.207) 10.647 11.269 ( 3.367 0.122 -6.259) 7.109 11.593 ( 1.942 0.736 0.023) 2.077 11.617 ( 0.734 -1.006 -0.300) 1.281 13.825 ( -2.185 -0.654 -6.341) 6.739 13.913 ( -2.604 0.340 2.362) 3.532 16.140 ( 7.421 0.031 3.808) 8.341 18.365 ( -12.926 -0.944 -6.897) 14.682 19.284 ( 0.965 0.023 -1.878) 2.112 19.298 ( 2.074 -0.034 -1.209) 2.401 19.754 ( -0.339 0.047 0.165) 0.380 19.904 ( -0.464 0.116 4.214) 4.241 20.657 ( -1.929 0.156 -1.696) 2.573 21.293 ( -12.466 0.456 8.957) 15.357 21.392 ( 0.441 -0.516 -3.525) 3.590 21.712 ( 10.056 0.046 -4.664) 11.085 21.976 ( -16.136 -0.037 5.668) 17.102 22.340 ( 15.879 0.247 -0.686) 15.896 24.317 ( -2.567 0.186 -0.441) 2.612 24.375 ( 1.542 -0.367 1.128) 1.945 24.526 ( 0.441 -0.057 -1.784) 1.839 25.376 ( -2.717 0.862 -5.962) 6.609 25.436 ( 3.008 -0.831 -2.932) 4.282 25.564 ( 5.103 -0.103 1.900) 5.446 26.235 ( -5.107 0.995 13.006) 14.008 26.678 ( 2.894 -0.613 -4.784) 5.625 47.095 ( -0.067 -0.002 0.257) 0.265 47.341 ( 0.167 0.016 -0.341) 0.380 49.212 ( 0.356 0.005 0.385) 0.524 49.525 ( -0.032 0.011 -0.299) 0.301 98.561 ( 1.607 0.049 -2.390) 2.881 98.766 ( -0.376 0.016 1.000) 1.069 98.880 ( -1.447 -0.024 1.196) 1.878 99.252 ( 0.981 -0.054 -3.074) 3.228 100.557 ( -1.012 -0.156 -0.270) 1.059 100.825 ( -0.919 0.215 1.130) 1.472 101.408 ( -5.280 -1.516 -2.901) 6.212 102.154 ( 20.937 2.865 11.023) 23.835 ======================= Grid point 22 (16/230) ======================= q-point: (-0.56 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.586 ( -9.963 10.294 -8.359) 16.586 2.198 ( 6.657 5.219 8.382) 11.908 2.322 ( -15.151 5.996 -2.421) 16.474 2.489 ( 5.148 -2.872 5.960) 8.383 2.527 ( -9.071 5.371 0.541) 10.556 2.711 ( 2.327 -4.025 -5.274) 7.031 2.775 ( 1.853 -1.382 -2.513) 3.414 2.906 ( 0.109 -2.742 8.569) 8.998 3.394 ( -0.189 -2.010 2.301) 3.061 3.478 ( -4.532 2.472 3.766) 6.390 3.985 ( -1.383 7.159 -8.477) 11.181 4.012 ( -3.704 -0.652 7.033) 7.975 4.147 ( 2.278 -1.573 -0.931) 2.921 4.300 ( 5.909 -1.889 8.393) 10.437 4.397 ( 8.027 4.544 -5.254) 10.616 4.718 ( -6.467 -5.184 -10.661) 13.503 5.127 ( 2.451 -0.502 -14.483) 14.698 5.302 ( 0.225 1.353 12.134) 12.211 5.491 ( -9.542 1.117 -3.152) 10.111 5.546 ( -4.961 0.031 -1.294) 5.127 5.792 ( -9.482 -7.318 -5.405) 13.140 6.054 ( 3.629 -2.158 0.654) 4.273 6.626 ( -6.664 -0.652 -1.421) 6.845 6.705 ( -3.717 0.029 -0.450) 3.745 6.958 ( -0.702 -3.926 1.270) 4.186 7.528 ( -0.537 -1.277 -0.042) 1.386 8.473 ( -4.084 -2.649 -6.102) 7.806 9.141 ( 5.213 3.890 3.836) 7.551 9.968 ( -2.623 -0.399 -1.960) 3.299 10.235 ( -1.476 -2.147 2.523) 3.626 10.394 ( 0.690 4.201 6.052) 7.400 10.719 ( 0.282 -1.634 -12.562) 12.671 10.838 ( 3.974 5.651 4.716) 8.365 11.060 ( 5.477 0.485 11.576) 12.815 11.275 ( 3.035 0.805 -3.348) 4.590 11.317 ( 1.712 -1.744 3.677) 4.415 11.642 ( 1.413 -1.106 2.586) 3.148 11.672 ( 5.856 0.070 0.585) 5.886 13.700 ( -6.235 -2.019 -8.187) 10.487 13.861 ( -4.742 0.046 0.968) 4.840 16.440 ( 20.448 0.209 10.082) 22.800 17.974 ( -24.263 -4.584 -12.002) 27.455 19.280 ( 1.094 0.139 -3.421) 3.595 19.340 ( 3.744 -0.665 -1.668) 4.152 19.730 ( -1.817 0.439 -1.287) 2.269 19.957 ( -1.117 -0.094 8.791) 8.863 20.560 ( -4.655 0.619 -5.911) 7.550 21.053 ( -23.412 0.368 10.300) 25.581 21.369 ( 0.302 -0.726 -4.105) 4.180 21.732 ( -16.060 0.372 5.427) 16.956 21.902 ( 13.628 0.206 -2.672) 13.889 22.624 ( 16.843 1.128 0.341) 16.884 24.294 ( -0.327 0.052 1.232) 1.275 24.404 ( -0.064 -1.108 1.173) 1.615 24.526 ( 2.802 0.001 -4.196) 5.045 25.219 ( -6.896 0.478 -6.447) 9.452 25.483 ( 5.171 0.330 -2.971) 5.973 25.724 ( 10.318 -0.448 -0.054) 10.328 26.235 ( -6.612 2.231 12.784) 14.564 26.708 ( 1.915 -1.215 0.308) 2.289 47.099 ( 0.420 -0.040 -0.021) 0.423 47.339 ( 0.060 0.090 -0.513) 0.524 49.228 ( 0.688 0.051 1.313) 1.483 49.517 ( -0.182 0.081 -1.124) 1.141 98.573 ( 2.963 0.050 -3.867) 4.872 98.779 ( 0.273 -0.133 1.966) 1.989 98.857 ( -3.025 -0.162 2.332) 3.823 99.233 ( 1.808 -0.050 -7.152) 7.377 100.532 ( -1.899 -0.598 -0.588) 2.076 100.810 ( -1.081 0.563 0.259) 1.246 101.301 ( -5.142 -1.172 -2.882) 6.010 102.670 ( 31.659 10.083 15.007) 36.458 ======================= Grid point 23 (17/230) ======================= q-point: (-0.44 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.262 ( -9.475 15.250 -6.091) 18.958 1.733 ( -27.720 9.297 -8.761) 30.522 2.273 ( -5.139 21.903 -6.709) 23.477 2.448 ( 2.308 -2.842 6.833) 7.752 2.658 ( 6.000 6.265 5.389) 10.212 2.703 ( 0.598 -3.619 -5.859) 6.913 2.785 ( 3.034 0.677 -1.578) 3.486 3.076 ( 3.905 -5.841 12.531) 14.366 3.380 ( -5.151 1.923 2.467) 6.026 3.464 ( 2.410 0.980 4.295) 5.021 3.796 ( -1.804 8.193 -12.982) 15.456 3.966 ( -6.547 1.985 5.061) 8.510 4.177 ( 0.411 -1.251 -0.616) 1.454 4.412 ( -1.206 -0.302 6.986) 7.095 4.505 ( 2.755 -2.382 -1.008) 3.779 4.601 ( -2.452 -10.073 -4.879) 11.458 5.089 ( 5.337 1.488 -10.411) 11.794 5.239 ( -7.828 1.008 -10.764) 13.347 5.347 ( -2.683 -1.284 4.975) 5.797 5.533 ( -1.848 -0.640 6.813) 7.088 5.629 ( -9.854 -9.945 -7.380) 15.826 6.114 ( 2.160 -0.383 0.144) 2.199 6.521 ( -9.268 -6.531 0.879) 11.372 6.641 ( -4.489 -1.427 -0.150) 4.713 7.010 ( 1.886 -2.848 2.819) 4.429 7.525 ( -2.329 -3.728 0.850) 4.477 8.397 ( -2.856 -5.375 -3.764) 7.156 9.207 ( 4.029 7.363 2.530) 8.766 9.898 ( -2.985 2.484 -0.929) 3.993 10.255 ( -0.915 -4.626 1.046) 4.831 10.382 ( -0.495 6.964 1.207) 7.085 10.619 ( -2.597 -5.202 -11.684) 13.050 10.927 ( 5.310 8.313 8.934) 13.309 11.234 ( 4.779 4.178 8.436) 10.557 11.299 ( 2.652 -0.114 -0.934) 2.814 11.411 ( 7.613 -0.884 -1.726) 7.856 11.716 ( 1.897 -3.449 4.901) 6.286 11.801 ( 8.466 1.044 0.945) 8.583 13.514 ( -9.076 -3.582 -8.888) 13.199 13.781 ( -5.094 -0.922 -0.070) 5.177 16.969 ( 28.923 0.551 13.982) 32.130 17.452 ( -30.121 -9.724 -12.588) 34.064 19.248 ( -1.007 0.123 -5.528) 5.620 19.396 ( 2.809 -1.562 -1.082) 3.392 19.656 ( -4.445 1.216 -2.618) 5.301 19.986 ( -4.356 0.207 8.293) 9.370 20.414 ( -4.413 0.878 -7.575) 8.811 20.715 ( -24.268 -0.177 8.595) 25.745 21.345 ( 0.390 -0.792 -3.997) 4.094 21.531 ( -12.103 -0.323 4.616) 12.957 22.109 ( 11.996 1.326 0.571) 12.083 22.874 ( 13.024 2.303 0.872) 13.255 24.324 ( 1.880 0.981 3.268) 3.895 24.411 ( -0.695 -2.274 -0.319) 2.399 24.551 ( 3.960 -0.049 -3.981) 5.615 25.045 ( -6.362 0.119 -7.299) 9.684 25.552 ( 6.651 0.566 -3.932) 7.747 25.894 ( 9.704 0.411 -0.626) 9.733 26.198 ( -7.624 2.859 11.436) 14.039 26.758 ( 0.243 -1.598 4.235) 4.533 47.107 ( 0.678 -0.034 -0.378) 0.777 47.333 ( -0.007 0.196 -0.560) 0.593 49.254 ( 0.828 0.106 1.839) 2.020 49.501 ( -0.083 0.130 -1.500) 1.508 98.594 ( 3.679 -0.060 -4.510) 5.820 98.804 ( -0.652 -0.092 2.909) 2.983 98.826 ( -2.599 -0.499 2.387) 3.564 99.193 ( 2.049 0.040 -9.692) 9.907 100.490 ( -2.848 -1.083 -1.177) 3.267 100.788 ( -0.842 1.124 -0.053) 1.406 101.210 ( -3.608 -0.278 -2.194) 4.232 103.319 ( 40.546 18.982 17.912) 48.220 ======================= Grid point 24 (18/230) ======================= q-point: (-0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.954 ( -7.024 19.347 -3.151) 20.822 1.099 ( -28.061 11.908 -7.276) 31.339 1.916 ( -2.211 40.875 -7.677) 41.649 2.443 ( -5.475 -3.536 -2.416) 6.951 2.626 ( -1.263 1.414 -0.630) 1.998 2.777 ( 2.415 5.700 5.636) 8.372 2.904 ( 9.606 -0.232 2.263) 9.872 3.246 ( 3.517 1.400 3.693) 5.288 3.325 ( -3.937 2.119 4.357) 6.243 3.466 ( 2.097 8.362 -5.435) 10.191 3.674 ( -0.874 0.269 -3.889) 3.995 3.886 ( -4.553 1.968 4.878) 6.956 4.180 ( -1.133 -2.851 0.681) 3.143 4.349 ( -7.452 -3.930 -1.954) 8.648 4.513 ( -7.521 -10.208 -2.011) 12.838 4.634 ( -0.639 -2.723 6.630) 7.195 5.007 ( -1.106 -2.977 -13.060) 13.441 5.198 ( 7.337 -1.057 -4.426) 8.634 5.345 ( -3.993 -6.489 -1.352) 7.738 5.557 ( 3.274 -4.688 -5.022) 7.610 5.562 ( -2.268 1.065 12.160) 12.415 6.141 ( 1.053 0.288 -0.253) 1.120 6.382 ( -16.472 -9.872 0.449) 19.209 6.570 ( -3.269 0.307 -0.906) 3.407 7.103 ( 2.887 -2.948 3.195) 5.219 7.522 ( -3.053 -6.399 1.131) 7.180 8.397 ( -0.992 -8.506 -0.605) 8.585 9.211 ( 2.062 10.174 1.115) 10.440 9.826 ( -1.226 6.659 0.390) 6.782 10.257 ( -1.202 -1.544 -5.456) 5.796 10.344 ( -0.094 1.278 3.280) 3.521 10.514 ( -3.945 -5.646 -8.824) 11.194 11.039 ( 4.543 8.616 11.138) 14.796 11.278 ( 3.149 1.215 -5.276) 6.264 11.353 ( 0.339 -0.117 4.550) 4.564 11.534 ( 8.481 3.856 -1.821) 9.493 11.831 ( 2.724 -4.447 4.186) 6.687 11.954 ( 9.697 1.903 1.421) 9.984 13.315 ( -8.950 -3.872 -6.919) 11.957 13.714 ( -3.345 -2.114 -0.637) 4.008 16.904 ( -30.997 -11.231 -10.277) 34.533 17.593 ( 28.781 1.064 13.828) 31.948 19.102 ( -10.077 -0.093 -8.931) 13.465 19.420 ( -1.165 -1.082 0.061) 1.591 19.538 ( -4.308 2.036 -1.704) 5.061 19.955 ( -4.418 1.266 4.732) 6.597 20.299 ( 0.219 0.267 -8.067) 8.074 20.434 ( -16.919 -0.730 8.669) 19.024 21.323 ( -0.108 0.137 -2.412) 2.419 21.419 ( -5.441 -1.810 2.507) 6.259 22.288 ( 8.312 1.187 2.385) 8.729 23.034 ( 7.112 3.118 0.721) 7.799 24.388 ( 1.687 0.526 3.678) 4.080 24.425 ( 2.044 -1.376 0.301) 2.482 24.585 ( 2.753 -0.374 -2.285) 3.597 24.875 ( -5.411 0.182 -8.999) 10.502 25.629 ( 6.734 0.145 -4.457) 8.077 26.024 ( 6.472 1.557 -0.107) 6.657 26.138 ( -6.564 2.690 8.374) 10.975 26.802 ( -1.741 -1.732 5.990) 6.474 47.113 ( 0.551 0.104 -0.757) 0.942 47.327 ( -0.015 0.288 -0.397) 0.491 49.281 ( 0.575 0.148 1.438) 1.555 49.492 ( 0.416 -0.090 -0.949) 1.040 98.618 ( 2.992 -0.214 -3.565) 4.659 98.785 ( -3.266 -0.226 3.492) 4.786 98.837 ( 0.843 -0.258 -0.373) 0.957 99.142 ( 1.386 0.239 -8.212) 8.331 100.435 ( -2.962 -0.899 -1.348) 3.376 100.767 ( -0.386 1.587 -0.012) 1.634 101.148 ( -1.851 0.399 -1.229) 2.257 104.069 ( 44.859 18.839 18.585) 52.083 ======================= Grid point 25 (19/230) ======================= q-point: (-0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.623 ( -0.000 19.246 0.000) 19.246 0.730 ( -0.000 22.833 0.000) 22.833 1.519 ( -0.000 49.612 0.000) 49.612 2.388 ( 0.000 -0.490 -0.000) 0.490 2.606 ( -0.000 0.330 0.000) 0.330 2.773 ( -0.000 6.000 0.000) 6.000 3.046 ( -0.000 3.065 0.000) 3.065 3.243 ( -0.000 7.922 0.000) 7.922 3.244 ( -0.000 0.017 0.000) 0.017 3.449 ( -0.000 3.365 0.000) 3.365 3.583 ( -0.000 5.394 0.000) 5.394 3.860 ( -0.000 3.064 0.000) 3.064 4.208 ( 0.000 -5.317 -0.000) 5.317 4.283 ( 0.000 -5.310 -0.000) 5.310 4.449 ( 0.000 -3.012 -0.000) 3.012 4.733 ( 0.000 -8.263 -0.000) 8.263 4.942 ( 0.000 -2.877 -0.000) 2.877 5.268 ( 0.000 -5.559 -0.000) 5.559 5.348 ( 0.000 -7.574 -0.000) 7.574 5.538 ( -0.000 4.046 0.000) 4.046 5.767 ( 0.000 -6.369 -0.000) 6.369 6.134 ( 0.000 -4.287 -0.000) 4.287 6.169 ( -0.000 2.789 0.000) 2.789 6.531 ( -0.000 1.097 0.000) 1.097 7.172 ( 0.000 -3.279 -0.000) 3.279 7.549 ( 0.000 -7.401 -0.000) 7.401 8.464 ( 0.000 -11.060 -0.000) 11.060 9.152 ( -0.000 11.541 0.000) 11.541 9.763 ( -0.000 8.559 0.000) 8.559 10.197 ( -0.000 3.297 0.000) 3.297 10.411 ( 0.000 -5.086 -0.000) 5.086 10.437 ( 0.000 -4.784 -0.000) 4.784 11.087 ( -0.000 8.838 0.000) 8.838 11.280 ( 0.000 -2.357 -0.000) 2.357 11.375 ( -0.000 0.010 0.000) 0.010 11.579 ( -0.000 3.698 0.000) 3.698 11.908 ( 0.000 -4.103 -0.000) 4.103 12.070 ( -0.000 1.111 0.000) 1.111 13.196 ( 0.000 -1.061 -0.000) 1.061 13.698 ( 0.000 -2.515 -0.000) 2.515 16.547 ( 0.000 -2.192 -0.000) 2.192 17.970 ( -0.000 1.568 0.000) 1.568 18.893 ( 0.000 -0.396 -0.000) 0.396 19.391 ( -0.000 1.433 0.000) 1.433 19.480 ( -0.000 2.312 0.000) 2.312 19.924 ( -0.000 1.600 0.000) 1.600 20.297 ( -0.000 1.173 0.000) 1.173 20.306 ( 0.000 -2.431 -0.000) 2.431 21.306 ( -0.000 0.707 0.000) 0.707 21.404 ( 0.000 -2.496 -0.000) 2.496 22.383 ( 0.000 -0.701 -0.000) 0.701 23.075 ( -0.000 3.212 0.000) 3.212 24.419 ( 0.000 -3.142 -0.000) 3.142 24.496 ( 0.000 -0.103 -0.000) 0.103 24.603 ( 0.000 -0.470 -0.000) 0.470 24.738 ( -0.000 3.138 0.000) 3.138 25.680 ( 0.000 -0.958 -0.000) 0.958 26.073 ( -0.000 1.818 0.000) 1.818 26.094 ( -0.000 2.381 0.000) 2.381 26.824 ( 0.000 -1.570 -0.000) 1.570 47.112 ( -0.000 0.360 0.000) 0.360 47.323 ( -0.000 0.309 0.000) 0.309 49.291 ( -0.000 0.179 0.000) 0.179 49.499 ( 0.000 -0.751 -0.000) 0.751 98.631 ( 0.000 -0.248 -0.000) 0.248 98.775 ( 0.000 -0.452 -0.000) 0.452 98.836 ( -0.000 0.764 0.000) 0.764 99.113 ( -0.000 0.363 0.000) 0.363 100.400 ( -0.000 0.030 0.000) 0.030 100.752 ( -0.000 1.676 0.000) 1.676 101.123 ( -0.000 0.619 0.000) 0.619 104.633 ( 0.000 -0.243 -0.000) 0.243 ======================= Grid point 30 (20/230) ======================= q-point: (-0.67 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.667 ( -9.027 -0.000 -8.563) 12.442 2.223 ( 10.019 0.000 14.969) 18.012 2.374 ( -25.036 -0.000 -7.142) 26.035 2.469 ( 9.196 0.000 7.352) 11.774 2.581 ( -8.074 -0.000 3.742) 8.899 2.674 ( 2.592 0.000 -3.978) 4.748 2.765 ( 5.766 0.000 -2.349) 6.226 2.884 ( -1.072 -0.000 7.068) 7.149 3.377 ( 0.589 0.000 2.368) 2.440 3.497 ( -5.385 -0.000 4.204) 6.831 3.995 ( -2.272 -0.000 5.595) 6.039 4.087 ( -0.309 -0.000 -1.031) 1.077 4.095 ( 0.673 0.000 -3.261) 3.330 4.289 ( 7.961 0.000 6.041) 9.993 4.437 ( 4.591 0.000 -5.552) 7.204 4.673 ( -5.829 -0.000 -13.320) 14.540 5.127 ( 3.363 0.000 -16.647) 16.984 5.310 ( -0.316 -0.000 13.803) 13.807 5.509 ( -7.768 -0.000 -3.164) 8.388 5.546 ( -5.492 -0.000 -3.011) 6.263 5.725 ( -11.715 -0.000 -4.800) 12.661 6.036 ( 3.915 0.000 0.931) 4.024 6.627 ( -8.247 -0.000 -2.961) 8.763 6.707 ( -3.965 -0.000 -0.974) 4.083 6.926 ( 0.342 0.000 2.344) 2.369 7.518 ( -0.871 -0.000 -0.854) 1.220 8.453 ( -4.284 -0.000 -6.656) 7.916 9.170 ( 5.718 0.000 4.421) 7.228 9.963 ( -2.129 -0.000 -1.908) 2.859 10.219 ( -2.043 -0.000 2.875) 3.527 10.428 ( 0.726 0.000 8.467) 8.498 10.702 ( -0.453 -0.000 -15.209) 15.216 10.886 ( 5.695 0.000 2.729) 6.315 11.062 ( 4.793 0.000 16.256) 16.948 11.290 ( 6.450 0.000 -7.994) 10.272 11.293 ( -2.116 -0.000 8.189) 8.458 11.633 ( 0.940 0.000 1.762) 1.997 11.673 ( 6.316 0.000 0.832) 6.370 13.685 ( -6.433 -0.000 -8.429) 10.604 13.861 ( -4.892 -0.000 0.684) 4.939 16.442 ( 20.508 0.000 10.119) 22.868 17.940 ( -25.138 -0.000 -12.504) 28.076 19.281 ( 1.198 0.000 -3.598) 3.792 19.336 ( 3.660 0.000 -1.928) 4.137 19.734 ( -1.763 -0.000 -1.075) 2.065 19.957 ( -0.950 -0.000 8.588) 8.640 20.565 ( -4.714 -0.000 -5.581) 7.305 21.055 ( -23.738 -0.000 10.427) 25.927 21.363 ( 0.611 0.000 -4.772) 4.811 21.736 ( -16.800 -0.000 6.031) 17.850 21.903 ( 14.355 0.000 -2.854) 14.636 22.632 ( 16.937 0.000 0.775) 16.955 24.294 ( -0.226 -0.000 1.259) 1.279 24.395 ( -0.406 -0.000 1.267) 1.330 24.526 ( 2.870 0.000 -4.219) 5.102 25.222 ( -7.081 -0.000 -6.480) 9.599 25.485 ( 5.590 0.000 -3.613) 6.656 25.721 ( 10.551 0.000 0.176) 10.552 26.253 ( -7.697 -0.000 15.187) 17.026 26.697 ( 2.888 0.000 -1.823) 3.415 47.099 ( 0.356 0.000 0.115) 0.374 47.339 ( 0.111 0.000 -0.562) 0.573 49.228 ( 0.715 0.000 1.282) 1.468 49.517 ( -0.187 -0.000 -1.098) 1.114 98.573 ( 3.126 0.000 -4.251) 5.277 98.778 ( 0.167 0.000 2.185) 2.191 98.856 ( -3.194 -0.000 2.551) 4.087 99.232 ( 1.856 0.000 -7.209) 7.444 100.528 ( -2.019 -0.000 -0.541) 2.090 100.815 ( -1.118 -0.000 0.580) 1.260 101.292 ( -4.720 -0.000 -2.568) 5.373 102.744 ( 32.900 0.000 15.841) 36.515 ======================= Grid point 32 (21/230) ======================= q-point: (-0.56 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.429 ( -8.018 6.535 -7.112) 12.553 1.822 ( -29.652 3.112 -7.079) 30.644 2.367 ( -6.193 -1.896 5.120) 8.256 2.546 ( 8.675 7.449 -2.576) 11.721 2.673 ( 5.616 1.492 -0.562) 5.838 2.723 ( 6.835 -1.135 1.736) 7.143 2.836 ( 4.910 7.101 1.913) 8.842 2.996 ( 2.114 -4.528 15.787) 16.559 3.382 ( -10.079 -1.122 4.244) 10.994 3.459 ( 4.351 -0.728 4.767) 6.495 3.927 ( -5.218 7.204 -5.383) 10.397 3.995 ( -4.083 3.041 -0.315) 5.101 4.127 ( 0.798 -5.786 -2.618) 6.401 4.407 ( -1.388 1.109 1.564) 2.367 4.472 ( -0.750 -6.661 -0.175) 6.705 4.488 ( -2.257 -0.494 -6.359) 6.766 5.119 ( 11.102 2.006 -12.458) 16.807 5.281 ( -9.628 3.849 -8.936) 13.689 5.326 ( -4.970 -1.843 0.477) 5.322 5.489 ( -11.211 -6.752 -5.665) 14.261 5.529 ( -0.310 -0.545 6.085) 6.117 6.093 ( 1.070 -1.480 1.507) 2.367 6.472 ( -8.774 -0.927 -0.432) 8.834 6.638 ( -3.594 0.181 -0.370) 3.617 6.979 ( 2.264 -1.252 3.291) 4.186 7.482 ( -3.088 -1.740 -0.787) 3.630 8.344 ( -3.248 -1.887 -4.693) 6.011 9.285 ( 4.683 2.893 3.309) 6.423 9.918 ( -1.896 0.407 0.309) 1.964 10.213 ( -1.596 -1.270 2.124) 2.945 10.467 ( -0.853 4.392 2.626) 5.188 10.551 ( -3.303 -3.787 -13.206) 14.130 11.008 ( 6.245 2.770 4.144) 7.990 11.278 ( -0.305 1.409 18.034) 18.091 11.309 ( 0.265 1.388 1.093) 1.786 11.393 ( 14.140 -1.313 -5.551) 15.247 11.676 ( 0.835 -1.625 3.586) 4.025 11.811 ( 8.908 0.376 0.876) 8.959 13.478 ( -9.008 -1.273 -9.113) 12.876 13.771 ( -5.487 -0.365 -0.605) 5.532 16.975 ( 29.105 0.220 14.012) 32.303 17.358 ( -30.325 -3.228 -13.272) 33.260 19.250 ( -0.947 0.065 -5.816) 5.893 19.383 ( 3.380 -0.364 -1.697) 3.800 19.669 ( -4.241 0.446 -2.219) 4.807 19.990 ( -3.529 0.236 7.818) 8.581 20.423 ( -4.834 0.359 -7.101) 8.597 20.712 ( -24.690 -0.176 8.400) 26.080 21.336 ( 1.057 -0.426 -5.095) 5.221 21.529 ( -12.874 -0.015 5.316) 13.928 22.120 ( 12.002 0.305 0.486) 12.015 22.899 ( 13.176 0.942 1.407) 13.284 24.333 ( 2.348 0.304 3.549) 4.266 24.388 ( -1.121 -0.848 -0.056) 1.406 24.550 ( 3.838 -0.034 -4.099) 5.615 25.047 ( -6.834 0.127 -6.469) 9.411 25.555 ( 6.672 0.061 -4.535) 8.068 25.901 ( 10.397 0.320 -0.408) 10.410 26.229 ( -9.272 1.244 14.285) 17.076 26.739 ( 2.076 -0.805 0.448) 2.272 47.107 ( 0.576 0.016 -0.009) 0.576 47.335 ( 0.075 0.079 -0.633) 0.643 49.255 ( 0.859 0.032 1.790) 1.986 49.502 ( -0.190 0.004 -1.512) 1.524 98.593 ( 3.930 -0.020 -5.188) 6.508 98.805 ( -0.030 0.190 3.260) 3.266 98.820 ( -3.789 -0.309 3.410) 5.106 99.193 ( 2.047 0.004 -9.523) 9.741 100.481 ( -2.857 -0.323 -0.917) 3.018 100.800 ( -0.826 0.464 0.361) 1.014 101.207 ( -3.225 -0.120 -1.830) 3.710 103.497 ( 39.654 5.903 18.252) 44.050 ======================= Grid point 33 (22/230) ======================= q-point: (-0.44 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.190 ( -7.085 12.031 -5.481) 15.000 1.249 ( -23.666 8.080 -4.475) 25.404 2.302 ( -2.204 1.888 0.971) 3.060 2.532 ( 2.128 23.544 -6.362) 24.481 2.623 ( -2.756 0.791 -1.623) 3.295 2.843 ( 2.295 1.444 1.347) 3.028 2.945 ( 11.001 6.939 7.324) 14.927 3.235 ( 4.640 -2.179 14.723) 15.590 3.332 ( -2.738 -4.504 4.946) 7.228 3.571 ( 3.331 5.231 -0.940) 6.272 3.703 ( -2.349 5.353 -9.121) 10.833 3.905 ( -5.971 -0.184 3.227) 6.789 4.142 ( -1.054 -2.716 -1.310) 3.195 4.291 ( -10.053 -3.491 -3.560) 11.221 4.353 ( -6.090 -10.214 -5.981) 13.311 4.603 ( 2.245 -1.502 7.205) 7.695 5.009 ( -4.704 2.579 -12.387) 13.499 5.204 ( 3.688 2.782 -4.306) 6.315 5.245 ( -5.719 -6.522 -3.827) 9.481 5.442 ( 6.776 -9.519 -2.375) 11.924 5.587 ( -0.637 1.231 6.756) 6.897 6.109 ( -3.295 -3.698 1.035) 5.061 6.326 ( -8.419 0.554 0.575) 8.457 6.580 ( -2.190 0.745 -0.670) 2.409 7.068 ( 3.087 -1.798 3.258) 4.835 7.436 ( -3.727 -4.818 -0.950) 6.165 8.300 ( -1.461 -4.640 -1.736) 5.165 9.334 ( 2.519 6.343 1.631) 7.017 9.906 ( 0.361 3.947 3.364) 5.198 10.211 ( -1.106 -2.052 -2.100) 3.137 10.347 ( -4.282 -3.143 -9.064) 10.506 10.487 ( -1.558 1.838 0.349) 2.435 11.124 ( 5.225 3.325 5.294) 8.148 11.293 ( -0.905 1.105 -1.548) 2.106 11.352 ( -0.104 -0.066 4.986) 4.987 11.597 ( 8.874 4.610 1.199) 10.072 11.761 ( 2.517 -5.048 4.254) 7.065 11.975 ( 9.434 0.889 1.338) 9.570 13.274 ( -7.403 -1.769 -6.517) 10.021 13.687 ( -3.781 -1.433 -1.116) 4.195 16.794 ( -25.607 -4.556 -9.744) 27.775 17.606 ( 29.160 0.692 13.867) 32.297 19.101 ( -10.169 -0.016 -9.037) 13.604 19.415 ( 1.311 0.131 -0.913) 1.603 19.563 ( -4.173 1.251 -1.546) 4.623 19.972 ( -3.733 0.949 4.501) 5.924 20.300 ( -1.553 -0.121 -7.140) 7.308 20.426 ( -15.932 -0.298 7.593) 17.652 21.321 ( 1.679 -0.393 -4.518) 4.835 21.400 ( -7.413 -0.780 4.374) 8.642 22.296 ( 7.376 0.167 1.604) 7.550 23.073 ( 7.159 2.057 0.980) 7.513 24.374 ( -0.614 -1.299 -0.384) 1.487 24.424 ( 3.801 0.399 4.357) 5.796 24.580 ( 2.642 -0.278 -2.470) 3.627 24.883 ( -5.605 0.594 -6.227) 8.399 25.627 ( 5.890 -0.224 -4.333) 7.316 26.045 ( 6.888 1.117 -0.039) 6.978 26.173 ( -7.641 1.856 9.730) 12.510 26.779 ( 0.567 -1.322 1.550) 2.115 47.116 ( 0.456 0.147 -0.151) 0.502 47.331 ( 0.044 0.191 -0.445) 0.486 49.283 ( 0.609 0.084 1.426) 1.553 49.489 ( 0.012 -0.236 -1.138) 1.162 98.616 ( 3.234 -0.124 -4.152) 5.264 98.782 ( -3.448 -0.142 3.434) 4.868 98.837 ( 0.267 0.118 2.294) 2.313 99.145 ( 1.362 0.147 -7.856) 7.974 100.427 ( -2.470 -0.299 -0.867) 2.634 100.787 ( -0.374 1.040 0.220) 1.127 101.153 ( -1.639 0.256 -0.992) 1.933 104.240 ( 33.652 6.470 14.942) 37.384 ======================= Grid point 34 (23/230) ======================= q-point: (-0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.870 ( -0.000 14.162 0.000) 14.162 1.026 ( -0.000 17.191 0.000) 17.191 2.201 ( -0.000 43.578 0.000) 43.578 2.335 ( 0.000 -5.400 -0.000) 5.400 2.605 ( 0.000 -1.050 -0.000) 1.050 2.854 ( -0.000 3.544 0.000) 3.544 3.088 ( -0.000 2.304 0.000) 2.304 3.327 ( -0.000 11.977 0.000) 11.977 3.332 ( -0.000 4.292 0.000) 4.292 3.472 ( 0.000 -2.259 -0.000) 2.259 3.661 ( -0.000 5.036 0.000) 5.036 3.893 ( -0.000 0.870 0.000) 0.870 4.129 ( 0.000 -4.845 -0.000) 4.845 4.200 ( 0.000 -5.890 -0.000) 5.890 4.341 ( 0.000 -11.135 -0.000) 11.135 4.668 ( 0.000 -0.558 -0.000) 0.558 4.911 ( 0.000 -1.575 -0.000) 1.575 5.179 ( 0.000 -6.428 -0.000) 6.428 5.249 ( 0.000 -4.285 -0.000) 4.285 5.590 ( -0.000 2.933 0.000) 2.933 5.640 ( 0.000 -10.819 -0.000) 10.819 6.069 ( 0.000 -4.188 -0.000) 4.188 6.229 ( -0.000 4.823 0.000) 4.823 6.549 ( -0.000 1.256 0.000) 1.256 7.131 ( 0.000 -2.173 -0.000) 2.173 7.438 ( 0.000 -7.289 -0.000) 7.289 8.327 ( 0.000 -7.459 -0.000) 7.459 9.306 ( -0.000 9.058 0.000) 9.058 9.890 ( -0.000 8.627 0.000) 8.627 10.181 ( 0.000 -4.088 -0.000) 4.088 10.323 ( 0.000 -6.862 -0.000) 6.862 10.447 ( -0.000 4.361 0.000) 4.361 11.196 ( -0.000 6.011 0.000) 6.011 11.249 ( 0.000 -1.813 -0.000) 1.813 11.374 ( 0.000 -0.173 -0.000) 0.173 11.638 ( -0.000 4.267 0.000) 4.267 11.846 ( 0.000 -4.412 -0.000) 4.412 12.081 ( -0.000 0.499 0.000) 0.499 13.181 ( 0.000 -0.921 -0.000) 0.921 13.661 ( 0.000 -2.321 -0.000) 2.321 16.516 ( 0.000 -1.880 -0.000) 1.880 17.993 ( -0.000 1.389 0.000) 1.389 18.888 ( 0.000 -0.303 -0.000) 0.303 19.412 ( -0.000 1.383 0.000) 1.383 19.511 ( -0.000 1.803 0.000) 1.803 19.947 ( -0.000 1.470 0.000) 1.470 20.272 ( 0.000 -2.137 -0.000) 2.137 20.314 ( -0.000 1.119 0.000) 1.119 21.316 ( -0.000 0.528 0.000) 0.528 21.368 ( 0.000 -2.269 -0.000) 2.269 22.373 ( 0.000 -0.576 -0.000) 0.576 23.121 ( -0.000 2.821 0.000) 2.821 24.379 ( 0.000 -2.201 -0.000) 2.201 24.495 ( 0.000 -0.036 -0.000) 0.036 24.596 ( 0.000 -0.486 -0.000) 0.486 24.777 ( -0.000 2.197 0.000) 2.197 25.667 ( 0.000 -0.747 -0.000) 0.747 26.098 ( -0.000 1.503 0.000) 1.503 26.129 ( -0.000 2.250 0.000) 2.250 26.800 ( 0.000 -1.542 -0.000) 1.542 47.117 ( -0.000 0.318 0.000) 0.318 47.327 ( -0.000 0.276 0.000) 0.276 49.294 ( -0.000 0.157 0.000) 0.157 49.488 ( 0.000 -0.664 -0.000) 0.664 98.628 ( 0.000 -0.180 -0.000) 0.180 98.769 ( 0.000 -0.376 -0.000) 0.376 98.846 ( -0.000 0.637 0.000) 0.637 99.118 ( -0.000 0.309 0.000) 0.309 100.400 ( -0.000 0.025 0.000) 0.025 100.776 ( -0.000 1.464 0.000) 1.464 101.131 ( -0.000 0.542 0.000) 0.542 104.630 ( 0.000 -0.215 -0.000) 0.215 ======================= Grid point 41 (24/230) ======================= q-point: (-0.56 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.279 ( -11.159 -0.000 -7.771) 13.598 1.314 ( -17.936 -0.000 -2.335) 18.087 2.286 ( -4.394 -0.000 1.861) 4.772 2.595 ( 1.359 0.000 -5.176) 5.352 2.811 ( 6.743 0.000 -0.884) 6.800 2.830 ( 5.948 0.000 -1.312) 6.091 3.089 ( 12.111 0.000 8.014) 14.523 3.138 ( -5.298 -0.000 11.555) 12.712 3.263 ( -1.012 -0.000 11.333) 11.379 3.602 ( 6.789 0.000 3.805) 7.783 3.814 ( -10.135 -0.000 1.520) 10.248 3.859 ( -3.309 -0.000 -12.797) 13.218 4.111 ( 1.161 0.000 -0.950) 1.500 4.265 ( -8.118 -0.000 -9.352) 12.384 4.271 ( -9.912 -0.000 -1.490) 10.024 4.592 ( 3.766 0.000 7.720) 8.589 5.044 ( -6.817 -0.000 -14.089) 15.651 5.176 ( -7.877 -0.000 -3.082) 8.459 5.294 ( -2.888 -0.000 -1.659) 3.330 5.307 ( 14.860 0.000 -5.329) 15.787 5.596 ( 0.256 0.000 5.855) 5.860 6.077 ( -4.491 -0.000 1.934) 4.890 6.338 ( -5.707 -0.000 0.333) 5.716 6.586 ( -2.101 -0.000 -0.434) 2.145 7.054 ( 3.285 0.000 3.252) 4.623 7.399 ( -4.096 -0.000 -1.577) 4.389 8.266 ( -1.607 -0.000 -2.125) 2.665 9.382 ( 2.672 0.000 1.836) 3.242 9.934 ( 1.441 0.000 4.721) 4.936 10.204 ( -0.821 -0.000 1.501) 1.711 10.309 ( -6.443 -0.000 -15.303) 16.604 10.508 ( -0.759 -0.000 2.714) 2.819 11.146 ( 5.512 0.000 2.530) 6.065 11.304 ( -2.524 -0.000 1.452) 2.912 11.351 ( 0.538 0.000 3.293) 3.336 11.650 ( 10.902 0.000 4.485) 11.788 11.704 ( 0.235 0.000 2.647) 2.657 11.981 ( 9.221 0.000 1.386) 9.324 13.262 ( -6.867 -0.000 -6.386) 9.377 13.676 ( -3.964 -0.000 -1.308) 4.174 16.762 ( -23.980 -0.000 -9.524) 25.802 17.611 ( 29.310 0.000 13.885) 32.432 19.101 ( -10.206 -0.000 -9.083) 13.663 19.417 ( 2.036 0.000 -1.184) 2.355 19.572 ( -4.150 -0.000 -1.458) 4.399 19.980 ( -3.544 -0.000 4.454) 5.692 20.298 ( -2.580 -0.000 -6.531) 7.022 20.425 ( -15.196 -0.000 7.014) 16.737 21.317 ( 2.249 0.000 -5.198) 5.663 21.394 ( -8.073 -0.000 4.956) 9.472 22.297 ( 7.126 0.000 1.401) 7.263 23.089 ( 7.169 0.000 1.064) 7.248 24.364 ( -0.739 -0.000 -0.615) 0.961 24.427 ( 3.746 0.000 4.619) 5.947 24.577 ( 2.587 0.000 -2.532) 3.620 24.888 ( -5.564 -0.000 -5.528) 7.843 25.625 ( 5.651 0.000 -4.242) 7.066 26.053 ( 6.972 0.000 -0.047) 6.972 26.187 ( -8.061 -0.000 10.236) 13.029 26.769 ( 1.314 0.000 0.234) 1.335 47.117 ( 0.433 0.000 0.016) 0.433 47.332 ( 0.066 0.000 -0.461) 0.466 49.283 ( 0.627 0.000 1.426) 1.558 49.487 ( -0.117 -0.000 -1.201) 1.207 98.615 ( 3.332 0.000 -4.377) 5.501 98.781 ( -3.515 -0.000 3.361) 4.863 98.838 ( 0.136 0.000 3.030) 3.033 99.146 ( 1.367 0.000 -7.740) 7.860 100.425 ( -2.338 -0.000 -0.720) 2.446 100.795 ( -0.373 -0.000 0.304) 0.481 101.155 ( -1.554 -0.000 -0.897) 1.794 104.284 ( 30.305 0.000 13.830) 33.311 ======================= Grid point 43 (25/230) ======================= q-point: (-0.44 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.017 ( -0.000 5.452 0.000) 5.452 1.207 ( -0.000 6.805 0.000) 6.805 2.267 ( 0.000 -2.936 -0.000) 2.936 2.584 ( 0.000 -1.181 -0.000) 1.181 2.749 ( -0.000 29.003 0.000) 29.003 2.877 ( -0.000 0.423 0.000) 0.423 3.097 ( 0.000 -2.264 -0.000) 2.264 3.338 ( 0.000 -8.619 -0.000) 8.619 3.391 ( 0.000 -1.069 -0.000) 1.069 3.546 ( -0.000 14.505 0.000) 14.505 3.722 ( -0.000 3.607 0.000) 3.607 3.845 ( 0.000 -8.498 -0.000) 8.498 4.082 ( 0.000 -1.580 -0.000) 1.580 4.135 ( 0.000 -1.532 -0.000) 1.532 4.194 ( 0.000 -6.904 -0.000) 6.904 4.683 ( -0.000 1.359 0.000) 1.359 4.892 ( 0.000 -0.867 -0.000) 0.867 5.101 ( 0.000 -3.414 -0.000) 3.414 5.252 ( -0.000 3.673 0.000) 3.673 5.480 ( 0.000 -9.250 -0.000) 9.250 5.620 ( -0.000 1.093 0.000) 1.093 6.024 ( 0.000 -1.706 -0.000) 1.706 6.287 ( -0.000 2.410 0.000) 2.410 6.564 ( -0.000 0.563 0.000) 0.563 7.110 ( 0.000 -0.723 -0.000) 0.723 7.356 ( 0.000 -3.217 -0.000) 3.217 8.253 ( 0.000 -2.579 -0.000) 2.579 9.400 ( -0.000 3.518 0.000) 3.518 10.002 ( -0.000 5.741 0.000) 5.741 10.130 ( 0.000 -2.079 -0.000) 2.079 10.226 ( 0.000 -5.346 -0.000) 5.346 10.504 ( -0.000 2.385 0.000) 2.385 11.230 ( 0.000 -0.679 -0.000) 0.679 11.257 ( -0.000 2.246 0.000) 2.246 11.371 ( 0.000 -0.215 -0.000) 0.215 11.700 ( -0.000 3.916 0.000) 3.916 11.782 ( 0.000 -3.947 -0.000) 3.947 12.086 ( -0.000 0.132 0.000) 0.132 13.172 ( 0.000 -0.359 -0.000) 0.359 13.636 ( 0.000 -0.948 -0.000) 0.948 16.497 ( 0.000 -0.731 -0.000) 0.731 18.007 ( -0.000 0.552 0.000) 0.552 18.885 ( 0.000 -0.111 -0.000) 0.111 19.427 ( -0.000 0.581 0.000) 0.581 19.529 ( -0.000 0.653 0.000) 0.653 19.963 ( -0.000 0.607 0.000) 0.607 20.249 ( 0.000 -0.857 -0.000) 0.857 20.327 ( -0.000 0.467 0.000) 0.467 21.321 ( -0.000 0.186 0.000) 0.186 21.343 ( 0.000 -0.917 -0.000) 0.917 22.367 ( 0.000 -0.217 -0.000) 0.217 23.151 ( -0.000 1.114 0.000) 1.114 24.357 ( 0.000 -0.780 -0.000) 0.780 24.495 ( -0.000 0.004 0.000) 0.004 24.590 ( 0.000 -0.215 -0.000) 0.215 24.799 ( -0.000 0.779 0.000) 0.779 25.660 ( 0.000 -0.275 -0.000) 0.275 26.114 ( -0.000 0.574 0.000) 0.574 26.154 ( -0.000 0.939 0.000) 0.939 26.783 ( 0.000 -0.661 -0.000) 0.661 47.120 ( -0.000 0.126 0.000) 0.126 47.330 ( -0.000 0.110 0.000) 0.110 49.295 ( -0.000 0.062 0.000) 0.062 49.481 ( 0.000 -0.263 -0.000) 0.263 98.626 ( 0.000 -0.063 -0.000) 0.063 98.765 ( 0.000 -0.143 -0.000) 0.143 98.853 ( -0.000 0.244 0.000) 0.244 99.121 ( -0.000 0.119 0.000) 0.119 100.400 ( -0.000 0.010 0.000) 0.010 100.791 ( -0.000 0.576 0.000) 0.576 101.137 ( -0.000 0.214 0.000) 0.214 104.627 ( 0.000 -0.085 -0.000) 0.085 ======================= Grid point 85 (26/230) ======================= q-point: ( 0.00 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.484 ( 11.903 0.000 25.782) 28.397 0.500 ( 10.293 0.000 25.547) 27.542 0.953 ( -10.371 -0.000 47.588) 48.705 2.363 ( 3.721 0.000 6.844) 7.790 2.643 ( -0.723 -0.000 -1.612) 1.767 2.704 ( -1.159 -0.000 2.667) 2.908 3.050 ( -2.657 -0.000 5.038) 5.696 3.109 ( -3.815 -0.000 3.836) 5.410 3.292 ( 5.086 0.000 -1.050) 5.194 3.435 ( -5.435 -0.000 3.059) 6.237 3.546 ( 3.382 0.000 6.805) 7.599 3.824 ( -5.068 -0.000 2.407) 5.611 4.233 ( -1.519 -0.000 -4.521) 4.770 4.341 ( 0.065 0.000 -5.272) 5.273 4.541 ( 8.189 0.000 7.313) 10.980 4.592 ( -1.336 -0.000 -15.872) 15.928 5.256 ( -10.971 -0.000 -2.883) 11.344 5.284 ( 9.566 0.000 12.498) 15.739 5.404 ( -1.042 -0.000 -4.973) 5.081 5.534 ( 9.542 0.000 8.145) 12.546 5.830 ( -44.573 -0.000 -4.622) 44.812 6.112 ( -1.245 -0.000 -3.531) 3.744 6.400 ( 20.250 0.000 -0.610) 20.260 6.766 ( 1.377 0.000 -8.299) 8.412 7.185 ( -1.186 -0.000 -5.059) 5.196 7.234 ( 2.882 0.000 -1.587) 3.290 8.740 ( -0.466 -0.000 0.210) 0.511 8.808 ( 1.681 0.000 -1.317) 2.136 9.670 ( 1.527 0.000 6.392) 6.572 10.184 ( -0.369 -0.000 3.935) 3.952 10.415 ( -1.010 -0.000 -5.578) 5.669 10.451 ( -0.080 -0.000 -8.757) 8.757 10.845 ( 2.310 0.000 3.991) 4.611 11.463 ( -4.941 -0.000 8.570) 9.892 11.477 ( 2.121 0.000 -3.773) 4.328 11.848 ( -0.255 -0.000 -0.361) 0.442 11.891 ( 4.019 0.000 -0.175) 4.023 11.970 ( -4.316 -0.000 -3.065) 5.293 13.277 ( 17.925 0.000 1.313) 17.973 13.726 ( -0.544 -0.000 -1.488) 1.585 16.657 ( 33.683 0.000 2.496) 33.775 17.858 ( -19.197 -0.000 -7.808) 20.724 18.958 ( 15.394 0.000 4.920) 16.161 19.369 ( -10.823 -0.000 -3.406) 11.347 19.458 ( 0.634 0.000 2.300) 2.386 19.927 ( -5.883 -0.000 2.672) 6.462 20.111 ( 4.422 0.000 -3.484) 5.630 20.399 ( -6.010 -0.000 8.496) 10.407 21.215 ( 2.508 0.000 -7.373) 7.788 21.518 ( -1.723 -0.000 -1.115) 2.053 22.132 ( -0.551 -0.000 3.693) 3.734 23.029 ( -1.046 -0.000 0.861) 1.355 24.226 ( 0.280 0.000 -1.590) 1.614 24.531 ( 0.309 0.000 4.040) 4.052 24.576 ( 0.285 0.000 -3.467) 3.479 25.513 ( 45.001 0.000 -0.887) 45.010 25.528 ( -1.185 -0.000 -1.816) 2.168 25.944 ( 1.477 0.000 -9.032) 9.152 26.071 ( 2.929 0.000 3.032) 4.216 26.372 ( -51.327 -0.000 4.884) 51.559 47.316 ( -4.899 -0.000 4.493) 6.647 47.396 ( -2.280 -0.000 7.642) 7.975 49.226 ( 1.264 0.000 -6.084) 6.214 49.417 ( 3.150 0.000 -2.683) 4.138 98.678 ( 1.247 0.000 4.276) 4.454 98.781 ( -3.220 -0.000 0.581) 3.272 99.077 ( -0.006 -0.000 -2.849) 2.849 100.255 ( -30.031 -0.000 -2.140) 30.107 100.618 ( 6.295 0.000 -5.245) 8.194 100.978 ( 0.592 0.000 10.500) 10.516 101.107 ( 1.799 0.000 -0.527) 1.874 102.240 ( -0.306 -0.000 -3.636) 3.649 ======================= Grid point 86 (27/230) ======================= q-point: ( 0.11 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.881 ( 10.516 4.319 25.917) 28.301 1.096 ( 20.932 -6.430 24.051) 32.526 1.373 ( 12.092 -15.786 31.930) 37.615 2.537 ( 6.696 0.143 8.068) 10.486 2.601 ( -1.645 2.064 -2.821) 3.863 2.733 ( 0.789 -0.899 3.671) 3.861 2.982 ( -6.280 1.370 4.216) 7.687 3.197 ( 3.019 -0.814 4.407) 5.404 3.322 ( -1.537 0.160 -0.489) 1.621 3.388 ( -3.398 -0.688 3.443) 4.886 3.725 ( 5.006 -0.520 4.478) 6.737 3.792 ( 1.910 -0.898 -1.276) 2.466 4.169 ( -0.679 1.487 -5.795) 6.021 4.232 ( -3.132 -4.004 -11.163) 12.266 4.554 ( 3.629 0.830 -3.674) 5.231 4.820 ( 15.420 3.908 4.906) 16.647 5.057 ( -10.075 -4.372 -1.445) 11.077 5.346 ( 0.621 -0.296 -7.447) 7.478 5.380 ( -13.897 0.921 2.711) 14.189 5.537 ( 7.971 3.392 11.381) 14.303 5.742 ( 8.184 1.594 5.422) 9.946 6.030 ( -4.140 -3.042 -4.449) 6.796 6.569 ( 5.452 0.068 0.510) 5.476 6.878 ( 21.308 19.392 -17.233) 33.571 7.108 ( -2.007 1.337 -4.940) 5.497 7.325 ( 5.209 -9.721 -6.836) 12.975 8.685 ( 0.181 9.131 0.521) 9.148 8.872 ( 0.311 -9.608 -0.937) 9.659 9.790 ( 3.964 -1.083 9.111) 9.995 10.207 ( -0.787 -0.015 2.561) 2.679 10.298 ( -2.288 -4.719 -11.299) 12.457 10.469 ( 2.669 -2.121 -1.543) 3.742 10.890 ( 1.633 1.406 0.579) 2.232 11.393 ( -5.990 6.851 1.058) 9.162 11.442 ( -3.465 2.430 2.383) 4.857 11.621 ( -20.414 -1.392 11.761) 23.600 11.825 ( -5.964 -4.546 -0.552) 7.519 11.840 ( -4.852 1.505 -4.520) 6.800 13.552 ( 13.620 3.117 -0.050) 13.972 13.727 ( 2.262 -0.591 -2.704) 3.575 17.301 ( -30.321 -0.343 -13.401) 33.152 17.424 ( 44.404 8.702 -8.093) 45.967 19.241 ( 7.200 0.003 4.672) 8.583 19.385 ( 10.052 0.928 -9.089) 13.583 19.555 ( 6.711 -0.778 5.990) 9.029 19.863 ( -3.044 -0.500 -1.068) 3.265 20.244 ( 14.513 -1.883 -4.369) 15.272 20.433 ( 0.447 -0.879 7.998) 8.059 21.225 ( 5.819 -0.383 -7.768) 9.713 21.493 ( 0.694 1.481 0.246) 1.654 22.140 ( -4.768 -3.260 4.420) 7.273 22.974 ( -6.436 -0.601 0.502) 6.483 24.231 ( 1.037 -1.468 -1.785) 2.533 24.533 ( -0.130 3.047 -2.169) 3.742 24.581 ( -0.332 -2.399 2.690) 3.620 25.377 ( -7.645 16.213 5.794) 18.839 25.580 ( -12.078 -9.735 2.300) 15.682 25.989 ( -6.745 -0.540 -0.262) 6.771 26.100 ( 7.714 8.630 -0.235) 11.578 26.302 ( 15.671 -15.236 -11.850) 24.862 47.247 ( -6.379 1.265 6.495) 9.191 47.401 ( -3.815 0.097 8.058) 8.916 49.196 ( 1.419 -0.209 -6.285) 6.446 49.450 ( 2.895 -0.618 -2.635) 3.963 98.689 ( -4.547 -0.416 3.685) 5.868 98.781 ( 2.664 0.505 1.600) 3.148 99.008 ( -4.125 3.043 -1.986) 5.498 99.661 ( -28.819 9.897 17.633) 35.206 100.588 ( 0.042 3.642 -0.696) 3.708 100.893 ( -4.962 8.184 13.770) 16.769 101.160 ( 3.823 -0.779 0.761) 3.975 102.314 ( -12.172 -38.752 -11.738) 42.280 ======================= Grid point 87 (28/230) ======================= q-point: ( 0.22 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.243 ( 10.264 2.685 24.363) 26.573 1.634 ( 7.705 -16.979 26.202) 32.159 2.009 ( 27.085 -6.379 12.278) 30.414 2.459 ( -7.446 4.630 -2.820) 9.210 2.669 ( 2.384 4.518 1.496) 5.323 2.785 ( -0.250 -1.237 2.780) 3.053 2.914 ( -4.402 0.975 6.673) 8.054 3.184 ( -7.546 5.998 1.818) 9.810 3.288 ( 1.004 -2.086 1.379) 2.695 3.413 ( 1.624 -0.754 2.087) 2.750 3.832 ( 2.750 -1.590 5.407) 6.271 3.888 ( 6.363 -1.860 2.487) 7.080 4.100 ( -1.690 -3.294 -5.256) 6.429 4.152 ( -0.559 -4.124 -7.818) 8.857 4.526 ( -5.892 -0.547 -2.496) 6.423 4.906 ( 0.973 5.217 4.670) 7.069 5.111 ( 7.120 -0.892 -4.124) 8.277 5.224 ( -5.824 -1.828 -1.800) 6.364 5.348 ( 7.023 -1.435 -2.467) 7.580 5.650 ( 1.883 8.683 5.963) 10.701 5.899 ( 6.816 1.506 2.873) 7.548 5.982 ( -2.305 -8.065 -1.808) 8.581 6.661 ( 4.696 0.908 1.620) 5.050 6.856 ( 9.004 18.055 -14.806) 25.026 7.047 ( 1.769 2.062 -5.157) 5.829 7.397 ( 4.283 -5.731 -7.973) 10.712 8.646 ( 0.853 6.142 1.431) 6.364 8.925 ( -0.400 -7.546 -1.110) 7.638 9.953 ( 4.918 0.558 8.982) 10.256 10.154 ( -1.395 -2.917 -8.347) 8.951 10.276 ( -0.731 -4.258 0.665) 4.372 10.523 ( 3.574 -0.564 -1.031) 3.762 10.895 ( 0.400 -0.250 -2.436) 2.481 11.204 ( -9.255 5.471 -0.785) 10.779 11.356 ( -5.451 4.170 2.523) 7.312 11.499 ( -10.382 -3.535 11.329) 15.768 11.720 ( -4.577 1.158 -2.466) 5.326 11.739 ( -5.929 -2.101 -0.144) 6.292 13.728 ( 8.775 2.393 0.364) 9.102 13.761 ( 4.615 -0.189 -2.723) 5.362 16.706 ( -25.988 -0.302 -11.425) 28.390 17.933 ( 27.696 7.757 2.670) 28.885 19.306 ( -0.514 -0.572 1.818) 1.974 19.414 ( 2.877 2.033 -6.871) 7.722 19.715 ( 3.270 -0.749 6.678) 7.474 19.814 ( 0.854 -0.495 -7.581) 7.645 20.520 ( 13.955 -1.250 -3.297) 14.393 20.553 ( 11.699 -0.316 3.962) 12.355 21.277 ( 6.759 -1.293 -7.582) 10.239 21.535 ( 6.286 1.732 -0.590) 6.547 22.092 ( -8.413 -1.708 6.587) 10.820 22.831 ( -11.367 -0.496 0.844) 11.409 24.249 ( 1.804 -0.546 -1.472) 2.391 24.475 ( -1.006 2.424 -3.944) 4.738 24.605 ( -2.221 -1.245 4.147) 4.866 25.257 ( -2.396 5.830 5.404) 8.302 25.498 ( -7.117 -6.738 0.612) 9.820 25.869 ( -6.728 -0.704 -2.724) 7.293 26.153 ( 6.065 8.876 0.365) 10.757 26.492 ( 8.043 -8.894 -8.415) 14.649 47.199 ( -4.986 0.805 6.295) 8.070 47.406 ( -3.648 -0.167 7.794) 8.607 49.173 ( 1.783 -0.223 -5.768) 6.041 49.475 ( 2.501 -0.312 -3.094) 3.990 98.637 ( -4.027 -0.763 1.067) 4.236 98.845 ( 1.774 0.841 4.348) 4.771 98.896 ( -4.820 2.955 0.897) 5.724 99.424 ( -11.525 2.071 9.390) 15.010 100.571 ( 0.146 1.464 0.177) 1.482 100.895 ( -3.255 3.214 10.853) 11.778 101.260 ( 6.221 -0.389 1.559) 6.425 102.204 ( -14.571 -23.134 -10.637) 29.337 ======================= Grid point 88 (29/230) ======================= q-point: ( 0.33 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.603 ( 10.297 -0.517 20.634) 23.066 1.995 ( -2.429 -10.532 12.176) 16.281 2.252 ( -5.596 3.853 1.514) 6.960 2.527 ( 16.186 1.187 3.271) 16.556 2.616 ( 2.269 6.303 -0.373) 6.709 2.789 ( -1.859 -1.004 1.698) 2.711 2.910 ( -2.584 0.444 5.817) 6.381 3.039 ( -5.902 7.973 4.613) 10.940 3.294 ( -1.511 -2.984 -2.398) 4.116 3.487 ( 4.159 0.979 1.849) 4.655 3.908 ( 3.560 1.947 -2.993) 5.042 4.016 ( 2.323 -3.710 1.105) 4.515 4.094 ( -0.121 -2.828 -0.121) 2.833 4.151 ( 1.304 -5.852 1.997) 6.319 4.359 ( -11.302 -1.819 1.234) 11.514 4.968 ( 2.887 2.291 -0.278) 3.695 5.071 ( 1.680 1.403 -7.803) 8.104 5.188 ( -0.648 -5.287 -1.295) 5.481 5.555 ( 10.692 -0.199 4.415) 11.569 5.632 ( 0.398 6.477 2.443) 6.934 5.936 ( -2.267 -2.537 -1.060) 3.563 6.051 ( 2.870 -4.136 0.605) 5.070 6.717 ( 3.153 12.661 -12.377) 17.984 6.734 ( 2.857 1.445 1.488) 3.530 7.036 ( 3.302 1.057 -5.468) 6.474 7.430 ( 3.439 -3.267 -6.505) 8.051 8.640 ( 0.333 1.852 0.660) 1.994 8.951 ( -0.082 -3.570 -0.996) 3.707 10.033 ( 0.749 -0.497 -1.908) 2.109 10.167 ( 3.544 -1.248 4.145) 5.594 10.293 ( -0.365 -0.993 -0.114) 1.064 10.575 ( 3.659 1.274 -0.723) 3.941 10.859 ( -1.957 -1.929 -5.328) 5.995 11.031 ( -5.139 2.551 -3.128) 6.534 11.270 ( -4.479 3.565 4.828) 7.489 11.456 ( -7.120 -0.165 9.154) 11.598 11.629 ( -3.876 0.172 0.166) 3.883 11.676 ( -3.630 -1.360 1.784) 4.267 13.782 ( 3.580 -0.987 -5.528) 6.660 13.864 ( 5.644 1.807 1.442) 6.099 16.274 ( -15.203 -0.102 -6.321) 16.465 18.300 ( 16.003 4.241 4.580) 17.178 19.301 ( -1.506 -0.923 0.535) 1.846 19.363 ( -2.718 0.810 -1.824) 3.372 19.768 ( 3.875 0.563 -8.510) 9.368 19.794 ( -0.199 -0.493 3.617) 3.656 20.624 ( 3.490 0.300 -0.571) 3.549 20.885 ( 21.289 -0.344 -2.572) 21.447 21.325 ( 4.404 -1.991 -6.664) 8.232 21.683 ( 13.682 1.762 -1.722) 13.902 21.995 ( -11.660 -0.381 8.568) 14.474 22.619 ( -14.662 0.136 1.425) 14.732 24.275 ( 2.545 0.451 -1.231) 2.863 24.405 ( -1.550 1.042 -3.731) 4.173 24.592 ( -3.385 -0.133 2.986) 4.516 25.283 ( 3.481 -0.185 1.725) 3.890 25.440 ( -4.597 -4.315 -0.294) 6.312 25.722 ( -7.954 0.128 -2.556) 8.356 26.182 ( 5.308 8.904 -0.952) 10.410 26.602 ( 3.895 -6.509 -1.280) 7.693 47.170 ( -4.051 0.538 5.936) 7.206 47.411 ( -3.690 -0.242 7.490) 8.353 49.163 ( 2.224 -0.200 -4.881) 5.367 49.486 ( 2.098 -0.082 -3.903) 4.432 98.587 ( -2.886 -1.038 -0.293) 3.081 98.822 ( -2.921 1.715 2.310) 4.100 98.905 ( 0.211 0.562 5.697) 5.729 99.327 ( -5.834 -0.091 2.238) 6.249 100.569 ( 0.152 0.573 0.429) 0.732 100.905 ( -3.530 1.850 8.805) 9.665 101.395 ( 7.712 0.374 1.153) 7.807 102.016 ( -11.701 -11.452 -7.986) 18.216 ======================= Grid point 89 (30/230) ======================= q-point: ( 0.44 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.818 ( -13.094 8.606 -3.388) 16.031 1.936 ( 8.222 -0.971 15.991) 18.008 2.249 ( -2.924 4.462 0.336) 5.346 2.483 ( -1.703 4.156 -2.400) 5.092 2.697 ( -1.842 0.700 -1.722) 2.617 2.861 ( -0.283 -1.067 6.861) 6.949 2.944 ( -1.126 -0.801 10.115) 10.209 2.973 ( 0.251 4.238 3.276) 5.363 3.318 ( 5.612 -3.196 -1.644) 6.664 3.519 ( -0.845 1.099 0.547) 1.490 3.859 ( 2.863 6.649 -11.333) 13.448 3.999 ( -3.224 2.365 -6.073) 7.271 4.121 ( 2.737 -3.961 1.125) 4.944 4.213 ( -4.373 0.584 3.639) 5.719 4.342 ( -1.588 -8.059 15.583) 17.615 4.894 ( -2.827 -1.523 -9.955) 10.460 5.075 ( 3.355 -4.173 -7.773) 9.439 5.275 ( 1.297 -2.008 8.723) 9.045 5.600 ( 0.095 2.783 2.927) 4.040 5.754 ( 7.657 2.199 0.462) 7.980 5.870 ( -5.935 -3.193 -1.622) 6.932 6.094 ( -0.147 -1.773 -1.903) 2.606 6.605 ( 3.507 4.900 -9.455) 11.211 6.774 ( 1.420 -1.196 0.590) 1.948 7.047 ( 2.351 -1.986 -4.348) 5.327 7.460 ( 3.579 -1.990 -4.683) 6.221 8.623 ( -2.075 -2.371 -2.126) 3.801 8.965 ( 1.569 1.436 -0.119) 2.130 10.038 ( -0.078 -2.723 -0.743) 2.823 10.250 ( 0.793 1.576 0.755) 1.919 10.283 ( 2.002 4.436 2.159) 5.324 10.616 ( 3.332 2.750 0.117) 4.322 10.779 ( -2.317 -1.451 -5.826) 6.436 10.938 ( -0.152 0.303 -6.862) 6.871 11.248 ( -2.432 2.277 9.015) 9.611 11.412 ( -4.251 1.416 5.012) 6.723 11.605 ( -1.388 -0.720 3.653) 3.974 11.664 ( -1.733 -0.920 4.160) 4.600 13.782 ( 1.461 -1.897 -7.511) 7.884 13.926 ( 1.712 0.925 0.950) 2.166 16.108 ( -1.088 0.102 0.547) 1.222 18.442 ( 0.451 0.044 -2.511) 2.551 19.281 ( -1.632 -0.883 -0.837) 2.036 19.296 ( -2.708 -0.401 -0.887) 2.877 19.798 ( -0.455 0.470 2.882) 2.956 19.826 ( 7.267 0.251 -2.452) 7.674 20.622 ( 0.056 1.074 -5.810) 5.909 21.210 ( 17.486 0.724 0.553) 17.510 21.346 ( 3.041 -2.460 -6.022) 7.181 21.842 ( -14.783 0.248 8.359) 16.985 21.927 ( 17.178 1.923 -1.480) 17.349 22.370 ( -15.217 0.802 1.569) 15.318 24.303 ( 2.179 0.444 -1.582) 2.729 24.358 ( -0.066 -0.089 -2.073) 2.076 24.549 ( -3.209 0.061 0.556) 3.258 25.351 ( -0.693 -2.826 -3.122) 4.268 25.419 ( 2.113 -3.149 -1.033) 3.930 25.577 ( -5.638 1.352 0.205) 5.801 26.188 ( 4.552 8.973 -2.052) 10.269 26.709 ( 1.969 -5.366 4.962) 7.569 47.154 ( -3.351 0.389 5.834) 6.740 47.411 ( -3.803 -0.221 7.132) 8.085 49.168 ( 2.642 -0.151 -3.850) 4.672 49.481 ( 1.760 0.083 -4.879) 5.187 98.551 ( -1.600 -1.204 -1.124) 2.297 98.803 ( -1.416 0.651 3.678) 3.995 98.942 ( -1.496 0.523 6.214) 6.413 99.251 ( -3.498 -0.560 -2.387) 4.272 100.572 ( -0.142 0.088 0.613) 0.635 100.895 ( -4.109 1.393 6.785) 8.054 101.482 ( 0.934 -1.051 -3.434) 3.711 101.909 ( 1.952 1.018 -1.143) 2.481 ======================= Grid point 90 (31/230) ======================= q-point: (-0.44 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.486 ( -14.901 11.144 -0.324) 18.610 1.879 ( -11.700 21.266 -8.162) 25.608 2.285 ( 8.483 -0.152 10.425) 13.441 2.482 ( 3.008 -1.210 -1.135) 3.435 2.622 ( -4.376 0.852 -4.962) 6.671 2.793 ( -9.038 0.462 0.310) 9.055 2.933 ( -7.257 -2.222 0.337) 7.597 3.048 ( 1.496 -1.322 11.377) 11.550 3.399 ( -0.213 5.768 0.744) 5.820 3.493 ( -1.235 -0.630 -0.391) 1.441 3.768 ( -1.692 4.176 -5.758) 7.311 3.937 ( 9.823 2.499 -4.277) 11.001 4.144 ( -3.332 1.803 -0.089) 3.790 4.223 ( 2.609 -2.510 3.976) 5.377 4.503 ( -1.352 -4.002 15.181) 15.758 4.772 ( -2.026 -0.561 -8.947) 9.191 5.105 ( 0.801 -11.273 -8.027) 13.863 5.316 ( -1.668 2.648 1.901) 3.662 5.629 ( -2.451 -1.023 1.581) 3.091 5.689 ( -7.490 0.139 0.986) 7.556 5.902 ( 3.175 -2.535 2.892) 4.987 6.036 ( -2.070 1.029 -5.754) 6.201 6.584 ( 3.500 0.798 -8.576) 9.297 6.855 ( 3.107 -8.413 3.402) 9.592 7.063 ( 0.338 -5.663 -3.956) 6.917 7.502 ( 4.247 -0.791 -3.420) 5.509 8.579 ( -3.126 -5.646 -3.316) 7.256 8.977 ( 2.714 5.893 0.141) 6.490 10.006 ( -4.582 1.268 -1.570) 5.007 10.245 ( 3.128 0.710 -3.408) 4.680 10.313 ( 0.685 4.779 6.135) 7.806 10.647 ( 2.055 4.075 1.224) 4.725 10.721 ( 0.357 -0.497 -5.108) 5.144 10.892 ( 3.540 1.645 -9.269) 10.058 11.297 ( -0.605 0.810 10.075) 10.125 11.397 ( -1.084 1.453 5.023) 5.340 11.631 ( 0.580 -0.862 1.890) 2.157 11.712 ( 0.784 -0.818 7.685) 7.768 13.726 ( -1.565 -2.880 -9.618) 10.161 13.928 ( -1.712 0.015 0.624) 1.823 16.246 ( 13.062 0.243 7.562) 15.095 18.285 ( -12.796 -4.497 -10.342) 17.056 19.252 ( -0.795 -0.811 -1.945) 2.253 19.283 ( 2.007 -0.864 -1.878) 2.881 19.771 ( -3.991 0.968 2.729) 4.931 19.992 ( 9.041 -1.287 3.416) 9.750 20.522 ( -2.913 1.652 -8.632) 9.259 21.328 ( 0.235 -2.287 -4.024) 4.634 21.457 ( -0.363 2.118 7.095) 7.413 21.670 ( -3.324 -0.177 0.887) 3.445 22.044 ( -11.776 1.363 2.943) 12.215 22.283 ( 15.004 1.994 -1.526) 15.213 24.305 ( -0.084 -0.405 -0.846) 0.942 24.380 ( 3.577 0.022 -1.347) 3.822 24.499 ( -2.203 -0.376 -1.535) 2.711 25.237 ( -6.584 -0.294 -7.306) 9.840 25.458 ( -0.723 -2.159 0.697) 2.381 25.600 ( 6.880 -1.405 0.186) 7.024 26.171 ( 3.682 9.187 -2.775) 10.280 26.833 ( 0.767 -5.172 9.710) 11.028 47.149 ( -2.856 0.317 5.966) 6.622 47.407 ( -3.886 -0.162 6.731) 7.774 49.188 ( 2.941 -0.068 -2.890) 4.124 49.462 ( 1.581 0.238 -5.816) 6.031 98.533 ( -0.241 -1.244 -1.421) 1.904 98.820 ( -0.800 0.284 5.109) 5.180 98.952 ( -3.078 0.474 6.089) 6.839 99.175 ( -2.058 -0.537 -4.932) 5.371 100.572 ( -0.765 -0.471 0.744) 1.167 100.862 ( -4.406 1.177 4.879) 6.679 101.388 ( -5.929 -1.527 -6.155) 8.681 102.048 ( 16.658 12.707 3.396) 21.225 ======================= Grid point 91 (32/230) ======================= q-point: (-0.33 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.152 ( -16.497 11.689 3.435) 20.508 1.381 ( -14.107 28.862 -9.533) 33.510 2.272 ( -26.107 5.403 -5.746) 27.272 2.508 ( 6.740 -0.068 9.295) 11.482 2.565 ( 1.714 -1.111 -3.769) 4.287 2.687 ( 1.183 -0.719 -2.033) 2.460 2.832 ( -5.420 -0.215 1.009) 5.517 3.141 ( 0.443 3.627 0.097) 3.656 3.342 ( 0.504 4.966 6.376) 8.097 3.407 ( -6.808 2.623 -2.867) 7.839 3.688 ( 0.402 -1.524 -2.889) 3.291 4.062 ( -4.714 2.594 3.129) 6.224 4.150 ( 9.027 -1.683 1.555) 9.313 4.330 ( 5.564 0.699 3.030) 6.374 4.601 ( 1.706 -1.335 5.674) 6.074 4.736 ( 0.661 -3.618 2.788) 4.615 5.084 ( -4.767 -6.844 -8.384) 11.826 5.240 ( -3.528 -2.916 -8.111) 9.313 5.493 ( -6.423 -0.068 -0.112) 6.425 5.681 ( -1.846 0.346 3.773) 4.215 5.854 ( -7.263 -3.233 -7.462) 10.903 6.066 ( 2.826 -1.246 7.352) 7.975 6.541 ( 1.401 1.246 -8.770) 8.968 7.035 ( 4.221 -8.918 4.961) 11.044 7.073 ( -2.575 -13.337 -4.390) 14.275 7.560 ( 5.360 -0.632 -2.703) 6.036 8.562 ( -1.665 -8.237 -2.331) 8.721 8.968 ( 2.792 9.293 -0.309) 9.708 9.864 ( -5.704 4.926 -3.258) 8.211 10.232 ( -0.954 4.701 0.201) 4.801 10.382 ( 2.366 -3.967 3.218) 5.630 10.630 ( -0.445 2.237 -2.198) 3.168 10.719 ( 3.594 3.650 -1.629) 5.375 10.873 ( 6.029 5.667 -8.410) 11.798 11.374 ( 2.121 0.384 5.362) 5.779 11.431 ( -1.810 0.836 9.740) 9.942 11.676 ( 3.592 0.276 0.520) 3.640 11.821 ( 2.753 -1.669 7.825) 8.461 13.609 ( -4.387 -3.648 -11.258) 12.621 13.886 ( -3.893 -0.805 0.513) 4.008 16.654 ( 24.078 0.327 12.965) 27.349 17.958 ( -17.573 -9.125 -14.626) 24.617 19.218 ( -1.365 -0.581 -3.400) 3.710 19.353 ( 6.695 -2.684 -2.494) 7.632 19.696 ( -5.710 1.475 0.679) 5.936 20.165 ( 3.493 -4.144 5.831) 7.961 20.371 ( -4.133 1.681 -8.789) 9.857 21.185 ( -21.760 1.736 6.447) 22.761 21.353 ( -1.985 -2.587 -2.580) 4.158 21.767 ( -5.625 0.136 0.982) 5.712 21.866 ( 4.154 2.949 1.518) 5.316 22.561 ( 17.456 2.493 0.257) 17.634 24.302 ( 0.030 0.898 0.483) 1.020 24.437 ( 4.341 -0.283 -1.901) 4.748 24.461 ( -0.820 -1.097 -2.155) 2.553 25.048 ( -7.097 0.884 -8.404) 11.036 25.478 ( 0.695 -1.289 1.185) 1.884 25.746 ( 8.527 -2.517 -1.718) 9.055 26.133 ( 2.850 9.286 -3.343) 10.272 26.974 ( -0.325 -6.139 12.677) 14.089 47.153 ( -2.655 0.312 6.416) 6.951 47.397 ( -3.860 -0.111 6.328) 7.413 49.217 ( 2.987 0.038 -2.298) 3.769 49.435 ( 1.700 0.473 -6.429) 6.666 98.538 ( 1.032 -1.134 -1.091) 1.882 98.851 ( -1.175 0.322 6.212) 6.331 98.935 ( -4.238 0.489 5.569) 7.016 99.114 ( -0.777 -0.448 -3.806) 3.910 100.564 ( -1.776 -1.479 0.715) 2.419 100.816 ( -4.053 0.983 3.425) 5.397 101.250 ( -4.782 -0.181 -4.979) 6.906 102.285 ( 22.858 24.315 2.921) 33.500 ======================= Grid point 92 (33/230) ======================= q-point: (-0.22 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.746 ( -13.934 22.691 -12.626) 29.470 0.938 ( -16.747 22.299 16.778) 32.545 1.627 ( -38.332 8.024 -1.069) 39.177 2.460 ( -4.749 3.622 -5.908) 8.401 2.653 ( 1.859 -0.242 5.153) 5.484 2.758 ( -0.729 0.272 1.854) 2.011 2.832 ( 5.340 -1.570 5.725) 7.984 3.052 ( 1.576 7.552 -6.705) 10.222 3.243 ( -3.843 2.882 -4.397) 6.512 3.440 ( 1.508 -0.076 8.822) 8.950 3.734 ( 2.801 -3.654 -0.723) 4.660 3.978 ( -6.642 2.130 4.715) 8.419 4.260 ( 1.994 -3.442 0.586) 4.021 4.375 ( 0.512 3.303 -0.541) 3.386 4.763 ( 6.810 -2.318 5.916) 9.314 4.875 ( -10.273 -3.032 -4.591) 11.653 4.897 ( 7.322 -3.853 3.374) 8.936 5.118 ( -4.549 -5.952 -13.751) 15.659 5.450 ( -0.365 1.480 2.282) 2.744 5.676 ( -1.917 -1.396 -0.224) 2.382 5.690 ( -6.214 -2.498 -2.584) 7.179 6.166 ( -0.395 -1.582 7.452) 7.628 6.480 ( 1.070 0.848 -8.151) 8.265 7.072 ( -3.203 -12.936 -4.436) 14.045 7.190 ( -0.254 -11.424 2.402) 11.676 7.652 ( 5.614 -5.187 -3.950) 8.604 8.602 ( 0.401 -9.817 -1.641) 9.961 8.931 ( 2.303 11.616 -0.809) 11.870 9.718 ( -4.158 5.012 -1.581) 6.701 10.174 ( -2.422 4.662 2.078) 5.650 10.464 ( -0.178 -4.813 2.405) 5.383 10.585 ( -0.814 -3.666 -5.304) 6.499 10.738 ( 7.211 9.265 -6.529) 13.434 10.870 ( 4.432 9.445 1.451) 10.534 11.439 ( 1.853 -1.065 0.472) 2.189 11.482 ( -2.026 2.750 12.959) 13.402 11.754 ( 5.599 1.422 0.194) 5.780 11.944 ( 2.899 -2.128 5.212) 6.332 13.451 ( -5.416 -3.873 -11.540) 13.323 13.824 ( -4.442 -1.141 0.348) 4.599 17.237 ( 29.295 0.375 15.342) 33.072 17.596 ( -18.090 -14.507 -20.673) 31.066 19.136 ( -4.936 -0.329 -6.421) 8.105 19.494 ( 8.368 -6.531 -3.604) 11.210 19.573 ( -6.397 1.514 -1.086) 6.663 20.222 ( -2.812 0.799 -7.653) 8.192 20.251 ( -5.847 -8.911 4.666) 11.634 20.834 ( -21.369 3.809 6.628) 22.695 21.337 ( -1.284 -4.191 -2.768) 5.184 21.582 ( -10.031 -0.024 0.040) 10.031 22.029 ( 11.039 6.364 1.442) 12.824 22.814 ( 12.838 2.063 1.902) 13.141 24.298 ( 1.079 3.865 0.192) 4.018 24.455 ( 0.444 -1.867 -0.743) 2.058 24.494 ( 4.013 0.190 -1.330) 4.232 24.851 ( -6.673 1.207 -7.806) 10.340 25.515 ( 1.572 -1.120 0.404) 1.972 25.883 ( 7.679 -1.640 -2.391) 8.208 26.080 ( 2.377 8.727 -3.851) 9.831 27.120 ( -1.613 -8.943 11.433) 14.604 47.165 ( -2.681 0.257 8.011) 8.452 47.386 ( -3.668 -0.090 5.952) 6.992 49.244 ( 2.534 0.086 -2.674) 3.685 49.409 ( 2.393 0.995 -6.157) 6.681 98.566 ( 2.008 -0.883 -0.031) 2.193 98.883 ( -3.315 -0.866 5.656) 6.613 98.914 ( -1.950 -0.201 10.359) 10.543 99.109 ( 0.199 -0.097 4.724) 4.729 100.543 ( -3.341 -3.256 0.230) 4.671 100.775 ( -3.008 0.729 2.780) 4.161 101.152 ( -2.472 0.351 -3.354) 4.181 102.492 ( 27.894 42.168 -0.255) 50.560 ======================= Grid point 93 (34/230) ======================= q-point: (-0.11 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.283 ( -3.782 29.869 2.050) 30.178 0.669 ( -25.188 8.680 15.331) 30.738 0.977 ( -32.071 13.394 28.402) 44.885 2.334 ( -2.614 3.067 0.301) 4.041 2.669 ( -2.134 -1.445 0.521) 2.630 2.730 ( -3.093 1.746 2.345) 4.256 2.977 ( 4.658 1.473 1.958) 5.264 3.061 ( 5.455 2.171 5.922) 8.339 3.210 ( 4.414 0.524 -2.322) 5.015 3.488 ( -3.173 0.162 4.893) 5.834 3.750 ( -4.855 -4.039 -6.790) 9.273 3.894 ( -6.529 1.131 4.879) 8.229 4.300 ( -0.984 -3.295 -1.186) 3.638 4.346 ( 0.730 1.850 -2.321) 3.057 4.585 ( -11.664 -1.719 -9.249) 14.985 4.822 ( -3.449 -0.359 -17.591) 17.929 5.041 ( 5.095 -2.024 8.054) 9.743 5.206 ( 10.760 -4.177 10.422) 15.552 5.450 ( -0.572 0.136 -1.118) 1.263 5.514 ( -8.256 -0.254 -5.294) 9.810 5.837 ( 14.094 -2.249 8.497) 16.610 6.201 ( -1.796 -0.689 4.349) 4.756 6.412 ( -1.656 0.125 -10.313) 10.445 7.062 ( -12.665 -30.724 -7.321) 34.029 7.237 ( -0.870 -3.391 -0.766) 3.583 7.586 ( -11.414 0.829 -31.004) 33.049 8.675 ( 0.779 -10.762 -1.754) 10.932 8.866 ( 1.678 12.939 -1.276) 13.109 9.641 ( -1.420 2.843 2.214) 3.873 10.146 ( -0.788 2.293 6.082) 6.548 10.454 ( -1.181 2.076 -2.437) 3.412 10.593 ( 1.667 2.874 -10.283) 10.806 10.721 ( 3.202 -4.307 3.517) 6.417 11.029 ( 19.012 8.387 24.085) 31.810 11.464 ( -2.032 -1.587 4.066) 4.815 11.537 ( 1.798 6.688 9.624) 11.857 11.831 ( 4.536 2.769 0.195) 5.318 12.012 ( 0.191 -1.690 -0.046) 1.701 13.294 ( -5.723 -2.712 -9.713) 11.595 13.765 ( -3.123 -0.516 -0.230) 3.173 17.095 ( -31.306 -14.534 -36.774) 50.434 17.817 ( 21.000 0.422 11.448) 23.921 18.930 ( -8.994 -0.161 -8.562) 12.419 19.469 ( -3.065 0.753 0.376) 3.179 19.625 ( 2.432 -11.389 -13.001) 17.454 20.115 ( -7.378 -3.440 -2.903) 8.643 20.157 ( -11.318 -6.279 -6.653) 14.553 20.544 ( -14.614 7.037 5.067) 16.993 21.282 ( -3.653 -2.520 -6.520) 7.887 21.507 ( -0.148 -2.861 1.602) 3.282 22.128 ( 6.576 10.751 -0.580) 12.616 22.985 ( 5.953 0.928 2.211) 6.417 24.268 ( 0.847 6.634 -3.207) 7.417 24.491 ( 0.985 -0.896 2.292) 2.650 24.578 ( 4.245 -0.745 1.702) 4.634 24.760 ( 6.116 -0.687 11.194) 12.774 25.544 ( 1.240 -0.051 -0.855) 1.507 25.980 ( 6.242 2.398 -3.731) 7.657 26.030 ( 1.840 4.765 -3.112) 5.981 27.141 ( -14.324 -10.700 -10.209) 20.589 47.224 ( 0.153 -1.549 13.145) 13.237 47.377 ( -3.279 -0.002 5.658) 6.540 49.249 ( 1.654 0.063 -4.551) 4.842 49.402 ( 3.374 1.897 -4.644) 6.046 98.617 ( 2.440 -0.432 1.730) 3.022 98.838 ( -4.753 -0.000 2.696) 5.464 99.058 ( 3.131 -3.698 -0.388) 4.861 99.499 ( 26.448 -24.898 63.190) 72.886 100.493 ( -6.486 -5.459 -1.326) 8.580 100.757 ( -1.769 -0.261 3.943) 4.330 101.105 ( -0.249 0.260 -1.794) 1.829 102.558 ( 32.340 76.536 -11.275) 83.850 ======================= Grid point 95 (35/230) ======================= q-point: ( 0.11 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.327 ( 13.071 0.000 22.826) 26.304 1.438 ( 1.169 0.000 34.258) 34.278 1.966 ( 32.677 0.000 12.687) 35.054 2.495 ( -7.188 -0.000 -2.795) 7.712 2.709 ( 3.921 0.000 1.257) 4.117 2.775 ( 0.174 0.000 2.992) 2.997 2.920 ( -6.549 -0.000 7.997) 10.336 3.246 ( -1.954 -0.000 4.368) 4.786 3.254 ( -5.287 -0.000 1.524) 5.503 3.404 ( 2.324 0.000 3.369) 4.093 3.827 ( 2.613 0.000 7.044) 7.513 3.867 ( 6.421 0.000 -0.453) 6.437 4.070 ( -1.620 -0.000 -8.833) 8.980 4.124 ( 0.132 0.000 -6.229) 6.231 4.522 ( -5.552 -0.000 -3.770) 6.711 4.947 ( -1.386 -0.000 6.672) 6.815 5.104 ( 10.347 0.000 -4.190) 11.163 5.209 ( -6.758 -0.000 -3.943) 7.824 5.337 ( 7.166 0.000 -2.867) 7.719 5.742 ( 3.817 0.000 7.785) 8.671 5.895 ( -4.722 -0.000 -4.238) 6.345 5.908 ( 6.424 0.000 2.581) 6.923 6.668 ( 4.802 0.000 1.693) 5.092 7.041 ( -1.721 -0.000 -4.820) 5.118 7.046 ( 10.766 0.000 -21.912) 24.414 7.327 ( 5.006 0.000 -4.106) 6.474 8.708 ( -1.220 -0.000 -0.892) 1.511 8.852 ( 1.719 0.000 0.869) 1.926 9.959 ( 5.711 0.000 11.029) 12.420 10.127 ( -2.375 -0.000 -11.278) 11.525 10.239 ( -0.365 -0.000 4.612) 4.626 10.524 ( 4.378 0.000 -0.199) 4.382 10.893 ( 0.421 0.000 -4.315) 4.336 11.249 ( -9.743 -0.000 -4.805) 10.863 11.410 ( -11.997 -0.000 8.971) 14.980 11.448 ( -5.926 -0.000 11.771) 13.179 11.718 ( -4.697 -0.000 -1.690) 4.992 11.733 ( -4.871 -0.000 -2.144) 5.322 13.750 ( 3.895 0.000 -4.303) 5.804 13.756 ( 9.174 0.000 0.859) 9.214 16.703 ( -25.898 -0.000 -11.357) 28.279 17.994 ( 26.006 0.000 0.359) 26.008 19.301 ( -0.545 -0.000 1.628) 1.717 19.432 ( 3.085 0.000 -8.370) 8.920 19.709 ( 3.296 0.000 7.235) 7.951 19.811 ( 1.794 0.000 -8.557) 8.743 20.508 ( 15.936 0.000 -3.407) 16.296 20.551 ( 10.053 0.000 5.204) 11.320 21.267 ( 6.616 0.000 -7.689) 10.143 21.549 ( 6.101 0.000 -0.668) 6.138 22.078 ( -7.854 -0.000 7.555) 10.898 22.828 ( -11.213 -0.000 1.105) 11.267 24.244 ( 2.224 0.000 -1.077) 2.471 24.495 ( -1.443 -0.000 -5.062) 5.263 24.593 ( -1.672 -0.000 4.857) 5.137 25.328 ( -9.584 -0.000 8.467) 12.788 25.421 ( -1.828 -0.000 -2.802) 3.345 25.863 ( -6.443 -0.000 -2.763) 7.011 26.259 ( 1.647 0.000 8.684) 8.839 26.386 ( 13.855 0.000 -16.083) 21.228 47.205 ( -5.260 -0.000 6.228) 8.152 47.405 ( -3.702 -0.000 7.826) 8.657 49.171 ( 1.824 0.000 -5.760) 6.042 49.473 ( 2.606 0.000 -2.944) 3.932 98.631 ( -3.935 -0.000 0.896) 4.036 98.851 ( 1.811 0.000 4.438) 4.793 98.920 ( -5.713 -0.000 0.181) 5.716 99.443 ( -14.065 -0.000 9.782) 17.132 100.583 ( -0.378 -0.000 -0.605) 0.713 100.929 ( -5.429 -0.000 11.689) 12.888 101.253 ( 6.477 0.000 1.209) 6.589 102.012 ( -6.994 -0.000 -4.564) 8.351 ======================= Grid point 96 (36/230) ======================= q-point: ( 0.22 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.656 ( 8.497 7.584 23.353) 25.982 1.810 ( 4.445 -12.826 21.770) 25.655 2.317 ( -9.119 2.993 -1.593) 9.729 2.545 ( 21.758 1.017 6.721) 22.795 2.673 ( -0.727 1.713 -5.043) 5.375 2.768 ( -2.744 -1.385 2.489) 3.956 2.936 ( -0.767 2.069 9.317) 9.575 3.152 ( -6.101 7.108 3.643) 10.051 3.238 ( -4.656 -4.743 0.753) 6.689 3.489 ( 3.319 -0.377 1.758) 3.775 3.908 ( 0.439 -2.005 1.596) 2.600 3.956 ( 2.657 -2.078 5.652) 6.582 4.075 ( 3.130 0.588 -1.563) 3.547 4.098 ( 5.022 -2.122 -4.909) 7.337 4.350 ( -9.896 -0.027 -1.517) 10.012 5.006 ( -3.281 2.590 -6.708) 7.904 5.074 ( 2.970 -1.370 4.904) 5.895 5.134 ( 2.515 -1.545 -11.562) 11.933 5.554 ( 12.406 0.024 5.574) 13.601 5.740 ( -1.951 8.224 1.203) 8.537 5.861 ( -3.096 -7.598 -0.167) 8.206 6.004 ( 2.803 -1.517 0.100) 3.189 6.746 ( 3.045 0.575 0.755) 3.190 6.905 ( 0.599 11.163 -12.984) 17.134 7.017 ( 1.066 -4.120 -9.698) 10.591 7.386 ( 5.009 -2.190 -5.521) 7.770 8.662 ( -1.786 0.911 -2.352) 3.091 8.910 ( 2.566 -1.631 1.663) 3.465 10.022 ( -0.585 -0.719 -6.607) 6.671 10.156 ( 5.584 -0.325 9.710) 11.206 10.277 ( -0.258 -0.683 4.599) 4.657 10.598 ( 4.736 1.127 -0.098) 4.869 10.837 ( -1.367 -0.811 -7.201) 7.375 11.058 ( -6.660 1.052 -4.576) 8.148 11.313 ( -6.629 1.897 7.098) 9.895 11.450 ( -6.336 -0.487 11.343) 13.002 11.636 ( -3.462 0.768 -0.380) 3.567 11.654 ( -3.470 -1.444 0.349) 3.775 13.772 ( 3.416 -0.385 -6.031) 6.942 13.883 ( 5.264 0.728 0.765) 5.369 16.273 ( -15.111 -0.041 -6.206) 16.335 18.346 ( 13.730 1.695 3.003) 14.156 19.291 ( -1.360 -0.381 0.198) 1.426 19.373 ( -3.570 0.422 -2.349) 4.295 19.778 ( 4.906 0.572 -9.891) 11.055 19.787 ( 0.048 -0.386 4.355) 4.373 20.626 ( 3.733 0.070 -0.049) 3.734 20.880 ( 21.425 -0.198 -1.647) 21.489 21.303 ( 4.623 -0.837 -7.352) 8.725 21.702 ( 13.312 0.733 -1.421) 13.408 21.990 ( -11.318 -0.190 9.244) 14.615 22.621 ( -14.530 0.059 2.030) 14.671 24.280 ( 2.913 0.231 -0.866) 3.048 24.416 ( -2.451 0.379 -4.559) 5.190 24.590 ( -2.971 -0.077 3.190) 4.359 25.289 ( -0.094 0.678 2.286) 2.386 25.387 ( -1.393 -2.465 -1.903) 3.412 25.722 ( -7.292 -0.034 -2.654) 7.760 26.318 ( 2.734 8.775 5.331) 10.625 26.493 ( 6.537 -7.728 -6.201) 11.870 47.176 ( -4.265 0.233 5.986) 7.354 47.408 ( -3.657 -0.095 7.463) 8.311 49.161 ( 2.283 -0.085 -4.908) 5.413 49.485 ( 2.170 -0.046 -3.788) 4.366 98.577 ( -2.679 -0.395 -0.687) 2.794 98.842 ( -3.903 0.856 2.056) 4.494 98.911 ( 0.132 0.205 5.768) 5.773 99.326 ( -6.576 0.003 2.371) 6.991 100.575 ( -0.182 0.224 0.129) 0.316 100.929 ( -4.600 1.161 9.437) 10.563 101.387 ( 7.203 -0.891 0.341) 7.266 101.895 ( -4.783 -4.426 -2.643) 7.033 ======================= Grid point 97 (37/230) ======================= q-point: ( 0.33 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.905 ( -3.231 3.106 2.817) 5.294 1.960 ( 2.174 3.514 15.797) 16.329 2.249 ( 1.075 -2.258 7.544) 7.948 2.567 ( -0.285 5.313 -2.149) 5.738 2.706 ( -2.875 -0.837 -2.177) 3.702 2.864 ( -1.084 1.301 6.658) 6.870 2.951 ( -3.687 3.150 10.422) 11.495 3.032 ( -7.064 3.389 2.110) 8.114 3.270 ( 10.278 -3.073 -0.808) 10.758 3.507 ( -3.028 -2.195 0.396) 3.761 3.961 ( 4.720 4.769 -6.437) 9.298 4.006 ( 1.329 -2.691 -1.275) 3.261 4.078 ( 0.515 1.902 -1.889) 2.730 4.212 ( -1.695 -1.840 5.588) 6.123 4.254 ( 0.694 -3.152 8.851) 9.421 4.843 ( -4.482 -4.458 -11.926) 13.497 5.045 ( 1.781 -0.225 -14.302) 14.414 5.263 ( 4.226 -0.253 13.030) 13.701 5.657 ( -2.580 5.058 1.579) 5.894 5.780 ( 9.219 1.228 1.767) 9.467 5.816 ( -6.438 -4.256 -1.898) 7.948 6.029 ( -1.553 -5.435 -1.965) 5.984 6.710 ( 0.333 7.852 -13.442) 15.571 6.777 ( -0.089 1.459 0.600) 1.580 6.993 ( -0.161 -5.222 -5.686) 7.722 7.433 ( 4.765 -1.469 -5.470) 7.401 8.592 ( -3.349 -1.679 -4.544) 5.890 8.985 ( 3.882 1.075 2.189) 4.584 9.998 ( 0.495 -2.381 -2.170) 3.259 10.266 ( 0.267 0.708 2.176) 2.304 10.344 ( 3.207 3.583 8.393) 9.673 10.661 ( 3.946 2.560 0.255) 4.710 10.750 ( -1.660 -1.976 -7.648) 8.072 10.944 ( -0.563 0.383 -6.611) 6.646 11.282 ( -3.540 2.098 9.657) 10.497 11.429 ( -4.686 0.866 6.584) 8.128 11.599 ( -1.553 -0.093 2.542) 2.980 11.644 ( -1.337 -1.550 4.006) 4.498 13.758 ( 1.123 -1.218 -8.066) 8.234 13.938 ( 1.305 0.606 0.334) 1.477 16.109 ( -1.026 0.063 0.665) 1.224 18.441 ( -2.267 -0.092 -3.875) 4.490 19.270 ( -1.129 -0.624 -1.093) 1.691 19.292 ( -3.063 -0.164 -1.447) 3.391 19.805 ( -1.582 0.393 4.069) 4.383 19.830 ( 8.271 0.328 -3.541) 9.003 20.636 ( 0.130 0.754 -4.835) 4.895 21.220 ( 18.317 0.613 1.190) 18.366 21.313 ( 3.183 -1.849 -7.132) 8.026 21.845 ( -14.946 0.135 8.693) 17.291 21.951 ( 17.080 1.275 -0.735) 17.144 22.379 ( -15.334 0.469 2.296) 15.512 24.315 ( 1.912 1.094 -1.650) 2.752 24.351 ( -0.428 -0.820 -2.411) 2.582 24.550 ( -3.454 0.036 0.643) 3.514 25.317 ( 1.125 -1.727 -3.936) 4.443 25.381 ( 1.449 -1.875 -1.567) 2.841 25.592 ( -5.213 0.647 0.093) 5.253 26.329 ( 3.118 10.123 2.144) 10.807 26.613 ( 2.868 -7.807 2.275) 8.623 47.159 ( -3.513 0.271 5.970) 6.932 47.409 ( -3.716 -0.143 7.054) 7.974 49.166 ( 2.723 -0.106 -3.910) 4.766 49.482 ( 1.811 0.042 -4.782) 5.113 98.536 ( -1.291 -0.745 -1.733) 2.286 98.812 ( -1.927 0.550 3.614) 4.132 98.948 ( -1.654 0.339 6.399) 6.618 99.243 ( -3.527 -0.402 -2.517) 4.352 100.573 ( -0.467 0.019 0.570) 0.737 100.915 ( -4.591 1.156 7.257) 8.665 101.449 ( -1.046 -2.676 -3.990) 4.917 101.936 ( 9.954 2.032 3.061) 10.610 ======================= Grid point 98 (38/230) ======================= q-point: (-0.56 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.648 ( -12.759 10.292 -1.548) 16.466 2.135 ( -0.569 11.060 2.969) 11.465 2.324 ( 4.834 5.087 6.205) 9.368 2.491 ( 0.603 4.133 -0.210) 4.182 2.634 ( -1.836 0.613 -2.714) 3.334 2.794 ( -11.671 -0.415 0.173) 11.680 2.863 ( -9.605 -5.520 3.776) 11.704 3.048 ( 0.235 0.293 13.706) 13.711 3.464 ( 5.093 1.222 0.788) 5.297 3.472 ( -1.709 -0.540 2.535) 3.104 3.873 ( -2.567 9.418 -8.453) 12.913 3.982 ( 9.608 3.488 -6.235) 11.973 4.164 ( -2.592 -2.310 6.882) 7.708 4.182 ( 3.226 0.676 -2.255) 3.994 4.436 ( 0.828 -5.437 14.875) 15.859 4.729 ( -3.434 -6.231 -9.461) 11.837 4.965 ( 1.228 -5.522 -13.696) 14.819 5.381 ( -0.496 5.116 6.698) 8.443 5.613 ( -2.655 -0.963 0.435) 2.857 5.672 ( -10.385 -2.084 1.284) 10.669 5.868 ( 0.572 -1.963 -2.360) 3.123 6.015 ( -0.057 -3.721 -3.947) 5.425 6.601 ( 2.129 1.466 -8.586) 8.967 6.770 ( -1.185 -2.764 0.530) 3.053 6.988 ( -0.167 -5.030 -3.747) 6.275 7.479 ( 4.304 -1.997 -4.853) 6.787 8.505 ( -3.990 -4.221 -5.057) 7.701 9.056 ( 4.591 4.648 1.909) 6.806 10.004 ( -1.934 -1.414 0.473) 2.442 10.253 ( 0.587 1.169 -2.441) 2.769 10.404 ( 0.438 6.785 6.257) 9.240 10.660 ( -1.814 -3.076 -4.080) 5.422 10.744 ( 5.287 4.032 -0.243) 6.654 10.917 ( 5.604 1.484 -8.666) 10.426 11.322 ( -1.183 2.382 12.076) 12.366 11.411 ( -2.227 0.503 5.019) 5.514 11.619 ( 1.329 -0.636 1.707) 2.255 11.695 ( 0.022 -1.422 7.633) 7.764 13.685 ( -2.189 -2.468 -10.094) 10.619 13.928 ( -2.167 0.017 0.029) 2.167 16.249 ( 13.134 0.208 7.623) 15.187 18.221 ( -16.051 -3.914 -11.376) 20.059 19.243 ( -0.557 -0.491 -2.321) 2.437 19.269 ( 1.595 -0.891 -2.355) 2.981 19.784 ( -3.709 0.774 3.106) 4.900 19.980 ( 7.892 -0.407 3.274) 8.554 20.546 ( -2.999 1.563 -7.617) 8.334 21.296 ( 1.293 -2.006 -6.523) 6.946 21.484 ( -1.000 1.569 9.322) 9.506 21.668 ( -2.638 -0.126 0.576) 2.704 22.061 ( -13.066 0.857 3.208) 13.481 22.312 ( 15.873 1.872 -0.550) 15.993 24.301 ( 0.030 -0.179 -0.915) 0.933 24.380 ( 3.353 -0.061 -1.169) 3.552 24.493 ( -2.724 -0.398 -1.572) 3.170 25.234 ( -4.749 -0.145 -7.917) 9.233 25.420 ( 1.517 -2.609 -1.203) 3.249 25.594 ( 4.846 0.158 1.432) 5.056 26.315 ( 2.551 10.414 0.797) 10.752 26.740 ( 0.860 -7.533 7.040) 10.347 47.154 ( -2.969 0.300 6.189) 6.871 47.404 ( -3.770 -0.130 6.615) 7.615 49.187 ( 3.045 -0.079 -2.969) 4.253 49.465 ( 1.646 0.168 -5.724) 5.958 98.516 ( 0.120 -1.036 -2.165) 2.403 98.825 ( -0.895 0.314 5.205) 5.290 98.958 ( -3.277 0.411 6.461) 7.256 99.168 ( -1.845 -0.497 -5.205) 5.545 100.566 ( -1.260 -0.339 0.798) 1.529 100.881 ( -4.545 1.254 5.218) 7.033 101.360 ( -5.219 -1.970 -5.089) 7.551 102.223 ( 23.320 10.371 5.357) 26.078 ======================= Grid point 99 (39/230) ======================= q-point: (-0.44 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.338 ( -13.803 12.991 1.861) 19.046 1.801 ( -10.878 26.742 -8.672) 30.144 2.364 ( -20.172 6.627 -3.059) 21.452 2.520 ( 3.568 1.165 10.667) 11.308 2.567 ( 3.853 2.281 -0.328) 4.490 2.655 ( 1.517 -3.611 -2.530) 4.663 2.803 ( -5.356 -2.691 2.215) 6.390 3.185 ( 2.585 1.829 10.715) 11.173 3.441 ( -3.655 3.223 0.425) 4.892 3.448 ( -0.814 6.837 -0.749) 6.926 3.694 ( -3.581 3.267 -4.280) 6.466 4.104 ( -4.661 3.070 3.460) 6.567 4.137 ( 7.795 -0.298 0.240) 7.804 4.315 ( 9.388 -2.479 0.250) 9.713 4.584 ( -0.585 -1.911 11.343) 11.518 4.655 ( -1.896 -7.659 -4.576) 9.121 4.939 ( 1.240 -9.475 -11.597) 15.027 5.268 ( -8.297 4.581 -6.343) 11.404 5.470 ( -7.122 -2.755 -0.925) 7.692 5.677 ( -2.024 -0.750 7.657) 7.956 5.774 ( -8.966 -7.478 -7.993) 14.149 6.059 ( 4.039 -0.057 1.712) 4.387 6.561 ( 0.787 1.019 -6.821) 6.941 6.803 ( -3.579 -13.530 0.633) 14.010 7.009 ( 2.179 -3.312 -0.830) 4.050 7.524 ( 3.346 -3.720 -4.788) 6.925 8.450 ( -2.616 -6.871 -3.455) 8.123 9.097 ( 4.224 8.146 0.906) 9.221 9.935 ( -4.704 4.169 -0.054) 6.285 10.250 ( 1.467 -1.943 -4.026) 4.705 10.390 ( -1.612 4.917 4.906) 7.130 10.607 ( -2.837 -3.367 -4.986) 6.652 10.816 ( 7.741 7.104 0.074) 10.507 10.949 ( 8.306 4.500 -7.574) 12.108 11.391 ( 1.674 1.454 3.999) 4.572 11.441 ( -2.363 1.104 13.893) 14.136 11.682 ( 4.725 0.493 0.831) 4.823 11.790 ( 1.434 -2.574 7.902) 8.433 13.552 ( -5.265 -3.824 -11.260) 13.005 13.873 ( -4.433 -0.916 0.000) 4.526 16.659 ( 24.221 0.370 12.928) 27.458 17.819 ( -22.364 -9.166 -15.009) 28.450 19.210 ( -1.037 -0.517 -3.683) 3.861 19.314 ( 4.853 -2.339 -3.114) 6.223 19.718 ( -5.327 1.526 1.038) 5.637 20.120 ( 2.031 -1.981 5.993) 6.631 20.398 ( -4.509 1.961 -8.105) 9.480 21.206 ( -18.541 1.141 4.222) 19.050 21.311 ( -5.236 -3.070 -2.172) 6.447 21.780 ( -7.945 1.454 1.465) 8.208 21.896 ( 7.493 1.073 1.775) 7.775 22.602 ( 17.597 2.897 0.873) 17.855 24.314 ( 1.386 0.647 1.157) 1.918 24.430 ( 2.497 -0.664 -0.371) 2.610 24.446 ( 0.055 -0.711 -3.443) 3.516 25.061 ( -6.413 0.902 -8.443) 10.640 25.455 ( 2.017 -1.660 -0.929) 2.773 25.725 ( 8.884 -0.495 -0.338) 8.905 26.277 ( 1.606 10.369 -0.266) 10.496 26.867 ( -1.065 -8.343 9.245) 12.498 47.158 ( -2.707 0.380 6.678) 7.216 47.396 ( -3.729 -0.075 6.191) 7.228 49.218 ( 3.095 -0.005 -2.382) 3.906 49.441 ( 1.845 0.338 -6.341) 6.613 98.520 ( 1.407 -1.227 -1.864) 2.638 98.856 ( -0.982 0.410 5.867) 5.962 98.942 ( -4.475 0.473 6.156) 7.625 99.108 ( -0.491 -0.428 -4.163) 4.214 100.546 ( -2.552 -0.970 0.856) 2.861 100.835 ( -3.919 1.470 3.599) 5.520 101.245 ( -4.258 -0.444 -4.205) 6.001 102.631 ( 32.928 21.400 4.322) 39.508 ======================= Grid point 100 (40/230) ======================= q-point: (-0.33 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.016 ( -13.459 16.651 1.166) 21.442 1.336 ( -15.183 25.231 -2.572) 29.559 1.828 ( -26.066 20.525 1.533) 33.212 2.499 ( -3.259 0.754 -4.863) 5.902 2.666 ( -0.389 1.686 6.252) 6.487 2.769 ( 2.860 1.196 1.170) 3.313 2.800 ( 5.511 -1.879 6.964) 9.078 3.188 ( 1.669 10.356 -4.843) 11.553 3.304 ( -4.519 5.480 -3.941) 8.123 3.455 ( 0.495 2.072 9.839) 10.067 3.679 ( 1.274 -3.245 0.542) 3.528 4.020 ( -6.448 3.475 4.752) 8.731 4.215 ( 0.965 -2.829 0.756) 3.083 4.406 ( -0.402 0.739 -2.087) 2.250 4.717 ( 5.822 -5.472 4.777) 9.309 4.726 ( -2.411 -13.055 2.855) 13.579 4.883 ( -2.237 -0.119 -9.956) 10.205 5.058 ( -2.342 -1.928 -6.379) 7.064 5.424 ( -2.549 -4.824 -0.735) 5.505 5.605 ( -7.262 -7.121 -7.965) 12.918 5.696 ( -0.918 1.918 5.499) 5.896 6.141 ( 0.770 -1.399 5.326) 5.561 6.498 ( -0.079 1.375 -6.555) 6.698 6.795 ( -10.730 -18.624 -3.035) 21.707 7.102 ( 3.623 -4.118 2.478) 6.019 7.562 ( 1.788 -6.902 -6.121) 9.397 8.462 ( -0.412 -9.327 -2.068) 9.562 9.094 ( 3.109 10.690 -0.210) 11.135 9.815 ( -3.498 7.747 -0.106) 8.501 10.235 ( -1.405 1.453 -0.012) 2.021 10.395 ( -0.208 -1.952 3.571) 4.076 10.528 ( -3.639 -3.890 -6.284) 8.238 10.885 ( 11.514 9.276 -11.190) 18.543 10.996 ( 5.476 7.255 3.035) 9.584 11.418 ( 0.293 -1.807 -0.616) 1.931 11.540 ( 0.158 5.122 16.993) 17.749 11.780 ( 6.696 1.817 0.662) 6.970 11.903 ( 2.268 -3.207 5.437) 6.708 13.386 ( -6.448 -4.585 -10.304) 12.991 13.802 ( -4.879 -1.801 0.202) 5.205 17.245 ( 29.535 0.571 15.212) 33.227 17.364 ( -25.574 -15.339 -17.461) 34.557 19.130 ( -4.738 -0.396 -6.522) 8.071 19.401 ( 4.735 -5.411 -3.605) 8.043 19.601 ( -6.507 2.164 -0.861) 6.911 20.158 ( -6.229 -3.369 6.085) 9.337 20.244 ( -3.986 1.711 -6.973) 8.212 20.868 ( -22.036 1.017 6.798) 23.083 21.278 ( -0.298 -3.725 -5.388) 6.557 21.584 ( -10.342 0.312 0.659) 10.368 22.104 ( 12.521 3.599 1.490) 13.113 22.853 ( 12.889 3.147 1.815) 13.391 24.353 ( 3.446 3.226 1.472) 4.944 24.425 ( -0.466 -2.150 -0.602) 2.281 24.494 ( 4.345 -0.124 -1.356) 4.554 24.872 ( -6.188 1.624 -7.858) 10.132 25.497 ( 3.007 -1.231 -1.967) 3.799 25.877 ( 9.066 0.499 -0.505) 9.094 26.217 ( 0.844 9.763 -1.393) 9.898 26.971 ( -4.178 -10.758 7.866) 13.967 47.170 ( -2.753 0.396 7.826) 8.306 47.386 ( -3.517 0.020 5.859) 6.833 49.246 ( 2.595 0.075 -2.769) 3.796 49.421 ( 2.766 0.616 -6.119) 6.743 98.550 ( 2.366 -1.260 -0.755) 2.785 98.874 ( -2.316 -0.231 4.249) 4.845 98.914 ( -4.002 0.083 6.414) 7.561 99.107 ( 0.498 -0.135 4.743) 4.770 100.506 ( -4.087 -1.691 0.838) 4.502 100.793 ( -2.751 1.596 2.679) 4.158 101.158 ( -2.327 0.444 -2.978) 3.805 103.092 ( 44.450 35.836 -1.044) 57.106 ======================= Grid point 101 (41/230) ======================= q-point: (-0.22 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.675 ( -8.070 23.229 -0.004) 24.591 0.848 ( -26.497 14.181 4.662) 30.413 1.358 ( -13.041 35.873 21.844) 43.979 2.394 ( -2.610 3.460 -1.136) 4.481 2.652 ( -3.029 -0.359 2.413) 3.889 2.768 ( -1.919 3.624 1.472) 4.357 3.000 ( 7.531 1.390 6.664) 10.152 3.131 ( 4.097 6.670 -2.105) 8.106 3.223 ( 0.796 1.665 -1.258) 2.234 3.503 ( -2.349 2.572 8.023) 8.747 3.689 ( -5.651 -2.929 -1.117) 6.462 3.923 ( -6.608 2.673 3.759) 8.059 4.242 ( -0.921 -4.386 -1.875) 4.858 4.355 ( -2.327 -0.921 -1.502) 2.919 4.555 ( -11.597 -2.230 -5.185) 12.898 4.764 ( -3.140 -8.202 -12.716) 15.454 4.996 ( 7.065 -3.475 8.871) 11.861 5.146 ( 9.441 -2.572 5.157) 11.061 5.408 ( -2.391 -6.778 -2.511) 7.613 5.505 ( -3.999 -1.539 -4.800) 6.435 5.796 ( 9.777 -2.265 6.654) 12.041 6.183 ( -1.917 -1.580 4.424) 5.073 6.404 ( -7.792 -2.258 -9.310) 12.349 6.640 ( -19.588 -18.463 -2.889) 27.072 7.189 ( 1.105 -3.787 0.182) 3.949 7.543 ( -1.650 -5.832 -13.085) 14.421 8.520 ( 0.659 -10.621 -2.800) 11.004 9.046 ( 1.676 11.870 -1.119) 12.040 9.721 ( -1.345 7.533 1.451) 7.788 10.208 ( -1.171 5.243 5.712) 7.842 10.438 ( -2.949 -3.582 -4.739) 6.632 10.507 ( 3.589 -8.812 7.496) 12.113 10.826 ( 5.932 11.737 -19.434) 23.465 11.127 ( 9.583 4.330 8.471) 13.504 11.428 ( -0.334 -3.126 -0.720) 3.225 11.650 ( 1.620 6.555 15.415) 16.829 11.887 ( 6.938 2.749 1.452) 7.603 11.983 ( 2.061 -0.713 0.368) 2.212 13.244 ( -5.145 -3.401 -5.946) 8.567 13.749 ( -3.053 -1.768 0.537) 3.569 16.852 ( -29.643 -14.542 -17.733) 37.479 17.828 ( 21.490 0.978 11.466) 24.378 18.926 ( -9.108 -0.366 -8.747) 12.633 19.451 ( -2.260 -7.693 -4.252) 9.076 19.494 ( -3.066 1.321 -0.338) 3.356 20.059 ( -11.725 -1.261 5.009) 12.812 20.147 ( 0.311 0.950 -5.940) 6.023 20.600 ( -15.370 0.999 6.051) 16.549 21.245 ( -0.176 -2.278 -6.396) 6.792 21.476 ( -3.386 -1.328 0.970) 3.764 22.257 ( 8.773 5.366 -2.831) 10.666 23.011 ( 6.019 2.556 1.704) 6.758 24.369 ( 2.533 4.963 -6.135) 8.288 24.470 ( 1.930 -1.425 3.279) 4.063 24.564 ( 3.398 -0.786 0.743) 3.566 24.755 ( 1.195 0.309 4.342) 4.514 25.541 ( 4.442 -0.391 -3.646) 5.760 26.007 ( 6.832 1.739 0.803) 7.095 26.145 ( 1.061 8.896 -2.912) 9.420 26.955 ( -13.662 -12.005 -2.861) 18.410 47.202 ( -2.543 -1.010 10.636) 10.982 47.378 ( -3.033 0.218 5.840) 6.584 49.251 ( 1.719 0.134 -4.482) 4.803 49.427 ( 4.112 1.029 -5.255) 6.751 98.605 ( 2.807 -1.114 1.278) 3.279 98.838 ( -4.819 0.102 3.091) 5.726 98.964 ( 0.485 -6.820 4.646) 8.266 99.258 ( 1.419 -6.869 29.118) 29.951 100.450 ( -4.512 -1.198 1.363) 4.863 100.767 ( -1.697 1.325 2.731) 3.478 101.112 ( -0.275 0.647 -1.641) 1.785 103.577 ( 57.985 49.524 -25.067) 80.270 ======================= Grid point 102 (42/230) ======================= q-point: (-0.11 0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.543 ( 6.429 11.839 18.254) 22.687 0.612 ( 5.922 12.858 21.118) 25.424 1.227 ( -4.418 31.529 36.321) 48.299 2.388 ( 3.388 2.769 4.893) 6.564 2.628 ( -1.548 -1.300 -0.437) 2.068 2.722 ( -1.535 1.894 1.964) 3.131 3.072 ( -8.733 1.772 5.659) 10.556 3.118 ( 2.828 1.894 -0.463) 3.435 3.284 ( 5.239 -0.968 0.794) 5.386 3.465 ( -7.383 4.048 3.480) 9.111 3.578 ( 3.710 4.337 7.538) 9.455 3.833 ( -4.521 0.629 0.870) 4.646 4.210 ( -1.188 -2.724 -4.280) 5.211 4.339 ( 1.366 -0.744 -3.598) 3.920 4.528 ( 6.032 -1.244 6.915) 9.260 4.593 ( -2.265 -0.863 -15.065) 15.258 5.252 ( 5.150 -3.449 12.204) 13.687 5.293 ( -0.215 3.153 -4.075) 5.157 5.397 ( -1.443 -2.088 -4.329) 5.018 5.462 ( 2.965 -7.893 7.489) 11.277 5.833 ( -33.530 -0.101 -3.338) 33.696 6.119 ( 0.775 1.002 -2.724) 3.004 6.319 ( 21.939 -12.196 3.019) 25.282 6.550 ( -0.743 -8.661 0.497) 8.707 7.180 ( -2.652 -2.730 -4.404) 5.821 7.398 ( 3.107 9.015 -12.928) 16.064 8.594 ( 0.827 -11.077 -0.480) 11.118 8.962 ( 0.360 12.078 -1.649) 12.196 9.702 ( 1.150 4.180 5.378) 6.908 10.205 ( -0.692 3.774 4.159) 5.658 10.391 ( -0.802 -3.350 -4.598) 5.745 10.586 ( 0.530 14.004 -14.529) 20.186 10.781 ( 3.494 -8.118 7.819) 11.800 11.350 ( 0.870 -10.427 6.511) 12.324 11.446 ( 1.343 -3.701 -2.968) 4.931 11.742 ( -3.665 -2.200 8.630) 9.631 11.934 ( -3.491 -4.141 -3.407) 6.399 12.017 ( -1.118 6.258 -1.029) 6.440 13.256 ( 12.084 -1.827 2.681) 12.512 13.731 ( -0.361 -0.175 -0.791) 0.887 16.629 ( 23.531 -2.873 3.720) 23.996 17.866 ( -19.307 1.032 -7.903) 20.887 18.954 ( 15.551 -0.457 4.804) 16.283 19.358 ( -4.608 -0.604 -2.522) 5.288 19.470 ( 0.668 1.538 2.214) 2.777 19.934 ( -5.969 1.039 2.670) 6.621 20.138 ( 5.822 2.023 -5.622) 8.342 20.438 ( -7.491 3.012 6.713) 10.500 21.215 ( 3.094 -0.072 -7.480) 8.095 21.477 ( -1.069 -3.617 1.048) 3.914 22.235 ( -0.791 8.572 -3.803) 9.411 23.043 ( -1.106 1.836 0.667) 2.245 24.278 ( -0.449 5.509 -5.189) 7.581 24.511 ( -0.372 -2.428 1.999) 3.167 24.585 ( 1.101 0.948 -1.287) 1.941 25.135 ( 12.678 -22.227 14.998) 29.660 25.614 ( 10.264 0.498 -5.536) 11.673 26.044 ( -0.838 3.483 -2.838) 4.571 26.111 ( 1.220 4.499 1.816) 5.003 26.517 ( -23.896 12.830 -11.478) 29.451 47.266 ( -4.571 -4.651 8.811) 10.962 47.387 ( -2.467 -0.250 7.412) 7.816 49.229 ( 1.323 0.282 -6.056) 6.205 49.438 ( 3.121 1.711 -4.443) 5.693 98.676 ( 1.768 -0.413 4.049) 4.437 98.780 ( -3.653 -0.066 0.926) 3.769 99.031 ( -0.682 -6.391 -1.526) 6.606 99.734 ( -16.172 -42.462 34.996) 57.352 100.464 ( 4.450 -4.015 6.105) 8.555 100.777 ( -0.737 -1.538 6.888) 7.096 101.113 ( 1.861 0.406 -0.225) 1.918 103.352 ( -2.789 71.752 -62.120) 94.948 ======================= Grid point 105 (43/230) ======================= q-point: ( 0.22 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.931 ( -2.124 -0.000 2.293) 3.126 1.986 ( 4.169 0.000 20.857) 21.270 2.229 ( -0.098 -0.000 7.158) 7.158 2.614 ( 1.537 0.000 -4.070) 4.350 2.684 ( -2.787 -0.000 1.172) 3.023 2.873 ( -0.153 -0.000 7.440) 7.442 3.000 ( -6.717 -0.000 10.330) 12.322 3.058 ( -13.055 -0.000 0.219) 13.057 3.244 ( 15.072 0.000 -0.420) 15.078 3.483 ( -3.911 -0.000 0.524) 3.946 3.953 ( 3.645 0.000 4.386) 5.703 4.007 ( 2.458 0.000 -5.579) 6.097 4.150 ( 2.507 0.000 -8.253) 8.626 4.150 ( 2.615 0.000 11.149) 11.452 4.242 ( -1.159 -0.000 3.946) 4.113 4.804 ( -5.940 -0.000 -14.282) 15.468 5.047 ( 1.527 0.000 -14.713) 14.792 5.261 ( 5.153 0.000 13.881) 14.807 5.733 ( -4.375 -0.000 1.415) 4.598 5.746 ( -5.189 -0.000 -2.610) 5.809 5.791 ( 10.014 0.000 3.367) 10.564 5.982 ( -3.185 -0.000 -2.686) 4.166 6.764 ( 0.595 0.000 -8.554) 8.575 6.822 ( -2.875 -0.000 -8.743) 9.204 6.928 ( -0.262 -0.000 -3.392) 3.402 7.422 ( 5.228 0.000 -5.752) 7.772 8.579 ( -3.757 -0.000 -5.413) 6.590 8.993 ( 4.753 0.000 3.020) 5.632 9.979 ( 0.643 0.000 -2.583) 2.662 10.271 ( 0.132 0.000 3.374) 3.376 10.373 ( 3.773 0.000 11.239) 11.856 10.679 ( 3.174 0.000 -1.377) 3.460 10.735 ( -0.495 -0.000 -8.032) 8.047 10.947 ( -0.761 -0.000 -6.507) 6.551 11.300 ( -4.070 -0.000 10.251) 11.029 11.435 ( -4.908 -0.000 7.381) 8.864 11.600 ( -1.873 -0.000 1.336) 2.301 11.629 ( -0.800 -0.000 4.381) 4.454 13.749 ( 0.994 0.000 -8.284) 8.344 13.943 ( 1.145 0.000 0.082) 1.148 16.110 ( -1.002 -0.000 0.710) 1.228 18.440 ( -3.341 -0.000 -4.391) 5.517 19.265 ( -0.945 -0.000 -1.196) 1.524 19.290 ( -3.191 -0.000 -1.674) 3.604 19.808 ( -2.288 -0.000 4.857) 5.369 19.833 ( 8.928 0.000 -4.338) 9.927 20.641 ( 0.178 0.000 -4.435) 4.439 21.225 ( 19.058 0.000 1.536) 19.119 21.298 ( 2.827 0.000 -7.612) 8.120 21.846 ( -15.015 -0.000 8.826) 17.417 21.961 ( 17.030 0.000 -0.460) 17.037 22.383 ( -15.376 -0.000 2.558) 15.587 24.329 ( 3.353 0.000 -0.812) 3.450 24.340 ( -2.103 -0.000 -3.411) 4.007 24.550 ( -3.573 -0.000 0.681) 3.638 25.304 ( 1.743 0.000 -4.213) 4.559 25.367 ( 1.294 0.000 -1.723) 2.154 25.596 ( -5.004 -0.000 0.069) 5.004 26.454 ( -1.758 -0.000 13.818) 13.929 26.505 ( 7.505 0.000 -8.923) 11.660 47.161 ( -3.579 -0.000 6.020) 7.004 47.408 ( -3.681 -0.000 7.024) 7.931 49.166 ( 2.754 0.000 -3.934) 4.802 49.482 ( 1.831 0.000 -4.742) 5.083 98.531 ( -1.166 -0.000 -1.980) 2.298 98.817 ( -2.168 -0.000 3.570) 4.176 98.951 ( -1.712 -0.000 6.468) 6.691 99.240 ( -3.552 -0.000 -2.549) 4.372 100.573 ( -0.590 -0.000 0.566) 0.818 100.924 ( -4.868 -0.000 7.412) 8.868 101.426 ( -1.141 -0.000 -3.718) 3.890 101.952 ( 12.545 0.000 4.290) 13.258 ======================= Grid point 106 (44/230) ======================= q-point: (-0.67 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.760 ( -11.147 4.361 -2.636) 12.257 2.215 ( 6.521 2.046 11.389) 13.282 2.364 ( 6.045 0.464 3.794) 7.152 2.602 ( -4.220 6.695 -4.294) 9.004 2.640 ( 0.693 0.629 -1.184) 1.509 2.782 ( -16.160 -0.666 1.672) 16.259 2.801 ( -8.890 -2.787 5.392) 10.765 3.051 ( -2.033 0.153 16.363) 16.489 3.436 ( -2.604 -1.564 2.697) 4.062 3.492 ( 9.123 0.694 1.748) 9.315 3.991 ( -0.904 5.140 -2.936) 5.989 4.025 ( 6.571 0.951 -5.414) 8.567 4.134 ( 0.861 0.762 5.244) 5.368 4.222 ( 1.243 4.224 -1.822) 4.766 4.335 ( 3.060 -8.215 3.924) 9.605 4.632 ( -3.448 -4.530 -7.870) 9.713 4.936 ( 0.191 -0.180 -13.918) 13.920 5.443 ( 1.535 2.681 12.421) 12.800 5.605 ( -5.279 -0.069 -3.162) 6.154 5.641 ( -9.379 -1.791 -1.261) 9.631 5.849 ( -6.644 -0.555 -4.654) 8.130 5.956 ( 5.083 -3.027 -0.478) 5.935 6.625 ( -0.826 1.389 -11.357) 11.471 6.759 ( -2.887 0.329 -0.565) 2.960 6.924 ( 1.024 -2.958 -2.571) 4.051 7.455 ( 4.054 -0.970 -5.938) 7.255 8.462 ( -4.338 -1.566 -6.016) 7.580 9.104 ( 5.719 1.824 2.913) 6.673 9.981 ( -0.543 -1.166 0.365) 1.337 10.273 ( -1.386 1.040 1.244) 2.133 10.494 ( 0.890 4.883 7.536) 9.023 10.603 ( -2.414 -3.864 -7.571) 8.837 10.790 ( 6.362 1.759 0.199) 6.604 10.931 ( 6.806 0.524 -8.805) 11.141 11.354 ( -1.629 1.500 14.853) 15.017 11.413 ( -3.093 -0.051 4.030) 5.080 11.613 ( 1.892 -0.221 1.600) 2.488 11.676 ( -0.402 -0.841 7.430) 7.489 13.660 ( -2.568 -0.960 -10.397) 10.752 13.929 ( -2.452 0.009 -0.375) 2.480 16.251 ( 13.183 0.081 7.662) 15.248 18.180 ( -17.994 -1.527 -11.940) 21.649 19.238 ( -0.443 -0.130 -2.508) 2.550 19.259 ( 1.448 -0.391 -2.719) 3.105 19.792 ( -3.550 0.289 3.362) 4.898 19.978 ( 7.412 -0.018 3.147) 8.053 20.563 ( -3.065 0.651 -6.956) 7.630 21.274 ( 1.875 -0.822 -7.769) 8.034 21.500 ( -1.853 0.583 10.578) 10.755 21.666 ( -1.734 -0.036 0.290) 1.759 22.069 ( -13.943 0.254 3.300) 14.330 22.332 ( 16.385 0.767 0.048) 16.403 24.299 ( -0.092 -0.019 -1.062) 1.066 24.379 ( 3.319 -0.059 -0.886) 3.436 24.488 ( -2.996 -0.168 -1.660) 3.429 25.233 ( -3.647 -0.016 -8.405) 9.162 25.392 ( 2.604 -1.080 -1.641) 3.262 25.597 ( 4.059 0.199 1.808) 4.448 26.468 ( 0.714 10.308 5.071) 11.510 26.617 ( 1.990 -9.264 3.110) 9.973 47.157 ( -3.036 0.124 6.324) 7.016 47.403 ( -3.690 -0.049 6.546) 7.514 49.186 ( 3.106 -0.035 -3.020) 4.333 49.467 ( 1.667 0.057 -5.669) 5.909 98.505 ( 0.353 -0.395 -2.655) 2.707 98.828 ( -0.982 0.139 5.243) 5.336 98.963 ( -3.396 0.161 6.663) 7.481 99.162 ( -1.703 -0.204 -5.335) 5.604 100.562 ( -1.503 -0.119 0.874) 1.743 100.895 ( -4.658 0.533 5.400) 7.151 101.338 ( -4.408 -0.871 -4.158) 6.122 102.329 ( 26.682 3.873 6.302) 27.688 ======================= Grid point 107 (45/230) ======================= q-point: (-0.56 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.503 ( -11.828 8.723 -0.060) 14.697 2.115 ( -14.089 16.195 -8.098) 22.943 2.420 ( -6.107 -0.610 -2.840) 6.762 2.527 ( -3.145 -0.020 5.291) 6.155 2.582 ( 4.079 -3.191 2.464) 5.735 2.665 ( 1.039 7.748 4.111) 8.833 2.781 ( -1.276 0.201 2.741) 3.030 3.191 ( 0.780 -0.899 18.020) 18.059 3.458 ( -0.529 0.700 4.157) 4.249 3.537 ( -1.277 3.327 0.610) 3.615 3.803 ( -5.497 11.676 -8.139) 15.258 4.121 ( 3.997 -3.125 -0.717) 5.124 4.145 ( -4.707 2.117 5.918) 7.852 4.282 ( 11.618 -0.992 -4.155) 12.378 4.454 ( 0.523 -13.532 -3.458) 13.977 4.599 ( -3.098 -0.800 4.898) 5.851 4.857 ( 3.473 -2.234 -10.682) 11.453 5.344 ( -11.228 5.374 -6.802) 14.186 5.425 ( -7.548 -2.937 -3.802) 8.947 5.642 ( -5.448 -6.415 0.932) 8.467 5.681 ( -6.486 -1.736 2.762) 7.260 6.050 ( 4.744 -1.235 -0.390) 4.918 6.553 ( -0.918 -1.886 -5.056) 5.474 6.694 ( -4.253 -2.087 -1.652) 5.018 6.962 ( 2.893 -2.822 -0.926) 4.146 7.470 ( 2.085 -3.080 -6.264) 7.285 8.370 ( -3.209 -3.883 -4.353) 6.657 9.196 ( 5.323 5.062 1.779) 7.558 9.968 ( -2.710 0.431 2.324) 3.596 10.240 ( -0.707 1.083 -2.327) 2.663 10.447 ( -2.872 1.118 -2.946) 4.264 10.571 ( -2.547 -0.466 0.897) 2.740 10.895 ( 7.955 3.526 0.098) 8.702 11.000 ( 10.901 2.501 -9.805) 14.874 11.395 ( -1.369 -0.625 1.412) 2.064 11.478 ( -0.031 3.317 19.519) 19.799 11.689 ( 5.561 0.481 1.151) 5.699 11.750 ( 0.152 -2.669 7.533) 7.993 13.505 ( -5.759 -2.343 -11.223) 12.830 13.862 ( -4.910 -0.598 -0.486) 4.971 16.664 ( 24.351 0.240 12.893) 27.555 17.711 ( -25.240 -5.342 -15.122) 29.904 19.204 ( -0.784 -0.249 -3.946) 4.031 19.288 ( 4.094 -1.242 -3.555) 5.563 19.737 ( -5.040 0.929 1.394) 5.311 20.103 ( 1.860 -0.490 5.986) 6.287 20.423 ( -4.816 1.336 -7.559) 9.062 21.221 ( -13.754 0.948 1.098) 13.831 21.269 ( -10.291 -2.517 -0.234) 10.597 21.805 ( -11.903 1.697 1.936) 12.179 21.900 ( 11.598 -0.386 1.831) 11.748 22.638 ( 17.743 1.912 1.272) 17.891 24.320 ( 2.211 0.270 1.579) 2.730 24.419 ( -0.739 -0.735 0.641) 1.224 24.442 ( 2.537 -0.084 -4.195) 4.904 25.072 ( -5.930 0.543 -8.432) 10.323 25.434 ( 3.274 -1.076 -2.132) 4.052 25.725 ( 9.091 0.212 0.485) 9.107 26.431 ( -0.302 10.639 3.232) 11.123 26.736 ( -0.550 -9.610 5.345) 11.010 47.163 ( -2.743 0.258 6.860) 7.393 47.395 ( -3.599 -0.028 6.100) 7.082 49.217 ( 3.175 -0.024 -2.449) 4.010 49.444 ( 1.842 0.140 -6.287) 6.553 98.505 ( 1.719 -0.768 -2.502) 3.131 98.862 ( -0.849 0.288 5.761) 5.830 98.948 ( -4.666 0.272 6.450) 7.966 99.102 ( -0.221 -0.259 -4.405) 4.418 100.536 ( -2.853 -0.429 1.012) 3.057 100.855 ( -3.846 1.028 3.723) 5.450 101.239 ( -3.695 -0.341 -3.418) 5.045 102.873 ( 37.557 11.479 4.970) 39.586 ======================= Grid point 108 (46/230) ======================= q-point: (-0.44 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.235 ( -11.347 12.907 1.954) 17.296 1.606 ( -24.975 13.140 -4.333) 28.551 2.170 ( -6.109 21.277 -2.616) 22.290 2.499 ( -4.803 0.857 -1.002) 4.981 2.662 ( -1.884 -1.631 3.479) 4.279 2.765 ( 7.448 -0.502 1.825) 7.684 2.837 ( 6.670 5.699 8.158) 11.980 3.330 ( -0.323 7.647 9.679) 12.340 3.413 ( -2.314 9.781 -5.489) 11.452 3.468 ( -0.631 -0.665 1.798) 2.018 3.659 ( -0.832 0.849 2.566) 2.828 4.074 ( -7.036 3.532 5.821) 9.791 4.173 ( 0.023 -3.318 0.558) 3.365 4.396 ( -0.738 -1.972 -3.188) 3.821 4.481 ( -3.882 -17.042 -5.099) 18.207 4.669 ( 4.106 -3.093 7.802) 9.344 4.884 ( 3.894 0.360 -10.430) 11.139 5.061 ( -5.486 2.194 -4.050) 7.163 5.337 ( -4.792 -6.341 -4.762) 9.266 5.481 ( -7.013 -9.454 -7.038) 13.715 5.724 ( -1.860 1.701 9.170) 9.510 6.126 ( 2.075 -1.162 1.883) 3.034 6.493 ( -4.641 -3.306 -3.719) 6.804 6.616 ( -5.861 -4.470 -2.549) 7.800 7.047 ( 4.038 -3.427 0.883) 5.369 7.464 ( 0.102 -6.182 -7.536) 9.748 8.343 ( -1.238 -6.639 -2.345) 7.149 9.234 ( 3.864 8.285 0.209) 9.144 9.923 ( -2.393 6.387 2.944) 7.429 10.206 ( -0.706 -2.727 -2.907) 4.048 10.383 ( -3.117 -3.603 -1.199) 4.913 10.511 ( -3.275 3.010 -0.537) 4.480 10.994 ( 10.513 5.502 -8.312) 14.487 11.075 ( 7.392 3.979 -2.750) 8.833 11.388 ( -1.086 -2.183 -0.747) 2.550 11.620 ( 1.097 5.555 17.509) 18.401 11.796 ( 4.961 -0.136 1.895) 5.312 11.861 ( 4.376 -2.072 6.252) 7.907 13.328 ( -6.480 -3.204 -9.226) 11.720 13.776 ( -5.408 -1.633 -0.042) 5.650 17.181 ( -27.519 -9.446 -15.174) 32.814 17.253 ( 29.865 0.498 15.117) 33.477 19.126 ( -4.521 -0.252 -6.675) 8.066 19.344 ( 4.193 -2.547 -3.928) 6.285 19.631 ( -6.321 1.800 -0.591) 6.599 20.134 ( -4.974 -0.497 6.380) 8.105 20.269 ( -4.387 1.575 -6.648) 8.119 20.873 ( -23.729 -0.160 7.357) 24.844 21.231 ( 1.350 -2.660 -7.251) 7.841 21.590 ( -11.043 0.422 1.028) 11.099 22.137 ( 12.208 1.281 1.720) 12.395 22.898 ( 12.952 2.754 1.647) 13.344 24.387 ( 3.633 1.358 1.659) 4.219 24.397 ( -0.690 -1.362 0.547) 1.622 24.492 ( 4.449 -0.155 -1.551) 4.714 24.894 ( -5.721 1.269 -7.838) 9.787 25.481 ( 4.171 -0.843 -3.316) 5.395 25.889 ( 9.937 1.015 0.315) 9.993 26.360 ( -1.925 9.802 2.151) 10.218 26.817 ( -3.290 -10.241 3.601) 11.343 47.176 ( -2.814 0.347 7.671) 8.179 47.387 ( -3.329 0.091 5.821) 6.707 49.246 ( 2.677 0.040 -2.814) 3.884 49.426 ( 2.617 0.136 -6.084) 6.625 98.532 ( 2.753 -1.036 -1.456) 3.282 98.875 ( -1.731 0.281 2.459) 3.020 98.915 ( -4.909 0.070 5.749) 7.560 99.105 ( 0.820 -0.125 4.409) 4.486 100.490 ( -3.966 -0.676 1.152) 4.185 100.817 ( -2.652 1.473 2.642) 4.022 101.164 ( -2.113 0.367 -2.484) 3.281 103.490 ( 45.526 19.155 -1.579) 49.417 ======================= Grid point 109 (47/230) ======================= q-point: (-0.33 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.963 ( -11.291 16.098 2.422) 19.812 1.071 ( -20.869 16.359 3.685) 26.771 1.909 ( -1.618 36.992 8.131) 37.910 2.401 ( -4.029 -2.000 -1.187) 4.652 2.655 ( -2.672 0.188 3.860) 4.698 2.828 ( 0.007 3.479 0.138) 3.482 3.032 ( 9.414 3.577 8.058) 12.897 3.215 ( -1.669 5.784 -10.356) 11.979 3.296 ( -0.389 8.224 2.533) 8.614 3.548 ( -0.561 1.514 10.030) 10.159 3.674 ( -1.998 1.037 1.932) 2.966 3.966 ( -7.407 2.840 2.242) 8.243 4.180 ( -2.248 -3.773 -0.836) 4.471 4.320 ( -5.384 -3.572 -0.336) 6.469 4.469 ( -7.074 -11.927 -1.264) 13.924 4.660 ( -3.448 -2.569 -8.481) 9.509 4.950 ( 7.242 -2.822 8.783) 11.728 5.127 ( 8.002 -0.486 -0.079) 8.018 5.271 ( -2.156 -10.606 -4.796) 11.838 5.459 ( 0.408 -4.820 -4.845) 6.846 5.774 ( 2.421 -1.251 6.373) 6.931 6.159 ( -2.176 -1.968 2.504) 3.857 6.335 ( -14.782 -4.681 -4.693) 16.200 6.534 ( -2.028 -0.361 -2.650) 3.356 7.133 ( 1.740 -3.650 -0.483) 4.072 7.440 ( 0.117 -7.683 -9.511) 12.227 8.376 ( 0.217 -8.767 -1.697) 8.932 9.210 ( 1.905 10.462 -1.185) 10.700 9.843 ( -1.740 8.893 0.501) 9.076 10.239 ( 0.274 -2.728 6.405) 6.967 10.374 ( -1.864 -5.711 -2.147) 6.380 10.440 ( -0.432 1.640 1.992) 2.616 10.979 ( 7.093 9.147 -18.059) 21.451 11.170 ( 5.342 2.057 3.832) 6.888 11.379 ( -0.659 -3.491 -2.530) 4.362 11.716 ( -0.836 2.813 11.463) 11.833 11.874 ( 1.256 -2.743 0.338) 3.036 12.016 ( 7.512 3.557 5.312) 9.864 13.203 ( -3.243 -2.183 -3.745) 5.414 13.718 ( -3.282 -2.272 1.129) 4.148 16.696 ( -21.587 -7.505 -10.221) 25.036 17.843 ( 22.183 1.091 11.506) 25.014 18.921 ( -9.291 -0.342 -9.049) 12.974 19.380 ( 1.161 -2.530 -3.778) 4.692 19.524 ( -3.164 2.193 0.084) 3.850 20.060 ( -8.687 0.841 5.336) 10.229 20.164 ( -0.324 1.226 -5.244) 5.395 20.597 ( -16.395 -0.868 7.685) 18.128 21.215 ( 2.286 -1.927 -7.608) 8.174 21.463 ( -4.905 -0.617 0.874) 5.020 22.300 ( 7.161 1.407 -1.079) 7.377 23.053 ( 6.135 2.975 1.147) 6.914 24.391 ( 0.243 -1.115 -1.725) 2.068 24.469 ( 2.775 1.070 1.108) 3.174 24.557 ( 3.430 -0.219 0.042) 3.437 24.767 ( -0.639 1.170 -0.580) 1.454 25.534 ( 5.723 -0.493 -4.836) 7.509 26.033 ( 6.795 1.741 1.102) 7.100 26.266 ( -3.363 7.708 1.820) 8.604 26.808 ( -7.092 -8.599 -3.340) 11.636 47.194 ( -3.229 -0.203 8.850) 9.422 47.382 ( -2.870 0.307 5.979) 6.639 49.253 ( 1.781 0.147 -4.459) 4.804 49.432 ( 3.596 -0.047 -4.991) 6.152 98.587 ( 3.274 -1.156 0.477) 3.505 98.842 ( -4.440 0.419 3.021) 5.386 98.898 ( -1.885 -2.597 2.650) 4.162 99.209 ( 0.101 -1.496 16.940) 17.007 100.440 ( -3.373 -0.350 1.845) 3.860 100.790 ( -1.670 1.613 2.368) 3.317 101.122 ( -0.322 0.728 -1.435) 1.641 104.042 ( 42.628 18.938 -20.871) 51.101 ======================= Grid point 110 (48/230) ======================= q-point: (-0.22 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.772 ( 4.907 16.709 12.196) 21.260 0.849 ( 0.759 18.964 12.064) 22.489 1.744 ( -0.371 37.157 21.351) 42.856 2.408 ( 2.978 -1.306 1.963) 3.798 2.630 ( -2.491 2.054 0.971) 3.371 2.757 ( -2.633 3.296 0.512) 4.250 3.067 ( -10.081 -1.630 -0.391) 10.220 3.174 ( 6.047 4.041 -0.518) 7.291 3.278 ( 0.653 0.948 1.432) 1.837 3.539 ( -6.545 5.477 3.472) 9.214 3.665 ( 3.970 7.011 9.861) 12.734 3.830 ( -4.799 -1.001 -3.558) 6.057 4.167 ( 0.127 -2.626 -2.039) 3.327 4.312 ( 1.198 -2.975 0.252) 3.217 4.504 ( 3.719 -3.119 5.461) 7.307 4.563 ( -1.195 -2.222 -9.727) 10.049 5.183 ( 4.136 -5.315 15.545) 16.941 5.296 ( 6.503 -7.386 1.946) 10.031 5.317 ( 0.688 -4.481 -2.547) 5.201 5.399 ( -2.013 0.235 -6.482) 6.792 5.811 ( -17.608 -3.296 -0.475) 17.920 6.130 ( 10.919 -2.004 -2.067) 11.292 6.177 ( -0.240 -2.814 1.568) 3.230 6.517 ( 1.978 0.548 -1.421) 2.496 7.129 ( -2.305 -3.871 -4.620) 6.453 7.431 ( 3.963 -2.631 -9.829) 10.919 8.445 ( 1.185 -9.318 -0.093) 9.393 9.132 ( 0.033 11.191 -2.051) 11.377 9.780 ( 0.122 6.144 2.834) 6.767 10.286 ( -0.567 6.165 4.267) 7.519 10.323 ( -1.199 -5.219 -4.854) 7.227 10.619 ( 5.580 -9.431 12.841) 16.881 10.807 ( 1.117 12.415 -18.094) 21.972 11.259 ( 1.177 -2.394 1.842) 3.242 11.382 ( 0.497 -4.939 -3.249) 5.932 11.742 ( -5.140 0.505 8.289) 9.767 11.870 ( -2.834 -3.913 -3.407) 5.912 12.079 ( -3.673 2.879 1.311) 4.848 13.234 ( 7.657 -1.289 3.044) 8.340 13.716 ( -0.356 -1.702 0.905) 1.961 16.587 ( 15.122 -2.736 3.714) 15.810 17.885 ( -19.594 1.495 -8.015) 21.223 18.946 ( 15.965 -0.608 4.545) 16.611 19.359 ( 0.236 0.633 -3.117) 3.189 19.498 ( 0.799 2.204 2.058) 3.120 19.955 ( -6.030 1.633 2.677) 6.797 20.159 ( 6.047 0.998 -5.219) 8.050 20.458 ( -8.075 0.089 7.508) 11.027 21.212 ( 4.333 -0.415 -7.940) 9.055 21.435 ( -1.178 -2.205 1.142) 2.748 22.318 ( -0.844 3.170 -3.715) 4.956 23.078 ( -1.128 2.824 0.175) 3.046 24.347 ( -1.108 3.398 -5.964) 6.953 24.469 ( -1.264 -2.991 -0.055) 3.248 24.600 ( 1.817 1.059 0.734) 2.227 24.927 ( 7.190 -8.060 11.532) 15.800 25.609 ( 8.059 -0.703 -5.537) 9.803 26.079 ( -1.182 2.070 0.138) 2.387 26.166 ( -7.920 3.284 4.666) 9.761 26.635 ( -4.361 3.940 -13.706) 14.913 47.218 ( -4.215 -1.981 8.978) 10.114 47.389 ( -2.636 0.280 6.961) 7.449 49.233 ( 1.362 0.213 -5.916) 6.074 49.452 ( 3.094 0.255 -4.332) 5.329 98.665 ( 2.830 -1.008 3.234) 4.414 98.782 ( -4.487 0.427 1.946) 4.909 98.925 ( -1.666 -6.431 1.373) 6.784 99.402 ( -5.569 -9.601 25.531) 27.839 100.439 ( 0.668 -0.764 3.993) 4.120 100.781 ( -1.012 1.109 3.796) 4.082 101.121 ( 1.632 0.584 -0.254) 1.752 104.003 ( -1.601 24.987 -49.917) 55.844 ======================= Grid point 111 (49/230) ======================= q-point: (-0.11 0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.909 ( 8.141 9.092 19.460) 22.970 1.199 ( 27.334 7.821 17.675) 33.477 1.730 ( 3.813 29.494 26.472) 39.814 2.533 ( 6.534 -1.980 3.248) 7.561 2.556 ( -4.456 -1.697 -2.137) 5.225 2.752 ( 0.771 1.483 4.123) 4.448 2.949 ( -6.787 -2.824 3.370) 8.087 3.221 ( 2.035 2.060 1.832) 3.427 3.280 ( -2.940 -5.343 -1.744) 6.343 3.433 ( -3.479 4.761 2.418) 6.373 3.765 ( 2.773 4.999 6.394) 8.577 3.796 ( 3.098 -0.293 -0.876) 3.233 4.159 ( 0.096 0.215 -3.465) 3.473 4.295 ( -1.490 3.592 -8.925) 9.735 4.532 ( 4.001 -2.099 -1.842) 4.879 4.748 ( 10.425 -5.191 6.680) 13.426 5.137 ( -8.263 5.273 -5.114) 11.055 5.338 ( 1.519 -2.358 -4.951) 5.691 5.356 ( -9.888 -2.171 5.533) 11.537 5.463 ( 6.137 -4.572 7.317) 10.588 5.710 ( 6.424 -2.774 4.854) 8.516 6.094 ( -2.569 4.864 -1.892) 5.817 6.552 ( 16.118 -19.246 -6.384) 25.903 6.569 ( 8.399 -1.927 -2.014) 8.850 7.072 ( -1.844 -3.443 -5.050) 6.384 7.428 ( 5.188 3.216 -9.453) 11.253 8.548 ( 1.698 -8.928 2.083) 9.324 9.023 ( -1.051 10.527 -2.192) 10.804 9.819 ( 3.203 2.672 6.862) 8.031 10.234 ( -1.091 3.192 -1.776) 3.812 10.328 ( 0.436 -1.379 -3.640) 3.916 10.572 ( -0.402 11.573 -10.015) 15.310 10.845 ( 2.371 -4.864 6.433) 8.406 11.272 ( -5.687 -7.203 2.764) 9.584 11.390 ( -1.115 -4.478 -3.494) 5.788 11.651 ( -12.966 2.333 9.165) 16.049 11.801 ( -4.046 -3.615 -4.102) 6.802 11.901 ( -10.441 4.724 0.651) 11.478 13.490 ( 13.291 -4.513 2.819) 14.316 13.731 ( 1.953 -0.188 -1.717) 2.608 17.244 ( 40.153 -13.195 2.509) 42.340 17.310 ( -30.241 0.824 -13.365) 33.073 19.241 ( 7.742 0.037 4.878) 9.151 19.372 ( 5.877 -0.411 -5.784) 8.256 19.574 ( 6.512 1.730 5.434) 8.656 19.877 ( -2.984 1.287 -1.148) 3.447 20.274 ( 14.811 1.665 -5.898) 16.029 20.448 ( -0.460 0.821 7.562) 7.621 21.235 ( 6.484 0.810 -7.923) 10.270 21.461 ( 1.230 -2.552 0.646) 2.906 22.204 ( -6.154 4.361 1.031) 7.613 22.992 ( -6.850 1.743 0.093) 7.069 24.264 ( -0.174 2.645 -3.377) 4.293 24.481 ( -0.260 -3.803 -1.223) 4.003 24.614 ( -0.471 1.935 2.431) 3.143 25.165 ( -0.067 -11.702 8.799) 14.641 25.660 ( -3.438 2.020 -0.462) 4.014 26.002 ( -5.697 1.248 -0.985) 5.914 26.034 ( -1.534 -0.898 0.273) 1.799 26.503 ( 8.565 10.973 -12.490) 18.702 47.220 ( -5.270 -1.918 7.225) 9.146 47.401 ( -3.362 0.099 7.801) 8.496 49.200 ( 1.368 0.322 -6.301) 6.456 49.462 ( 2.590 0.724 -3.245) 4.214 98.700 ( -4.749 1.087 4.232) 6.453 98.767 ( 2.931 -1.331 1.346) 3.489 98.934 ( -3.744 -6.061 0.323) 7.132 99.497 ( -14.176 -9.198 18.546) 25.090 100.526 ( 1.896 -3.616 3.086) 5.118 100.819 ( -0.934 -1.839 8.753) 8.993 101.167 ( 3.767 0.170 0.939) 3.886 102.993 ( -28.488 43.802 -31.927) 61.234 ======================= Grid point 115 (50/230) ======================= q-point: (-0.67 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( -11.107 -0.000 -1.058) 11.158 2.260 ( -24.760 -0.000 -4.536) 25.172 2.374 ( 5.735 0.000 -7.411) 9.371 2.526 ( -4.814 -0.000 4.359) 6.494 2.562 ( 7.058 0.000 3.037) 7.684 2.725 ( -2.973 -0.000 4.368) 5.284 2.803 ( 4.237 0.000 5.662) 7.072 3.178 ( -1.061 -0.000 19.851) 19.879 3.465 ( 1.634 0.000 6.562) 6.762 3.554 ( -3.118 -0.000 1.735) 3.569 3.984 ( -5.903 -0.000 -9.367) 11.072 4.018 ( 0.062 0.000 -0.533) 0.536 4.159 ( -4.197 -0.000 7.574) 8.659 4.299 ( 12.527 0.000 -9.084) 15.474 4.317 ( 3.525 0.000 -6.854) 7.708 4.594 ( -3.052 -0.000 7.956) 8.521 4.846 ( 3.651 0.000 -10.291) 10.920 5.396 ( -13.592 -0.000 -7.826) 15.685 5.400 ( -7.352 -0.000 -4.978) 8.878 5.575 ( -7.425 -0.000 -4.158) 8.510 5.676 ( -4.153 -0.000 10.180) 10.994 6.037 ( 4.979 0.000 -0.850) 5.051 6.537 ( -2.062 -0.000 -5.037) 5.443 6.687 ( -3.806 -0.000 -2.136) 4.365 6.939 ( 3.320 0.000 -1.121) 3.505 7.446 ( 1.637 0.000 -6.799) 6.993 8.342 ( -3.392 -0.000 -4.687) 5.785 9.234 ( 5.768 0.000 2.103) 6.140 9.967 ( -1.749 -0.000 2.652) 3.176 10.257 ( -1.907 -0.000 0.746) 2.048 10.441 ( -3.665 -0.000 -11.010) 11.604 10.578 ( -1.992 -0.000 6.596) 6.890 10.919 ( 7.475 0.000 0.564) 7.496 11.019 ( 12.351 0.000 -11.357) 16.779 11.389 ( -2.435 -0.000 1.694) 2.966 11.508 ( 0.839 0.000 20.873) 20.890 11.694 ( 6.202 0.000 1.235) 6.324 11.726 ( -0.863 -0.000 6.935) 6.989 13.488 ( -5.899 -0.000 -11.199) 12.657 13.857 ( -5.100 -0.000 -0.687) 5.146 16.666 ( 24.403 0.000 12.879) 27.593 17.671 ( -26.104 -0.000 -15.125) 30.169 19.203 ( -0.699 -0.000 -4.054) 4.114 19.279 ( 3.950 0.000 -3.710) 5.419 19.744 ( -4.935 -0.000 1.540) 5.170 20.100 ( 1.893 0.000 5.960) 6.253 20.434 ( -4.938 -0.000 -7.348) 8.853 21.234 ( 1.833 0.000 -8.109) 8.313 21.244 ( -25.995 -0.000 8.571) 27.372 21.819 ( -15.972 -0.000 2.184) 16.120 21.894 ( 15.624 0.000 1.773) 15.724 22.653 ( 17.803 0.000 1.403) 17.858 24.322 ( 2.463 0.000 1.704) 2.995 24.413 ( -1.471 -0.000 0.744) 1.648 24.441 ( 2.999 0.000 -4.178) 5.143 25.076 ( -5.767 -0.000 -8.415) 10.202 25.426 ( 3.760 0.000 -2.475) 4.501 25.727 ( 9.170 0.000 0.700) 9.197 26.567 ( -7.890 -0.000 16.582) 18.363 26.607 ( 6.558 0.000 -8.154) 10.464 47.165 ( -2.755 -0.000 6.922) 7.451 47.395 ( -3.545 -0.000 6.070) 7.029 49.217 ( 3.205 0.000 -2.474) 4.048 49.445 ( 1.819 0.000 -6.270) 6.528 98.499 ( 1.839 0.000 -2.748) 3.307 98.864 ( -0.804 -0.000 5.754) 5.810 98.950 ( -4.739 -0.000 6.527) 8.065 99.100 ( -0.114 -0.000 -4.484) 4.486 100.533 ( -2.928 -0.000 1.076) 3.119 100.862 ( -3.827 -0.000 3.767) 5.371 101.237 ( -3.457 -0.000 -3.094) 4.640 102.957 ( 38.695 0.000 5.135) 39.034 ======================= Grid point 117 (51/230) ======================= q-point: (-0.56 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.369 ( -10.109 4.931 0.519) 11.260 1.741 ( -28.717 5.184 -0.956) 29.196 2.323 ( 1.367 2.096 -8.860) 9.207 2.515 ( -2.985 -0.494 0.589) 3.082 2.697 ( 3.271 5.398 3.555) 7.244 2.756 ( 4.494 -1.204 1.879) 5.018 2.943 ( 8.949 7.635 7.290) 13.840 3.348 ( 0.171 -4.351 15.656) 16.250 3.462 ( -7.215 3.104 5.577) 9.633 3.561 ( 2.474 3.464 2.153) 4.770 3.724 ( -3.862 9.960 -8.309) 13.533 4.041 ( -6.195 -10.876 2.478) 12.759 4.141 ( -2.445 0.841 4.596) 5.273 4.292 ( -2.151 -5.591 -7.006) 9.218 4.374 ( -2.007 -1.365 -4.691) 5.282 4.636 ( 2.784 -1.203 8.074) 8.625 4.899 ( 8.011 1.256 -10.775) 13.485 5.109 ( -7.025 3.384 -3.888) 8.713 5.255 ( -5.882 -4.241 -7.045) 10.110 5.361 ( -8.120 -5.471 -6.128) 11.551 5.744 ( -3.232 0.828 12.261) 12.707 6.103 ( 2.597 -1.438 -0.452) 3.003 6.448 ( -6.047 -1.493 -2.123) 6.581 6.606 ( -2.697 0.541 -2.906) 4.002 7.008 ( 4.551 -1.595 -0.199) 4.827 7.397 ( -0.738 -2.509 -8.166) 8.574 8.276 ( -1.625 -2.351 -2.509) 3.803 9.321 ( 4.354 3.252 0.413) 5.450 9.981 ( -0.382 1.548 6.478) 6.671 10.208 ( -2.117 3.255 -3.589) 5.287 10.301 ( -4.548 -6.182 -6.584) 10.112 10.564 ( -3.026 2.474 2.856) 4.841 11.043 ( 7.742 1.464 -1.459) 8.014 11.119 ( 10.985 1.860 -11.283) 15.857 11.361 ( -2.307 -1.242 0.107) 2.622 11.694 ( 1.499 4.176 15.670) 16.286 11.767 ( -0.273 -3.035 4.858) 5.734 11.851 ( 9.212 0.111 5.609) 10.786 13.296 ( -6.212 -1.120 -8.632) 10.693 13.759 ( -5.774 -0.658 -0.237) 5.816 17.091 ( -27.354 -3.073 -14.126) 30.939 17.258 ( 30.085 0.200 15.041) 33.636 19.123 ( -4.395 -0.081 -6.786) 8.086 19.322 ( 4.503 -0.700 -4.215) 6.208 19.649 ( -6.177 0.687 -0.395) 6.227 20.133 ( -4.270 0.060 6.391) 7.686 20.286 ( -4.714 0.637 -6.411) 7.983 20.869 ( -24.712 -0.168 7.691) 25.882 21.203 ( 2.313 -1.004 -8.168) 8.549 21.594 ( -11.555 0.193 1.166) 11.615 22.147 ( 11.931 0.278 1.876) 12.081 22.927 ( 12.997 1.085 1.524) 13.131 24.379 ( -1.407 -0.587 -0.592) 1.635 24.403 ( 4.121 0.449 3.489) 5.418 24.490 ( 4.403 -0.060 -1.659) 4.705 24.907 ( -5.451 0.470 -7.795) 9.523 25.473 ( 4.745 -0.296 -3.838) 6.110 25.901 ( 10.323 0.455 0.545) 10.348 26.497 ( -7.313 8.384 9.025) 14.325 26.677 ( 1.449 -8.470 -3.604) 9.318 47.180 ( -2.848 0.136 7.584) 8.102 47.388 ( -3.215 0.047 5.820) 6.649 49.247 ( 2.738 0.011 -2.827) 3.935 49.427 ( 2.432 -0.004 -6.070) 6.539 98.522 ( 2.995 -0.394 -1.863) 3.549 98.879 ( -1.271 0.184 1.493) 1.969 98.916 ( -5.474 0.011 5.967) 8.097 99.103 ( 1.034 -0.052 4.102) 4.231 100.484 ( -3.851 -0.180 1.271) 4.059 100.832 ( -2.625 0.587 2.630) 3.762 101.168 ( -1.963 0.141 -2.153) 2.917 103.667 ( 43.422 5.787 -1.784) 43.842 ======================= Grid point 118 (52/230) ======================= q-point: (-0.44 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.143 ( -13.193 8.744 1.579) 15.907 1.289 ( -15.609 12.012 6.504) 20.742 2.298 ( 4.854 6.684 -1.164) 8.342 2.404 ( -3.650 8.329 -5.700) 10.732 2.686 ( -1.975 7.006 7.130) 10.189 2.853 ( 2.713 0.469 0.728) 2.847 3.098 ( 6.650 5.802 7.118) 11.338 3.331 ( -4.914 7.986 -13.351) 16.315 3.397 ( -2.647 0.687 1.865) 3.310 3.538 ( 0.541 2.500 9.489) 9.828 3.710 ( 1.206 2.942 5.990) 6.781 3.981 ( -9.125 -2.740 0.511) 9.541 4.139 ( -2.504 -2.161 1.563) 3.658 4.245 ( -6.646 -8.162 2.077) 10.728 4.282 ( -2.894 -7.972 -0.493) 8.496 4.670 ( -4.067 2.104 -5.878) 7.452 4.914 ( 6.982 -2.045 6.181) 9.547 5.136 ( -3.775 -5.130 -4.553) 7.829 5.145 ( 7.750 1.685 -2.360) 8.275 5.363 ( 4.806 -8.248 -3.925) 10.322 5.757 ( -4.414 -1.006 7.783) 9.004 6.121 ( -3.122 -2.813 0.323) 4.215 6.311 ( -7.653 0.680 -1.935) 7.923 6.548 ( -0.458 1.286 -2.575) 2.914 7.089 ( 2.686 -2.297 -1.230) 3.742 7.339 ( 0.192 -5.505 -8.809) 10.390 8.276 ( 0.018 -4.785 -0.810) 4.853 9.337 ( 2.135 6.465 -1.419) 6.955 9.970 ( -2.482 8.202 -0.353) 8.576 10.176 ( 0.985 -4.004 5.791) 7.109 10.275 ( -0.968 -7.243 -0.912) 7.364 10.502 ( -2.396 4.434 0.315) 5.050 11.091 ( 7.034 6.177 -13.368) 16.320 11.189 ( 5.416 0.461 -1.032) 5.533 11.331 ( -1.723 -2.871 -2.525) 4.194 11.737 ( -1.876 0.340 4.358) 4.757 11.843 ( 0.610 -1.204 3.751) 3.987 12.057 ( 6.528 1.902 7.878) 10.407 13.179 ( -2.025 -1.082 -2.751) 3.583 13.689 ( -3.523 -1.575 1.457) 4.125 16.620 ( -16.960 -3.276 -7.853) 18.975 17.857 ( 22.790 0.709 11.528) 25.549 18.917 ( -9.468 -0.191 -9.319) 13.286 19.360 ( 3.414 -0.609 -4.231) 5.470 19.551 ( -3.246 1.397 0.088) 3.534 20.074 ( -7.598 0.829 5.303) 9.303 20.179 ( -1.180 0.784 -4.597) 4.810 20.584 ( -16.679 -0.744 8.102) 18.557 21.190 ( 3.532 -1.287 -8.313) 9.124 21.457 ( -5.779 -0.246 0.987) 5.868 22.311 ( 6.264 0.271 -0.135) 6.271 23.090 ( 6.219 1.953 0.740) 6.560 24.370 ( -0.295 -1.251 -0.011) 1.286 24.482 ( 1.809 0.551 0.595) 1.983 24.556 ( 3.733 -0.029 0.314) 3.746 24.784 ( -0.992 0.899 -2.988) 3.275 25.528 ( 6.117 -0.319 -5.231) 8.055 26.055 ( 6.814 1.092 1.066) 6.983 26.368 ( -9.688 6.032 7.373) 13.586 26.700 ( 0.359 -6.195 -7.492) 9.728 47.193 ( -3.373 0.019 8.018) 8.698 47.386 ( -2.792 0.213 6.080) 6.694 49.255 ( 1.833 0.094 -4.453) 4.816 49.430 ( 3.217 -0.229 -4.778) 5.765 98.574 ( 3.646 -0.682 -0.127) 3.712 98.850 ( -3.263 0.622 1.565) 3.672 98.875 ( -3.487 -0.988 2.450) 4.375 99.197 ( 0.293 -0.473 13.507) 13.518 100.437 ( -3.004 -0.125 1.858) 3.535 100.810 ( -1.690 1.060 2.173) 2.950 101.131 ( -0.360 0.471 -1.259) 1.392 104.215 ( 32.369 6.553 -17.280) 37.274 ======================= Grid point 119 (53/230) ======================= q-point: (-0.33 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.989 ( 4.404 12.669 11.131) 17.429 1.124 ( -1.247 17.495 8.372) 19.435 2.232 ( -0.067 22.481 3.358) 22.731 2.373 ( 5.725 2.678 3.904) 7.429 2.669 ( -2.365 3.441 5.113) 6.601 2.822 ( -3.099 4.738 -1.859) 5.959 3.062 ( -10.114 2.421 -5.376) 11.707 3.184 ( 2.553 -2.659 -2.610) 4.517 3.320 ( -4.979 2.951 -1.160) 5.903 3.605 ( -0.582 3.072 3.470) 4.671 3.733 ( -1.111 0.452 2.854) 3.096 3.836 ( -1.435 3.936 0.441) 4.212 4.144 ( 0.750 -0.550 1.545) 1.803 4.258 ( 0.735 -4.251 3.741) 5.710 4.409 ( 3.084 -9.156 6.294) 11.530 4.560 ( 0.022 1.303 -4.760) 4.935 5.117 ( 0.442 -3.598 13.752) 14.222 5.184 ( 6.844 -6.016 1.041) 9.172 5.244 ( 4.733 -4.634 -0.012) 6.624 5.420 ( 2.490 1.059 -8.087) 8.528 5.741 ( -9.389 -5.694 2.209) 11.201 6.071 ( 1.350 -3.553 0.109) 3.802 6.212 ( -0.041 3.946 -1.414) 4.192 6.533 ( 1.973 1.248 -1.695) 2.885 7.078 ( -2.006 -2.972 -5.601) 6.651 7.365 ( 5.091 -5.334 -6.672) 9.944 8.330 ( 1.474 -6.236 1.153) 6.511 9.279 ( -0.228 8.549 -2.783) 8.993 9.868 ( -1.410 5.502 -0.034) 5.680 10.234 ( -0.455 -5.371 -2.101) 5.785 10.379 ( 0.287 4.347 4.574) 6.317 10.501 ( 4.551 -5.647 9.857) 12.238 10.973 ( 1.910 10.156 -16.755) 19.686 11.252 ( 0.912 0.536 0.448) 1.149 11.305 ( 0.191 -5.518 -5.647) 7.897 11.731 ( -3.152 -1.970 2.922) 4.728 11.837 ( -4.350 -0.668 0.369) 4.416 12.109 ( -5.092 1.315 2.609) 5.871 13.218 ( 6.002 -0.884 3.204) 6.861 13.689 ( -0.264 -1.797 2.083) 2.764 16.552 ( 11.844 -2.056 3.505) 12.522 17.906 ( -19.928 1.294 -8.158) 21.572 18.938 ( 16.476 -0.466 4.283) 17.030 19.371 ( 2.253 0.822 -3.884) 4.565 19.529 ( 0.818 1.815 1.961) 2.794 19.978 ( -6.062 1.502 2.691) 6.801 20.169 ( 5.200 0.426 -4.245) 6.726 20.452 ( -7.792 -0.609 7.950) 11.148 21.203 ( 5.546 -0.722 -8.421) 10.109 21.410 ( -1.800 -1.198 1.271) 2.508 22.343 ( -0.865 0.812 -2.053) 2.371 23.119 ( -1.082 2.489 -0.378) 2.740 24.372 ( -0.298 0.089 -2.250) 2.271 24.437 ( -2.760 -1.051 -3.450) 4.542 24.613 ( 1.731 0.636 2.174) 2.851 24.859 ( 5.840 -2.265 6.294) 8.880 25.599 ( 7.241 -0.654 -5.559) 9.152 26.106 ( -0.917 1.608 0.652) 1.963 26.210 ( -12.009 2.745 6.278) 13.826 26.659 ( 2.869 0.084 -12.286) 12.616 47.200 ( -4.054 -0.635 7.875) 8.880 47.393 ( -2.704 0.315 6.894) 7.412 49.235 ( 1.367 0.151 -5.865) 6.024 49.451 ( 3.094 -0.247 -3.814) 4.918 98.650 ( 3.566 -0.866 2.228) 4.293 98.792 ( -4.928 0.889 2.949) 5.811 98.860 ( -1.625 -2.870 0.450) 3.329 99.328 ( -2.827 -2.472 18.005) 18.393 100.431 ( -0.117 -0.367 3.218) 3.241 100.799 ( -1.110 1.159 2.902) 3.316 101.129 ( 1.363 0.510 -0.309) 1.488 104.227 ( -0.921 8.659 -36.620) 37.641 ======================= Grid point 120 (54/230) ======================= q-point: (-0.22 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.111 ( 6.409 16.935 11.736) 21.578 1.320 ( 25.321 8.476 14.577) 30.422 2.152 ( 1.419 25.186 15.011) 29.355 2.468 ( -0.000 -3.003 -0.430) 3.033 2.594 ( -1.058 5.343 -2.933) 6.187 2.771 ( 0.218 0.953 5.180) 5.272 2.906 ( -6.858 -2.778 1.766) 7.607 3.164 ( -7.886 -9.001 -2.860) 12.304 3.260 ( 3.496 1.241 -2.553) 4.503 3.496 ( -5.861 3.372 -0.853) 6.815 3.786 ( 6.184 -0.044 -3.428) 7.071 3.866 ( 1.288 7.556 10.215) 12.771 4.172 ( 0.996 1.465 -0.191) 1.782 4.320 ( 0.724 -0.265 -4.499) 4.565 4.497 ( 4.171 -2.446 1.171) 4.976 4.674 ( 5.551 -5.207 6.683) 10.129 5.181 ( -4.010 0.313 -2.942) 4.983 5.284 ( 1.404 -2.994 1.899) 3.813 5.330 ( -2.843 -0.470 7.018) 7.586 5.437 ( 5.459 -0.285 -0.971) 5.552 5.655 ( 1.009 -4.809 5.044) 7.042 6.141 ( -1.753 -0.208 -0.891) 1.978 6.323 ( 15.914 -8.802 -4.907) 18.837 6.569 ( 4.152 0.183 -0.803) 4.233 7.016 ( -1.565 -3.922 -5.783) 7.161 7.430 ( 5.595 -2.020 -7.063) 9.234 8.434 ( 2.632 -6.601 3.558) 7.948 9.167 ( -1.979 8.966 -3.384) 9.785 9.861 ( 2.070 2.809 3.898) 5.232 10.238 ( 0.314 -3.827 -5.466) 6.680 10.337 ( -0.496 4.285 0.339) 4.327 10.752 ( -0.592 9.660 -7.567) 12.285 10.760 ( 3.392 -3.632 6.295) 8.020 11.207 ( -4.104 -2.298 -2.839) 5.494 11.319 ( 0.082 -5.089 -4.360) 6.702 11.680 ( -10.272 1.413 7.192) 12.619 11.745 ( -3.879 -3.630 -3.344) 6.278 11.953 ( -11.140 2.433 1.169) 11.462 13.433 ( 11.916 -3.142 4.739) 13.203 13.723 ( 2.086 -0.867 -0.371) 2.289 17.081 ( 34.601 -8.856 8.245) 36.656 17.324 ( -30.849 0.915 -13.637) 33.741 19.242 ( 8.468 0.121 5.128) 9.900 19.374 ( 3.166 0.484 -4.458) 5.489 19.600 ( 5.993 1.761 4.918) 7.950 19.898 ( -3.073 1.491 -1.211) 3.624 20.288 ( 14.622 0.372 -5.707) 15.700 20.453 ( -0.466 0.008 7.407) 7.421 21.245 ( 7.680 0.581 -8.262) 11.295 21.426 ( 0.997 -2.103 1.081) 2.566 22.252 ( -6.570 2.208 -0.077) 6.931 23.022 ( -7.297 2.196 -0.768) 7.659 24.299 ( -1.347 1.976 -4.416) 5.022 24.427 ( -0.103 -3.500 -1.019) 3.647 24.636 ( -1.110 1.052 3.355) 3.687 25.045 ( 4.577 -5.243 7.193) 10.008 25.665 ( 1.596 -0.721 -1.699) 2.440 26.024 ( -6.025 1.750 -0.938) 6.344 26.046 ( -6.703 1.680 0.483) 6.928 26.614 ( 5.869 4.743 -10.858) 13.223 47.198 ( -4.516 -1.138 7.066) 8.463 47.404 ( -3.186 0.278 7.609) 8.254 49.204 ( 1.361 0.235 -6.234) 6.385 49.468 ( 2.576 0.190 -3.362) 4.240 98.718 ( -4.926 1.272 5.502) 7.493 98.746 ( 3.136 -1.280 0.544) 3.431 98.859 ( -2.325 -3.973 0.862) 4.684 99.411 ( -7.145 -3.457 15.104) 17.063 100.488 ( 1.734 -1.762 3.565) 4.338 100.812 ( -0.850 0.281 5.729) 5.798 101.168 ( 3.355 0.041 0.728) 3.434 103.484 ( -28.602 24.119 -36.164) 52.034 ======================= Grid point 121 (55/230) ======================= q-point: (-0.11 0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.288 ( 10.124 8.413 17.866) 22.192 1.837 ( 21.139 9.940 17.553) 29.219 2.166 ( 7.352 14.442 9.905) 18.993 2.380 ( -6.881 -5.341 -3.597) 9.424 2.602 ( 0.049 -4.232 -0.087) 4.233 2.808 ( -1.036 1.867 2.422) 3.229 2.892 ( -1.651 -1.787 6.957) 7.370 3.073 ( -8.488 -9.062 0.525) 12.427 3.310 ( 3.950 0.757 -2.037) 4.509 3.417 ( -0.389 -0.064 0.077) 0.402 3.856 ( 5.460 1.092 -3.223) 6.434 3.935 ( 2.642 4.816 9.747) 11.188 4.145 ( -0.646 3.041 -2.262) 3.845 4.228 ( -1.873 5.044 -5.432) 7.646 4.545 ( -6.065 2.284 1.221) 6.594 4.811 ( 3.970 -7.416 3.274) 9.026 5.130 ( 2.657 1.731 -5.381) 6.246 5.255 ( -3.639 2.158 1.220) 4.403 5.374 ( 6.742 2.106 0.340) 7.071 5.539 ( 1.534 -5.826 5.265) 8.001 5.857 ( 7.908 -4.567 4.018) 9.977 6.081 ( -1.648 4.520 -1.213) 4.961 6.596 ( 10.428 -14.236 -8.065) 19.402 6.650 ( 5.120 -1.747 -0.968) 5.496 7.001 ( 1.584 -4.063 -4.148) 6.018 7.452 ( 4.136 1.768 -7.540) 8.779 8.559 ( 2.635 -5.392 3.973) 7.197 9.038 ( -2.353 7.595 -3.087) 8.529 9.949 ( 3.862 -0.027 6.024) 7.155 10.193 ( -0.140 1.794 -6.300) 6.552 10.319 ( -0.060 0.947 -1.512) 1.785 10.574 ( 0.704 7.030 -6.244) 9.429 10.896 ( 0.503 -0.395 3.658) 3.714 11.121 ( -6.934 -5.186 -1.064) 8.724 11.296 ( -2.712 -4.155 -2.508) 5.559 11.537 ( -10.934 1.749 8.802) 14.145 11.695 ( -3.309 -1.976 -1.278) 4.061 11.774 ( -8.208 2.207 0.896) 8.547 13.687 ( 10.177 -3.088 2.882) 11.019 13.762 ( 3.806 0.098 -2.853) 4.758 16.711 ( -26.206 0.456 -11.594) 28.660 17.798 ( 30.207 -9.749 7.107) 32.527 19.316 ( -0.438 0.835 2.275) 2.463 19.387 ( 1.982 -1.461 -4.734) 5.336 19.727 ( 2.952 0.865 5.841) 6.602 19.826 ( -0.493 1.071 -6.283) 6.393 20.532 ( 9.588 0.199 -1.259) 9.673 20.561 ( 15.839 0.678 0.344) 15.857 21.301 ( 7.126 1.846 -7.307) 10.372 21.504 ( 6.543 -2.391 -0.451) 6.981 22.119 ( -9.323 1.750 4.957) 10.703 22.842 ( -11.769 0.943 0.009) 11.806 24.258 ( 0.930 0.603 -2.247) 2.505 24.435 ( -0.293 -2.928 -2.722) 4.009 24.622 ( -3.080 0.902 3.866) 5.025 25.191 ( 3.071 -3.232 4.698) 6.477 25.582 ( -8.088 4.410 2.033) 9.434 25.881 ( -7.686 0.830 -2.355) 8.082 26.049 ( 5.835 -5.046 -3.736) 8.571 26.600 ( 5.199 5.729 -6.024) 9.805 47.185 ( -4.477 -0.930 6.286) 7.773 47.410 ( -3.579 0.289 7.745) 8.537 49.177 ( 1.714 0.273 -5.752) 6.008 49.480 ( 2.354 0.268 -3.332) 4.089 98.652 ( -4.240 1.221 1.465) 4.649 98.825 ( 0.505 -1.913 3.564) 4.076 98.853 ( -1.660 -2.328 2.347) 3.699 99.396 ( -7.912 -1.491 8.441) 11.666 100.547 ( 0.881 -1.633 1.390) 2.319 100.860 ( -1.785 -1.511 8.772) 9.079 101.257 ( 5.792 -0.677 1.634) 6.056 102.574 ( -24.269 24.914 -20.007) 40.125 ======================= Grid point 126 (56/230) ======================= q-point: (-0.56 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.209 ( -12.899 -0.000 1.178) 12.952 1.382 ( -14.731 -0.000 7.949) 16.739 2.301 ( -2.015 -0.000 0.400) 2.055 2.466 ( 4.581 0.000 -10.204) 11.185 2.788 ( 2.168 0.000 0.524) 2.230 2.857 ( 4.414 0.000 4.461) 6.275 3.222 ( 10.474 0.000 5.435) 11.800 3.263 ( -10.145 -0.000 1.070) 10.201 3.412 ( -6.741 -0.000 -2.409) 7.158 3.618 ( -1.975 -0.000 -2.738) 3.376 3.761 ( 4.388 0.000 8.088) 9.202 3.886 ( -8.141 -0.000 3.768) 8.971 4.118 ( -2.699 -0.000 1.377) 3.030 4.193 ( -3.263 -0.000 4.992) 5.963 4.226 ( -7.708 -0.000 -2.191) 8.013 4.690 ( -3.180 -0.000 -4.244) 5.304 4.898 ( 5.898 0.000 3.687) 6.956 5.083 ( -2.597 -0.000 -5.931) 6.475 5.232 ( 13.138 0.000 -0.366) 13.143 5.238 ( -0.610 -0.000 -3.342) 3.398 5.749 ( -6.897 -0.000 8.257) 10.759 6.097 ( -2.764 -0.000 0.065) 2.764 6.321 ( -5.190 -0.000 -1.884) 5.521 6.558 ( -0.582 -0.000 -2.374) 2.445 7.071 ( 3.291 0.000 -1.512) 3.621 7.297 ( -0.043 -0.000 -8.715) 8.715 8.241 ( -0.031 -0.000 -0.510) 0.510 9.386 ( 2.214 0.000 -1.549) 2.702 10.050 ( -3.885 -0.000 -1.536) 4.177 10.146 ( 2.126 0.000 7.481) 7.778 10.200 ( -0.815 -0.000 -1.869) 2.039 10.537 ( -2.667 -0.000 0.197) 2.674 11.146 ( 5.542 0.000 -3.296) 6.448 11.186 ( 8.164 0.000 -13.238) 15.553 11.307 ( -3.135 -0.000 -0.186) 3.140 11.737 ( -2.080 -0.000 0.338) 2.107 11.835 ( 0.543 0.000 6.492) 6.515 12.071 ( 5.863 0.000 8.631) 10.434 13.172 ( -1.646 -0.000 -2.457) 2.957 13.677 ( -3.623 -0.000 1.565) 3.946 16.597 ( -15.600 -0.000 -7.275) 17.213 17.862 ( 23.030 0.000 11.534) 25.757 18.916 ( -9.541 -0.000 -9.426) 13.412 19.356 ( 4.122 0.000 -4.457) 6.071 19.562 ( -3.283 -0.000 0.097) 3.285 20.080 ( -7.308 -0.000 5.293) 9.023 20.185 ( -1.565 -0.000 -4.327) 4.601 20.578 ( -16.694 -0.000 8.138) 18.572 21.180 ( 3.903 0.000 -8.516) 9.368 21.455 ( -6.064 -0.000 1.022) 6.150 22.312 ( 6.011 0.000 0.126) 6.012 23.105 ( 6.249 0.000 0.590) 6.277 24.360 ( -0.412 -0.000 0.197) 0.457 24.486 ( 1.445 0.000 0.597) 1.563 24.556 ( 3.800 0.000 0.590) 3.846 24.790 ( -1.018 -0.000 -3.669) 3.807 25.525 ( 6.206 0.000 -5.326) 8.178 26.063 ( 6.824 0.000 1.036) 6.902 26.420 ( -15.351 -0.000 12.470) 19.777 26.647 ( 6.344 0.000 -12.254) 13.799 47.193 ( -3.399 -0.000 7.775) 8.485 47.388 ( -2.769 -0.000 6.119) 6.716 49.255 ( 1.854 0.000 -4.451) 4.822 49.428 ( 3.095 0.000 -4.709) 5.636 98.569 ( 3.787 0.000 -0.327) 3.801 98.857 ( -0.971 -0.000 -1.639) 1.905 98.866 ( -5.874 -0.000 5.254) 7.881 99.193 ( 0.405 0.000 12.631) 12.638 100.436 ( -2.914 -0.000 1.832) 3.442 100.818 ( -1.702 -0.000 2.105) 2.707 101.135 ( -0.374 -0.000 -1.190) 1.248 104.260 ( 29.269 0.000 -16.158) 33.433 ======================= Grid point 128 (57/230) ======================= q-point: (-0.44 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.122 ( 3.715 4.967 10.110) 11.862 1.316 ( -1.502 7.545 9.476) 12.206 2.253 ( -2.283 -2.944 -2.382) 4.422 2.536 ( 11.197 3.914 -3.087) 12.256 2.804 ( 1.372 11.096 3.927) 11.850 2.882 ( -4.151 6.618 2.141) 8.100 3.103 ( -5.199 -8.309 -7.623) 12.417 3.156 ( -11.723 9.591 -6.227) 16.377 3.297 ( -8.499 -6.906 -3.132) 11.390 3.624 ( 7.624 0.110 2.008) 7.885 3.724 ( -8.745 -0.203 -4.102) 9.662 3.914 ( 3.659 4.534 9.113) 10.817 4.148 ( 0.703 1.099 1.877) 2.286 4.199 ( 0.161 -3.516 5.414) 6.458 4.280 ( 4.986 -6.475 11.406) 14.031 4.581 ( -2.177 1.039 -4.500) 5.106 5.080 ( 3.408 -0.903 3.404) 4.900 5.119 ( 7.410 -3.373 10.809) 13.532 5.223 ( 2.964 1.246 -2.280) 3.941 5.415 ( 6.011 -1.283 -3.548) 7.097 5.672 ( -8.183 -2.866 2.703) 9.082 6.036 ( -2.949 -1.236 1.242) 3.430 6.259 ( 0.906 1.967 -2.593) 3.378 6.547 ( 1.536 0.561 -1.728) 2.379 7.047 ( -1.872 -1.084 -6.506) 6.856 7.302 ( 5.857 -2.570 -5.031) 8.138 8.268 ( 1.639 -2.167 1.991) 3.368 9.368 ( -0.366 3.292 -3.411) 4.754 9.928 ( -3.174 2.344 -2.229) 4.531 10.178 ( -0.102 -1.981 -2.821) 3.448 10.381 ( 6.911 -2.004 16.789) 18.266 10.485 ( -1.378 1.278 -1.676) 2.518 11.105 ( 1.807 8.030 -12.671) 15.110 11.214 ( 2.695 -6.411 -9.384) 11.680 11.266 ( -1.144 0.395 -0.272) 1.241 11.703 ( -1.749 -1.253 -0.973) 2.362 11.836 ( -5.521 0.188 3.358) 6.464 12.121 ( -5.778 0.370 3.142) 6.587 13.209 ( 5.408 -0.328 3.318) 6.353 13.669 ( -0.160 -0.749 2.707) 2.814 16.531 ( 10.680 -0.771 3.423) 11.241 17.920 ( -20.155 0.509 -8.267) 21.790 18.933 ( 16.830 -0.171 4.126) 17.329 19.380 ( 3.096 0.352 -4.370) 5.367 19.547 ( 0.760 0.688 1.949) 2.202 19.995 ( -6.081 0.620 2.703) 6.683 20.172 ( 4.357 0.075 -3.483) 5.579 20.445 ( -7.338 -0.249 7.780) 10.697 21.194 ( 6.211 -0.379 -8.625) 10.635 21.399 ( -2.191 -0.371 1.403) 2.628 22.349 ( -0.882 0.129 -1.300) 1.576 23.145 ( -1.037 0.984 -0.736) 1.608 24.364 ( 0.224 -0.546 0.102) 0.598 24.433 ( -3.484 0.034 -5.402) 6.428 24.618 ( 1.427 0.170 3.076) 3.395 24.842 ( 5.596 -0.390 3.608) 6.669 25.592 ( 6.890 -0.251 -5.582) 8.871 26.123 ( -0.782 0.608 0.815) 1.282 26.240 ( -14.238 1.166 7.241) 16.016 26.654 ( 6.167 -0.379 -11.994) 13.492 47.195 ( -3.989 -0.141 7.300) 8.320 47.397 ( -2.735 0.131 6.907) 7.429 49.237 ( 1.363 0.056 -5.857) 6.014 49.447 ( 3.102 -0.144 -3.550) 4.717 98.642 ( 3.910 -0.296 1.719) 4.281 98.805 ( -5.370 0.714 3.770) 6.600 98.832 ( -1.268 -1.089 -0.760) 1.836 99.307 ( -2.024 -0.583 15.543) 15.685 100.428 ( -0.349 -0.123 2.852) 2.876 100.811 ( -1.161 0.470 2.512) 2.807 101.134 ( 1.189 0.201 -0.346) 1.254 104.300 ( -0.655 2.187 -31.068) 31.152 ======================= Grid point 129 (58/230) ======================= q-point: (-0.33 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.349 ( 4.639 13.902 10.148) 17.826 1.429 ( 23.077 5.973 12.431) 26.884 2.269 ( 3.238 -4.717 -2.273) 6.157 2.604 ( -9.371 15.404 -1.422) 18.087 2.698 ( 7.550 6.603 2.580) 10.357 2.799 ( -4.942 6.437 1.735) 8.298 2.879 ( -7.268 -0.898 0.073) 7.324 3.020 ( -7.857 -9.943 -4.647) 13.498 3.239 ( 1.617 -5.014 -4.647) 7.025 3.529 ( -7.861 1.401 -2.041) 8.242 3.790 ( 8.246 0.273 -1.768) 8.438 3.975 ( 1.372 7.215 6.680) 9.928 4.194 ( 0.327 0.882 3.639) 3.758 4.294 ( 4.342 -2.605 -0.543) 5.092 4.469 ( 3.845 -1.080 5.103) 6.480 4.591 ( 1.409 -5.907 5.603) 8.263 5.173 ( 3.942 -0.136 -0.859) 4.037 5.276 ( 2.465 1.646 2.824) 4.094 5.340 ( 0.838 0.785 10.673) 10.735 5.427 ( 4.450 -1.295 -1.483) 4.866 5.580 ( -5.191 -4.735 3.509) 7.854 6.077 ( 2.257 -5.422 -2.054) 6.221 6.298 ( 8.829 1.765 -1.981) 9.219 6.573 ( 3.375 0.265 -1.335) 3.640 6.967 ( -1.473 -2.606 -7.009) 7.621 7.392 ( 6.401 -2.584 -4.686) 8.344 8.360 ( 3.181 -3.478 4.710) 6.663 9.274 ( -2.621 5.375 -4.610) 7.551 9.894 ( 0.894 1.536 1.720) 2.473 10.177 ( 0.919 -3.404 -3.674) 5.092 10.404 ( -1.097 3.893 -3.154) 5.129 10.679 ( 5.232 -4.183 16.523) 17.829 10.920 ( -1.189 10.631 -14.105) 17.702 11.167 ( -3.169 -4.755 -8.533) 10.270 11.260 ( 0.601 -2.095 -3.607) 4.215 11.680 ( -2.920 -1.469 1.254) 3.501 11.715 ( -10.224 -0.229 2.500) 10.528 11.976 ( -11.040 0.915 1.255) 11.149 13.399 ( 10.680 -1.583 5.562) 12.146 13.711 ( 2.440 -0.674 0.662) 2.617 16.987 ( 30.817 -4.206 10.008) 32.674 17.335 ( -31.210 0.575 -13.839) 34.146 19.244 ( 9.042 0.116 5.306) 10.484 19.382 ( 2.039 0.521 -4.253) 4.745 19.621 ( 5.516 1.063 4.621) 7.274 19.917 ( -3.245 0.992 -1.270) 3.623 20.288 ( 14.075 -0.219 -5.033) 14.949 20.452 ( 0.102 -0.023 7.006) 7.007 21.250 ( 8.875 0.124 -8.617) 12.371 21.402 ( 0.393 -1.082 1.620) 1.987 22.272 ( -6.535 0.731 -0.048) 6.576 23.050 ( -7.562 1.502 -1.597) 7.873 24.321 ( -2.142 1.031 -4.860) 5.410 24.385 ( 0.224 -2.153 -0.851) 2.326 24.645 ( -1.717 0.352 4.192) 4.543 24.998 ( 6.590 -1.663 5.235) 8.579 25.652 ( 2.897 -0.742 -2.383) 3.824 26.048 ( -6.863 1.246 -0.420) 6.988 26.070 ( -7.490 1.348 0.053) 7.611 26.656 ( 5.267 1.442 -9.211) 10.708 47.187 ( -4.215 -0.456 6.642) 7.880 47.408 ( -3.159 0.215 7.548) 8.185 49.207 ( 1.361 0.121 -6.173) 6.322 49.469 ( 2.675 -0.044 -3.253) 4.211 98.729 ( 1.353 -0.183 5.972) 6.126 98.739 ( -3.162 0.600 0.479) 3.253 98.818 ( -1.403 -1.849 0.138) 2.325 99.379 ( -4.906 -1.170 13.093) 14.031 100.470 ( 1.453 -0.778 3.311) 3.699 100.818 ( -0.935 0.443 4.370) 4.491 101.168 ( 2.913 0.010 0.492) 2.954 103.724 ( -25.349 9.903 -34.702) 44.101 ======================= Grid point 130 (59/230) ======================= q-point: (-0.22 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.456 ( 8.749 13.170 12.358) 20.068 1.940 ( 27.184 5.115 12.311) 30.277 2.288 ( -10.858 -2.971 -7.795) 13.692 2.379 ( 2.790 7.119 2.671) 8.100 2.572 ( -6.642 1.245 -2.958) 7.376 2.831 ( -2.743 0.795 1.366) 3.166 2.873 ( 0.692 -0.675 9.731) 9.779 2.941 ( -6.801 -7.624 1.863) 10.384 3.305 ( 6.801 -1.544 -5.434) 8.841 3.414 ( -2.915 -0.277 -0.556) 2.980 3.870 ( 5.284 0.860 -5.187) 7.454 4.003 ( 1.311 3.880 4.985) 6.452 4.187 ( -1.636 1.966 0.601) 2.627 4.287 ( -1.936 3.870 -0.494) 4.356 4.583 ( -5.265 2.032 4.774) 7.391 4.702 ( 7.643 -6.935 4.885) 11.419 5.158 ( 0.020 1.900 -7.908) 8.133 5.290 ( -1.485 3.362 5.849) 6.908 5.409 ( 5.460 2.764 4.989) 7.895 5.490 ( 1.490 -1.183 1.860) 2.661 5.758 ( 8.796 -9.039 5.728) 13.852 6.093 ( -1.168 -2.562 -2.205) 3.577 6.467 ( 11.007 -2.943 -4.744) 12.342 6.636 ( 4.757 -0.624 -0.187) 4.802 6.937 ( 1.305 -4.430 -4.775) 6.643 7.458 ( 4.771 -0.522 -5.332) 7.174 8.494 ( 3.744 -3.533 5.882) 7.817 9.136 ( -3.721 5.590 -4.851) 8.284 9.950 ( 3.045 0.087 3.878) 4.932 10.188 ( 1.468 -2.173 -4.274) 5.015 10.334 ( -0.884 1.782 -3.730) 4.228 10.704 ( -1.040 9.926 -11.407) 15.157 10.881 ( 0.994 -1.401 11.599) 11.725 11.056 ( -5.278 -4.348 -6.913) 9.723 11.239 ( -1.279 -3.264 -3.990) 5.311 11.553 ( -11.127 0.630 6.956) 13.138 11.668 ( -2.028 -1.643 0.049) 2.611 11.798 ( -9.445 1.129 1.166) 9.584 13.645 ( 10.358 -2.471 4.400) 11.522 13.764 ( 4.064 0.121 -2.109) 4.580 16.718 ( -26.449 0.402 -11.785) 28.959 17.672 ( 31.270 -7.066 10.413) 33.707 19.328 ( -0.367 0.716 2.742) 2.858 19.374 ( 0.986 -0.454 -3.636) 3.794 19.739 ( 2.416 0.723 5.562) 6.106 19.841 ( -1.225 0.949 -5.944) 6.142 20.529 ( 9.569 -0.464 -1.467) 9.691 20.570 ( 16.100 0.527 -0.397) 16.114 21.326 ( 7.611 1.508 -7.048) 10.482 21.471 ( 6.597 -1.976 -0.239) 6.890 22.139 ( -9.857 0.951 3.976) 10.671 22.857 ( -12.226 0.974 -1.162) 12.320 24.265 ( 0.210 0.387 -2.815) 2.849 24.396 ( 0.301 -2.276 -2.030) 3.064 24.630 ( -3.641 0.357 4.021) 5.436 25.161 ( 6.260 -1.110 4.390) 7.726 25.623 ( -6.355 1.499 2.759) 7.089 25.891 ( -9.105 0.580 -1.777) 9.295 26.007 ( 3.959 -1.127 -6.865) 8.004 26.659 ( 3.889 2.628 -4.505) 6.505 47.174 ( -4.106 -0.609 6.102) 7.380 47.414 ( -3.565 0.273 7.727) 8.514 49.180 ( 1.668 0.196 -5.701) 5.943 49.482 ( 2.314 0.092 -3.452) 4.157 98.669 ( -4.436 1.132 1.834) 4.932 98.799 ( -0.821 -1.330 2.251) 2.740 98.828 ( 1.164 -1.288 3.669) 4.059 99.381 ( -5.960 -0.688 7.736) 9.789 100.526 ( 1.248 -1.156 2.013) 2.636 100.848 ( -1.448 -0.385 6.887) 7.048 101.245 ( 5.025 -0.863 1.310) 5.264 102.877 ( -28.404 16.038 -25.497) 41.402 ======================= Grid point 131 (60/230) ======================= q-point: (-0.11 0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.665 ( 10.336 7.343 15.348) 19.907 2.031 ( -13.362 -4.132 -4.687) 14.751 2.291 ( -0.449 7.510 6.187) 9.741 2.506 ( 4.583 -7.535 -0.156) 8.820 2.513 ( 12.524 -0.895 1.453) 12.640 2.792 ( -1.818 -0.793 0.714) 2.108 2.914 ( -2.913 -0.537 5.329) 6.097 2.938 ( -4.417 -4.464 7.747) 9.973 3.326 ( 1.904 1.515 -4.853) 5.429 3.459 ( 3.786 -2.684 1.388) 4.844 3.879 ( 2.439 -1.345 -7.800) 8.282 4.040 ( 1.804 0.009 -1.183) 2.157 4.141 ( -1.064 3.313 -0.963) 3.610 4.226 ( -3.413 2.976 5.646) 7.237 4.425 ( -10.590 6.911 6.143) 14.058 4.942 ( 7.767 -1.157 5.596) 9.642 5.051 ( -0.727 -0.997 -10.810) 10.880 5.276 ( -0.789 6.765 3.092) 7.480 5.542 ( 1.177 -3.358 1.904) 4.036 5.573 ( 9.538 -0.094 3.058) 10.017 5.945 ( 1.922 -1.335 0.675) 2.436 6.074 ( 0.375 -2.178 -0.232) 2.222 6.574 ( 5.522 -5.033 -8.920) 11.635 6.726 ( 4.107 0.114 1.094) 4.252 6.996 ( 4.886 -4.212 -3.031) 7.127 7.469 ( 2.936 1.959 -5.478) 6.516 8.613 ( 2.263 -1.736 3.750) 4.711 9.005 ( -2.716 3.565 -3.760) 5.850 10.034 ( 2.120 -0.279 2.358) 3.183 10.185 ( 1.759 0.873 -0.813) 2.126 10.289 ( -0.617 -1.546 -4.012) 4.344 10.587 ( 1.646 3.528 -4.475) 5.932 10.885 ( -3.411 1.127 -4.021) 5.392 10.989 ( -2.389 -2.836 -1.036) 3.851 11.218 ( -2.653 -3.265 2.808) 5.058 11.454 ( -7.480 -0.397 6.733) 10.072 11.630 ( -3.406 0.313 1.072) 3.585 11.689 ( -4.406 0.327 2.786) 5.224 13.798 ( 3.832 1.143 -4.784) 6.235 13.835 ( 6.192 -1.998 2.413) 6.940 16.276 ( -15.344 0.113 -6.501) 16.665 18.233 ( 18.984 -4.701 6.824) 20.714 19.315 ( -1.743 0.983 1.053) 2.261 19.353 ( -1.846 -0.511 -1.216) 2.269 19.765 ( 2.703 0.196 -7.504) 7.979 19.800 ( -0.645 0.170 3.057) 3.129 20.618 ( 3.438 -0.441 -1.474) 3.766 20.889 ( 21.127 0.189 -3.496) 21.415 21.356 ( 3.925 2.049 -5.387) 6.974 21.655 ( 14.324 -1.850 -2.414) 14.643 22.000 ( -12.115 0.270 7.777) 14.399 22.617 ( -14.897 -0.133 0.336) 14.901 24.269 ( 2.224 -0.224 -1.480) 2.680 24.387 ( -0.497 -1.393 -2.893) 3.249 24.593 ( -3.770 0.082 2.792) 4.692 25.295 ( 6.114 1.194 2.203) 6.608 25.502 ( -6.467 3.873 1.316) 7.652 25.716 ( -9.102 -0.733 -2.335) 9.425 26.074 ( 6.156 -5.842 -5.524) 10.126 26.676 ( 2.808 3.760 0.666) 4.740 47.162 ( -3.775 -0.532 5.813) 6.951 47.415 ( -3.750 0.278 7.537) 8.423 49.166 ( 2.145 0.204 -4.828) 5.287 49.487 ( 2.023 0.041 -4.042) 4.520 98.605 ( -3.181 1.249 0.279) 3.429 98.799 ( -1.849 -1.323 2.416) 3.317 98.896 ( 0.403 -0.681 5.629) 5.685 99.329 ( -5.108 0.161 2.186) 5.558 100.560 ( 0.562 -0.694 0.820) 1.213 100.882 ( -2.816 -1.213 7.716) 8.303 101.375 ( 7.330 -2.119 1.520) 7.780 102.195 ( -18.644 12.005 -14.092) 26.274 ======================= Grid point 137 (61/230) ======================= q-point: ( 0.56 -0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.455 ( 6.964 0.000 11.355) 13.321 1.482 ( 19.088 0.000 11.547) 22.308 2.217 ( 3.367 0.000 -5.212) 6.205 2.707 ( -0.482 -0.000 1.022) 1.130 2.758 ( -6.027 -0.000 -5.657) 8.266 2.864 ( -13.155 -0.000 -1.862) 13.286 2.882 ( 0.464 0.000 -4.494) 4.518 2.974 ( -6.153 -0.000 1.073) 6.246 3.153 ( 2.824 0.000 -3.269) 4.320 3.540 ( -8.473 -0.000 -1.942) 8.693 3.791 ( 8.682 0.000 -1.359) 8.788 4.044 ( 2.117 0.000 2.514) 3.287 4.188 ( -3.351 -0.000 6.631) 7.430 4.273 ( 9.547 0.000 1.606) 9.681 4.468 ( 4.242 0.000 10.843) 11.643 4.534 ( -1.345 -0.000 1.359) 1.912 5.176 ( 5.704 0.000 -2.693) 6.308 5.311 ( 9.691 0.000 0.544) 9.707 5.329 ( 4.549 0.000 13.990) 14.711 5.415 ( -5.805 -0.000 5.675) 8.118 5.542 ( -5.451 -0.000 -0.634) 5.488 6.035 ( 2.347 0.000 -1.847) 2.987 6.315 ( 7.414 0.000 -1.697) 7.605 6.575 ( 3.099 0.000 -1.519) 3.452 6.947 ( -1.494 -0.000 -7.632) 7.777 7.371 ( 6.789 0.000 -3.742) 7.752 8.334 ( 3.362 0.000 5.138) 6.140 9.315 ( -2.847 -0.000 -5.189) 5.919 9.904 ( 0.304 0.000 1.041) 1.085 10.152 ( 1.094 0.000 -3.418) 3.589 10.434 ( -1.225 -0.000 -4.829) 4.982 10.647 ( 5.774 0.000 18.043) 18.945 11.049 ( -3.512 -0.000 -7.787) 8.542 11.077 ( 0.411 0.000 -16.702) 16.707 11.250 ( -0.210 -0.000 -3.052) 3.059 11.666 ( -1.151 -0.000 -0.623) 1.309 11.716 ( -11.758 -0.000 4.533) 12.601 11.982 ( -10.963 -0.000 1.235) 11.032 13.387 ( 10.224 0.000 5.780) 11.745 13.705 ( 2.614 0.000 1.052) 2.818 16.956 ( 29.594 0.000 10.383) 31.362 17.339 ( -31.350 -0.000 -13.923) 34.303 19.245 ( 9.258 0.000 5.369) 10.702 19.386 ( 1.750 0.000 -4.278) 4.622 19.629 ( 5.327 0.000 4.541) 7.000 19.924 ( -3.337 -0.000 -1.299) 3.581 20.286 ( 13.778 0.000 -4.674) 14.549 20.452 ( 0.433 0.000 6.726) 6.740 21.251 ( 9.349 0.000 -8.733) 12.793 21.395 ( 0.128 0.000 1.834) 1.838 22.277 ( -6.497 -0.000 0.033) 6.497 23.061 ( -7.643 -0.000 -1.928) 7.882 24.328 ( -2.616 -0.000 -5.177) 5.801 24.368 ( 0.571 0.000 -0.594) 0.824 24.648 ( -1.931 -0.000 4.494) 4.891 24.987 ( 7.132 0.000 4.522) 8.445 25.647 ( 3.101 0.000 -2.604) 4.049 26.057 ( -7.070 -0.000 -0.219) 7.073 26.080 ( -7.611 -0.000 -0.141) 7.612 26.665 ( 5.204 0.000 -8.623) 10.071 47.184 ( -4.138 -0.000 6.464) 7.675 47.409 ( -3.161 -0.000 7.538) 8.174 49.208 ( 1.359 0.000 -6.151) 6.299 49.468 ( 2.721 0.000 -3.194) 4.196 98.727 ( 3.223 0.000 3.930) 5.083 98.745 ( -5.057 -0.000 2.720) 5.743 98.804 ( -1.124 -0.000 -0.236) 1.149 99.371 ( -4.367 -0.000 12.514) 13.254 100.465 ( 1.359 0.000 3.172) 3.451 100.822 ( -0.967 -0.000 3.952) 4.069 101.168 ( 2.731 0.000 0.395) 2.760 103.793 ( -23.984 -0.000 -33.816) 41.458 ======================= Grid point 139 (62/230) ======================= q-point: (-0.33 0.56 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.620 ( 6.965 7.353 11.173) 15.080 1.994 ( 27.118 2.159 10.182) 29.047 2.228 ( -3.371 -3.551 -8.117) 9.479 2.433 ( -3.336 1.731 -10.123) 10.798 2.597 ( -12.817 -0.012 -5.960) 14.135 2.815 ( -5.563 -1.755 3.546) 6.826 2.868 ( 0.056 0.394 7.959) 7.969 2.911 ( -4.722 1.666 6.713) 8.375 3.274 ( 11.622 -1.939 -6.776) 13.592 3.411 ( -4.922 -0.153 -0.807) 4.990 3.878 ( 4.553 0.216 -4.504) 6.408 4.046 ( 0.757 1.868 -2.678) 3.352 4.191 ( -3.032 -0.634 5.239) 6.086 4.352 ( -2.383 3.900 1.009) 4.681 4.569 ( -3.567 -3.216 5.634) 7.404 4.645 ( 11.127 -0.713 8.664) 14.120 5.175 ( -0.217 0.461 -9.191) 9.205 5.361 ( -4.194 5.047 11.381) 13.138 5.453 ( 4.501 3.366 5.162) 7.631 5.486 ( 2.866 -0.165 0.705) 2.956 5.614 ( 9.359 -9.097 5.635) 14.216 6.049 ( 0.346 -2.044 -2.576) 3.306 6.465 ( 10.552 0.853 -1.662) 10.716 6.630 ( 4.920 -0.163 -0.562) 4.955 6.885 ( 0.665 -2.109 -5.972) 6.368 7.448 ( 5.387 -0.512 -3.697) 6.554 8.459 ( 4.272 -1.225 6.903) 8.209 9.193 ( -4.441 2.088 -6.096) 7.826 9.950 ( 2.552 -0.049 3.115) 4.027 10.157 ( 1.970 -1.403 -2.968) 3.829 10.359 ( -1.391 1.121 -6.473) 6.715 10.839 ( 0.242 6.158 -5.282) 8.117 10.871 ( -0.640 2.408 7.671) 8.066 10.975 ( -3.951 -7.111 -10.634) 13.389 11.210 ( -0.927 -0.840 -4.159) 4.343 11.558 ( -11.321 0.113 6.212) 12.914 11.651 ( -1.243 -0.619 0.945) 1.679 11.808 ( -9.913 0.296 1.005) 9.968 13.619 ( 10.271 -0.934 5.102) 11.507 13.766 ( 4.361 0.061 -1.519) 4.618 16.722 ( -26.612 0.161 -11.911) 29.157 17.602 ( 31.422 -2.502 11.916) 33.699 19.336 ( -0.336 0.286 3.034) 3.066 19.371 ( 0.450 -0.055 -3.283) 3.314 19.747 ( 2.060 0.292 5.678) 6.047 19.851 ( -1.535 0.354 -6.127) 6.326 20.522 ( 10.734 -0.282 -2.326) 10.987 20.576 ( 15.215 0.212 -0.007) 15.217 21.342 ( 8.020 0.570 -6.956) 10.632 21.451 ( 6.504 -0.764 -0.010) 6.549 22.147 ( -10.054 0.262 3.629) 10.692 22.867 ( -12.518 0.415 -2.014) 12.686 24.269 ( -0.110 0.136 -3.018) 3.023 24.372 ( 0.593 -0.862 -1.772) 2.058 24.633 ( -3.853 0.077 4.150) 5.663 25.152 ( 7.606 -0.208 4.292) 8.736 25.633 ( -4.750 0.165 2.743) 5.488 25.898 ( -10.114 0.297 -1.611) 10.246 26.002 ( 2.614 0.041 -8.133) 8.543 26.682 ( 3.388 0.690 -3.623) 5.008 47.168 ( -3.938 -0.200 5.931) 7.122 47.417 ( -3.576 0.111 7.730) 8.518 49.182 ( 1.646 0.069 -5.658) 5.893 49.483 ( 2.328 0.009 -3.480) 4.187 98.682 ( -4.550 0.468 2.023) 5.001 98.788 ( -1.149 -0.279 1.192) 1.679 98.815 ( 2.171 -0.551 4.620) 5.134 99.375 ( -5.207 -0.204 7.447) 9.089 100.514 ( 1.377 -0.417 2.187) 2.618 100.845 ( -1.376 -0.041 5.864) 6.024 101.236 ( 4.438 -0.369 1.020) 4.569 103.033 ( -29.328 5.317 -27.547) 40.586 ======================= Grid point 140 (63/230) ======================= q-point: (-0.22 0.56 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.789 ( 8.607 8.424 11.271) 16.495 1.969 ( -14.433 -3.280 -9.311) 17.487 2.335 ( -11.563 -2.727 -7.625) 14.117 2.441 ( 6.545 -1.453 -2.936) 7.319 2.514 ( 21.087 1.532 7.618) 22.473 2.767 ( -2.844 -1.747 1.153) 3.531 2.883 ( -4.500 -0.862 8.480) 9.638 2.923 ( -2.902 -0.772 7.490) 8.070 3.341 ( 2.247 0.739 -4.470) 5.057 3.419 ( 4.370 -2.478 -1.608) 5.275 3.874 ( 1.311 0.360 -7.032) 7.162 4.029 ( 0.673 -1.124 -4.265) 4.462 4.178 ( -2.097 1.568 2.132) 3.376 4.250 ( -7.471 0.982 3.680) 8.386 4.517 ( -6.647 4.652 7.437) 11.006 4.934 ( 9.984 -0.033 10.659) 14.605 5.044 ( -2.536 0.013 -12.279) 12.538 5.379 ( -0.631 6.569 9.365) 11.457 5.506 ( 1.637 -0.432 -0.629) 1.806 5.582 ( 7.572 0.430 1.392) 7.711 5.878 ( 7.775 -7.919 3.077) 11.517 6.024 ( -2.926 -2.476 -1.893) 4.274 6.564 ( 6.543 1.813 -6.808) 9.615 6.742 ( 6.566 2.204 2.013) 7.213 6.922 ( 5.030 -5.549 -2.142) 7.790 7.488 ( 3.121 0.717 -3.893) 5.041 8.592 ( 3.368 -1.025 5.787) 6.774 9.048 ( -4.358 2.175 -5.755) 7.539 10.030 ( 2.684 -0.160 3.990) 4.812 10.181 ( 1.946 -1.411 -1.852) 3.035 10.269 ( -2.148 -0.650 -6.461) 6.840 10.669 ( -0.154 6.931 -9.107) 11.445 10.866 ( -4.099 -4.107 -7.508) 9.489 10.965 ( -0.338 -0.232 4.428) 4.447 11.181 ( -1.536 -1.739 1.875) 2.983 11.447 ( -7.653 -0.428 5.212) 9.269 11.637 ( -2.350 0.625 1.943) 3.112 11.686 ( -5.419 -0.516 2.917) 6.176 13.810 ( 6.594 -1.271 3.156) 7.420 13.813 ( 4.109 0.752 -4.098) 5.852 16.277 ( -15.470 0.073 -6.662) 16.844 18.175 ( 21.151 -2.987 8.603) 23.028 19.327 ( -1.966 0.609 1.499) 2.546 19.349 ( -1.364 -0.127 -0.822) 1.598 19.772 ( 1.931 0.708 -7.266) 7.552 19.798 ( -0.965 -0.319 2.907) 3.079 20.612 ( 3.593 -0.308 -2.383) 4.322 20.890 ( 21.009 0.045 -3.962) 21.379 21.380 ( 3.341 1.205 -3.976) 5.331 21.633 ( 15.024 -1.103 -3.315) 15.425 22.002 ( -12.470 0.081 7.296) 14.448 22.616 ( -15.131 -0.075 -0.774) 15.151 24.269 ( 2.171 0.103 -1.398) 2.584 24.368 ( 0.151 -1.116 -2.527) 2.767 24.594 ( -3.948 0.031 2.694) 4.780 25.312 ( 7.626 1.051 3.114) 8.304 25.547 ( -6.784 2.223 3.156) 7.805 25.703 ( -10.321 -0.955 -2.730) 10.718 26.014 ( 6.113 -2.409 -9.345) 11.423 26.714 ( 2.293 1.551 1.866) 3.339 47.155 ( -3.574 -0.308 5.670) 6.709 47.418 ( -3.809 0.183 7.585) 8.490 49.168 ( 2.084 0.122 -4.772) 5.208 49.487 ( 1.985 0.002 -4.135) 4.587 98.621 ( -3.413 0.855 0.739) 3.596 98.785 ( -1.219 -0.568 2.345) 2.703 98.887 ( 0.589 -0.466 5.628) 5.677 99.331 ( -4.703 0.093 2.254) 5.216 100.551 ( 0.852 -0.487 1.105) 1.478 100.870 ( -2.480 -0.507 6.725) 7.185 101.344 ( 6.264 -1.785 1.305) 6.642 102.338 ( -22.599 7.109 -18.063) 29.791 ======================= Grid point 141 (64/230) ======================= q-point: (-0.11 -0.44 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.693 ( -15.007 -7.554 -4.965) 17.519 1.957 ( 0.938 -0.256 7.334) 7.399 2.142 ( -4.231 -6.013 -4.327) 8.531 2.467 ( 1.955 0.463 -3.172) 3.755 2.702 ( -1.352 1.226 -1.630) 2.447 2.877 ( -4.398 0.386 6.422) 7.793 2.901 ( 6.190 -4.259 4.244) 8.629 2.967 ( 2.168 1.186 9.167) 9.494 3.358 ( 4.205 2.160 -2.477) 5.337 3.471 ( 0.495 -4.732 -0.159) 4.761 3.809 ( -0.229 -0.190 -8.443) 8.449 3.959 ( -4.558 -3.012 -6.715) 8.657 4.157 ( 1.256 1.302 0.324) 1.838 4.202 ( -3.838 -0.880 4.713) 6.141 4.461 ( -4.246 7.405 13.774) 16.205 4.895 ( -2.304 -0.676 -11.817) 12.059 5.126 ( 3.741 1.563 5.523) 6.852 5.351 ( -0.942 8.866 1.421) 9.028 5.573 ( 2.972 -1.003 4.198) 5.240 5.716 ( 6.158 -3.157 -1.601) 7.103 5.909 ( -5.342 2.194 0.450) 5.792 6.054 ( 1.637 -6.541 -1.483) 6.904 6.582 ( 5.177 0.850 -8.621) 10.092 6.818 ( 4.120 4.786 1.758) 6.556 7.051 ( 6.130 -1.297 -1.446) 6.431 7.485 ( 2.114 1.368 -3.805) 4.563 8.655 ( -0.149 1.871 1.094) 2.173 8.947 ( -1.354 -1.060 -3.219) 3.649 10.072 ( -0.813 2.060 0.491) 2.268 10.217 ( 0.352 -3.189 -0.634) 3.271 10.222 ( 1.452 -3.627 -0.526) 3.942 10.602 ( 2.185 1.230 -3.734) 4.498 10.778 ( -2.037 -1.904 -5.894) 6.520 10.939 ( -0.237 0.569 -6.319) 6.349 11.222 ( -1.370 -1.205 9.646) 9.817 11.391 ( -3.962 -1.362 3.378) 5.382 11.618 ( -1.317 1.126 4.105) 4.456 11.668 ( -1.743 -0.302 4.423) 4.764 13.809 ( 1.862 1.719 -6.880) 7.332 13.913 ( 2.178 -0.827 1.619) 2.837 16.107 ( -1.159 -0.096 0.410) 1.233 18.440 ( 3.508 -0.231 -0.876) 3.623 19.294 ( -2.133 0.779 -0.481) 2.321 19.302 ( -2.397 0.433 -0.344) 2.460 19.793 ( -1.279 -0.206 3.049) 3.313 19.824 ( 8.315 -0.056 -2.896) 8.805 20.607 ( 0.041 -0.874 -6.883) 6.938 21.200 ( 17.018 -0.553 -0.171) 17.028 21.379 ( 2.380 1.948 -4.504) 5.454 21.838 ( -14.657 -0.275 7.961) 16.682 21.900 ( 17.282 -1.647 -2.413) 17.527 22.357 ( -15.073 -0.794 0.622) 15.107 24.303 ( 2.676 0.407 -1.296) 3.001 24.354 ( 0.222 -0.657 -1.901) 2.024 24.549 ( -3.031 -0.057 0.472) 3.068 25.395 ( -3.054 3.069 -2.098) 4.811 25.466 ( 2.804 3.091 0.208) 4.178 25.553 ( -5.463 -1.952 0.364) 5.812 26.076 ( 5.285 -6.178 -6.309) 10.292 26.769 ( 1.629 2.902 6.734) 7.512 47.149 ( -3.174 -0.317 5.664) 6.501 47.415 ( -3.901 0.197 7.224) 8.212 49.170 ( 2.550 0.121 -3.778) 4.559 49.480 ( 1.701 -0.091 -4.984) 5.267 98.569 ( -1.936 1.125 -0.463) 2.287 98.795 ( -0.982 -0.394 3.687) 3.836 98.934 ( -1.302 -0.463 5.995) 6.152 99.258 ( -3.504 0.429 -2.162) 4.139 100.570 ( 0.250 -0.149 0.726) 0.782 100.878 ( -3.725 -0.901 6.149) 7.245 101.470 ( 3.878 -2.354 -1.520) 4.784 101.914 ( -7.610 1.516 -7.023) 10.466 ======================= Grid point 148 (65/230) ======================= q-point: ( 0.67 -0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.862 ( 7.094 0.000 10.368) 12.562 1.944 ( -14.420 -0.000 -11.151) 18.229 2.302 ( -12.343 -0.000 -8.767) 15.139 2.424 ( 7.098 0.000 -8.369) 10.973 2.532 ( 22.495 0.000 8.931) 24.203 2.757 ( -3.011 -0.000 2.108) 3.676 2.884 ( -5.365 -0.000 9.246) 10.689 2.911 ( -3.115 -0.000 7.170) 7.817 3.348 ( -0.976 -0.000 -1.478) 1.771 3.399 ( 7.564 0.000 -5.453) 9.325 3.878 ( 1.027 0.000 -5.692) 5.784 4.019 ( 0.206 0.000 -5.734) 5.738 4.188 ( -2.643 -0.000 4.605) 5.309 4.258 ( -8.866 -0.000 1.631) 9.015 4.550 ( -4.457 -0.000 7.219) 8.484 4.935 ( 10.205 0.000 12.373) 16.038 5.045 ( -3.017 -0.000 -12.798) 13.149 5.426 ( -1.194 -0.000 11.931) 11.990 5.534 ( 1.659 0.000 1.177) 2.034 5.576 ( 5.517 0.000 -0.703) 5.561 5.793 ( 10.441 0.000 1.964) 10.624 6.009 ( -2.767 -0.000 -1.360) 3.084 6.583 ( 6.306 0.000 -6.444) 9.016 6.773 ( 10.250 0.000 3.985) 10.997 6.865 ( 2.842 0.000 -3.247) 4.315 7.493 ( 3.274 0.000 -3.200) 4.578 8.585 ( 3.715 0.000 6.491) 7.479 9.064 ( -4.898 -0.000 -6.516) 8.152 10.029 ( 2.865 0.000 4.639) 5.452 10.166 ( 1.930 0.000 -2.054) 2.819 10.266 ( -2.741 -0.000 -7.679) 8.154 10.757 ( -1.455 -0.000 -12.824) 12.907 10.797 ( -2.533 -0.000 -6.823) 7.278 10.967 ( -0.629 -0.000 6.605) 6.635 11.168 ( -1.197 -0.000 1.491) 1.913 11.444 ( -7.711 -0.000 4.730) 9.046 11.644 ( -1.317 -0.000 2.458) 2.789 11.681 ( -6.388 -0.000 2.684) 6.929 13.801 ( 6.811 0.000 3.504) 7.659 13.819 ( 4.156 0.000 -3.901) 5.700 16.278 ( -15.521 -0.000 -6.727) 16.916 18.152 ( 21.903 0.000 9.254) 23.777 19.332 ( -2.060 -0.000 1.665) 2.649 19.348 ( -1.219 -0.000 -0.686) 1.399 19.780 ( 2.118 0.000 -9.319) 9.556 19.794 ( -1.507 -0.000 4.946) 5.170 20.610 ( 3.693 0.000 -2.771) 4.617 20.891 ( 20.961 0.000 -4.079) 21.354 21.389 ( 3.062 0.000 -3.319) 4.516 21.625 ( 15.349 0.000 -3.772) 15.806 22.002 ( -12.606 -0.000 7.157) 14.496 22.615 ( -15.231 -0.000 -1.249) 15.282 24.270 ( 2.222 0.000 -1.265) 2.557 24.359 ( 0.327 0.000 -2.495) 2.517 24.594 ( -3.991 -0.000 2.668) 4.800 25.321 ( 8.138 0.000 3.584) 8.892 25.563 ( -6.513 -0.000 4.264) 7.784 25.695 ( -10.981 -0.000 -3.416) 11.500 25.998 ( 5.916 0.000 -10.777) 12.294 26.725 ( 2.136 0.000 2.306) 3.143 47.153 ( -3.504 -0.000 5.606) 6.611 47.420 ( -3.834 -0.000 7.605) 8.517 49.169 ( 2.061 0.000 -4.748) 5.176 49.487 ( 1.975 0.000 -4.166) 4.611 98.627 ( -3.497 -0.000 0.906) 3.612 98.781 ( -1.033 -0.000 2.288) 2.510 98.883 ( 0.662 0.000 5.650) 5.689 99.331 ( -4.581 -0.000 2.303) 5.128 100.547 ( 0.953 0.000 1.201) 1.533 100.866 ( -2.373 -0.000 6.335) 6.765 101.330 ( 5.730 0.000 1.137) 5.842 102.391 ( -23.802 -0.000 -19.380) 30.694 ======================= Grid point 150 (66/230) ======================= q-point: (-0.22 -0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.617 ( -15.540 -2.683 -6.989) 17.249 1.905 ( -13.768 -3.805 -6.550) 15.714 2.133 ( 5.266 1.874 4.242) 7.017 2.470 ( 4.793 -0.112 -5.157) 7.041 2.724 ( -0.699 1.388 -3.747) 4.057 2.834 ( 1.632 -3.031 2.876) 4.485 2.890 ( -3.933 0.245 4.964) 6.338 2.979 ( 6.569 0.356 10.695) 12.557 3.375 ( 5.978 0.119 -1.034) 6.068 3.419 ( -1.664 -1.597 -1.093) 2.552 3.830 ( -0.239 1.923 -5.084) 5.441 3.916 ( -6.113 -2.382 -7.385) 9.878 4.167 ( -1.670 0.319 0.344) 1.735 4.191 ( -2.202 -0.554 5.158) 5.636 4.539 ( -4.780 2.886 11.698) 12.963 4.886 ( -2.290 -0.325 -12.816) 13.023 5.130 ( 1.794 -0.240 8.666) 8.853 5.498 ( -1.222 9.127 5.541) 10.747 5.568 ( 5.571 0.728 2.286) 6.065 5.655 ( 3.758 -5.527 -4.038) 7.809 5.932 ( -5.037 0.794 2.212) 5.558 5.956 ( 4.725 -4.892 -0.878) 6.858 6.599 ( 4.573 0.843 -9.287) 10.386 6.896 ( 5.236 4.625 1.021) 7.060 7.017 ( 10.703 -2.760 2.407) 11.312 7.498 ( 0.957 0.412 -3.338) 3.497 8.674 ( 1.422 0.676 3.522) 3.858 8.936 ( -3.488 -0.361 -5.595) 6.603 10.105 ( -1.082 2.706 -0.430) 2.946 10.156 ( 0.275 -4.187 -0.976) 4.308 10.192 ( 0.107 -1.025 0.325) 1.081 10.646 ( 1.771 3.889 -8.255) 9.295 10.730 ( -1.342 -3.941 -6.287) 7.541 10.949 ( -0.767 0.477 -5.426) 5.501 11.212 ( -0.709 -0.276 10.797) 10.824 11.376 ( -3.895 -0.584 2.160) 4.492 11.637 ( -1.346 1.305 3.908) 4.334 11.657 ( -1.570 -1.105 4.879) 5.243 13.828 ( 2.132 0.705 -6.484) 6.862 13.904 ( 2.484 -0.344 2.053) 3.241 16.106 ( -1.206 -0.039 0.318) 1.247 18.437 ( 5.466 -0.142 0.225) 5.472 19.303 ( -2.177 0.423 -0.019) 2.218 19.306 ( -2.494 0.081 -0.236) 2.507 19.791 ( -2.867 -0.067 3.671) 4.658 19.824 ( 10.152 0.057 -3.763) 10.827 20.598 ( 0.063 -0.328 -7.574) 7.582 21.195 ( 16.808 -0.204 -0.671) 16.822 21.399 ( 1.828 0.725 -3.309) 3.849 21.835 ( -14.739 -0.122 7.661) 16.612 21.883 ( 17.480 -0.641 -3.064) 17.758 22.349 ( -14.979 -0.338 -0.071) 14.983 24.312 ( 3.427 0.678 -0.843) 3.594 24.342 ( 0.024 -0.762 -2.055) 2.192 24.548 ( -2.970 -0.023 0.425) 3.000 25.434 ( -4.714 1.911 -1.676) 5.356 25.499 ( -0.864 1.061 2.856) 3.167 25.526 ( -0.829 -1.252 -0.412) 1.557 26.014 ( 5.429 -2.225 -9.661) 11.303 26.795 ( 1.515 0.883 7.752) 7.948 47.145 ( -3.062 -0.119 5.546) 6.336 47.417 ( -3.963 0.078 7.287) 8.295 49.172 ( 2.488 0.045 -3.730) 4.484 49.479 ( 1.660 -0.041 -5.050) 5.316 98.581 ( -2.143 0.462 -0.054) 2.193 98.792 ( -0.771 -0.111 3.667) 3.748 98.929 ( -1.169 -0.184 5.850) 5.968 99.263 ( -3.519 0.151 -1.973) 4.037 100.568 ( 0.515 -0.080 0.836) 0.985 100.869 ( -3.474 -0.268 5.703) 6.683 101.436 ( 4.399 -1.597 -0.608) 4.719 101.937 ( -12.455 1.043 -10.469) 16.304 ======================= Grid point 151 (67/230) ======================= q-point: (-0.11 -0.33 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.348 ( -16.632 -7.122 -0.182) 18.093 1.595 ( -17.567 -15.772 -12.952) 26.928 2.310 ( 8.526 2.476 8.333) 12.176 2.506 ( 3.171 1.780 -1.711) 4.019 2.615 ( -6.117 0.130 -7.599) 9.756 2.784 ( -7.023 -0.610 -0.884) 7.104 2.895 ( -2.092 -5.790 -2.391) 6.605 3.102 ( 0.730 4.648 9.526) 10.625 3.322 ( -7.114 -4.102 1.315) 8.316 3.489 ( -0.096 -0.819 -0.427) 0.929 3.744 ( -2.127 -0.016 -5.700) 6.084 3.912 ( 10.499 -1.031 0.172) 10.550 4.125 ( -2.871 -0.867 -1.097) 3.193 4.240 ( 1.385 0.100 5.409) 5.585 4.554 ( -2.859 2.807 11.925) 12.581 4.772 ( -0.612 -0.115 -8.089) 8.113 5.182 ( -0.876 -0.626 1.629) 1.953 5.381 ( -1.724 11.055 -5.514) 12.473 5.635 ( -5.182 -1.191 -2.004) 5.683 5.664 ( -0.953 -2.531 1.919) 3.316 5.937 ( 1.986 2.047 8.132) 8.618 5.998 ( -1.009 -3.393 -3.909) 5.274 6.579 ( 3.212 -0.041 -10.031) 10.533 6.965 ( 4.976 5.113 2.948) 7.720 7.166 ( 6.052 8.388 -0.794) 10.374 7.493 ( 2.510 -2.082 -2.835) 4.321 8.661 ( -1.583 5.356 -0.953) 5.666 8.892 ( 0.364 -5.473 -2.295) 5.946 9.979 ( -5.941 -1.847 -5.565) 8.347 10.208 ( -0.174 -3.107 0.538) 3.158 10.281 ( 4.267 -1.100 7.288) 8.516 10.612 ( 1.027 0.237 -2.676) 2.877 10.706 ( 1.868 -2.823 -5.950) 6.845 10.877 ( 0.784 -0.288 -9.351) 9.388 11.299 ( -0.186 0.921 10.214) 10.257 11.371 ( -0.322 -1.945 3.767) 4.251 11.642 ( -0.068 0.684 1.963) 2.080 11.718 ( 1.668 0.154 7.762) 7.941 13.762 ( -0.974 1.931 -9.186) 9.437 13.928 ( -1.286 -0.013 1.127) 1.710 16.243 ( 13.002 -0.162 7.505) 15.013 18.341 ( -9.677 2.929 -9.248) 13.702 19.264 ( -1.206 0.711 -1.533) 2.076 19.292 ( 2.696 0.435 -1.528) 3.129 19.759 ( -4.284 -0.698 2.422) 4.971 20.014 ( 10.746 1.485 3.499) 11.398 20.502 ( -2.848 -1.017 -9.549) 10.016 21.360 ( -0.997 2.103 -0.376) 2.358 21.424 ( -0.385 -2.238 4.020) 4.618 21.672 ( -3.358 0.121 1.032) 3.515 22.025 ( -10.756 -1.110 2.530) 11.105 22.258 ( 14.226 -1.225 -2.436) 14.485 24.311 ( -0.596 0.371 -0.946) 1.178 24.380 ( 4.089 -0.036 -1.252) 4.277 24.503 ( -1.675 0.185 -1.593) 2.318 25.241 ( -8.376 0.251 -6.835) 10.813 25.476 ( -2.060 0.438 3.044) 3.702 25.635 ( 8.476 2.958 -0.496) 8.991 26.056 ( 4.194 -6.251 -6.550) 9.979 26.890 ( 0.996 2.613 11.722) 12.051 47.145 ( -2.743 -0.191 5.752) 6.376 47.409 ( -3.979 0.115 6.845) 7.918 49.189 ( 2.838 0.031 -2.823) 4.003 49.459 ( 1.481 -0.187 -5.905) 6.091 98.549 ( -0.565 0.852 -0.771) 1.280 98.817 ( -0.749 -0.138 4.979) 5.037 98.946 ( -2.885 -0.314 5.694) 6.391 99.182 ( -2.231 0.341 -4.611) 5.134 100.578 ( -0.149 0.375 0.798) 0.894 100.850 ( -4.225 -0.499 4.525) 6.211 101.398 ( -5.577 -0.040 -6.302) 8.415 101.886 ( 8.470 -8.444 0.650) 11.978 ======================= Grid point 159 (68/230) ======================= q-point: (-0.22 -0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.294 ( -17.145 -0.000 -0.939) 17.171 1.472 ( -20.331 -0.000 -14.326) 24.871 2.333 ( 8.098 0.000 7.353) 10.938 2.521 ( 2.823 0.000 -1.635) 3.262 2.622 ( -6.167 -0.000 -9.068) 10.967 2.779 ( -4.041 -0.000 -5.864) 7.122 2.836 ( -3.375 -0.000 0.685) 3.443 3.143 ( 3.574 0.000 9.543) 10.191 3.290 ( -11.740 -0.000 1.551) 11.842 3.481 ( -0.069 -0.000 -0.000) 0.069 3.747 ( -1.952 -0.000 -7.619) 7.865 3.905 ( 10.460 0.000 3.353) 10.984 4.119 ( -2.380 -0.000 -1.564) 2.848 4.238 ( 0.681 0.000 6.066) 6.104 4.576 ( -3.337 -0.000 10.208) 10.740 4.771 ( -0.113 -0.000 -7.390) 7.391 5.170 ( -1.290 -0.000 2.352) 2.683 5.522 ( -5.054 -0.000 -1.182) 5.190 5.568 ( -0.019 -0.000 -12.393) 12.393 5.654 ( -1.932 -0.000 6.837) 7.105 5.955 ( 1.523 0.000 10.844) 10.951 5.966 ( -0.084 -0.000 -3.631) 3.632 6.579 ( 3.010 0.000 -10.609) 11.028 6.999 ( 4.270 0.000 1.662) 4.582 7.249 ( 13.073 0.000 2.569) 13.323 7.465 ( -1.223 -0.000 -3.739) 3.934 8.711 ( 0.135 0.000 1.611) 1.617 8.841 ( -1.677 -0.000 -4.933) 5.210 9.964 ( -6.218 -0.000 -7.426) 9.685 10.184 ( -1.210 -0.000 0.935) 1.530 10.269 ( 4.291 0.000 10.154) 11.023 10.640 ( -2.189 -0.000 -3.919) 4.489 10.659 ( 5.905 0.000 -8.147) 10.062 10.877 ( -0.305 -0.000 -8.971) 8.976 11.311 ( -0.074 -0.000 12.828) 12.828 11.351 ( -0.056 -0.000 0.849) 0.851 11.648 ( -0.381 -0.000 1.917) 1.955 11.719 ( 2.127 0.000 7.865) 8.148 13.777 ( -0.731 -0.000 -9.013) 9.042 13.928 ( -1.108 -0.000 1.321) 1.724 16.241 ( 12.979 0.000 7.482) 14.981 18.363 ( -8.388 -0.000 -8.766) 12.133 19.270 ( -1.546 -0.000 -1.328) 2.038 19.295 ( 3.175 0.000 -1.431) 3.483 19.753 ( -4.413 -0.000 2.311) 4.982 20.027 ( 11.692 0.000 3.530) 12.214 20.494 ( -2.824 -0.000 -9.922) 10.316 21.386 ( -3.153 -0.000 7.215) 7.874 21.397 ( 1.003 0.000 -3.244) 3.396 21.673 ( -3.241 -0.000 1.056) 3.409 22.016 ( -10.401 -0.000 2.303) 10.653 22.249 ( 13.937 0.000 -2.806) 14.217 24.314 ( -0.954 -0.000 -1.039) 1.411 24.379 ( 4.429 0.000 -1.136) 4.572 24.504 ( -1.454 -0.000 -1.639) 2.191 25.243 ( -9.143 -0.000 -6.658) 11.310 25.478 ( -2.085 -0.000 3.744) 4.285 25.662 ( 8.853 0.000 0.255) 8.857 26.007 ( 4.187 0.000 -8.799) 9.745 26.909 ( 1.136 0.000 12.509) 12.561 47.144 ( -2.695 -0.000 5.663) 6.271 47.410 ( -4.013 -0.000 6.892) 7.976 49.189 ( 2.794 0.000 -2.797) 3.953 49.458 ( 1.428 0.000 -5.943) 6.112 98.555 ( -0.695 -0.000 -0.514) 0.865 98.816 ( -0.734 -0.000 4.912) 4.967 98.943 ( -2.804 -0.000 5.519) 6.190 99.185 ( -2.292 -0.000 -4.461) 5.015 100.581 ( 0.162 0.000 0.858) 0.873 100.847 ( -4.085 -0.000 4.377) 5.987 101.395 ( -5.026 -0.000 -5.927) 7.771 101.823 ( 4.342 0.000 -0.958) 4.447 ======================= Grid point 160 (69/230) ======================= q-point: (-0.11 -0.22 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.022 ( -18.750 -6.613 -4.566) 20.399 1.046 ( -20.354 -12.521 -3.027) 24.088 2.217 ( -27.699 -1.978 -7.317) 28.718 2.518 ( 6.552 0.675 6.805) 9.471 2.598 ( -1.972 3.308 -7.015) 8.003 2.674 ( 3.519 -2.584 -0.610) 4.408 2.807 ( -1.662 -2.149 -0.656) 2.795 3.106 ( -6.822 -0.956 -2.688) 7.395 3.303 ( 3.690 -0.982 9.712) 10.436 3.379 ( -7.413 -1.018 -3.786) 8.386 3.712 ( 2.818 1.156 -3.420) 4.580 4.033 ( -4.891 -1.135 3.854) 6.330 4.182 ( 10.676 2.021 1.663) 10.992 4.304 ( 1.197 -2.047 5.051) 5.580 4.621 ( 3.738 0.918 3.680) 5.325 4.770 ( 1.483 1.156 5.096) 5.432 5.110 ( -6.278 -0.408 -5.288) 8.219 5.354 ( -2.929 9.361 -9.276) 13.500 5.461 ( -4.944 -4.787 -4.393) 8.165 5.670 ( -2.103 -0.692 4.719) 5.213 5.877 ( -5.331 0.529 -6.038) 8.072 6.086 ( 1.568 0.956 11.131) 11.282 6.530 ( 1.716 -0.288 -9.947) 10.098 7.074 ( 3.366 1.044 1.409) 3.796 7.331 ( 0.796 15.297 -1.915) 15.436 7.524 ( 8.558 -5.881 -0.003) 10.384 8.682 ( -0.491 7.866 -0.790) 7.921 8.835 ( 1.098 -8.461 -2.193) 8.810 9.810 ( -6.057 -2.060 -5.015) 8.129 10.172 ( -2.102 -2.454 1.319) 3.490 10.433 ( 4.271 1.436 8.978) 10.045 10.575 ( -1.774 -1.932 -1.731) 3.143 10.710 ( 4.943 0.083 -5.925) 7.717 10.803 ( 1.740 -3.037 -10.489) 11.057 11.380 ( 2.389 0.826 2.601) 3.627 11.415 ( -1.371 -1.131 11.098) 11.239 11.674 ( 2.740 -0.061 0.359) 2.764 11.837 ( 3.645 0.571 7.733) 8.568 13.648 ( -3.574 1.528 -11.229) 11.883 13.895 ( -3.541 0.317 0.823) 3.649 16.650 ( 23.988 -0.130 12.988) 27.278 18.058 ( -13.396 3.867 -14.162) 19.874 19.225 ( -1.592 0.258 -3.219) 3.600 19.384 ( 8.712 1.262 -1.988) 9.024 19.679 ( -6.030 -0.630 0.497) 6.083 20.224 ( 6.691 2.898 5.661) 9.232 20.353 ( -3.867 -0.719 -9.456) 10.241 21.162 ( -24.570 -1.144 8.027) 25.873 21.381 ( 0.209 1.034 -2.465) 2.681 21.779 ( -3.078 1.776 0.761) 3.635 21.818 ( -0.124 -3.362 1.084) 3.534 22.535 ( 17.396 -0.962 -0.274) 17.425 24.291 ( -1.203 -0.465 -0.071) 1.292 24.440 ( 4.321 0.117 -2.134) 4.821 24.473 ( -0.100 0.481 -2.077) 2.134 25.038 ( -7.636 -0.378 -8.351) 11.322 25.490 ( 0.078 0.399 2.933) 2.961 25.792 ( 8.327 2.938 -2.022) 9.059 26.020 ( 3.137 -5.257 -6.256) 8.754 27.038 ( 0.779 2.378 15.035) 15.242 47.150 ( -2.610 -0.115 6.205) 6.732 47.399 ( -3.925 0.060 6.441) 7.543 49.217 ( 2.895 -0.030 -2.237) 3.659 49.429 ( 1.460 -0.249 -6.509) 6.675 98.550 ( 0.769 0.462 -0.540) 1.047 98.848 ( -1.336 -0.114 6.654) 6.788 98.930 ( -4.071 -0.218 4.956) 6.417 99.119 ( -0.923 0.214 -3.509) 3.635 100.584 ( -0.586 0.920 0.706) 1.300 100.809 ( -4.068 -0.112 3.277) 5.225 101.250 ( -4.995 -0.126 -5.272) 7.263 102.001 ( 11.402 -11.684 1.244) 16.373 ======================= Grid point 169 (70/230) ======================= q-point: (-0.11 -0.11 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.487 ( -19.987 -0.000 -17.176) 26.353 0.790 ( -21.402 -0.000 22.206) 30.840 1.571 ( -40.644 -0.000 -2.125) 40.700 2.429 ( -6.273 -0.000 -6.311) 8.898 2.657 ( 3.077 0.000 3.627) 4.756 2.757 ( -1.877 -0.000 2.346) 3.005 2.842 ( 6.341 0.000 5.966) 8.707 2.994 ( 0.627 0.000 -6.600) 6.630 3.222 ( -3.486 -0.000 -4.952) 6.056 3.443 ( 2.053 0.000 7.976) 8.236 3.765 ( 4.175 0.000 -1.542) 4.451 3.962 ( -6.892 -0.000 5.011) 8.522 4.308 ( 4.188 0.000 -3.210) 5.277 4.326 ( -1.128 -0.000 3.924) 4.083 4.781 ( 7.416 0.000 5.385) 9.165 4.885 ( -11.042 -0.000 -10.259) 15.072 4.933 ( 9.218 0.000 11.588) 14.807 5.180 ( -6.170 -0.000 -18.280) 19.293 5.422 ( 0.520 0.000 4.310) 4.341 5.685 ( 0.100 0.000 5.159) 5.160 5.714 ( -7.920 -0.000 -6.391) 10.177 6.178 ( -0.751 -0.000 7.841) 7.877 6.475 ( 1.338 0.000 -8.714) 8.816 7.136 ( 2.913 0.000 0.020) 2.913 7.334 ( -2.079 -0.000 -3.902) 4.421 7.697 ( 10.831 0.000 -2.185) 11.050 8.732 ( 0.266 0.000 0.764) 0.809 8.782 ( 1.672 0.000 -3.278) 3.680 9.681 ( -4.334 -0.000 -1.925) 4.742 10.136 ( -2.571 -0.000 2.262) 3.425 10.488 ( -2.496 -0.000 -1.475) 2.899 10.614 ( 3.720 0.000 9.587) 10.284 10.694 ( -0.083 -0.000 -12.075) 12.075 10.767 ( 4.451 0.000 -1.775) 4.791 11.447 ( 3.371 0.000 1.160) 3.565 11.461 ( -3.880 -0.000 10.655) 11.340 11.743 ( 4.958 0.000 0.060) 4.958 11.960 ( 3.338 0.000 5.250) 6.221 13.483 ( -4.491 -0.000 -12.146) 12.950 13.833 ( -4.276 -0.000 0.380) 4.293 17.234 ( 29.192 0.000 15.388) 32.999 17.714 ( -11.976 -0.000 -22.300) 25.312 19.139 ( -5.012 -0.000 -6.391) 8.122 19.552 ( 12.318 0.000 -3.901) 12.921 19.559 ( -6.951 -0.000 -0.887) 7.007 20.214 ( -3.086 -0.000 -7.784) 8.373 20.353 ( 1.778 0.000 1.458) 2.299 20.788 ( -24.636 -0.000 7.750) 25.826 21.376 ( -0.248 -0.000 -1.110) 1.137 21.583 ( -10.282 -0.000 -0.441) 10.292 21.965 ( 7.786 0.000 1.641) 7.957 22.798 ( 12.819 0.000 1.901) 12.959 24.264 ( -1.246 -0.000 -0.443) 1.322 24.472 ( 0.843 0.000 -0.437) 0.950 24.490 ( 3.890 0.000 -1.694) 4.243 24.841 ( -6.893 -0.000 -7.758) 10.378 25.524 ( 0.883 0.000 1.986) 2.174 25.912 ( 7.142 0.000 -4.187) 8.279 25.995 ( 2.378 0.000 -4.384) 4.987 27.193 ( 1.292 0.000 13.008) 13.072 47.163 ( -2.643 -0.000 8.111) 8.530 47.387 ( -3.695 -0.000 6.018) 7.062 49.244 ( 2.505 0.000 -2.603) 3.612 49.400 ( 1.849 0.000 -6.170) 6.441 98.573 ( 1.861 0.000 0.287) 1.883 98.891 ( -4.729 -0.000 3.903) 6.131 98.918 ( 0.705 0.000 16.376) 16.391 99.109 ( 0.067 0.000 4.483) 4.484 100.577 ( -1.326 -0.000 -0.238) 1.347 100.772 ( -3.149 -0.000 2.899) 4.280 101.149 ( -2.503 -0.000 -3.414) 4.233 102.118 ( 8.423 0.000 -0.031) 8.423 ======================= Grid point 170 (71/230) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.985 ( 8.947 0.000 24.365) 25.956 1.006 ( 9.143 0.000 28.087) 29.538 1.808 ( -10.785 -0.000 39.609) 41.051 2.511 ( 4.474 0.000 5.518) 7.103 2.605 ( 0.488 0.000 -0.303) 0.574 2.791 ( -1.930 -0.000 5.985) 6.289 3.138 ( 7.694 0.000 3.007) 8.260 3.204 ( -13.346 -0.000 5.738) 14.528 3.282 ( 5.526 0.000 -0.146) 5.528 3.489 ( -5.376 -0.000 2.099) 5.771 3.745 ( 5.710 0.000 12.854) 14.066 3.852 ( -9.279 -0.000 -1.581) 9.413 4.147 ( -3.833 -0.000 -3.450) 5.157 4.176 ( -4.074 -0.000 -6.283) 7.489 4.414 ( 7.319 0.000 -4.687) 8.691 4.717 ( 8.326 0.000 10.885) 13.704 5.211 ( -9.988 -0.000 -1.317) 10.074 5.264 ( -2.581 -0.000 -9.409) 9.756 5.467 ( 12.212 0.000 6.725) 13.941 5.648 ( -13.079 -0.000 -13.880) 19.072 5.711 ( 5.690 0.000 9.027) 10.671 6.066 ( -3.035 -0.000 -1.126) 3.237 6.359 ( 11.184 0.000 -5.018) 12.258 6.591 ( -1.615 -0.000 -7.033) 7.216 7.043 ( 1.389 0.000 -9.618) 9.717 7.179 ( 2.529 0.000 -4.294) 4.983 8.746 ( -1.003 -0.000 0.309) 1.049 8.777 ( 3.027 0.000 -1.739) 3.491 9.843 ( 2.298 0.000 10.977) 11.215 10.197 ( -3.260 -0.000 -10.452) 10.949 10.264 ( -0.648 -0.000 3.614) 3.672 10.411 ( 1.900 0.000 -0.864) 2.088 10.870 ( 0.573 0.000 -0.623) 0.847 11.369 ( 1.048 0.000 -7.388) 7.462 11.663 ( -4.905 -0.000 10.915) 11.966 11.785 ( -0.710 -0.000 -7.484) 7.517 11.836 ( -1.236 -0.000 -0.900) 1.529 12.006 ( -5.067 -0.000 4.315) 6.656 13.303 ( 12.328 0.000 1.244) 12.391 13.683 ( -1.385 -0.000 -2.987) 3.292 16.726 ( 27.394 0.000 4.565) 27.772 17.673 ( -28.555 -0.000 -10.514) 30.429 19.051 ( 19.430 0.000 4.017) 19.841 19.294 ( -2.948 -0.000 -3.938) 4.919 19.530 ( 2.835 0.000 5.150) 5.879 19.980 ( -8.341 -0.000 2.402) 8.680 20.084 ( 3.155 0.000 0.793) 3.253 20.568 ( -6.757 -0.000 8.704) 11.019 21.032 ( 4.016 0.000 -10.948) 11.661 21.470 ( 1.057 0.000 -3.923) 4.063 22.238 ( -0.628 -0.000 7.170) 7.198 23.042 ( -1.590 -0.000 0.113) 1.594 24.190 ( 0.629 0.000 -1.937) 2.037 24.480 ( 0.339 0.000 -6.250) 6.259 24.637 ( 0.171 0.000 6.770) 6.772 25.486 ( -2.044 -0.000 -2.219) 3.017 25.490 ( 21.350 0.000 -1.366) 21.394 25.753 ( 4.860 0.000 -10.253) 11.347 26.148 ( 5.445 0.000 4.646) 7.158 26.451 ( -29.181 -0.000 2.945) 29.329 47.450 ( -7.368 -0.000 9.226) 11.807 47.601 ( -4.943 -0.000 13.280) 14.170 49.064 ( 3.292 0.000 -10.377) 10.886 49.327 ( 5.367 0.000 -6.721) 8.601 98.771 ( 1.118 0.000 2.602) 2.832 98.824 ( -4.503 -0.000 6.429) 7.849 99.007 ( 0.421 0.000 -4.088) 4.110 100.167 ( -15.390 -0.000 -7.079) 16.940 100.571 ( 1.594 0.000 0.436) 1.652 101.087 ( 3.413 0.000 -1.671) 3.800 101.190 ( -0.587 -0.000 11.030) 11.045 102.143 ( -0.378 -0.000 -6.056) 6.068 ======================= Grid point 171 (72/230) ======================= q-point: ( 0.11 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.376 ( 9.461 4.608 25.371) 27.467 1.510 ( 25.551 -1.664 19.718) 32.318 2.011 ( -5.900 -10.412 30.406) 32.676 2.542 ( -1.110 1.905 -2.978) 3.705 2.665 ( 2.116 1.644 4.170) 4.957 2.827 ( -0.701 -0.753 5.479) 5.575 3.096 ( -5.817 2.299 7.321) 9.629 3.257 ( 4.528 2.155 1.325) 5.187 3.333 ( -2.181 -0.603 2.048) 3.052 3.435 ( -1.941 -0.262 0.092) 1.961 3.750 ( 2.727 3.009 -1.611) 4.369 3.930 ( 1.866 -1.564 13.091) 13.316 4.057 ( -2.291 -1.135 -5.277) 5.864 4.096 ( -4.787 -6.318 0.027) 7.927 4.500 ( 4.499 -0.828 -2.379) 5.157 4.950 ( 5.455 4.044 5.517) 8.749 5.060 ( -4.002 0.292 0.669) 4.068 5.159 ( -0.298 -3.560 -9.491) 10.141 5.357 ( -7.631 0.299 -4.440) 8.834 5.701 ( 7.643 1.194 5.469) 9.473 5.835 ( 3.933 2.857 4.226) 6.441 5.982 ( -5.598 -3.712 -0.263) 6.722 6.501 ( 15.447 5.595 -15.066) 22.292 6.606 ( 6.770 3.059 -2.531) 7.849 6.972 ( 0.713 1.140 -9.437) 9.532 7.206 ( 4.261 -2.981 -6.303) 8.171 8.695 ( -0.204 6.120 0.381) 6.136 8.848 ( 1.483 -7.113 -1.437) 7.407 9.991 ( 3.672 1.374 10.054) 10.792 10.073 ( -2.260 -2.505 -7.157) 7.912 10.290 ( -0.064 -0.752 2.699) 2.803 10.453 ( 3.324 -0.074 -0.405) 3.349 10.861 ( -0.439 -1.159 -2.308) 2.620 11.243 ( -4.835 1.829 -10.837) 12.006 11.612 ( -4.962 10.201 5.926) 12.798 11.708 ( -5.744 -2.628 2.702) 6.870 11.782 ( -4.300 -1.090 -0.982) 4.544 11.893 ( -11.470 -3.136 6.123) 13.375 13.540 ( 13.960 1.007 -0.894) 14.025 13.655 ( 1.468 -0.813 -4.678) 4.970 17.056 ( -30.276 -0.201 -11.717) 32.464 17.383 ( 40.613 2.505 2.485) 40.766 19.254 ( 2.370 -0.102 -5.668) 6.144 19.295 ( 5.426 -0.177 1.414) 5.610 19.691 ( 8.385 -0.336 7.256) 11.094 19.858 ( -7.854 -0.444 -0.139) 7.868 20.205 ( 10.515 -0.500 0.354) 10.533 20.582 ( -0.400 -0.238 7.380) 7.395 21.039 ( 7.402 -0.333 -10.965) 13.234 21.465 ( 2.685 0.908 -2.976) 4.110 22.271 ( -3.973 -0.731 8.670) 9.565 22.975 ( -6.039 -0.278 -0.739) 6.090 24.197 ( 1.637 -0.472 -1.658) 2.378 24.427 ( 0.365 0.776 -6.894) 6.947 24.687 ( -1.504 -0.512 6.689) 6.875 25.388 ( -2.641 8.646 -1.755) 9.209 25.554 ( -4.163 -5.170 -4.300) 7.909 25.909 ( 12.840 0.244 -8.792) 15.564 26.101 ( -13.959 0.619 3.756) 14.469 26.305 ( 5.586 -4.487 5.810) 9.225 47.400 ( -7.506 0.522 9.743) 12.310 47.614 ( -6.501 0.097 13.496) 14.981 49.039 ( 3.814 -0.144 -9.819) 10.535 49.355 ( 4.810 -0.161 -7.249) 8.701 98.716 ( -4.908 -0.364 0.084) 4.923 98.900 ( 1.196 0.339 9.520) 9.601 98.960 ( -1.607 1.408 -2.440) 3.243 99.797 ( -18.573 4.778 -0.406) 19.182 100.578 ( -0.002 0.618 0.438) 0.757 101.135 ( 1.721 4.130 3.521) 5.694 101.191 ( -2.862 1.277 8.834) 9.373 102.115 ( -5.954 -16.746 -9.085) 19.960 ======================= Grid point 172 (73/230) ======================= q-point: ( 0.22 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.690 ( 8.965 6.220 21.322) 23.952 2.118 ( 19.058 -4.883 21.249) 28.959 2.216 ( 1.885 -5.210 9.744) 11.209 2.442 ( -5.989 3.325 1.442) 7.000 2.641 ( -2.314 1.971 -3.746) 4.824 2.845 ( -2.455 -0.830 2.789) 3.807 3.079 ( -3.234 3.294 11.028) 11.956 3.261 ( -4.286 4.722 2.221) 6.753 3.302 ( -1.147 3.513 2.113) 4.257 3.442 ( 3.041 -0.036 1.620) 3.445 3.798 ( 5.576 4.787 -5.268) 9.042 3.991 ( -2.209 -2.509 1.288) 3.582 4.011 ( 1.479 -3.019 -6.544) 7.357 4.189 ( -0.739 -11.080 15.135) 18.772 4.501 ( -5.484 -3.917 0.842) 6.791 4.892 ( 2.585 5.410 -8.666) 10.538 5.014 ( -4.234 0.823 -5.694) 7.143 5.140 ( 0.981 -6.132 -0.421) 6.224 5.437 ( 9.929 -0.465 7.690) 12.567 5.741 ( -2.067 7.166 3.852) 8.394 5.918 ( 2.919 0.814 -0.707) 3.112 5.969 ( 0.552 -7.218 0.045) 7.239 6.518 ( 9.858 9.030 -18.027) 22.443 6.685 ( 5.351 2.415 -0.330) 5.880 6.911 ( 2.545 0.264 -9.041) 9.396 7.248 ( 4.878 -3.425 -7.821) 9.833 8.660 ( -0.859 1.913 -0.309) 2.119 8.899 ( 1.411 -3.895 -1.311) 4.345 9.987 ( -0.814 -1.845 -3.370) 3.927 10.164 ( 4.685 0.452 7.816) 9.124 10.311 ( 0.369 1.914 2.268) 2.991 10.508 ( 4.041 1.182 -0.716) 4.271 10.835 ( -2.310 -3.405 -2.554) 4.842 11.038 ( -5.314 2.524 -11.081) 12.546 11.501 ( -6.043 6.434 6.290) 10.839 11.628 ( -6.117 0.703 -0.061) 6.158 11.727 ( -4.525 0.415 5.739) 7.320 11.808 ( -8.215 -3.683 7.394) 11.649 13.651 ( 2.988 -0.948 -6.279) 7.018 13.735 ( 10.492 1.035 -1.350) 10.630 16.513 ( -22.472 -0.098 -8.398) 23.990 18.000 ( 29.797 3.673 4.353) 30.336 19.263 ( 5.893 0.220 -8.314) 10.193 19.330 ( -1.272 -0.861 0.875) 1.768 19.710 ( -7.539 -0.538 -3.756) 8.440 19.856 ( 2.533 -0.480 6.619) 7.104 20.425 ( 14.031 0.047 -3.469) 14.453 20.680 ( 6.143 0.399 6.686) 9.088 21.093 ( 8.730 -1.328 -10.849) 13.988 21.513 ( 6.856 1.288 -1.876) 7.224 22.258 ( -7.454 -0.119 10.054) 12.516 22.831 ( -9.869 0.250 -1.170) 9.941 24.220 ( 2.338 0.208 -1.493) 2.782 24.367 ( 0.017 0.523 -6.371) 6.392 24.696 ( -3.918 -0.228 4.960) 6.324 25.289 ( -0.861 4.990 -0.818) 5.130 25.479 ( -5.737 -6.915 -3.403) 9.608 25.853 ( -9.441 -0.114 0.911) 9.486 26.072 ( 9.409 7.101 -7.026) 13.723 26.494 ( 5.592 -6.000 6.280) 10.330 47.359 ( -6.953 0.578 10.340) 12.473 47.615 ( -6.802 -0.122 13.335) 14.970 49.029 ( 4.383 -0.208 -8.966) 9.982 49.367 ( 4.183 -0.065 -8.070) 9.090 98.640 ( -4.510 -0.969 -0.185) 4.617 98.902 ( -2.136 1.717 0.588) 2.803 98.995 ( -0.001 0.368 10.112) 10.119 99.508 ( -12.567 2.053 -0.104) 12.734 100.580 ( -0.081 0.452 1.117) 1.208 101.130 ( -5.297 3.880 11.646) 13.369 101.270 ( 6.039 -1.184 -0.191) 6.157 102.012 ( -8.466 -11.475 -8.904) 16.812 ======================= Grid point 173 (74/230) ======================= q-point: ( 0.33 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.951 ( 6.709 2.616 13.224) 15.058 2.113 ( -11.032 6.535 5.063) 13.786 2.367 ( -4.785 1.438 3.991) 6.395 2.545 ( -3.026 3.245 -0.181) 4.440 2.666 ( 14.074 0.271 6.614) 15.553 2.825 ( 3.705 0.988 2.580) 4.622 3.120 ( -2.572 2.717 14.648) 15.118 3.144 ( -7.942 3.680 5.302) 10.233 3.242 ( -1.785 2.067 -2.535) 3.727 3.524 ( 2.631 0.817 1.838) 3.312 3.744 ( 1.739 4.785 -11.078) 12.192 3.994 ( -0.411 1.004 -3.172) 3.353 4.020 ( 2.435 -6.384 -2.416) 7.247 4.314 ( -3.025 -1.225 2.167) 3.917 4.506 ( -4.259 -10.468 16.982) 20.399 4.841 ( -2.947 -5.296 -7.911) 9.966 4.892 ( 0.525 -0.678 -9.359) 9.398 5.282 ( 7.536 -1.541 6.273) 9.925 5.647 ( 6.881 2.311 4.370) 8.473 5.673 ( -1.361 5.510 1.714) 5.928 5.907 ( -2.040 -2.161 -1.099) 3.168 6.039 ( 1.059 -4.702 -2.089) 5.253 6.431 ( 5.672 6.878 -16.524) 18.776 6.729 ( 3.043 1.466 -2.122) 3.989 6.909 ( 4.441 -1.940 -7.271) 8.738 7.289 ( 5.127 -3.496 -8.192) 10.277 8.620 ( -2.787 -2.359 -2.676) 4.527 8.936 ( 2.400 0.474 -0.396) 2.478 10.000 ( 0.983 -3.826 1.072) 4.093 10.252 ( 0.918 2.512 -0.338) 2.696 10.334 ( 3.083 6.174 6.496) 9.477 10.557 ( 4.624 2.849 -1.692) 5.689 10.776 ( -4.647 -3.014 -3.451) 6.526 10.873 ( -2.500 0.570 -7.855) 8.263 11.432 ( -4.090 3.808 6.018) 8.212 11.523 ( -4.299 1.563 0.384) 4.590 11.708 ( -4.493 -0.413 7.618) 8.854 11.787 ( -4.779 -1.324 8.905) 10.193 13.646 ( 2.375 -1.692 -8.371) 8.864 13.862 ( 6.455 0.805 -1.134) 6.603 16.189 ( -9.569 0.111 -2.391) 9.864 18.354 ( 10.138 1.807 0.630) 10.317 19.305 ( -1.055 -0.849 -0.814) 1.580 19.311 ( 1.995 -0.344 -2.562) 3.265 19.593 ( 3.116 -0.174 -7.650) 8.262 19.911 ( -2.036 0.039 5.912) 6.252 20.527 ( 4.169 1.543 -6.537) 7.905 20.936 ( 16.671 0.602 5.795) 17.660 21.152 ( 6.946 -2.570 -10.537) 12.880 21.662 ( 13.458 1.760 -0.686) 13.590 22.183 ( -11.831 0.512 10.364) 15.737 22.623 ( -12.667 1.147 -1.359) 12.791 24.244 ( 2.611 0.820 -1.847) 3.302 24.322 ( 0.307 -0.488 -4.212) 4.251 24.642 ( -5.561 0.468 2.167) 5.986 25.275 ( 1.487 -1.022 -2.366) 2.976 25.406 ( -4.003 -4.504 -3.374) 6.906 25.709 ( -8.249 0.301 1.444) 8.380 26.103 ( 8.245 9.629 -6.706) 14.341 26.683 ( 4.360 -5.786 8.232) 10.966 47.333 ( -6.290 0.536 10.923) 12.616 47.612 ( -6.924 -0.256 12.848) 14.597 49.038 ( 4.917 -0.237 -7.988) 9.383 49.360 ( 3.631 0.070 -9.034) 9.736 98.577 ( -3.630 -1.500 -0.359) 3.943 98.880 ( -1.402 0.857 3.555) 3.916 99.064 ( -1.723 0.616 10.136) 10.300 99.319 ( -7.976 0.150 -2.503) 8.361 100.587 ( -0.146 0.292 1.561) 1.595 101.103 ( -6.661 2.179 10.761) 12.842 101.374 ( 5.807 -0.869 -3.328) 6.750 101.884 ( -3.882 -3.365 -5.559) 7.569 ======================= Grid point 174 (75/230) ======================= q-point: (-0.56 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.826 ( -14.313 7.228 2.503) 16.229 2.152 ( -4.618 8.447 3.493) 10.241 2.271 ( 2.099 8.191 5.786) 10.245 2.451 ( 0.179 3.722 -0.025) 3.727 2.651 ( -4.654 0.597 -2.814) 5.472 3.003 ( 1.301 5.285 -0.368) 5.455 3.019 ( -10.968 2.254 5.512) 12.480 3.193 ( -2.694 0.374 13.670) 13.938 3.312 ( 11.996 -2.301 1.824) 12.350 3.528 ( -0.800 2.614 1.023) 2.919 3.677 ( 3.927 0.126 -5.003) 6.362 3.899 ( -4.293 3.689 -4.585) 7.284 4.111 ( 3.791 -3.214 -1.005) 5.071 4.262 ( -2.050 -0.058 0.726) 2.175 4.680 ( -2.914 -4.600 15.932) 16.836 4.722 ( -3.134 -1.933 -5.624) 6.722 4.892 ( 0.050 -13.867 -8.863) 16.458 5.405 ( 0.082 5.011 3.545) 6.139 5.638 ( 0.293 -0.088 -0.176) 0.353 5.754 ( 4.000 4.597 -0.145) 6.095 5.891 ( -1.786 -6.344 4.742) 8.119 5.996 ( -3.107 -0.993 -8.668) 9.262 6.383 ( 7.108 1.860 -12.811) 14.769 6.766 ( 3.521 -3.295 -1.288) 4.991 6.943 ( 3.196 -3.846 -6.134) 7.914 7.333 ( 5.584 -3.170 -8.479) 10.636 8.558 ( -3.952 -5.271 -4.057) 7.737 8.965 ( 3.248 4.563 0.026) 5.601 10.070 ( -0.784 -3.606 4.174) 5.571 10.189 ( -0.537 4.653 -3.003) 5.563 10.402 ( 2.932 6.801 6.050) 9.563 10.591 ( 5.108 4.227 -4.361) 7.936 10.691 ( -2.270 -1.135 -3.555) 4.368 10.798 ( -1.368 -0.911 -3.861) 4.196 11.391 ( -1.445 2.957 1.261) 3.524 11.501 ( -0.622 1.483 6.643) 6.835 11.709 ( -4.513 -1.370 8.543) 9.759 11.811 ( -1.886 0.152 8.850) 9.049 13.606 ( 0.280 -2.519 -10.308) 10.615 13.923 ( 2.308 0.195 -0.864) 2.472 16.160 ( 5.104 0.242 4.893) 7.075 18.326 ( -7.444 -1.620 -9.434) 12.126 19.259 ( -3.558 -0.900 -1.734) 4.059 19.271 ( -2.700 -1.237 -1.100) 3.167 19.758 ( 17.465 0.301 -2.477) 17.643 19.897 ( -4.342 0.677 4.511) 6.298 20.475 ( -0.679 2.516 -7.621) 8.054 21.183 ( 4.520 -3.472 -9.481) 11.063 21.277 ( 17.951 1.210 4.968) 18.665 21.921 ( 17.455 2.268 0.764) 17.618 22.017 ( -16.511 0.834 9.143) 18.892 22.370 ( -13.983 1.680 -1.715) 14.187 24.266 ( 2.295 -0.160 -1.802) 2.922 24.318 ( 1.726 -0.338 -1.939) 2.618 24.554 ( -5.098 0.390 -0.004) 5.113 25.232 ( -4.126 -2.933 -8.338) 9.754 25.399 ( 2.247 -3.403 -0.885) 4.173 25.612 ( -4.182 0.873 2.912) 5.170 26.101 ( 7.014 10.529 -6.765) 14.347 26.866 ( 3.022 -5.732 10.134) 12.029 47.324 ( -5.705 0.506 11.673) 13.002 47.603 ( -7.005 -0.288 12.216) 14.085 49.062 ( 5.313 -0.225 -7.055) 8.834 49.336 ( 3.281 0.196 -10.008) 10.534 98.535 ( -2.399 -1.859 -0.206) 3.042 98.900 ( -0.622 0.139 5.566) 5.602 99.098 ( -3.489 0.831 9.407) 10.067 99.185 ( -4.974 -0.543 -3.290) 5.989 100.595 ( -0.505 0.054 1.893) 1.960 101.054 ( -7.523 1.437 9.045) 11.852 101.373 ( -1.735 -1.362 -6.979) 7.319 101.896 ( 10.008 5.938 -1.075) 11.686 ======================= Grid point 175 (76/230) ======================= q-point: (-0.44 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.505 ( -15.973 12.486 -4.049) 20.675 1.835 ( -16.267 17.564 8.690) 25.468 2.426 ( 7.710 -0.591 0.237) 7.736 2.495 ( 2.173 4.092 2.491) 5.260 2.546 ( -2.112 2.540 0.250) 3.312 2.779 ( -10.879 5.261 -3.282) 12.522 2.937 ( -5.353 2.521 1.364) 6.072 3.210 ( -5.299 -1.086 3.035) 6.203 3.438 ( 1.664 1.321 5.022) 5.453 3.517 ( -3.121 2.841 4.736) 6.344 3.707 ( -5.192 5.873 -2.299) 8.169 3.906 ( 16.056 -2.495 0.565) 16.258 4.141 ( -0.171 0.369 0.398) 0.569 4.296 ( 2.186 -2.742 2.771) 4.469 4.606 ( -0.842 2.250 -4.079) 4.734 4.814 ( -3.720 -7.068 10.475) 13.173 4.919 ( -0.667 -14.016 -7.199) 15.771 5.309 ( -6.206 5.860 -1.310) 8.636 5.592 ( -6.297 -2.269 -2.340) 7.090 5.705 ( -0.174 4.626 -1.755) 4.951 5.840 ( -5.679 -3.011 -11.415) 13.100 6.073 ( 4.991 -6.783 9.780) 12.906 6.379 ( 6.093 2.965 -11.886) 13.681 6.887 ( 4.377 -11.883 -1.803) 12.791 6.968 ( 2.579 -4.108 -4.159) 6.389 7.377 ( 6.236 -2.185 -9.547) 11.611 8.509 ( -2.931 -7.309 -3.756) 8.725 8.975 ( 3.340 7.935 -0.346) 8.616 9.989 ( -6.212 6.442 -0.249) 8.953 10.232 ( 2.073 -5.310 3.105) 6.491 10.424 ( 0.016 6.549 5.195) 8.359 10.586 ( 4.798 4.728 -7.782) 10.292 10.650 ( -2.572 -2.841 -3.584) 5.248 10.791 ( 4.456 3.498 0.434) 5.681 11.377 ( 1.012 2.190 0.926) 2.584 11.570 ( 2.485 1.489 7.244) 7.802 11.716 ( -4.491 -0.399 9.557) 10.567 11.870 ( 0.466 -0.253 7.430) 7.449 13.515 ( -2.353 -3.138 -11.534) 12.182 13.927 ( -1.203 -0.538 -0.465) 1.398 16.430 ( 18.008 0.251 11.410) 21.320 18.026 ( -16.309 -5.210 -16.312) 23.648 19.218 ( -1.801 -1.122 -1.402) 2.543 19.235 ( 0.796 -1.333 -2.795) 3.197 19.829 ( -6.222 1.320 2.200) 6.730 20.028 ( 13.554 -0.947 0.220) 13.589 20.358 ( -2.968 2.822 -7.019) 8.126 21.197 ( 2.905 -4.337 -8.489) 9.966 21.590 ( 12.795 3.002 6.217) 14.539 21.741 ( -19.535 0.251 5.680) 20.345 22.072 ( -13.435 1.162 -0.710) 13.504 22.275 ( 18.553 2.857 1.170) 18.808 24.295 ( 1.474 -0.293 -0.006) 1.503 24.347 ( 3.354 -0.340 -1.694) 3.772 24.477 ( -3.118 0.047 -0.620) 3.179 25.072 ( -6.419 -0.566 -9.471) 11.455 25.457 ( 0.939 -4.538 -0.849) 4.711 25.620 ( 3.302 0.675 1.858) 3.848 26.074 ( 5.869 10.652 -7.152) 14.109 27.038 ( 1.553 -6.311 10.450) 12.306 47.331 ( -5.265 0.483 12.717) 13.773 47.587 ( -6.989 -0.265 11.527) 13.482 49.098 ( 5.397 -0.161 -6.379) 8.358 49.301 ( 3.305 0.330 -10.776) 11.276 98.521 ( -0.903 -1.997 0.427) 2.232 98.932 ( -0.984 -0.397 3.119) 3.294 99.090 ( -4.666 0.796 6.192) 7.794 99.128 ( -1.791 -0.481 4.815) 5.160 100.600 ( -1.246 -0.419 2.221) 2.581 100.985 ( -7.685 1.025 7.348) 10.682 101.262 ( -3.980 -0.233 -6.622) 7.729 102.072 ( 19.007 14.205 -1.259) 23.762 ======================= Grid point 176 (77/230) ======================= q-point: (-0.33 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.038 ( -15.848 20.821 -9.346) 27.785 1.566 ( -17.972 11.962 18.661) 28.536 2.239 ( -22.375 8.322 3.734) 24.163 2.452 ( 0.221 2.045 -5.114) 5.512 2.658 ( 6.033 2.161 4.407) 7.778 2.741 ( 5.421 -1.756 6.430) 8.592 2.847 ( -1.050 4.309 -0.621) 4.478 3.090 ( -8.445 1.091 -1.158) 8.594 3.356 ( -8.542 6.896 -1.333) 11.059 3.542 ( 0.898 2.354 10.516) 10.814 3.654 ( 2.933 0.496 -0.587) 3.032 4.120 ( 0.479 0.735 2.149) 2.321 4.147 ( 5.744 -0.090 -1.936) 6.062 4.379 ( 1.577 -1.295 2.013) 2.867 4.644 ( 6.987 -2.042 4.274) 8.441 4.824 ( -3.922 -11.601 -8.114) 14.690 4.938 ( -5.240 -4.567 -1.707) 7.158 5.133 ( -6.559 2.544 3.075) 7.678 5.500 ( -4.124 -1.574 0.198) 4.418 5.621 ( -1.550 0.004 -10.922) 11.031 5.715 ( -3.265 -2.353 -3.561) 5.374 6.237 ( 0.610 -3.613 7.102) 7.991 6.347 ( 4.106 2.968 -9.944) 11.160 6.946 ( -1.168 -13.254 -8.231) 15.646 7.091 ( 5.396 -7.382 0.338) 9.151 7.414 ( 7.063 -2.223 -12.286) 14.345 8.508 ( -0.809 -9.038 -3.069) 9.579 8.957 ( 2.916 10.344 -0.877) 10.783 9.838 ( -5.359 6.769 0.884) 8.679 10.297 ( -2.381 1.479 6.558) 7.132 10.441 ( 1.225 -2.732 2.439) 3.862 10.561 ( -1.339 0.200 -3.522) 3.774 10.582 ( 2.543 1.256 -8.748) 9.196 10.884 ( 7.345 6.521 4.335) 10.736 11.405 ( 1.844 -0.092 1.355) 2.291 11.673 ( 4.814 1.787 4.562) 6.869 11.725 ( -3.940 2.450 11.350) 12.261 11.947 ( 1.403 -1.297 4.677) 5.052 13.384 ( -4.009 -3.069 -11.012) 12.114 13.888 ( -3.556 -1.052 -0.163) 3.711 16.929 ( 26.507 0.202 15.317) 30.614 17.609 ( -19.292 -8.124 -20.948) 29.614 19.157 ( -4.050 -0.609 -2.633) 4.868 19.288 ( 5.844 -3.086 -3.816) 7.632 19.701 ( -7.822 1.770 -1.156) 8.102 20.196 ( 2.414 -0.766 -2.057) 3.263 20.244 ( 0.294 0.978 -3.168) 3.329 21.190 ( -2.454 -4.798 -5.781) 7.903 21.373 ( -20.548 1.776 4.547) 21.120 21.774 ( -11.038 0.264 -1.400) 11.129 21.897 ( 9.310 3.309 2.395) 10.167 22.601 ( 17.713 2.309 3.589) 18.220 24.304 ( 0.257 1.680 -0.548) 1.786 24.408 ( 4.027 -0.733 -0.208) 4.098 24.452 ( 0.262 -0.455 0.998) 1.127 24.884 ( -6.107 0.476 -8.204) 10.238 25.486 ( -0.094 -4.062 -0.496) 4.093 25.719 ( 7.536 0.520 -0.823) 7.598 26.027 ( 4.683 9.818 -7.113) 12.997 27.176 ( -0.816 -7.365 7.518) 10.556 47.356 ( -4.868 0.322 14.242) 15.054 47.567 ( -6.793 -0.209 10.851) 12.804 49.133 ( 4.721 -0.069 -6.608) 8.121 49.267 ( 4.115 0.521 -10.677) 11.454 98.542 ( 0.662 -1.886 1.630) 2.579 98.929 ( -0.081 -1.827 -1.176) 2.174 99.047 ( -5.616 0.978 5.588) 7.982 99.225 ( 2.129 -1.197 16.557) 16.736 100.595 ( -2.539 -1.188 2.560) 3.796 100.912 ( -6.731 0.616 6.215) 9.182 101.153 ( -2.541 0.589 -5.042) 5.676 102.273 ( 22.704 23.795 -4.153) 33.150 ======================= Grid point 177 (78/230) ======================= q-point: (-0.22 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.611 ( -8.950 21.419 3.839) 23.529 1.299 ( -23.675 6.823 13.277) 27.988 1.858 ( -24.980 10.424 25.497) 37.185 2.396 ( -0.961 3.783 0.140) 3.905 2.705 ( -1.152 1.493 -0.794) 2.046 2.822 ( 0.902 -0.845 3.802) 3.997 2.938 ( -2.773 4.143 -3.034) 5.836 3.006 ( 10.323 -1.970 9.633) 14.256 3.203 ( -1.801 6.279 1.449) 6.691 3.598 ( -1.293 2.494 6.694) 7.260 3.709 ( 2.064 -1.083 -1.507) 2.776 4.084 ( -6.190 0.819 5.795) 8.519 4.205 ( 4.201 -0.424 -4.788) 6.384 4.387 ( -2.809 -0.496 1.103) 3.059 4.687 ( -4.831 -3.635 -14.914) 16.093 4.703 ( -13.241 -0.614 -7.584) 15.271 4.909 ( 11.562 -4.418 4.708) 13.243 5.220 ( 3.457 -3.086 13.768) 14.527 5.454 ( -2.468 -2.015 -1.824) 3.672 5.543 ( -2.757 -5.179 -6.553) 8.796 5.669 ( 3.914 2.137 -4.395) 6.261 6.275 ( -0.823 -0.082 1.699) 1.890 6.304 ( 0.823 1.695 -8.116) 8.332 6.945 ( -3.967 -17.034 -8.319) 19.367 7.185 ( 1.840 -4.306 -2.811) 5.461 7.389 ( 1.600 -0.985 -19.891) 19.979 8.560 ( 0.844 -10.827 -1.763) 11.002 8.909 ( 2.126 11.818 -1.369) 12.086 9.744 ( -3.050 4.825 4.369) 7.188 10.271 ( -2.830 4.724 5.746) 7.959 10.464 ( 0.754 3.877 -3.700) 5.412 10.472 ( -2.284 -2.000 -8.993) 9.491 10.661 ( 4.412 -8.675 6.213) 11.547 11.016 ( 9.454 6.443 6.751) 13.284 11.462 ( 0.988 -4.303 2.711) 5.181 11.735 ( -0.253 5.184 7.167) 8.849 11.782 ( 3.723 4.612 7.426) 9.501 11.997 ( -0.112 -2.191 0.367) 2.224 13.257 ( -3.169 -2.069 -7.637) 8.523 13.824 ( -4.374 -0.783 -0.362) 4.458 17.131 ( -21.621 -8.055 -24.377) 33.565 17.537 ( 27.987 0.234 15.304) 31.899 19.014 ( -10.051 -0.308 -5.960) 11.689 19.383 ( 6.016 -4.638 -6.641) 10.090 19.548 ( -5.661 1.541 -1.981) 6.193 20.122 ( -2.950 1.343 -2.020) 3.819 20.256 ( -3.165 -2.229 -1.919) 4.321 20.951 ( -21.080 1.445 5.780) 21.905 21.222 ( -2.346 -3.641 -8.771) 9.782 21.552 ( -7.797 0.345 -2.998) 8.361 22.070 ( 8.462 4.342 3.513) 10.139 22.874 ( 11.789 1.272 3.422) 12.341 24.270 ( -0.434 3.462 -2.451) 4.264 24.486 ( 2.797 -1.639 2.530) 4.112 24.511 ( 4.036 -0.018 1.765) 4.405 24.765 ( -0.241 -0.274 -0.771) 0.853 25.508 ( -0.107 -4.032 -1.123) 4.187 25.825 ( 8.414 4.367 -4.504) 10.495 25.982 ( 3.608 5.870 -4.343) 8.145 27.205 ( -7.435 -7.320 -0.646) 10.454 47.409 ( -3.979 -0.480 15.870) 16.369 47.546 ( -6.280 -0.034 10.407) 12.155 49.135 ( 3.261 0.062 -8.920) 9.497 49.263 ( 5.628 0.703 -8.495) 10.214 98.598 ( 2.018 -1.446 3.264) 4.101 98.955 ( 0.764 -3.004 -0.528) 3.144 98.985 ( -4.282 0.530 2.619) 5.047 99.550 ( 12.106 -8.765 28.100) 31.828 100.570 ( -4.514 -1.800 2.831) 5.624 100.867 ( -4.466 -0.359 7.019) 8.327 101.086 ( -0.500 0.662 -3.527) 3.623 102.391 ( 21.895 34.983 -9.115) 42.264 ======================= Grid point 178 (79/230) ======================= q-point: (-0.11 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.634 ( 5.466 4.344 26.509) 27.413 0.944 ( -22.220 4.325 17.135) 28.391 1.727 ( -16.827 8.485 40.293) 44.482 2.402 ( 1.312 1.449 6.326) 6.621 2.639 ( -1.850 0.290 -3.873) 4.302 2.808 ( -5.281 0.996 5.452) 7.655 2.977 ( 8.598 0.301 0.213) 8.606 3.189 ( 5.186 1.270 0.672) 5.381 3.295 ( 2.230 -1.583 12.299) 12.600 3.574 ( -4.250 3.372 3.594) 6.508 3.648 ( -5.472 0.953 -1.498) 5.753 4.000 ( -9.414 -0.668 5.060) 10.709 4.238 ( 0.681 -2.828 -3.226) 4.344 4.276 ( -5.130 1.050 -4.963) 7.215 4.456 ( -3.647 1.473 -15.755) 16.238 4.571 ( -0.825 -0.511 5.248) 5.337 5.186 ( 12.295 -2.096 6.784) 14.198 5.356 ( -2.622 -4.043 -2.635) 5.492 5.399 ( -6.406 1.519 -4.344) 7.888 5.509 ( 4.714 -1.612 10.665) 11.771 5.776 ( 12.756 -0.819 -11.335) 17.085 6.174 ( -6.194 1.071 -8.199) 10.332 6.285 ( 1.161 -0.124 0.203) 1.185 6.839 ( -18.358 -19.558 -13.247) 29.917 7.135 ( -1.749 6.975 -14.233) 15.947 7.193 ( 1.370 2.110 -4.483) 5.141 8.658 ( 1.597 -11.964 -0.371) 12.076 8.837 ( 1.307 12.207 -1.503) 12.368 9.747 ( -0.205 1.875 8.380) 8.590 10.251 ( -1.612 1.610 4.110) 4.700 10.349 ( -2.328 1.773 -10.689) 11.082 10.414 ( 0.153 2.209 -2.287) 3.183 10.830 ( 2.386 -3.679 3.390) 5.543 11.276 ( 14.389 -2.349 0.975) 14.612 11.568 ( -0.234 -13.326 7.828) 15.457 11.765 ( 3.594 8.316 6.308) 11.039 11.853 ( 4.113 8.173 2.927) 9.607 11.986 ( -1.653 -2.325 0.336) 2.873 13.195 ( 0.315 -0.446 -1.618) 1.708 13.749 ( -3.638 0.266 -1.481) 3.937 16.643 ( -15.038 -2.117 -11.936) 19.316 17.983 ( 5.049 0.446 4.977) 7.103 18.803 ( -0.676 -0.383 -3.905) 3.981 19.394 ( -0.973 -2.670 -8.644) 9.099 19.487 ( -0.533 0.763 1.450) 1.723 20.069 ( -0.972 0.634 -0.295) 1.197 20.126 ( -10.698 -0.111 1.009) 10.746 20.684 ( -15.004 1.862 8.188) 17.194 21.101 ( -1.564 -0.763 -11.054) 11.190 21.483 ( 0.371 -1.249 -3.421) 3.660 22.175 ( 3.270 3.060 5.078) 6.771 23.021 ( 4.030 0.653 1.321) 4.291 24.215 ( -0.465 2.198 -2.484) 3.349 24.521 ( 0.212 -1.226 -4.766) 4.926 24.572 ( 1.455 0.364 5.255) 5.465 25.008 ( 20.818 -4.408 9.491) 23.300 25.516 ( -0.698 -3.083 -1.847) 3.661 25.820 ( 4.883 8.555 -10.260) 14.223 26.030 ( 5.176 0.569 1.923) 5.551 26.950 ( -23.689 -2.666 -6.387) 24.680 47.473 ( -5.314 -1.312 11.873) 13.074 47.551 ( -3.689 0.030 12.910) 13.427 49.101 ( 2.957 0.159 -10.367) 10.781 49.292 ( 5.767 0.535 -6.959) 9.054 98.683 ( 2.818 -0.723 4.847) 5.653 98.897 ( -6.460 0.471 3.455) 7.341 99.007 ( 2.581 -2.134 -3.787) 5.056 100.174 ( 17.568 -20.144 6.873) 27.599 100.522 ( -4.201 -0.287 5.232) 6.716 100.941 ( 2.697 -7.169 14.528) 16.423 101.066 ( 1.661 0.595 -2.177) 2.802 102.312 ( 10.648 38.011 -11.877) 41.222 ======================= Grid point 180 (80/230) ======================= q-point: ( 0.11 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.759 ( 8.928 0.000 21.346) 23.137 2.049 ( 3.233 0.000 27.813) 28.000 2.186 ( 20.665 0.000 9.485) 22.738 2.467 ( -6.696 -0.000 0.477) 6.713 2.655 ( -3.028 -0.000 -5.535) 6.309 2.837 ( -2.462 -0.000 2.807) 3.734 3.107 ( -3.313 -0.000 10.886) 11.379 3.302 ( -2.023 -0.000 1.627) 2.596 3.328 ( -2.537 -0.000 4.259) 4.958 3.442 ( 3.100 0.000 0.964) 3.246 3.854 ( 6.027 0.000 -1.361) 6.179 3.955 ( -1.375 -0.000 -8.779) 8.886 3.997 ( -2.622 -0.000 1.328) 2.939 4.085 ( 1.987 0.000 15.565) 15.691 4.474 ( -4.827 -0.000 -0.524) 4.855 4.946 ( -1.049 -0.000 -14.480) 14.518 5.027 ( -5.569 -0.000 -7.042) 8.978 5.076 ( 4.153 0.000 5.733) 7.079 5.434 ( 10.440 0.000 8.354) 13.371 5.833 ( 1.349 0.000 2.282) 2.651 5.871 ( -4.992 -0.000 1.248) 5.146 5.927 ( 4.420 0.000 -0.575) 4.457 6.587 ( 9.526 0.000 -18.746) 21.027 6.713 ( 6.591 0.000 -3.143) 7.302 6.907 ( 0.874 0.000 -9.396) 9.436 7.219 ( 5.012 0.000 -6.940) 8.560 8.677 ( -2.586 -0.000 -2.474) 3.579 8.867 ( 3.266 0.000 0.769) 3.355 9.972 ( -1.280 -0.000 -4.029) 4.228 10.167 ( 5.018 0.000 8.787) 10.119 10.326 ( 0.888 0.000 4.798) 4.880 10.519 ( 4.459 0.000 -0.376) 4.474 10.808 ( -2.248 -0.000 -3.471) 4.136 11.056 ( -5.748 -0.000 -11.419) 12.784 11.559 ( -7.845 -0.000 3.955) 8.785 11.634 ( -5.820 -0.000 0.209) 5.823 11.732 ( -3.995 -0.000 9.372) 10.188 11.770 ( -7.972 -0.000 5.934) 9.938 13.644 ( 2.908 0.000 -6.562) 7.178 13.742 ( 10.581 0.000 -1.653) 10.709 16.512 ( -22.410 -0.000 -8.311) 23.901 18.028 ( 29.490 0.000 3.196) 29.663 19.264 ( 6.230 0.000 -8.575) 10.599 19.323 ( -1.371 -0.000 0.835) 1.606 19.706 ( -7.609 -0.000 -3.793) 8.502 19.852 ( 2.706 0.000 6.862) 7.377 20.425 ( 14.307 0.000 -2.990) 14.617 20.683 ( 6.151 0.000 6.910) 9.252 21.082 ( 8.411 0.000 -10.869) 13.744 21.523 ( 6.911 0.000 -2.089) 7.220 22.257 ( -7.318 -0.000 10.499) 12.798 22.833 ( -9.701 -0.000 -0.886) 9.741 24.221 ( 2.618 0.000 -1.222) 2.889 24.371 ( -0.159 -0.000 -7.085) 7.087 24.694 ( -3.739 -0.000 5.386) 6.557 25.370 ( -1.556 -0.000 -2.294) 2.773 25.383 ( -6.638 -0.000 -2.224) 7.000 25.852 ( -9.710 -0.000 1.283) 9.794 26.137 ( 12.443 0.000 -10.344) 16.181 26.438 ( 4.103 0.000 9.716) 10.547 47.363 ( -7.018 -0.000 10.237) 12.412 47.614 ( -6.865 -0.000 13.336) 14.999 49.028 ( 4.395 0.000 -8.955) 9.975 49.366 ( 4.217 0.000 -8.000) 9.043 98.632 ( -4.571 -0.000 -0.229) 4.577 98.916 ( -2.378 -0.000 -0.131) 2.381 98.998 ( 0.079 0.000 10.142) 10.142 99.525 ( -14.000 -0.000 -0.401) 14.006 100.583 ( -0.153 -0.000 0.923) 0.936 101.172 ( -7.955 -0.000 12.417) 14.746 101.249 ( 7.401 0.000 -1.712) 7.596 101.921 ( -4.884 -0.000 -4.708) 6.784 ======================= Grid point 181 (81/230) ======================= q-point: ( 0.22 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.994 ( 2.080 2.267 10.922) 11.347 2.181 ( -4.735 2.341 14.176) 15.128 2.367 ( -6.121 -0.519 6.040) 8.615 2.566 ( 0.180 0.680 -1.379) 1.549 2.666 ( 13.599 -0.685 3.328) 14.017 2.833 ( 6.057 0.226 4.634) 7.630 3.146 ( -3.077 1.086 8.383) 8.995 3.229 ( -6.568 5.079 7.469) 11.168 3.261 ( -7.478 0.520 2.153) 7.799 3.519 ( 1.515 -0.722 1.391) 2.180 3.835 ( 2.968 6.081 -12.376) 14.105 3.934 ( 4.200 -4.932 -3.149) 7.203 4.006 ( 0.844 0.550 -1.235) 1.594 4.266 ( 1.020 -4.603 11.368) 12.307 4.394 ( -6.180 -3.159 6.711) 9.654 4.776 ( -4.461 -2.317 -10.844) 11.953 4.904 ( -1.396 0.740 -8.464) 8.610 5.265 ( 9.181 -0.659 8.270) 12.374 5.671 ( 8.566 0.908 5.746) 10.355 5.763 ( -3.608 6.624 0.737) 7.579 5.858 ( -3.587 -5.125 0.592) 6.283 5.975 ( 1.423 -2.670 -3.135) 4.357 6.519 ( 4.922 3.820 -20.475) 21.402 6.762 ( 2.755 2.691 -2.158) 4.414 6.865 ( 2.377 -3.325 -8.446) 9.383 7.251 ( 5.674 -1.467 -8.301) 10.161 8.594 ( -3.870 -1.014 -4.383) 5.934 8.941 ( 4.099 0.220 1.491) 4.368 9.960 ( 0.709 -1.505 0.759) 1.829 10.278 ( 2.315 0.946 1.860) 3.117 10.408 ( 3.304 3.282 8.245) 9.470 10.590 ( 5.111 1.295 -1.091) 5.385 10.727 ( -4.644 -2.505 -3.624) 6.401 10.884 ( -3.377 0.486 -9.239) 9.849 11.483 ( -4.830 2.503 6.267) 8.299 11.536 ( -4.189 0.134 -1.040) 4.318 11.705 ( -5.686 -0.086 6.751) 8.827 11.767 ( -3.731 -1.068 11.168) 11.823 13.628 ( 2.237 -0.668 -8.629) 8.939 13.870 ( 6.241 0.312 -1.546) 6.437 16.190 ( -9.522 0.042 -2.283) 9.792 18.373 ( 8.555 0.708 -0.462) 8.597 19.293 ( -2.554 -0.501 0.154) 2.608 19.310 ( 2.875 0.049 -3.906) 4.850 19.592 ( 4.149 -0.001 -7.703) 8.749 19.911 ( -1.773 -0.017 6.080) 6.333 20.543 ( 4.479 0.614 -5.779) 7.337 20.943 ( 16.693 0.257 6.123) 17.782 21.124 ( 6.580 -1.063 -10.659) 12.571 21.681 ( 13.677 0.714 -0.904) 13.726 22.188 ( -11.775 0.212 10.753) 15.947 22.634 ( -12.555 0.416 -0.945) 12.598 24.257 ( 2.974 0.730 -1.429) 3.379 24.312 ( -0.216 -0.613 -5.354) 5.394 24.647 ( -5.606 0.206 2.620) 6.191 25.272 ( -2.156 0.404 -3.778) 4.369 25.351 ( -0.965 -2.496 -1.762) 3.204 25.711 ( -7.914 0.050 1.449) 8.046 26.222 ( 10.026 5.432 -9.520) 14.854 26.604 ( 2.981 -3.933 11.177) 12.218 47.339 ( -6.359 0.216 10.873) 12.598 47.609 ( -6.941 -0.098 12.854) 14.609 49.035 ( 4.942 -0.096 -7.996) 9.400 49.361 ( 3.671 0.023 -8.971) 9.693 98.561 ( -3.642 -0.590 -0.507) 3.724 98.890 ( -1.689 0.397 2.856) 3.341 99.071 ( -1.708 0.238 10.202) 10.347 99.321 ( -8.823 0.124 -2.367) 9.136 100.590 ( -0.266 0.106 1.498) 1.526 101.131 ( -7.650 1.293 10.616) 13.149 101.352 ( 5.346 -1.368 -3.764) 6.680 101.854 ( 1.010 -0.934 -1.963) 2.397 ======================= Grid point 182 (82/230) ======================= q-point: (-0.67 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.917 ( -11.169 4.806 1.984) 12.320 2.229 ( 1.298 3.765 6.275) 7.432 2.346 ( -1.092 1.329 2.740) 3.235 2.556 ( -0.443 8.361 1.703) 8.544 2.653 ( -3.572 -0.300 -1.781) 4.003 3.012 ( -7.623 0.372 7.352) 10.597 3.082 ( -10.049 2.101 3.513) 10.850 3.239 ( -1.494 5.471 14.880) 15.925 3.277 ( 14.885 -2.313 2.231) 15.228 3.525 ( -2.091 -2.298 2.134) 3.769 3.739 ( 6.067 7.009 -12.763) 15.774 3.955 ( -1.233 4.026 -4.062) 5.851 4.060 ( 5.975 -3.248 0.028) 6.800 4.267 ( -2.989 0.555 -0.369) 3.062 4.497 ( -3.207 -16.214 6.612) 17.802 4.696 ( -3.217 -2.121 4.163) 5.672 4.810 ( -0.174 0.125 -8.743) 8.746 5.473 ( 4.986 3.788 7.107) 9.472 5.649 ( -4.442 1.642 -2.389) 5.305 5.785 ( 2.502 -3.388 0.719) 4.273 5.826 ( -3.622 1.159 1.930) 4.265 5.953 ( -2.593 -4.422 -6.380) 8.184 6.418 ( 5.724 2.538 -14.987) 16.242 6.751 ( 1.184 1.073 -2.968) 3.371 6.877 ( 2.242 -4.937 -6.555) 8.507 7.290 ( 6.106 -2.412 -9.230) 11.327 8.495 ( -4.535 -3.196 -4.973) 7.450 9.020 ( 4.821 2.795 1.373) 5.739 10.014 ( 0.774 -3.092 3.766) 4.934 10.268 ( -1.039 4.927 -1.127) 5.160 10.495 ( 3.051 5.692 5.395) 8.415 10.642 ( -3.775 -4.056 -3.171) 6.384 10.651 ( 5.568 2.993 -3.245) 7.106 10.791 ( -0.206 -0.457 -4.783) 4.809 11.440 ( -1.610 3.358 0.943) 3.842 11.514 ( -0.638 0.229 6.351) 6.387 11.690 ( -4.343 -1.074 8.607) 9.700 11.810 ( -2.497 -0.256 10.167) 10.472 13.574 ( -0.068 -1.620 -10.515) 10.639 13.925 ( 1.931 0.104 -1.195) 2.273 16.163 ( 5.109 0.151 4.949) 7.114 18.305 ( -9.713 -1.071 -10.057) 14.022 19.248 ( -3.295 -0.466 -1.648) 3.714 19.255 ( -2.813 -0.903 -1.482) 3.305 19.764 ( 17.058 0.372 -2.563) 17.253 19.905 ( -4.037 0.374 4.679) 6.191 20.507 ( -0.652 1.762 -6.777) 7.033 21.139 ( 4.326 -2.349 -10.073) 11.211 21.293 ( 18.385 0.801 5.350) 19.164 21.950 ( 17.965 1.564 0.604) 18.043 22.026 ( -16.944 0.454 9.466) 19.414 22.390 ( -14.091 0.996 -1.390) 14.194 24.268 ( 1.484 0.385 -2.460) 2.899 24.310 ( 2.457 -0.664 -1.897) 3.174 24.559 ( -5.591 0.249 0.310) 5.605 25.197 ( -2.658 -1.764 -7.836) 8.460 25.360 ( 1.364 -1.941 -0.628) 2.454 25.622 ( -3.804 0.477 2.601) 4.633 26.246 ( 8.110 8.633 -8.554) 14.611 26.778 ( 1.542 -5.819 11.824) 13.268 47.330 ( -5.745 0.332 11.678) 13.019 47.599 ( -6.979 -0.181 12.208) 14.063 49.060 ( 5.361 -0.153 -7.085) 8.886 49.339 ( 3.328 0.119 -9.958) 10.500 98.512 ( -2.347 -1.189 -0.462) 2.671 98.903 ( -0.681 0.171 4.999) 5.049 99.108 ( -3.524 0.503 9.628) 10.265 99.179 ( -5.284 -0.336 -3.176) 6.174 100.596 ( -0.725 0.039 1.896) 2.030 101.074 ( -7.747 1.139 8.643) 11.662 101.349 ( -1.669 -1.597 -5.916) 6.351 101.973 ( 14.944 4.078 0.149) 15.491 ======================= Grid point 183 (83/230) ======================= q-point: (-0.56 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( -13.215 9.829 1.067) 16.504 2.074 ( -10.232 13.726 -3.966) 17.574 2.411 ( 4.895 -1.202 -0.186) 5.044 2.567 ( 3.386 3.372 6.350) 7.948 2.586 ( -1.180 3.580 -1.067) 3.918 2.838 ( -16.106 4.061 4.646) 17.248 2.941 ( -7.815 -1.782 3.294) 8.666 3.271 ( 1.155 8.498 2.260) 8.869 3.453 ( 3.157 1.316 0.354) 3.438 3.547 ( -2.116 0.575 8.398) 8.680 3.804 ( -2.781 6.892 1.064) 7.508 3.883 ( 14.317 0.011 -3.473) 14.732 4.139 ( 2.101 -0.699 -1.391) 2.615 4.260 ( 1.451 -2.503 1.525) 3.271 4.553 ( -4.183 -16.105 -4.259) 17.176 4.680 ( -2.412 -0.764 -2.042) 3.252 4.819 ( -0.037 -2.783 7.933) 8.407 5.408 ( -7.080 7.454 -1.600) 10.405 5.542 ( -7.355 -3.741 -4.292) 9.301 5.764 ( -3.480 0.497 -2.781) 4.483 5.775 ( -6.583 -3.638 -4.777) 8.910 5.984 ( 7.016 -4.749 4.356) 9.527 6.416 ( 6.413 1.641 -9.968) 11.966 6.753 ( -0.582 -5.709 -2.333) 6.195 6.905 ( 3.396 -4.552 -4.434) 7.205 7.331 ( 5.785 -3.521 -10.342) 12.362 8.415 ( -3.608 -5.322 -4.071) 7.610 9.079 ( 4.811 6.070 0.410) 7.756 10.054 ( -3.564 0.712 4.211) 5.562 10.196 ( 0.252 2.327 -1.741) 2.917 10.502 ( -2.863 1.069 2.750) 4.111 10.612 ( -1.162 0.916 -0.413) 1.536 10.662 ( 5.963 4.873 -8.584) 11.532 10.818 ( 5.677 0.012 -0.647) 5.714 11.412 ( -0.180 2.172 0.683) 2.284 11.591 ( 3.450 1.363 6.205) 7.229 11.716 ( -3.290 0.374 11.733) 12.191 11.861 ( -1.010 -0.958 8.002) 8.122 13.471 ( -2.788 -2.660 -11.359) 11.995 13.919 ( -1.732 -0.508 -0.692) 1.933 16.433 ( 18.011 0.211 11.361) 21.296 17.954 ( -19.211 -4.326 -16.098) 25.435 19.204 ( -1.154 -0.801 -1.746) 2.242 19.215 ( -0.283 -1.227 -2.695) 2.975 19.847 ( -5.801 1.085 2.389) 6.367 20.019 ( 12.662 -0.331 0.620) 12.681 20.398 ( -3.240 2.568 -6.426) 7.641 21.138 ( 2.852 -3.494 -9.196) 10.242 21.627 ( 16.180 1.971 5.407) 17.173 21.747 ( -22.494 0.554 6.879) 23.529 22.086 ( -13.634 0.614 -0.975) 13.682 22.316 ( 18.549 2.516 1.074) 18.750 24.291 ( 2.294 -0.270 0.106) 2.312 24.344 ( 3.277 -0.089 -2.143) 3.917 24.476 ( -3.793 -0.134 -0.100) 3.797 25.064 ( -4.950 -0.432 -9.390) 10.624 25.400 ( 1.468 -3.080 -0.895) 3.528 25.630 ( 2.785 0.708 2.272) 3.664 26.229 ( 6.602 10.198 -8.604) 14.887 26.936 ( -0.427 -7.297 11.475) 13.605 47.338 ( -5.283 0.421 12.709) 13.770 47.583 ( -6.929 -0.203 11.507) 13.434 49.096 ( 5.477 -0.157 -6.434) 8.450 49.305 ( 3.377 0.244 -10.737) 11.259 98.493 ( -0.788 -1.681 0.085) 1.859 98.928 ( -1.070 -0.158 2.278) 2.521 99.099 ( -3.823 0.524 4.746) 6.117 99.122 ( -2.701 -0.366 6.499) 7.047 100.595 ( -1.648 -0.243 2.255) 2.803 101.001 ( -7.525 1.112 6.839) 10.229 101.256 ( -3.460 -0.413 -5.522) 6.530 102.263 ( 25.318 11.132 -1.497) 27.698 ======================= Grid point 184 (84/230) ======================= q-point: (-0.44 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.329 ( -12.339 18.087 -5.721) 22.630 1.757 ( -14.746 13.624 4.748) 20.630 2.343 ( -15.040 3.337 -0.387) 15.411 2.514 ( -2.209 6.663 1.039) 7.096 2.680 ( 4.575 -1.031 2.980) 5.556 2.733 ( 4.294 3.702 8.887) 10.541 2.867 ( -5.087 -1.545 3.339) 6.278 3.171 ( -0.060 10.456 -8.589) 13.532 3.466 ( -5.955 7.137 2.612) 9.655 3.555 ( -0.421 -0.250 8.935) 8.948 3.700 ( -0.928 5.470 4.381) 7.069 4.130 ( 8.503 0.536 -1.138) 8.596 4.152 ( 0.927 0.718 0.728) 1.380 4.348 ( 3.399 -2.979 1.920) 4.911 4.573 ( -0.154 -14.215 -4.172) 14.815 4.646 ( -0.575 -5.245 -2.252) 5.736 4.881 ( -3.148 -2.971 2.306) 4.905 5.183 ( -10.439 3.921 1.100) 11.205 5.435 ( -6.049 -5.991 -2.332) 8.827 5.575 ( -7.394 -6.480 -10.912) 14.688 5.743 ( 0.925 5.434 -0.106) 5.513 6.166 ( 2.471 -5.679 7.079) 9.406 6.402 ( 3.894 3.813 -8.978) 10.502 6.749 ( -3.861 -11.688 -5.320) 13.409 7.001 ( 5.467 -5.657 -0.783) 7.906 7.355 ( 4.539 -5.218 -12.512) 14.296 8.387 ( -1.593 -7.301 -2.900) 8.015 9.098 ( 4.056 8.914 -0.837) 9.829 9.952 ( -4.773 8.308 1.387) 9.681 10.245 ( 0.772 -5.836 4.579) 7.458 10.462 ( -3.507 -1.147 1.450) 3.965 10.535 ( -3.890 2.953 -2.431) 5.456 10.665 ( 7.527 6.829 -9.327) 13.795 10.940 ( 8.124 1.163 1.161) 8.288 11.406 ( -0.364 0.113 0.421) 0.568 11.698 ( 5.618 1.475 2.179) 6.204 11.771 ( -1.691 3.540 14.642) 15.159 11.925 ( 0.305 -1.593 5.899) 6.118 13.337 ( -4.272 -3.133 -10.072) 11.380 13.870 ( -4.055 -1.272 -0.106) 4.251 16.932 ( 26.587 0.222 15.154) 30.603 17.487 ( -22.661 -7.990 -18.979) 30.620 19.148 ( -3.869 -0.624 -2.474) 4.634 19.244 ( 4.244 -2.706 -3.785) 6.298 19.729 ( -7.431 1.898 -0.969) 7.731 20.184 ( 4.759 -0.655 0.734) 4.860 20.271 ( -3.582 2.218 -4.046) 5.841 21.126 ( 0.313 -3.902 -7.804) 8.731 21.387 ( -23.878 0.274 5.631) 24.535 21.785 ( -11.665 1.245 -1.597) 11.839 21.936 ( 11.013 1.923 2.700) 11.502 22.638 ( 17.806 2.648 2.704) 18.204 24.329 ( 2.065 1.585 -0.312) 2.621 24.395 ( 3.654 -0.984 -0.418) 3.807 24.445 ( -0.155 -0.343 1.558) 1.603 24.892 ( -5.509 0.551 -8.797) 10.395 25.433 ( 0.924 -3.088 -1.372) 3.503 25.731 ( 7.690 0.940 0.796) 7.788 26.178 ( 5.161 10.547 -8.903) 14.736 27.053 ( -3.478 -9.021 8.925) 13.158 47.361 ( -5.024 0.353 14.006) 14.884 47.564 ( -6.676 -0.137 10.870) 12.757 49.131 ( 4.827 -0.097 -6.666) 8.231 49.274 ( 4.246 0.392 -10.693) 11.512 98.512 ( 0.822 -1.993 1.221) 2.477 98.906 ( -1.017 -1.225 -2.027) 2.577 99.064 ( -5.616 1.254 6.215) 8.470 99.206 ( 1.484 -1.351 14.239) 14.380 100.580 ( -3.091 -0.776 2.754) 4.212 100.926 ( -6.386 1.177 5.591) 8.569 101.162 ( -2.342 0.610 -4.420) 5.040 102.609 ( 32.180 20.704 -6.446) 38.804 ======================= Grid point 185 (85/230) ======================= q-point: (-0.33 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.949 ( -7.503 23.414 -3.584) 24.846 1.421 ( -22.355 9.493 7.560) 25.437 2.052 ( -16.111 14.111 18.183) 28.094 2.452 ( -2.440 3.487 1.651) 4.565 2.740 ( -1.878 2.882 0.863) 3.546 2.810 ( 1.722 -0.611 3.102) 3.600 2.962 ( 3.784 -0.363 6.721) 7.722 3.039 ( 5.276 6.284 -6.093) 10.220 3.316 ( -4.096 9.501 4.382) 11.236 3.637 ( 0.296 0.463 5.730) 5.756 3.711 ( 0.070 3.269 4.010) 5.174 4.103 ( -5.718 1.789 2.906) 6.659 4.200 ( 1.601 -0.044 -1.493) 2.190 4.373 ( -1.864 -1.394 -1.999) 3.069 4.586 ( -1.753 -10.608 -10.207) 14.825 4.694 ( -11.766 -0.664 -8.269) 14.397 4.837 ( 10.787 -4.878 7.522) 14.026 5.162 ( 0.817 -4.599 7.326) 8.689 5.364 ( -4.236 -8.491 -1.914) 9.680 5.484 ( -2.438 -4.321 -3.627) 6.146 5.719 ( 2.537 4.979 -2.092) 5.967 6.251 ( -1.694 -2.836 4.328) 5.444 6.351 ( 1.759 3.823 -8.124) 9.149 6.696 ( -8.433 -14.898 -6.093) 18.171 7.114 ( 3.252 -5.415 -1.898) 6.595 7.333 ( 1.949 -6.024 -16.529) 17.700 8.416 ( 0.206 -8.888 -1.602) 9.033 9.073 ( 2.824 10.683 -1.891) 11.210 9.839 ( -3.109 7.909 2.905) 8.981 10.337 ( -1.347 0.809 7.647) 7.807 10.416 ( -4.480 -2.878 -5.843) 7.906 10.472 ( 2.335 -2.895 4.073) 5.515 10.644 ( 5.068 6.594 -8.800) 12.108 11.079 ( 7.854 1.949 2.180) 8.381 11.404 ( -1.240 -3.253 0.014) 3.481 11.779 ( 3.349 2.041 1.891) 4.354 11.862 ( 2.024 2.387 10.430) 10.889 11.980 ( 0.867 2.030 4.124) 4.678 13.221 ( -2.980 -2.495 -6.084) 7.219 13.807 ( -4.378 -1.434 0.293) 4.616 16.997 ( -22.850 -9.270 -18.986) 31.121 17.541 ( 28.321 0.343 15.137) 32.114 19.008 ( -10.010 -0.420 -5.902) 11.628 19.312 ( 4.282 -4.456 -4.869) 7.868 19.577 ( -5.689 2.244 -2.068) 6.455 20.148 ( -3.277 2.152 -1.628) 4.245 20.232 ( -3.563 -0.995 1.077) 3.853 20.970 ( -17.853 0.985 3.315) 18.185 21.158 ( -4.043 -4.718 -6.152) 8.744 21.559 ( -8.666 0.567 -3.149) 9.237 22.132 ( 9.776 3.583 2.070) 10.616 22.900 ( 11.921 2.155 2.506) 12.371 24.324 ( 1.100 3.379 -3.097) 4.713 24.462 ( 2.222 -1.400 2.513) 3.635 24.508 ( 3.814 -0.309 2.144) 4.386 24.761 ( -1.212 -0.191 -2.964) 3.208 25.455 ( 1.022 -2.929 -2.241) 3.827 25.874 ( 9.960 2.505 -0.267) 10.274 26.103 ( 3.641 9.786 -8.692) 13.586 27.074 ( -9.487 -9.983 3.062) 14.108 47.401 ( -4.954 -0.467 15.166) 15.961 47.547 ( -5.985 0.140 10.652) 12.219 49.136 ( 3.392 0.070 -8.830) 9.459 49.272 ( 5.849 0.529 -8.823) 10.599 98.571 ( 2.217 -2.119 2.859) 4.192 98.904 ( 0.705 -3.356 -1.386) 3.698 99.000 ( -6.043 1.389 4.589) 7.714 99.437 ( 4.904 -6.152 22.249) 23.599 100.548 ( -4.585 -1.136 3.597) 5.937 100.872 ( -4.378 0.938 5.757) 7.293 101.098 ( -0.532 0.996 -3.246) 3.437 102.905 ( 35.081 31.751 -16.549) 50.127 ======================= Grid point 186 (86/230) ======================= q-point: (-0.22 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.773 ( 0.680 14.611 12.716) 19.381 1.053 ( -19.305 9.883 15.398) 26.598 1.935 ( -10.135 18.026 31.907) 38.022 2.426 ( -0.836 0.853 4.401) 4.560 2.660 ( -2.616 3.292 -1.927) 4.625 2.830 ( -4.242 1.776 5.752) 7.364 2.980 ( 7.629 -0.039 -4.644) 8.931 3.214 ( 6.912 0.622 4.285) 8.156 3.283 ( -2.799 2.246 7.398) 8.222 3.638 ( -3.863 3.091 1.952) 5.319 3.684 ( -1.353 5.116 4.230) 6.775 3.975 ( -11.032 -2.868 0.098) 11.399 4.198 ( -2.198 -1.768 -0.283) 2.835 4.292 ( -1.689 1.364 -5.596) 6.003 4.482 ( -2.873 1.658 -9.736) 10.286 4.552 ( -0.649 -2.338 3.849) 4.550 5.136 ( 12.178 -4.317 6.668) 14.540 5.273 ( 1.523 -7.325 -1.394) 7.610 5.388 ( -4.713 -4.550 -5.756) 8.721 5.469 ( 1.793 -3.039 11.390) 11.924 5.763 ( 9.702 -0.311 -8.110) 12.648 6.202 ( -6.999 2.528 -5.990) 9.553 6.271 ( -3.367 -2.444 -0.447) 4.185 6.572 ( -11.706 -13.454 -3.816) 18.238 7.124 ( -1.571 -3.909 -8.762) 9.722 7.246 ( 3.108 0.736 -12.594) 12.993 8.496 ( 1.479 -10.118 0.728) 10.251 9.009 ( 1.460 11.419 -2.590) 11.800 9.797 ( -0.884 4.734 6.377) 7.991 10.298 ( -2.879 3.686 -0.873) 4.758 10.336 ( -2.064 -2.090 -3.048) 4.233 10.512 ( 2.798 9.674 -8.017) 12.872 10.733 ( 4.862 -8.770 7.971) 12.810 11.234 ( 8.967 -2.636 1.424) 9.454 11.417 ( -2.414 -7.799 1.500) 8.300 11.818 ( 1.097 2.200 1.793) 3.043 11.924 ( -2.989 -5.298 -1.330) 6.227 12.024 ( 5.774 10.840 7.572) 14.429 13.185 ( 1.204 -0.830 -0.710) 1.626 13.751 ( -2.955 -0.150 -0.558) 3.011 16.594 ( -11.640 -4.003 -8.437) 14.923 17.995 ( 5.681 1.099 5.065) 7.690 18.793 ( -1.132 -0.933 -4.302) 4.545 19.341 ( 0.117 -3.830 -5.572) 6.762 19.507 ( -0.566 1.830 1.317) 2.325 20.086 ( -1.113 1.607 -0.189) 1.964 20.129 ( -9.417 0.599 2.358) 9.727 20.716 ( -14.364 1.896 6.404) 15.841 21.079 ( -0.162 -2.128 -10.146) 10.368 21.460 ( -1.173 -1.569 -2.826) 3.439 22.237 ( 4.204 4.365 1.878) 6.344 23.039 ( 4.389 1.752 0.898) 4.810 24.267 ( -0.275 4.296 -4.244) 6.045 24.491 ( -0.404 -2.634 -3.444) 4.354 24.579 ( 2.232 0.658 4.388) 4.967 24.917 ( 13.062 -6.698 8.349) 16.888 25.473 ( 1.818 -2.236 -3.247) 4.341 25.984 ( 8.102 11.861 -9.995) 17.499 26.046 ( 4.315 1.626 1.227) 4.772 26.883 ( -20.784 -6.047 -2.631) 21.805 47.445 ( -6.083 -2.182 12.996) 14.514 47.553 ( -4.267 0.312 12.529) 13.240 49.105 ( 3.049 0.255 -10.337) 10.780 49.302 ( 6.008 0.679 -7.570) 9.689 98.663 ( 3.026 -1.927 4.434) 5.704 98.908 ( -5.886 0.738 3.977) 7.142 98.955 ( 1.156 -4.106 -2.314) 4.853 99.826 ( 5.026 -20.903 18.808) 28.564 100.516 ( -3.437 -0.515 5.366) 6.393 100.880 ( -1.793 -1.377 9.904) 10.159 101.077 ( 1.504 0.834 -2.070) 2.691 102.966 ( 24.379 41.982 -31.333) 57.781 ======================= Grid point 187 (87/230) ======================= q-point: (-0.11 0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.967 ( 8.636 -0.117 24.315) 25.803 1.054 ( 6.879 6.269 23.672) 25.436 1.949 ( -7.805 17.060 35.296) 39.972 2.496 ( 3.583 -2.173 3.573) 5.507 2.606 ( -0.804 0.382 0.694) 1.129 2.806 ( -2.147 1.792 6.028) 6.645 3.106 ( 5.420 -4.997 -0.973) 7.436 3.192 ( -9.487 0.859 6.166) 11.347 3.310 ( 3.817 2.079 1.738) 4.681 3.514 ( -6.095 3.277 1.757) 7.139 3.772 ( 2.104 2.226 7.236) 7.857 3.819 ( -5.041 -3.301 -0.682) 6.064 4.139 ( -3.229 0.254 -1.924) 3.768 4.226 ( -2.637 5.237 -3.201) 6.680 4.421 ( 5.712 0.968 -4.167) 7.137 4.704 ( 7.889 -1.713 10.970) 13.620 5.211 ( -9.029 0.082 -4.758) 10.206 5.269 ( -1.392 0.121 -6.628) 6.773 5.410 ( 9.042 -6.080 2.794) 11.249 5.663 ( -0.700 -4.800 9.104) 10.316 5.700 ( -4.682 3.578 -7.593) 9.611 6.077 ( -0.562 1.232 -1.501) 2.022 6.290 ( 7.481 -9.357 -5.071) 13.009 6.521 ( 0.772 -4.902 -1.536) 5.195 7.035 ( -0.101 -1.974 -10.288) 10.477 7.219 ( 4.121 3.765 -7.042) 8.986 8.609 ( 1.583 -9.720 1.567) 9.972 8.921 ( 0.612 10.864 -2.581) 11.183 9.852 ( 1.810 1.213 9.653) 9.896 10.202 ( -2.627 0.611 -8.109) 8.546 10.297 ( -0.762 2.966 0.457) 3.096 10.434 ( 1.414 4.202 -2.721) 5.202 10.865 ( 1.520 -0.977 1.265) 2.206 11.343 ( 1.026 -3.530 -7.399) 8.262 11.510 ( -1.358 -14.273 7.847) 16.344 11.798 ( -2.872 1.495 -0.694) 3.312 11.861 ( -3.698 -1.049 -2.134) 4.396 12.049 ( -4.685 5.275 3.448) 7.852 13.298 ( 11.340 -0.610 1.666) 11.478 13.694 ( -1.328 1.202 -2.882) 3.393 16.711 ( 25.742 -1.898 4.929) 26.278 17.680 ( -28.686 0.818 -10.625) 30.601 19.045 ( 19.687 -0.735 3.938) 20.090 19.290 ( -1.778 -0.446 -3.861) 4.274 19.540 ( 2.803 1.288 5.016) 5.888 19.987 ( -8.418 0.966 2.346) 8.792 20.094 ( 3.269 1.159 0.552) 3.512 20.582 ( -7.039 1.500 7.821) 10.629 21.032 ( 4.330 -0.139 -10.884) 11.714 21.452 ( 1.019 -2.106 -3.282) 4.030 22.264 ( -0.724 2.979 5.278) 6.103 23.051 ( -1.631 1.175 -0.193) 2.019 24.208 ( 0.280 2.312 -2.783) 3.629 24.465 ( 0.127 -1.986 -5.547) 5.894 24.644 ( 0.555 0.974 6.271) 6.371 25.288 ( 8.159 -15.704 3.364) 18.014 25.520 ( 8.357 -0.301 -4.008) 9.273 25.883 ( 4.044 11.309 -11.050) 16.320 26.166 ( 6.054 2.489 3.994) 7.668 26.466 ( -25.649 1.685 1.434) 25.744 47.438 ( -7.385 -1.525 9.929) 12.468 47.596 ( -4.930 -0.500 13.542) 14.420 49.067 ( 3.303 0.295 -10.433) 10.947 49.332 ( 5.370 0.549 -7.079) 8.902 98.761 ( 1.619 -1.392 2.939) 3.633 98.833 ( -4.936 1.315 6.231) 8.057 98.979 ( 0.281 -3.623 -3.224) 4.858 100.007 ( -12.536 -18.143 0.978) 22.074 100.552 ( 0.808 -1.794 2.914) 3.516 101.021 ( -0.196 -8.865 13.138) 15.850 101.110 ( 3.238 -1.012 1.616) 3.758 102.566 ( -1.394 41.912 -26.091) 49.390 ======================= Grid point 190 (88/230) ======================= q-point: ( 0.22 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.954 ( -9.518 -0.000 2.163) 9.761 2.260 ( -0.320 -0.000 5.229) 5.239 2.350 ( -0.534 -0.000 3.187) 3.231 2.626 ( 2.784 0.000 4.907) 5.642 2.645 ( -4.006 -0.000 -2.995) 5.002 3.016 ( -8.517 -0.000 6.921) 10.974 3.095 ( -14.188 -0.000 3.917) 14.719 3.256 ( 18.512 0.000 2.378) 18.664 3.295 ( -2.902 -0.000 17.626) 17.864 3.499 ( -2.248 -0.000 1.320) 2.607 3.806 ( 6.551 0.000 -15.081) 16.442 3.999 ( 2.808 0.000 -5.218) 5.925 4.033 ( 6.440 0.000 1.560) 6.626 4.271 ( -4.817 -0.000 -4.624) 6.677 4.346 ( -4.363 -0.000 6.800) 8.080 4.679 ( -2.448 -0.000 8.177) 8.536 4.817 ( -0.680 -0.000 -8.889) 8.915 5.502 ( 8.640 0.000 9.596) 12.912 5.673 ( -7.904 -0.000 -3.714) 8.733 5.739 ( -3.876 -0.000 -0.982) 3.998 5.860 ( 3.103 0.000 2.848) 4.212 5.899 ( -4.127 -0.000 -5.778) 7.100 6.440 ( 4.689 0.000 -16.593) 17.243 6.776 ( -0.533 -0.000 -2.566) 2.621 6.823 ( 3.184 0.000 -7.341) 8.002 7.271 ( 6.209 0.000 -9.607) 11.439 8.471 ( -4.707 -0.000 -5.266) 7.063 9.041 ( 5.430 0.000 1.854) 5.738 9.991 ( 0.834 0.000 3.617) 3.712 10.308 ( -0.209 -0.000 0.409) 0.459 10.556 ( 4.855 0.000 5.364) 7.234 10.586 ( -6.251 -0.000 -4.516) 7.712 10.679 ( 6.213 0.000 -1.460) 6.382 10.786 ( -0.669 -0.000 -5.979) 6.016 11.471 ( -2.324 -0.000 -0.843) 2.472 11.512 ( -0.056 -0.000 7.608) 7.608 11.681 ( -4.114 -0.000 8.703) 9.626 11.807 ( -2.838 -0.000 10.835) 11.200 13.562 ( -0.201 -0.000 -10.593) 10.595 13.926 ( 1.786 0.000 -1.332) 2.228 16.164 ( 5.111 0.000 4.970) 7.129 18.297 ( -10.592 -0.000 -10.274) 14.756 19.246 ( -2.441 -0.000 -0.592) 2.512 19.247 ( -3.607 -0.000 -2.659) 4.481 19.767 ( 16.934 0.000 -2.643) 17.139 19.908 ( -3.923 -0.000 4.757) 6.166 20.521 ( -0.649 -0.000 -6.414) 6.446 21.121 ( 4.299 0.000 -10.286) 11.148 21.299 ( 18.524 0.000 5.446) 19.308 21.962 ( 18.558 0.000 0.529) 18.565 22.030 ( -17.550 -0.000 9.618) 20.013 22.398 ( -14.122 -0.000 -1.258) 14.178 24.273 ( 0.629 0.000 -2.989) 3.055 24.303 ( 3.309 0.000 -1.607) 3.679 24.561 ( -5.824 -0.000 0.429) 5.840 25.183 ( -2.169 -0.000 -7.655) 7.956 25.345 ( 1.170 0.000 -0.530) 1.285 25.626 ( -3.655 -0.000 2.508) 4.432 26.318 ( 9.091 0.000 -10.722) 14.057 26.727 ( 0.369 0.000 13.943) 13.947 47.332 ( -5.761 -0.000 11.676) 13.019 47.598 ( -6.968 -0.000 12.207) 14.055 49.058 ( 5.380 0.000 -7.096) 8.905 49.340 ( 3.344 0.000 -9.938) 10.485 98.503 ( -2.321 -0.000 -0.562) 2.388 98.904 ( -0.712 -0.000 4.770) 4.822 99.112 ( -3.543 -0.000 9.709) 10.335 99.176 ( -5.419 -0.000 -3.131) 6.259 100.596 ( -0.802 -0.000 1.905) 2.067 101.083 ( -7.936 -0.000 8.492) 11.623 101.336 ( -1.327 -0.000 -5.332) 5.495 102.004 ( 16.625 0.000 0.480) 16.632 ======================= Grid point 191 (89/230) ======================= q-point: (-0.67 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.774 ( -12.291 3.944 3.324) 13.330 2.212 ( -2.369 5.050 -9.871) 11.339 2.394 ( 2.853 -0.982 -0.536) 3.064 2.592 ( -0.672 0.772 2.225) 2.450 2.618 ( -5.819 0.502 0.403) 5.855 2.899 ( -10.237 2.420 8.275) 13.384 2.920 ( -9.242 0.054 6.421) 11.254 3.390 ( 0.119 5.644 14.744) 15.788 3.487 ( 6.437 2.748 -4.861) 8.521 3.527 ( -0.030 -2.548 7.557) 7.975 3.881 ( 16.466 2.396 -6.797) 17.974 3.943 ( -4.016 9.715 -1.882) 10.679 4.117 ( -0.607 -4.449 -2.615) 5.196 4.172 ( 3.527 -9.552 -7.766) 12.806 4.355 ( -5.009 -5.601 6.656) 10.039 4.697 ( -2.523 1.010 -3.577) 4.493 4.796 ( 0.049 -0.613 10.268) 10.287 5.491 ( -8.912 -0.670 -3.827) 9.722 5.527 ( -9.857 6.299 -4.716) 12.612 5.663 ( -6.834 -7.606 -5.801) 11.756 5.802 ( -0.469 1.376 5.597) 5.783 5.936 ( 5.508 -1.914 -1.118) 5.937 6.427 ( 5.685 0.194 -8.631) 10.337 6.718 ( -2.706 -0.156 -3.277) 4.253 6.847 ( 4.370 -2.759 -5.097) 7.259 7.290 ( 5.386 -1.640 -10.956) 12.318 8.361 ( -3.924 -1.946 -4.199) 6.067 9.142 ( 5.731 2.336 0.817) 6.242 10.035 ( -0.797 -1.339 5.225) 5.453 10.268 ( -1.917 4.878 -1.436) 5.434 10.456 ( -5.816 -4.145 -3.786) 8.083 10.657 ( 2.313 2.532 3.821) 5.134 10.732 ( 4.868 4.274 -6.696) 9.317 10.797 ( 6.311 -2.561 -2.144) 7.140 11.432 ( -1.659 0.616 0.321) 1.798 11.606 ( 4.524 0.639 4.642) 6.514 11.725 ( -1.715 0.657 14.022) 14.142 11.846 ( -2.492 -0.799 8.275) 8.679 13.443 ( -3.029 -1.026 -11.216) 11.663 13.913 ( -2.071 -0.208 -0.857) 2.251 16.435 ( 18.015 0.081 11.327) 21.280 17.909 ( -20.907 -1.643 -15.908) 26.323 19.197 ( -0.328 -0.133 -2.529) 2.553 19.201 ( -1.276 -0.637 -2.056) 2.502 19.858 ( -5.537 0.411 2.499) 6.089 20.017 ( 12.311 -0.035 0.748) 12.334 20.426 ( -3.490 1.056 -6.018) 7.036 21.102 ( 3.025 -1.355 -9.678) 10.230 21.645 ( 17.053 0.607 4.559) 17.662 21.754 ( -23.283 0.360 8.095) 24.653 22.091 ( -13.860 0.138 -1.216) 13.914 22.343 ( 18.522 0.997 1.022) 18.577 24.288 ( 2.654 -0.101 0.108) 2.658 24.344 ( 3.364 0.001 -2.356) 4.107 24.474 ( -4.230 -0.091 0.218) 4.237 25.060 ( -4.016 -0.152 -9.347) 10.174 25.370 ( 1.666 -1.076 -0.750) 2.121 25.638 ( 2.717 0.281 2.316) 3.581 26.348 ( 7.766 5.109 -11.262) 14.603 26.846 ( -2.414 -4.085 13.908) 14.695 47.342 ( -5.295 0.165 12.693) 13.754 47.581 ( -6.880 -0.073 11.504) 13.404 49.094 ( 5.523 -0.066 -6.466) 8.504 49.308 ( 3.398 0.086 -10.711) 11.237 98.476 ( -0.701 -0.646 -0.118) 0.961 98.926 ( -1.087 -0.033 1.755) 2.065 99.105 ( -1.979 0.198 3.062) 3.652 99.118 ( -4.595 -0.152 8.360) 9.540 100.592 ( -1.839 -0.073 2.273) 2.925 101.013 ( -7.441 0.470 6.524) 9.907 101.252 ( -2.999 -0.195 -4.725) 5.600 102.377 ( 28.555 4.096 -1.714) 28.898 ======================= Grid point 192 (90/230) ======================= q-point: (-0.56 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.537 ( -12.174 9.796 1.190) 15.671 1.955 ( -10.051 13.732 -7.472) 18.586 2.315 ( -10.552 -6.673 -5.423) 13.612 2.586 ( -1.806 2.045 1.375) 3.055 2.648 ( 5.266 -2.022 4.362) 7.131 2.825 ( -6.122 0.974 7.850) 10.003 2.871 ( 1.485 8.259 7.876) 11.509 3.366 ( 2.417 14.659 -12.846) 19.641 3.505 ( 0.839 -0.209 6.668) 6.724 3.593 ( -4.892 4.190 12.001) 13.620 3.773 ( -4.902 3.583 3.337) 6.929 4.134 ( 11.738 -0.263 -0.544) 11.754 4.157 ( 3.136 -0.964 -0.769) 3.370 4.259 ( 4.247 -12.756 -7.119) 15.213 4.359 ( -5.427 -6.647 6.071) 10.512 4.623 ( -0.138 -0.340 -3.049) 3.071 4.858 ( -3.436 -0.167 4.440) 5.617 5.240 ( -12.665 3.828 -1.944) 13.372 5.349 ( -7.413 -5.436 -1.599) 9.331 5.472 ( -9.021 -6.647 -9.641) 14.782 5.835 ( 1.131 6.812 3.283) 7.646 6.076 ( 4.191 -6.686 3.580) 8.665 6.438 ( 2.901 0.869 -6.491) 7.163 6.640 ( -4.482 -3.272 -3.582) 6.604 6.926 ( 5.671 -4.347 -2.725) 7.647 7.283 ( 3.198 -3.954 -12.830) 13.801 8.303 ( -2.097 -4.094 -2.516) 5.243 9.206 ( 4.937 5.448 -0.923) 7.410 10.055 ( -2.748 4.400 5.419) 7.501 10.192 ( -0.833 0.310 -0.164) 0.904 10.382 ( -4.918 -7.235 -2.953) 9.234 10.624 ( -3.865 5.852 2.171) 7.341 10.761 ( 9.045 5.959 -8.971) 14.065 10.927 ( 8.475 -2.478 -2.022) 9.059 11.405 ( -1.958 -0.146 0.521) 2.032 11.714 ( 5.577 0.744 1.496) 5.822 11.820 ( -1.217 2.904 11.412) 11.838 11.903 ( 0.994 -1.407 10.387) 10.529 13.299 ( -4.314 -1.868 -9.235) 10.363 13.854 ( -4.517 -0.870 -0.098) 4.601 16.935 ( 26.663 0.141 15.006) 30.596 17.393 ( -24.638 -4.610 -17.494) 30.567 19.141 ( -3.697 -0.362 -2.388) 4.416 19.213 ( 3.502 -1.449 -3.809) 5.373 19.752 ( -7.091 1.181 -0.809) 7.235 20.179 ( 5.113 -0.109 1.716) 5.394 20.300 ( -4.612 1.611 -4.098) 6.377 21.080 ( 1.953 -2.290 -8.925) 9.419 21.387 ( -25.705 -0.173 6.054) 26.409 21.805 ( -13.608 1.178 -2.272) 13.846 21.953 ( 12.972 0.549 3.625) 13.480 22.672 ( 17.899 1.744 2.033) 18.098 24.349 ( 3.068 1.174 -0.005) 3.285 24.380 ( 3.111 -1.047 -0.729) 3.362 24.442 ( -0.093 -0.090 2.082) 2.086 24.899 ( -5.022 0.370 -9.255) 10.536 25.399 ( 1.701 -1.579 -1.599) 2.819 25.743 ( 7.919 0.653 1.253) 8.044 26.319 ( 6.075 8.193 -11.482) 15.358 26.929 ( -5.871 -7.423 11.429) 14.839 47.365 ( -5.145 0.222 13.795) 14.725 47.563 ( -6.537 -0.044 10.911) 12.719 49.130 ( 4.923 -0.072 -6.699) 8.314 49.278 ( 4.227 0.174 -10.686) 11.493 98.488 ( 0.982 -1.219 0.924) 1.818 98.893 ( -1.394 -0.551 -2.826) 3.199 99.082 ( -5.866 1.100 7.133) 9.300 99.187 ( 1.473 -1.088 12.536) 12.669 100.572 ( -3.304 -0.348 2.778) 4.331 100.941 ( -6.112 0.866 5.152) 8.040 101.169 ( -2.134 0.382 -3.842) 4.411 102.844 ( 36.574 11.067 -7.902) 39.021 ======================= Grid point 193 (91/230) ======================= q-point: (-0.44 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.254 ( -8.581 17.104 -1.357) 19.184 1.574 ( -19.853 12.007 1.989) 23.287 2.184 ( -4.160 2.057 2.290) 5.175 2.492 ( -6.758 1.206 0.447) 6.879 2.784 ( -0.104 3.703 8.881) 9.622 2.808 ( 1.141 0.312 3.373) 3.574 2.988 ( 8.621 4.732 6.456) 11.764 3.161 ( -0.416 10.519 -12.202) 16.116 3.466 ( -5.119 9.766 4.982) 12.100 3.612 ( 0.572 -1.880 4.820) 5.205 3.779 ( -1.507 3.743 8.669) 9.562 4.129 ( -6.001 0.811 -2.444) 6.530 4.205 ( -0.848 0.703 2.221) 2.479 4.343 ( 0.571 -4.602 -3.086) 5.570 4.402 ( -0.377 -11.073 0.555) 11.093 4.680 ( -5.191 -1.457 -9.293) 10.744 4.773 ( 6.467 -3.657 6.144) 9.641 5.096 ( -2.067 -3.920 -3.412) 5.593 5.264 ( -6.719 -4.407 3.665) 8.832 5.399 ( -1.921 -6.984 0.798) 7.288 5.809 ( 0.864 7.166 -0.168) 7.220 6.189 ( -0.364 -5.986 3.396) 6.892 6.394 ( -1.253 1.422 -5.937) 6.232 6.550 ( -5.770 -4.661 -3.799) 8.334 7.035 ( 4.546 -5.145 -2.399) 7.272 7.238 ( 1.453 -6.260 -15.206) 16.508 8.306 ( -0.206 -5.964 -0.792) 6.020 9.212 ( 3.421 8.062 -2.561) 9.124 9.963 ( -3.538 8.762 1.236) 9.530 10.271 ( 0.444 -5.903 6.607) 8.871 10.344 ( -1.666 -7.087 -0.139) 7.282 10.520 ( -3.588 6.284 0.406) 7.248 10.762 ( 6.904 8.550 -10.811) 15.416 11.071 ( 7.899 -2.843 -1.924) 8.613 11.372 ( -2.745 -1.195 -0.141) 2.998 11.802 ( 3.291 1.157 1.666) 3.866 11.841 ( -1.438 -2.884 2.387) 4.010 12.048 ( 4.432 5.065 12.015) 13.772 13.190 ( -2.530 -1.749 -4.687) 5.607 13.786 ( -4.548 -1.428 0.940) 4.859 16.882 ( -22.509 -6.210 -15.141) 27.829 17.546 ( 28.696 0.289 14.933) 32.350 19.002 ( -9.958 -0.311 -5.856) 11.557 19.261 ( 3.955 -2.532 -4.169) 6.280 19.608 ( -5.673 1.901 -2.166) 6.363 20.180 ( -3.690 2.075 -1.200) 4.401 20.225 ( -3.017 -0.064 2.120) 3.688 20.982 ( -16.036 0.856 1.970) 16.179 21.092 ( -5.142 -4.287 -4.811) 8.244 21.567 ( -9.361 0.494 -3.269) 9.927 22.170 ( 9.855 1.724 1.953) 10.194 22.932 ( 12.105 2.018 1.574) 12.373 24.356 ( 1.081 0.899 -2.547) 2.909 24.452 ( 2.447 0.068 2.039) 3.186 24.504 ( 3.769 -0.118 2.712) 4.645 24.760 ( -1.874 -0.027 -5.209) 5.536 25.423 ( 2.040 -1.583 -2.698) 3.735 25.903 ( 10.327 1.519 0.793) 10.469 26.246 ( 4.498 9.380 -11.360) 15.404 26.930 ( -10.850 -9.270 6.674) 15.754 47.396 ( -5.581 -0.254 14.443) 15.485 47.550 ( -5.698 0.220 10.896) 12.298 49.137 ( 3.518 0.049 -8.773) 9.452 49.277 ( 5.778 0.162 -8.915) 10.625 98.542 ( 2.414 -1.665 2.439) 3.814 98.865 ( -0.190 -1.925 -2.058) 2.824 99.022 ( -6.457 1.485 5.728) 8.759 99.371 ( 2.719 -3.197 18.021) 18.504 100.536 ( -4.380 -0.594 3.657) 5.737 100.888 ( -4.197 1.102 4.997) 6.618 101.112 ( -0.574 0.861 -2.944) 3.121 103.268 ( 37.819 18.072 -19.693) 46.311 ======================= Grid point 194 (92/230) ======================= q-point: (-0.33 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.025 ( -2.857 18.309 4.395) 19.045 1.218 ( -15.341 12.646 11.974) 23.209 2.175 ( -0.251 12.259 14.958) 19.341 2.408 ( -3.591 -3.256 1.394) 5.044 2.745 ( -4.623 8.204 4.762) 10.552 2.856 ( -1.567 1.885 4.300) 4.950 2.988 ( 2.740 2.291 -6.883) 7.754 3.205 ( 5.675 -0.435 4.439) 7.218 3.369 ( -4.267 7.517 4.577) 9.781 3.643 ( -1.883 -2.037 0.629) 2.844 3.775 ( -0.421 5.961 5.352) 8.022 3.929 ( -12.669 -2.871 -5.833) 14.240 4.193 ( -2.819 0.695 3.163) 4.294 4.322 ( -0.469 2.699 0.407) 2.769 4.489 ( 1.019 -5.968 2.620) 6.597 4.505 ( -2.828 1.144 -3.275) 4.476 5.068 ( 12.689 -4.891 5.212) 14.563 5.149 ( 5.870 -9.695 -4.626) 12.242 5.274 ( -2.015 -8.225 0.543) 8.486 5.439 ( -2.125 -1.619 9.580) 9.946 5.782 ( 2.954 2.756 -4.401) 5.974 6.203 ( -6.846 -6.106 0.158) 9.174 6.241 ( -8.226 2.550 -3.614) 9.339 6.477 ( -0.994 -1.184 -2.765) 3.168 7.058 ( -1.126 -4.757 -8.629) 9.918 7.212 ( 5.200 -4.572 -11.134) 13.111 8.369 ( 1.442 -7.295 1.678) 7.623 9.164 ( 1.629 9.545 -3.653) 10.349 9.875 ( -2.167 5.752 3.402) 7.025 10.259 ( -2.716 -5.310 -5.408) 8.051 10.394 ( -2.620 6.011 1.982) 6.850 10.581 ( 7.289 -6.625 11.283) 14.978 10.683 ( 2.826 8.745 -10.828) 14.203 11.196 ( 6.219 -3.565 -2.387) 7.555 11.333 ( -3.373 -3.611 -0.486) 4.965 11.824 ( -2.306 -3.874 1.306) 4.694 11.863 ( 0.387 -0.116 -0.818) 0.912 12.149 ( 2.274 6.387 6.699) 9.531 13.173 ( 2.094 -0.719 0.183) 2.221 13.743 ( -2.622 -0.885 0.887) 2.907 16.539 ( -8.042 -3.369 -5.668) 10.399 18.013 ( 6.652 1.214 5.206) 8.534 18.779 ( -1.824 -0.988 -4.912) 5.332 19.296 ( 1.939 -2.256 -4.296) 5.225 19.536 ( -0.602 2.025 1.115) 2.389 20.113 ( -1.544 1.872 0.111) 2.429 20.142 ( -8.256 1.168 2.898) 8.827 20.732 ( -14.733 0.310 6.378) 16.057 21.043 ( 1.862 -2.578 -9.719) 10.226 21.443 ( -2.507 -0.774 -2.933) 3.936 22.287 ( 4.360 2.392 0.688) 5.020 23.069 ( 4.786 2.086 0.162) 5.223 24.323 ( -0.151 3.091 -4.491) 5.454 24.453 ( -1.453 -2.324 -3.444) 4.401 24.591 ( 3.194 0.965 4.467) 5.576 24.835 ( 8.022 -4.411 5.457) 10.657 25.449 ( 3.438 -1.193 -3.813) 5.271 26.065 ( 7.260 1.618 2.144) 7.741 26.151 ( 5.575 10.289 -11.796) 16.616 26.786 ( -17.572 -7.060 1.257) 18.979 47.418 ( -6.676 -1.438 13.148) 14.816 47.559 ( -4.549 0.443 12.364) 13.182 49.108 ( 3.115 0.193 -10.282) 10.745 49.308 ( 6.024 0.205 -7.746) 9.815 98.632 ( 3.243 -2.042 3.911) 5.476 98.879 ( 0.204 -3.627 -0.411) 3.656 98.943 ( -6.141 1.589 4.139) 7.574 99.613 ( 0.741 -9.406 18.305) 20.594 100.508 ( -3.224 -0.571 5.039) 6.009 100.877 ( -2.337 0.487 7.457) 7.830 101.090 ( 1.235 0.907 -2.036) 2.548 103.439 ( 25.028 23.351 -35.969) 49.653 ======================= Grid point 195 (93/230) ======================= q-point: (-0.22 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.034 ( 6.650 9.707 15.840) 19.732 1.175 ( 5.148 9.881 19.667) 22.604 2.220 ( -2.247 16.797 23.820) 29.233 2.449 ( 2.863 -3.537 1.252) 4.720 2.629 ( -4.947 3.222 1.528) 6.099 2.837 ( -2.652 2.452 6.342) 7.298 3.021 ( 1.643 -5.529 -2.878) 6.446 3.216 ( -5.218 1.150 2.965) 6.111 3.325 ( -1.497 0.053 3.691) 3.983 3.575 ( -5.574 4.716 1.094) 7.383 3.712 ( -5.728 -6.519 -7.945) 11.766 3.852 ( 5.846 4.438 5.770) 9.336 4.161 ( -2.200 2.611 1.791) 3.855 4.308 ( -1.329 5.455 3.072) 6.400 4.440 ( 2.633 1.567 -2.709) 4.090 4.671 ( 7.507 -2.768 10.554) 13.244 5.201 ( -5.799 -2.504 -8.912) 10.924 5.253 ( 2.761 -2.753 -2.781) 4.789 5.323 ( 7.684 -4.829 0.624) 9.097 5.569 ( -0.956 -6.366 15.150) 16.461 5.734 ( -3.892 0.266 -5.879) 7.056 6.087 ( 4.579 -0.519 -2.036) 5.038 6.174 ( -2.388 -3.507 -2.120) 4.743 6.489 ( 3.367 -0.456 -0.860) 3.505 6.985 ( -0.622 -4.475 -10.159) 11.118 7.247 ( 5.780 -0.143 -8.348) 10.155 8.482 ( 2.394 -7.659 3.555) 8.777 9.073 ( 0.084 9.780 -4.090) 10.601 9.877 ( 0.680 2.037 6.692) 7.028 10.198 ( -1.448 -1.860 -7.056) 7.439 10.333 ( -1.406 2.692 0.233) 3.046 10.541 ( 0.686 9.493 -8.444) 12.724 10.835 ( 4.308 -3.238 7.130) 8.937 11.269 ( 0.207 -6.553 -8.037) 10.372 11.339 ( -0.672 -8.069 5.968) 10.058 11.811 ( -3.850 -4.518 -0.554) 5.962 11.824 ( -3.221 1.634 0.128) 3.614 12.121 ( -6.257 3.997 2.601) 7.867 13.289 ( 9.778 -0.658 2.306) 10.067 13.708 ( -1.340 0.532 -1.866) 2.358 16.678 ( 22.738 -2.532 5.454) 23.520 17.695 ( -29.019 1.199 -10.892) 31.019 19.032 ( 20.371 -1.006 3.720) 20.733 19.284 ( 0.314 -0.246 -4.138) 4.157 19.564 ( 2.714 1.894 4.711) 5.757 20.006 ( -8.517 1.542 2.204) 8.932 20.114 ( 3.097 1.516 0.433) 3.476 20.598 ( -7.497 0.504 7.030) 10.290 21.027 ( 5.220 -0.606 -10.731) 11.949 21.421 ( 0.841 -1.974 -2.640) 3.403 22.307 ( -0.892 2.582 2.802) 3.913 23.073 ( -1.723 1.781 -1.000) 2.672 24.248 ( -0.584 2.881 -4.219) 5.142 24.427 ( -0.196 -3.035 -4.239) 5.217 24.664 ( 1.215 1.600 5.551) 5.904 25.091 ( 6.893 -10.930 5.504) 14.046 25.509 ( 7.486 -0.995 -4.421) 8.751 26.015 ( -0.265 6.735 -8.537) 10.877 26.216 ( 5.731 4.175 2.036) 7.376 26.485 ( -17.763 0.501 -1.145) 17.807 47.412 ( -7.352 -1.732 11.004) 13.347 47.591 ( -4.964 -0.075 13.564) 14.444 49.071 ( 3.329 0.304 -10.462) 10.983 49.339 ( 5.371 0.354 -7.459) 9.198 98.734 ( 2.307 -2.113 3.242) 4.505 98.859 ( -5.416 2.105 6.394) 8.640 98.915 ( -0.090 -4.610 -1.399) 4.818 99.766 ( -8.016 -12.966 9.431) 17.925 100.529 ( -0.300 -1.287 4.393) 4.587 100.942 ( -1.127 -2.583 12.859) 13.164 101.110 ( 3.216 0.339 -0.843) 3.342 103.107 ( -1.544 30.059 -39.474) 49.640 ======================= Grid point 196 (94/230) ======================= q-point: (-0.11 0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.315 ( 9.163 -1.450 21.628) 23.534 1.556 ( 23.833 4.390 18.444) 30.454 2.236 ( -5.315 17.581 23.709) 29.991 2.489 ( -2.108 -5.045 -2.823) 6.154 2.624 ( 0.684 -3.405 3.888) 5.213 2.846 ( -0.980 1.694 5.097) 5.460 3.039 ( -3.902 -5.066 5.481) 8.422 3.227 ( 4.106 -1.739 -1.265) 4.635 3.306 ( -6.958 -4.842 4.482) 9.589 3.450 ( -3.955 1.758 -0.296) 4.338 3.705 ( 5.478 -1.896 -4.013) 7.050 3.956 ( 3.063 1.488 4.419) 5.579 4.100 ( -2.065 4.495 -1.717) 5.236 4.228 ( -4.141 10.125 6.248) 12.598 4.523 ( 5.867 2.131 0.367) 6.253 4.864 ( -0.005 -6.623 2.086) 6.944 5.068 ( -0.198 1.262 -1.572) 2.026 5.220 ( -0.205 4.225 -4.917) 6.486 5.346 ( -2.862 -1.319 -3.777) 4.919 5.662 ( -0.748 -3.930 9.162) 9.998 5.790 ( 6.566 -2.901 3.529) 7.999 6.053 ( -2.414 5.220 -2.118) 6.128 6.347 ( 15.207 -12.781 -11.868) 23.140 6.573 ( 5.363 -1.491 0.540) 5.592 6.939 ( 1.172 -3.410 -8.949) 9.648 7.258 ( 5.140 3.105 -8.172) 10.141 8.602 ( 1.889 -6.046 3.114) 7.059 8.966 ( -0.466 8.381 -3.671) 9.161 9.970 ( 2.591 -1.232 7.197) 7.748 10.116 ( -0.734 2.580 -5.525) 6.141 10.304 ( -0.483 0.747 -0.476) 1.009 10.467 ( 2.008 2.661 -2.376) 4.094 10.892 ( 0.144 2.845 -0.089) 2.850 11.191 ( -4.584 -5.318 -10.196) 12.380 11.454 ( -2.615 -10.428 7.490) 13.103 11.727 ( -6.049 0.780 1.014) 6.183 11.774 ( -4.272 -1.909 0.619) 4.720 11.956 ( -11.325 4.256 4.692) 12.976 13.518 ( 13.152 -1.744 0.431) 13.274 13.671 ( 1.285 1.185 -4.408) 4.741 17.062 ( -30.325 0.485 -11.896) 32.578 17.321 ( 38.274 -5.402 5.431) 39.033 19.257 ( 2.443 0.304 -5.770) 6.273 19.300 ( 6.069 0.383 1.342) 6.227 19.700 ( 7.872 0.894 6.812) 10.448 19.870 ( -7.702 1.138 -0.186) 7.788 20.216 ( 10.259 0.892 -0.211) 10.300 20.585 ( -0.891 0.116 6.708) 6.768 21.047 ( 7.988 0.672 -10.922) 13.548 21.444 ( 2.800 -1.847 -2.450) 4.154 22.288 ( -4.363 1.374 7.077) 8.427 22.983 ( -6.393 0.686 -1.345) 6.568 24.209 ( 0.966 1.029 -2.408) 2.791 24.406 ( 0.342 -1.971 -5.623) 5.968 24.700 ( -1.451 1.220 5.874) 6.172 25.249 ( 0.124 -9.149 1.131) 9.220 25.603 ( 2.898 1.021 -4.199) 5.203 25.915 ( 3.631 1.544 -8.268) 9.161 26.099 ( -15.578 0.547 4.856) 16.327 26.395 ( 7.416 6.538 0.723) 9.913 47.387 ( -7.358 -1.162 10.220) 12.647 47.613 ( -6.245 -0.056 13.577) 14.945 49.042 ( 3.799 0.308 -9.868) 10.579 49.359 ( 4.738 0.267 -7.500) 8.875 98.724 ( -4.286 0.656 0.038) 4.336 98.891 ( 0.351 -0.933 8.141) 8.202 98.926 ( -1.129 -2.817 0.760) 3.129 99.695 ( -13.800 -7.538 2.831) 15.978 100.564 ( 0.056 -1.145 1.602) 1.970 101.058 ( -2.376 -4.749 12.613) 13.685 101.180 ( 4.232 -0.569 1.464) 4.514 102.466 ( -12.624 26.800 -22.406) 37.143 ======================= Grid point 200 (95/230) ======================= q-point: (-0.67 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.607 ( -12.675 -0.000 3.729) 13.212 2.123 ( 2.845 0.000 -15.386) 15.647 2.196 ( -21.214 -0.000 -2.210) 21.328 2.595 ( -2.657 -0.000 0.231) 2.667 2.634 ( 7.187 0.000 5.185) 8.862 2.822 ( -5.355 -0.000 5.106) 7.400 2.958 ( 1.497 0.000 10.080) 10.191 3.464 ( -1.939 -0.000 -7.198) 7.454 3.586 ( 1.771 0.000 4.312) 4.662 3.587 ( 3.523 0.000 13.050) 13.518 3.799 ( -11.412 -0.000 -4.305) 12.197 4.067 ( 0.872 0.000 6.045) 6.108 4.143 ( 17.123 0.000 -5.599) 18.015 4.178 ( 2.916 0.000 -6.444) 7.073 4.329 ( -5.494 -0.000 9.872) 11.298 4.622 ( -0.859 -0.000 -4.484) 4.566 4.862 ( -3.541 -0.000 5.636) 6.656 5.278 ( -9.337 -0.000 -7.526) 11.993 5.300 ( -12.738 -0.000 2.628) 13.006 5.415 ( -8.936 -0.000 -8.825) 12.559 5.913 ( 0.280 0.000 10.305) 10.309 5.998 ( 5.552 0.000 -3.351) 6.485 6.441 ( 1.987 0.000 -4.873) 5.263 6.625 ( -3.946 -0.000 -3.860) 5.520 6.891 ( 5.912 0.000 -3.481) 6.860 7.253 ( 2.819 0.000 -12.964) 13.267 8.273 ( -2.259 -0.000 -2.348) 3.258 9.247 ( 5.296 0.000 -0.999) 5.389 10.074 ( -0.245 -0.000 8.272) 8.275 10.245 ( -1.934 -0.000 -1.847) 2.674 10.290 ( -6.537 -0.000 -4.654) 8.025 10.670 ( -4.329 -0.000 2.723) 5.114 10.817 ( 10.256 0.000 -8.570) 13.365 10.894 ( 8.084 0.000 -3.554) 8.830 11.404 ( -2.424 -0.000 0.811) 2.557 11.720 ( 5.531 0.000 1.405) 5.706 11.844 ( -3.587 -0.000 4.376) 5.658 11.890 ( 3.664 0.000 17.447) 17.828 13.285 ( -4.295 -0.000 -8.900) 9.882 13.847 ( -4.705 -0.000 -0.105) 4.706 16.936 ( 26.695 0.000 14.947) 30.595 17.359 ( -25.227 -0.000 -16.968) 30.402 19.138 ( -3.631 -0.000 -2.369) 4.336 19.203 ( 3.327 0.000 -3.825) 5.069 19.761 ( -6.957 -0.000 -0.747) 6.997 20.178 ( 5.215 0.000 1.939) 5.564 20.312 ( -4.908 -0.000 -4.061) 6.370 21.063 ( 2.491 0.000 -9.279) 9.607 21.385 ( -26.261 -0.000 6.148) 26.971 21.814 ( -14.863 -0.000 -2.696) 15.105 21.956 ( 14.099 0.000 4.161) 14.700 22.685 ( 17.934 0.000 1.793) 18.024 24.363 ( 4.562 0.000 2.424) 5.166 24.367 ( 1.632 0.000 -3.159) 3.556 24.442 ( 0.031 0.000 2.286) 2.287 24.902 ( -4.839 -0.000 -9.421) 10.591 25.387 ( 1.989 0.000 -1.641) 2.579 25.748 ( 8.020 0.000 1.341) 8.132 26.386 ( 7.081 0.000 -13.838) 15.544 26.867 ( -7.380 -0.000 13.769) 15.622 47.367 ( -5.190 -0.000 13.710) 14.659 47.563 ( -6.478 -0.000 10.933) 12.707 49.129 ( 4.962 0.000 -6.709) 8.344 49.279 ( 4.197 0.000 -10.680) 11.475 98.479 ( 1.049 0.000 0.825) 1.335 98.889 ( -1.480 -0.000 -3.132) 3.464 99.091 ( -6.184 -0.000 7.635) 9.825 99.178 ( 1.733 0.000 11.824) 11.951 100.569 ( -3.359 -0.000 2.766) 4.351 100.948 ( -6.013 -0.000 4.994) 7.817 101.172 ( -2.049 -0.000 -3.610) 4.151 102.925 ( 37.670 0.000 -8.367) 38.588 ======================= Grid point 202 (96/230) ======================= q-point: (-0.56 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.416 ( -10.884 5.211 3.445) 12.550 1.760 ( -20.651 10.894 1.598) 23.403 2.133 ( 6.176 -6.132 -9.849) 13.144 2.482 ( -8.314 -1.235 -3.324) 9.038 2.814 ( -0.577 0.329 4.212) 4.264 2.826 ( 6.472 1.328 9.033) 11.191 3.094 ( 7.247 7.039 8.346) 13.105 3.294 ( -3.935 4.640 -14.123) 15.377 3.560 ( -5.574 5.956 3.294) 8.798 3.631 ( -3.303 1.360 2.912) 4.609 3.789 ( 2.026 -1.881 10.310) 10.674 4.088 ( -7.400 -5.621 -5.079) 10.590 4.184 ( 0.039 -2.565 7.887) 8.294 4.273 ( 2.681 0.967 -2.006) 3.485 4.344 ( -3.323 -2.010 7.557) 8.497 4.654 ( 5.894 -1.370 -9.868) 11.575 4.745 ( -2.769 -0.335 2.264) 3.592 5.059 ( -5.296 -1.162 -9.697) 11.110 5.239 ( -5.271 0.933 3.743) 6.531 5.300 ( -2.126 -5.757 8.321) 10.339 5.919 ( -2.511 7.090 4.065) 8.549 6.085 ( 1.909 -7.208 -0.858) 7.506 6.397 ( -3.711 -0.183 -2.807) 4.657 6.534 ( -2.103 0.514 -4.112) 4.647 6.976 ( 5.683 -2.364 -2.900) 6.804 7.170 ( 0.915 -2.540 -14.829) 15.073 8.247 ( -0.394 -2.090 -0.147) 2.131 9.296 ( 3.797 3.092 -3.139) 5.816 10.086 ( -4.813 7.748 -0.325) 9.127 10.207 ( 0.180 -2.513 5.332) 5.897 10.235 ( -0.361 -7.172 1.926) 7.435 10.591 ( -4.588 2.780 -0.093) 5.365 10.878 ( 8.210 6.800 -9.594) 14.342 11.008 ( 7.579 -5.118 -5.696) 10.775 11.364 ( -3.149 -0.157 0.683) 3.226 11.802 ( -3.770 -1.041 1.137) 4.073 11.820 ( 4.479 0.114 0.979) 4.586 12.100 ( 4.956 1.863 13.360) 14.371 13.172 ( -2.205 -0.609 -3.916) 4.535 13.770 ( -4.713 -0.599 1.322) 4.931 16.821 ( -21.898 -2.107 -13.404) 25.761 17.549 ( 28.940 0.111 14.789) 32.500 18.999 ( -9.923 -0.108 -5.833) 11.511 19.237 ( 4.098 -0.784 -4.054) 5.817 19.628 ( -5.640 0.735 -2.227) 6.108 20.203 ( -4.227 1.014 -1.172) 4.502 20.225 ( -2.325 -0.075 2.584) 3.477 20.999 ( -17.452 1.473 2.796) 17.736 21.038 ( -3.460 -2.856 -5.699) 7.254 21.572 ( -9.779 0.193 -3.358) 10.341 22.185 ( 9.684 0.467 2.122) 9.925 22.954 ( 12.219 0.818 1.019) 12.289 24.359 ( 0.398 -0.095 -1.721) 1.769 24.456 ( 3.052 0.252 1.332) 3.340 24.504 ( 3.797 0.072 3.345) 5.061 24.760 ( -2.170 0.017 -6.625) 6.971 25.408 ( 2.569 -0.501 -2.869) 3.883 25.918 ( 10.482 0.540 0.994) 10.543 26.355 ( 5.915 4.707 -14.758) 16.582 26.822 ( -12.412 -4.633 10.661) 17.006 47.394 ( -5.839 -0.074 14.020) 15.188 47.553 ( -5.545 0.102 11.043) 12.357 49.137 ( 3.597 0.017 -8.748) 9.458 49.278 ( 5.658 0.014 -8.908) 10.553 98.525 ( 2.557 -0.603 2.232) 3.447 98.847 ( -0.536 -0.596 -2.644) 2.762 99.038 ( -6.725 0.667 6.494) 9.373 99.340 ( 2.358 -1.050 16.040) 16.247 100.530 ( -4.273 -0.192 3.552) 5.560 100.900 ( -4.110 0.461 4.620) 6.201 101.121 ( -0.600 0.336 -2.750) 2.835 103.437 ( 37.236 5.636 -20.465) 42.861 ======================= Grid point 203 (97/230) ======================= q-point: (-0.44 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.244 ( -6.915 10.221 7.325) 14.351 1.420 ( -11.148 14.335 6.903) 19.428 2.242 ( 7.894 -2.526 -5.286) 9.830 2.350 ( -3.886 -3.414 0.597) 5.207 2.835 ( -1.182 1.843 4.928) 5.393 2.928 ( -2.455 8.723 7.616) 11.837 3.053 ( -2.279 4.827 -7.446) 9.162 3.230 ( 2.364 4.781 3.076) 6.157 3.450 ( -6.970 2.324 2.519) 7.767 3.589 ( -2.342 -4.457 -1.024) 5.138 3.846 ( -4.724 3.513 2.145) 6.265 3.903 ( -5.746 -0.376 -4.063) 7.047 4.207 ( -2.784 1.053 4.087) 5.056 4.344 ( -3.811 -2.591 9.068) 10.172 4.386 ( 3.577 -4.411 8.404) 10.143 4.536 ( -1.537 2.537 -5.409) 6.169 5.000 ( 13.392 -4.172 2.428) 14.235 5.015 ( 7.282 -7.156 -5.857) 11.770 5.198 ( -1.572 -2.471 -0.203) 2.936 5.416 ( -1.052 -1.432 13.753) 13.867 5.830 ( -4.640 3.441 -0.383) 5.789 6.116 ( -2.914 -5.231 -1.298) 6.126 6.273 ( -6.887 1.701 -1.304) 7.213 6.486 ( 1.077 1.334 -3.451) 3.853 6.998 ( -0.785 -3.213 -9.681) 10.230 7.141 ( 6.524 -4.264 -9.053) 11.945 8.287 ( 1.442 -3.808 2.548) 4.804 9.277 ( 1.751 5.654 -4.811) 7.628 9.955 ( -4.027 4.868 0.589) 6.345 10.183 ( -2.078 -4.650 -3.965) 6.454 10.455 ( 3.156 -0.226 10.294) 10.770 10.501 ( 0.742 -0.950 3.798) 3.985 10.830 ( 4.259 10.214 -11.749) 16.141 11.112 ( 5.343 -7.608 -7.161) 11.734 11.312 ( -3.490 -0.012 0.440) 3.518 11.760 ( -3.328 -3.559 0.208) 4.877 11.877 ( 1.484 0.936 0.120) 1.758 12.215 ( -0.187 2.851 6.492) 7.093 13.165 ( 2.584 -0.418 0.741) 2.721 13.730 ( -2.564 -0.797 2.066) 3.388 16.501 ( -5.906 -1.843 -4.323) 7.548 18.028 ( 7.531 0.778 5.325) 9.256 18.767 ( -2.450 -0.606 -5.448) 6.004 19.273 ( 3.268 -0.930 -4.216) 5.415 19.561 ( -0.631 1.297 0.931) 1.717 20.137 ( -2.002 1.285 0.406) 2.413 20.158 ( -7.567 0.852 3.015) 8.190 20.731 ( -15.541 -0.243 6.999) 17.046 21.011 ( 3.548 -1.732 -9.922) 10.678 21.436 ( -3.257 -0.292 -3.105) 4.509 22.309 ( 4.179 0.862 0.639) 4.314 23.095 ( 5.036 1.389 -0.519) 5.250 24.350 ( 0.277 0.653 -2.448) 2.548 24.431 ( -2.808 -0.609 -5.077) 5.833 24.606 ( 3.875 0.945 4.977) 6.378 24.787 ( 5.995 -2.163 2.631) 6.895 25.437 ( 4.064 -0.571 -4.042) 5.760 26.085 ( 6.854 0.972 1.977) 7.200 26.284 ( 6.450 7.574 -13.942) 17.128 26.687 ( -16.344 -6.159 5.283) 18.248 47.403 ( -6.893 -0.633 12.859) 14.604 47.565 ( -4.657 0.307 12.341) 13.194 49.110 ( 3.154 0.103 -10.256) 10.731 49.309 ( 5.941 -0.029 -7.657) 9.692 98.609 ( 3.425 -1.118 3.575) 5.075 98.838 ( 0.074 -1.900 -1.022) 2.159 98.967 ( -6.762 1.356 5.606) 8.888 99.524 ( 0.181 -3.561 16.131) 16.520 100.501 ( -3.161 -0.373 4.682) 5.662 100.886 ( -2.493 0.549 6.339) 6.834 101.101 ( 1.011 0.584 -2.005) 2.320 103.672 ( 22.676 9.663 -35.027) 42.830 ======================= Grid point 204 (98/230) ======================= q-point: (-0.33 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.223 ( 5.985 14.286 10.634) 18.789 1.329 ( 2.628 11.137 14.241) 18.269 2.277 ( -0.224 -7.692 -0.427) 7.707 2.484 ( 10.475 5.792 6.339) 13.545 2.704 ( -9.910 6.273 -1.065) 11.777 2.877 ( -2.810 2.827 6.446) 7.579 2.984 ( -3.350 2.185 0.277) 4.009 3.193 ( -5.820 -4.646 2.224) 7.772 3.318 ( -8.994 -1.176 1.417) 9.180 3.636 ( 4.502 0.960 -0.942) 4.698 3.646 ( -8.812 0.430 -4.052) 9.708 3.912 ( 5.258 3.714 0.068) 6.438 4.204 ( -0.983 2.775 4.277) 5.193 4.361 ( -2.604 1.248 8.557) 9.031 4.466 ( 0.364 2.161 0.145) 2.197 4.625 ( 7.541 -3.615 9.460) 12.626 5.124 ( 2.586 -7.031 -5.884) 9.526 5.199 ( 4.916 -2.758 -2.279) 6.080 5.290 ( 9.077 -0.990 -0.358) 9.138 5.513 ( -2.549 -1.144 16.280) 16.518 5.717 ( -5.187 -2.103 -3.358) 6.527 6.073 ( -0.089 -0.834 -0.064) 0.842 6.178 ( -1.212 2.103 -2.203) 3.277 6.492 ( 3.240 0.609 -1.953) 3.832 6.916 ( -0.521 -4.635 -10.808) 11.772 7.224 ( 7.166 -2.455 -6.982) 10.302 8.391 ( 2.921 -4.828 5.014) 7.548 9.197 ( -0.292 6.960 -5.690) 8.995 9.907 ( -0.679 2.008 3.694) 4.259 10.153 ( -0.549 -3.590 -4.709) 5.947 10.380 ( -2.576 3.271 -2.466) 4.839 10.686 ( 0.632 9.587 -10.643) 14.338 10.781 ( 7.035 -2.992 12.597) 14.735 11.158 ( 0.300 -8.650 -9.160) 12.603 11.273 ( -1.823 -1.786 2.145) 3.333 11.744 ( -2.675 -4.061 1.044) 4.974 11.847 ( -3.743 1.325 -0.534) 4.006 12.163 ( -7.792 1.871 2.452) 8.381 13.280 ( 8.722 -0.513 2.743) 9.157 13.710 ( -1.337 -0.124 -0.400) 1.401 16.643 ( 20.492 -2.016 5.755) 21.380 17.712 ( -29.407 1.015 -11.195) 31.483 19.018 ( 21.181 -0.795 3.462) 21.476 19.283 ( 1.881 -0.049 -4.731) 5.091 19.591 ( 2.598 1.615 4.414) 5.370 20.029 ( -8.571 1.425 2.043) 8.926 20.135 ( 2.491 1.220 0.646) 2.848 20.597 ( -7.785 -0.409 7.035) 10.501 21.015 ( 6.287 -0.862 -10.618) 12.370 21.399 ( 0.592 -1.086 -2.475) 2.767 22.335 ( -1.006 1.225 1.756) 2.365 23.098 ( -1.807 1.547 -1.966) 3.086 24.286 ( -1.579 2.173 -5.092) 5.757 24.383 ( -0.292 -2.754 -3.173) 4.211 24.688 ( 1.441 1.652 5.385) 5.814 24.970 ( 6.690 -5.918 4.731) 10.108 25.495 ( 6.867 -0.842 -4.647) 8.334 26.087 ( -2.370 3.499 -4.941) 6.501 26.283 ( 2.334 4.993 0.047) 5.512 26.474 ( -10.222 -2.108 -2.614) 10.760 47.391 ( -7.283 -1.088 11.410) 13.580 47.593 ( -5.029 0.183 13.399) 14.313 49.075 ( 3.359 0.199 -10.442) 10.970 49.342 ( 5.368 0.053 -7.493) 9.217 98.707 ( 2.798 -1.511 3.326) 4.601 98.854 ( -0.152 -3.126 0.433) 3.160 98.893 ( -5.912 1.931 6.095) 8.708 99.635 ( -5.334 -5.744 10.650) 13.224 100.514 ( -0.810 -0.878 4.634) 4.786 100.923 ( -1.561 -0.527 10.650) 10.777 101.115 ( 2.787 0.364 -1.249) 3.076 103.431 ( -1.257 15.230 -41.353) 44.086 ======================= Grid point 205 (99/230) ======================= q-point: (-0.22 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.365 ( 8.903 8.259 13.925) 18.477 1.630 ( 21.213 5.428 16.521) 27.430 2.356 ( 1.149 -7.097 0.985) 7.256 2.487 ( -11.739 6.168 5.759) 14.457 2.605 ( 0.700 4.416 4.038) 6.024 2.871 ( -0.823 1.529 4.616) 4.932 2.963 ( -0.729 -4.963 3.231) 5.967 3.183 ( -3.108 -5.910 3.282) 7.441 3.225 ( -5.284 -3.695 1.945) 6.734 3.480 ( -5.841 2.240 -0.407) 6.269 3.706 ( 6.456 1.685 -4.203) 7.886 3.972 ( 3.281 0.823 -0.934) 3.509 4.176 ( -1.342 5.553 0.392) 5.726 4.353 ( -3.795 6.451 9.272) 11.916 4.549 ( 8.129 0.866 3.609) 8.936 4.775 ( -2.574 -5.220 1.658) 6.052 5.091 ( 0.169 1.596 -3.047) 3.444 5.280 ( 1.891 3.715 -1.236) 4.348 5.327 ( 2.791 -0.253 -3.897) 4.801 5.604 ( -3.457 -3.470 10.922) 11.970 5.739 ( 5.257 -4.565 3.276) 7.695 6.101 ( -1.493 -0.978 -2.524) 3.091 6.215 ( 12.512 -2.249 -6.147) 14.121 6.555 ( 4.923 -0.990 -0.121) 5.023 6.876 ( 1.538 -4.930 -8.649) 10.073 7.285 ( 6.301 0.620 -7.574) 9.872 8.526 ( 3.178 -4.352 5.483) 7.687 9.079 ( -1.627 6.768 -5.717) 9.008 9.957 ( 1.973 -0.635 5.138) 5.541 10.132 ( 0.666 -0.473 -4.020) 4.102 10.310 ( -1.320 0.376 -2.896) 3.205 10.541 ( 0.212 7.260 -7.069) 10.135 10.934 ( 1.541 2.482 3.776) 4.774 11.095 ( -4.086 -7.453 -9.682) 12.884 11.326 ( -1.173 -7.024 6.541) 9.669 11.733 ( -4.635 -0.897 1.879) 5.081 11.744 ( -5.305 -1.013 0.262) 5.408 12.001 ( -11.280 1.989 3.518) 11.982 13.493 ( 12.276 -1.523 1.649) 12.480 13.686 ( 1.035 0.791 -3.506) 3.740 17.069 ( -30.255 0.556 -12.085) 32.584 17.242 ( 35.129 -5.073 8.245) 36.439 19.263 ( 2.536 0.436 -6.114) 6.633 19.305 ( 7.181 0.306 1.293) 7.303 19.715 ( 7.258 1.097 6.270) 9.654 19.888 ( -7.731 1.287 -0.357) 7.845 20.227 ( 9.549 0.611 -0.490) 9.581 20.583 ( -1.147 -0.374 6.170) 6.287 21.055 ( 8.943 0.411 -10.867) 14.080 21.418 ( 2.769 -1.505 -1.949) 3.706 22.305 ( -4.706 0.979 5.503) 7.307 22.993 ( -6.897 0.754 -2.412) 7.345 24.224 ( 0.068 0.941 -3.249) 3.383 24.375 ( 0.405 -2.237 -4.059) 4.652 24.719 ( -1.779 1.236 5.056) 5.500 25.138 ( 3.831 -5.871 2.697) 7.511 25.595 ( 6.784 -1.477 -4.108) 8.067 25.950 ( -3.260 2.786 -7.618) 8.742 26.114 ( -15.953 1.216 4.721) 16.681 26.475 ( 8.512 4.146 -2.204) 9.722 47.370 ( -7.170 -1.087 10.642) 12.878 47.613 ( -6.032 0.130 13.563) 14.844 49.047 ( 3.799 0.287 -9.889) 10.598 49.362 ( 4.688 0.129 -7.685) 9.003 98.731 ( -2.810 0.232 0.185) 2.826 98.865 ( -1.316 -2.453 1.637) 3.229 98.901 ( -0.444 -0.313 9.159) 9.175 99.605 ( -9.543 -4.599 4.347) 11.450 100.548 ( 0.022 -1.059 2.542) 2.754 101.008 ( -2.405 -2.284 13.347) 13.753 101.172 ( 4.621 -0.487 -0.187) 4.650 102.812 ( -15.614 19.681 -31.450) 40.252 ======================= Grid point 206 (100/230) ======================= q-point: (-0.11 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.637 ( 10.080 -0.264 17.080) 19.835 2.150 ( 25.409 0.718 11.488) 27.895 2.289 ( -12.682 0.470 6.455) 14.238 2.396 ( -2.751 -1.316 3.320) 4.508 2.596 ( -3.279 -3.853 -0.036) 5.059 2.855 ( -3.136 0.426 2.318) 3.923 3.041 ( -1.374 -1.113 9.651) 9.811 3.186 ( -7.540 -5.178 8.129) 12.237 3.240 ( 2.569 -4.350 -3.859) 6.357 3.439 ( 1.610 -0.680 2.028) 2.678 3.752 ( 4.249 -1.249 -6.890) 8.190 3.994 ( 1.374 -0.563 -2.156) 2.618 4.096 ( -1.303 6.724 -2.372) 7.248 4.331 ( -2.592 7.138 10.452) 12.920 4.591 ( -6.678 7.707 5.228) 11.460 4.821 ( 8.768 -3.912 -2.325) 9.879 5.003 ( -4.702 -0.601 -6.776) 8.269 5.233 ( 0.584 6.735 -1.982) 7.045 5.449 ( 9.169 1.041 5.843) 10.922 5.645 ( -3.183 -5.894 4.876) 8.286 5.893 ( 5.192 -2.731 -0.355) 5.878 6.058 ( 0.229 3.958 -0.568) 4.005 6.376 ( 9.593 -8.117 -12.814) 17.948 6.656 ( 5.160 -1.544 0.014) 5.387 6.888 ( 4.178 -2.904 -7.422) 8.998 7.300 ( 5.161 3.279 -8.050) 10.109 8.631 ( 1.445 -1.873 2.981) 3.806 8.964 ( -1.157 4.519 -4.404) 6.416 10.014 ( 0.749 1.392 -0.378) 1.626 10.157 ( 3.572 -0.481 4.406) 5.692 10.278 ( -0.627 -2.425 -2.222) 3.348 10.498 ( 2.657 0.421 -2.494) 3.669 10.895 ( -3.025 4.263 -1.578) 5.460 10.985 ( -3.734 -4.579 -10.025) 11.637 11.404 ( -3.674 -6.354 8.403) 11.157 11.615 ( -6.821 -1.003 -0.876) 6.950 11.721 ( -3.809 -0.413 5.145) 6.414 11.851 ( -8.916 2.040 6.449) 11.191 13.669 ( 3.289 1.410 -5.516) 6.575 13.715 ( 10.204 -1.565 -0.706) 10.348 16.515 ( -22.629 0.144 -8.618) 24.215 17.932 ( 30.344 -5.152 6.892) 31.540 19.260 ( 5.230 -0.140 -7.898) 9.474 19.346 ( -1.011 1.262 0.971) 1.887 19.721 ( -7.466 1.037 -3.758) 8.423 19.864 ( 2.166 0.491 6.147) 6.536 20.422 ( 13.292 -0.457 -4.362) 13.997 20.673 ( 6.284 -0.519 6.194) 8.839 21.117 ( 9.596 1.800 -10.873) 14.613 21.490 ( 6.595 -1.715 -1.374) 6.952 22.260 ( -7.730 0.101 9.087) 11.930 22.826 ( -10.290 -0.474 -1.968) 10.487 24.217 ( 1.800 -0.119 -1.922) 2.636 24.355 ( 0.356 -1.101 -4.883) 5.019 24.699 ( -4.338 0.206 4.034) 5.927 25.235 ( 2.737 -2.425 0.477) 3.688 25.569 ( -4.767 5.178 -3.773) 7.986 25.848 ( -7.252 -1.089 -1.253) 7.440 25.976 ( 2.301 -5.067 -3.536) 6.593 26.578 ( 6.669 5.069 3.513) 9.083 47.348 ( -6.803 -0.816 10.536) 12.568 47.618 ( -6.680 0.235 13.322) 14.904 49.033 ( 4.360 0.294 -8.979) 9.986 49.368 ( 4.115 0.046 -8.208) 9.182 98.658 ( -4.282 1.414 -0.093) 4.511 98.873 ( -1.610 -2.085 1.945) 3.275 98.988 ( -0.173 -0.572 10.216) 10.234 99.477 ( -9.932 -1.918 0.159) 10.117 100.571 ( 0.053 -0.676 1.512) 1.657 101.081 ( -4.450 -2.775 12.364) 13.430 101.271 ( 6.329 -0.838 -0.093) 6.385 102.211 ( -14.152 14.418 -16.836) 26.298 ======================= Grid point 211 (101/230) ======================= q-point: (-0.56 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.317 ( -7.956 -0.000 9.106) 12.092 1.549 ( -11.487 -0.000 7.885) 13.933 2.195 ( 9.487 0.000 -15.561) 18.225 2.326 ( -1.649 -0.000 1.784) 2.429 2.844 ( 0.025 0.000 3.476) 3.476 3.006 ( 2.976 0.000 10.416) 10.833 3.086 ( -8.130 -0.000 -11.675) 14.227 3.301 ( 2.044 0.000 2.602) 3.309 3.448 ( -11.473 -0.000 3.315) 11.942 3.546 ( -2.980 -0.000 -3.070) 4.279 3.867 ( -10.755 -0.000 -2.822) 11.119 3.912 ( 3.585 0.000 2.360) 4.292 4.218 ( -4.042 -0.000 1.962) 4.493 4.288 ( 2.124 0.000 12.732) 12.908 4.372 ( -2.800 -0.000 12.457) 12.768 4.560 ( -0.602 -0.000 -6.289) 6.318 4.963 ( 3.424 0.000 -6.115) 7.009 4.965 ( 17.590 0.000 1.683) 17.670 5.183 ( -0.716 -0.000 -2.248) 2.359 5.404 ( -0.224 -0.000 16.881) 16.882 5.861 ( -10.253 -0.000 2.592) 10.575 6.072 ( 1.860 0.000 -3.069) 3.589 6.286 ( -6.416 -0.000 -0.873) 6.476 6.498 ( 1.011 0.000 -3.630) 3.768 6.973 ( -0.622 -0.000 -10.345) 10.364 7.107 ( 6.983 0.000 -8.135) 10.721 8.260 ( 1.449 0.000 2.895) 3.237 9.319 ( 1.790 0.000 -5.343) 5.635 9.997 ( -5.720 -0.000 -0.793) 5.775 10.142 ( -1.030 -0.000 -3.578) 3.723 10.432 ( 7.964 0.000 16.867) 18.652 10.514 ( -4.099 -0.000 -2.629) 4.870 10.951 ( 5.283 0.000 -9.752) 11.091 11.009 ( 4.297 0.000 -10.262) 11.126 11.314 ( -3.277 -0.000 0.593) 3.331 11.733 ( -3.346 -0.000 0.112) 3.348 11.884 ( 1.567 0.000 0.164) 1.575 12.235 ( -1.040 -0.000 6.440) 6.523 13.162 ( 2.727 0.000 0.926) 2.880 13.723 ( -2.562 -0.000 2.511) 3.587 16.487 ( -5.242 -0.000 -3.935) 6.555 18.033 ( 7.888 0.000 5.370) 9.542 18.762 ( -2.706 -0.000 -5.657) 6.271 19.267 ( 3.724 0.000 -4.288) 5.680 19.571 ( -0.642 -0.000 0.859) 1.073 20.147 ( -2.132 -0.000 0.478) 2.185 20.165 ( -7.402 -0.000 3.079) 8.017 20.729 ( -15.925 -0.000 7.297) 17.517 20.997 ( 4.204 0.000 -10.095) 10.936 21.433 ( -3.494 -0.000 -3.161) 4.712 22.315 ( 4.087 0.000 0.698) 4.146 23.106 ( 5.118 0.000 -0.792) 5.178 24.352 ( 0.414 0.000 -1.346) 1.408 24.429 ( -3.289 -0.000 -5.898) 6.753 24.614 ( 4.070 0.000 5.368) 6.737 24.771 ( 5.501 0.000 1.359) 5.666 25.433 ( 4.220 0.000 -4.107) 5.889 26.092 ( 6.843 0.000 1.920) 7.108 26.347 ( 7.994 0.000 -17.039) 18.821 26.633 ( -17.393 -0.000 8.960) 19.565 47.399 ( -6.940 -0.000 12.714) 14.485 47.567 ( -4.687 -0.000 12.345) 13.205 49.111 ( 3.168 0.000 -10.252) 10.730 49.309 ( 5.902 0.000 -7.599) 9.622 98.601 ( 3.511 0.000 3.487) 4.949 98.824 ( -0.039 -0.000 -1.280) 1.280 98.978 ( -6.899 -0.000 6.051) 9.176 99.499 ( 0.210 0.000 15.331) 15.333 100.498 ( -3.147 -0.000 4.533) 5.518 100.890 ( -2.540 -0.000 5.991) 6.507 101.105 ( 0.924 0.000 -1.992) 2.196 103.740 ( 21.639 0.000 -34.318) 40.571 ======================= Grid point 213 (102/230) ======================= q-point: (-0.44 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.370 ( 5.750 4.878 14.328) 16.191 1.497 ( 0.384 9.458 8.352) 12.624 2.144 ( 0.353 -7.488 -8.268) 11.161 2.519 ( 16.022 0.155 1.069) 16.059 2.771 ( -9.061 2.490 -10.206) 13.873 2.914 ( -2.947 2.242 6.253) 7.267 3.077 ( -9.134 7.020 2.139) 11.717 3.110 ( -9.152 -4.852 3.965) 11.091 3.284 ( -10.957 -2.994 1.237) 11.426 3.627 ( 6.071 -0.079 -0.910) 6.139 3.684 ( -7.172 1.698 0.188) 7.373 3.956 ( 4.642 1.942 -3.636) 6.208 4.229 ( 0.764 0.610 5.264) 5.354 4.353 ( -4.392 -1.238 9.693) 10.714 4.508 ( 1.399 3.616 5.728) 6.917 4.567 ( 4.819 -4.134 7.199) 9.599 5.046 ( 7.901 -2.896 -3.473) 9.104 5.184 ( 3.486 0.037 -1.779) 3.914 5.273 ( 14.725 -1.014 0.342) 14.764 5.521 ( -2.315 1.264 15.020) 15.250 5.686 ( -9.690 -1.685 -1.007) 9.887 6.065 ( -1.944 -0.287 0.986) 2.199 6.205 ( 0.224 1.161 -2.101) 2.411 6.501 ( 2.703 0.428 -2.627) 3.794 6.864 ( -0.359 -2.055 -11.964) 12.144 7.193 ( 8.007 -1.342 -5.562) 9.842 8.343 ( 3.177 -1.641 5.772) 6.790 9.267 ( -0.520 2.546 -6.875) 7.350 9.930 ( -1.860 0.934 1.852) 2.786 10.111 ( -0.017 -1.753 -3.319) 3.754 10.415 ( -3.115 1.362 -4.539) 5.671 10.720 ( 7.173 -1.406 13.840) 15.652 10.859 ( 1.558 10.341 -9.480) 14.116 11.020 ( 1.023 -10.013 -10.191) 14.323 11.265 ( -2.648 0.003 0.202) 2.656 11.702 ( -1.968 -1.531 1.716) 3.027 11.861 ( -3.943 0.470 -0.759) 4.043 12.179 ( -8.631 0.507 2.362) 8.963 13.274 ( 8.215 -0.205 2.953) 8.732 13.708 ( -1.288 -0.132 0.561) 1.411 16.623 ( 19.407 -0.759 5.885) 20.294 17.722 ( -29.669 0.392 -11.397) 31.785 19.010 ( 21.715 -0.296 3.293) 21.966 19.282 ( 2.651 0.001 -5.167) 5.807 19.607 ( 2.519 0.629 4.245) 4.976 20.044 ( -8.600 0.586 1.929) 8.833 20.147 ( 1.951 0.457 0.896) 2.195 20.591 ( -7.869 -0.280 7.152) 10.637 21.005 ( 6.963 -0.409 -10.579) 12.671 21.388 ( 0.444 -0.330 -2.443) 2.505 22.345 ( -1.058 0.316 1.486) 1.851 23.115 ( -1.849 0.606 -2.623) 3.266 24.310 ( -2.637 1.069 -5.758) 6.423 24.352 ( 0.161 -1.377 -2.265) 2.656 24.707 ( 1.133 0.775 5.733) 5.895 24.914 ( 7.122 -1.933 3.442) 8.143 25.486 ( 6.533 -0.319 -4.766) 8.093 26.120 ( -2.585 1.115 -3.022) 4.130 26.357 ( -3.825 5.014 -0.245) 6.311 26.427 ( -2.912 -4.087 -3.823) 6.309 47.381 ( -7.239 -0.352 11.438) 13.540 47.595 ( -5.070 0.103 13.306) 14.240 49.077 ( 3.377 0.069 -10.424) 10.958 49.342 ( 5.366 -0.020 -7.425) 9.161 98.693 ( 3.100 -0.442 3.380) 4.607 98.823 ( -0.147 -1.143 0.238) 1.177 98.914 ( -6.215 0.841 6.811) 9.259 99.584 ( -4.172 -1.609 10.370) 11.293 100.505 ( -0.997 -0.327 4.611) 4.729 100.920 ( -1.759 -0.054 9.546) 9.707 101.119 ( 2.494 0.148 -1.407) 2.868 103.571 ( -1.052 4.509 -40.617) 40.880 ======================= Grid point 214 (103/230) ======================= q-point: (-0.33 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.532 ( 7.520 13.093 8.294) 17.227 1.701 ( 18.928 3.939 14.875) 24.394 2.206 ( 3.208 -11.652 -4.194) 12.793 2.499 ( -12.550 -0.850 -4.821) 13.471 2.729 ( -2.998 7.223 -0.093) 7.821 2.868 ( 5.648 -3.007 2.225) 6.775 2.922 ( -3.967 0.547 4.730) 6.197 3.107 ( -6.783 -2.394 10.792) 12.970 3.182 ( -4.377 -3.288 0.758) 5.526 3.511 ( -7.479 1.840 0.076) 7.703 3.738 ( 5.835 2.120 -3.204) 6.987 3.980 ( 2.428 0.274 -3.770) 4.493 4.256 ( -0.254 5.472 1.921) 5.805 4.398 ( -1.656 -1.039 8.556) 8.777 4.554 ( 6.537 1.284 3.529) 7.539 4.711 ( -1.980 -3.979 5.916) 7.400 5.109 ( 0.398 0.908 -3.236) 3.385 5.293 ( 9.930 -0.364 -1.881) 10.113 5.390 ( 2.505 7.386 -0.715) 7.831 5.570 ( -3.448 -1.280 9.584) 10.266 5.654 ( 2.174 -7.020 3.448) 8.118 6.052 ( -1.163 -3.004 0.070) 3.222 6.249 ( 8.729 3.534 -3.416) 10.018 6.544 ( 4.376 -0.483 -0.811) 4.476 6.806 ( 1.731 -4.167 -9.134) 10.188 7.283 ( 7.351 -0.472 -6.075) 9.549 8.477 ( 3.959 -2.267 7.038) 8.388 9.156 ( -2.366 3.726 -7.397) 8.614 9.951 ( 1.518 -0.178 3.632) 3.940 10.111 ( 1.335 -1.773 -2.302) 3.198 10.319 ( -2.185 0.730 -5.255) 5.738 10.667 ( -0.713 9.739 -9.906) 13.910 10.936 ( 1.770 -4.532 0.865) 4.942 10.998 ( -1.874 -3.622 -3.252) 5.216 11.253 ( -1.290 -3.011 4.360) 5.453 11.707 ( -1.795 -1.483 3.725) 4.393 11.745 ( -7.666 0.249 -1.096) 7.747 12.018 ( -11.348 0.530 2.738) 11.686 13.475 ( 11.553 -0.912 2.341) 11.823 13.694 ( 1.044 0.389 -2.569) 2.800 17.077 ( -30.394 0.453 -12.277) 32.783 17.182 ( 33.012 -2.988 9.808) 34.568 19.269 ( 2.451 0.353 -6.652) 7.098 19.308 ( 8.401 0.104 1.384) 8.515 19.729 ( 6.868 0.768 5.919) 9.099 19.904 ( -7.981 0.829 -0.577) 8.044 20.233 ( 8.675 0.230 -0.409) 8.687 20.577 ( -1.021 -0.377 5.906) 6.006 21.059 ( 9.800 0.058 -10.812) 14.593 21.402 ( 2.646 -0.724 -1.654) 3.204 22.315 ( -4.857 0.403 4.654) 6.739 23.003 ( -7.305 0.479 -3.472) 8.102 24.235 ( -0.576 0.519 -3.725) 3.805 24.347 ( 0.484 -1.452 -2.998) 3.366 24.734 ( -2.453 0.704 4.673) 5.324 25.078 ( 6.574 -2.599 2.980) 7.672 25.574 ( 7.209 -1.191 -4.328) 8.493 25.986 ( -5.766 1.922 -7.069) 9.323 26.129 ( -15.932 0.843 4.374) 16.543 26.516 ( 9.266 1.684 -3.199) 9.946 47.357 ( -7.042 -0.603 10.801) 12.908 47.615 ( -5.939 0.149 13.508) 14.757 49.050 ( 3.810 0.163 -9.881) 10.592 49.362 ( 4.679 0.014 -7.730) 9.035 98.733 ( -1.387 0.039 0.508) 1.478 98.834 ( -0.828 -1.664 1.481) 2.377 98.905 ( -1.935 0.556 10.133) 10.331 99.559 ( -7.338 -1.923 4.533) 8.837 100.535 ( -0.023 -0.654 3.036) 3.106 100.986 ( -2.453 -0.886 12.760) 13.024 101.166 ( 4.215 -0.300 -0.865) 4.313 103.025 ( -16.078 9.573 -35.063) 39.743 ======================= Grid point 215 (104/230) ======================= q-point: (-0.22 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.689 ( 10.062 7.077 10.940) 16.463 2.153 ( 12.346 -0.492 5.857) 13.674 2.234 ( -0.677 -5.033 5.051) 7.162 2.361 ( -0.522 -5.779 -2.796) 6.441 2.550 ( -10.107 -2.171 1.214) 10.408 2.860 ( -5.024 0.460 1.912) 5.396 3.049 ( 1.144 1.921 8.871) 9.148 3.125 ( -6.134 -2.708 13.176) 14.784 3.184 ( 4.302 -3.355 -5.557) 7.788 3.421 ( -1.950 -1.568 0.865) 2.648 3.759 ( 3.083 1.773 -5.953) 6.935 3.980 ( 1.199 -1.349 -3.330) 3.787 4.193 ( -1.991 6.402 -0.632) 6.734 4.393 ( -4.670 1.661 4.960) 7.012 4.677 ( -6.074 3.088 6.492) 9.412 4.792 ( 14.586 -0.003 4.971) 15.410 4.999 ( -5.336 0.008 -8.163) 9.752 5.349 ( 1.150 9.640 -0.398) 9.716 5.466 ( 8.967 1.261 3.460) 9.693 5.574 ( -4.072 -3.736 4.148) 6.910 5.828 ( 7.085 -6.606 1.052) 9.744 6.057 ( -0.779 -3.081 -0.626) 3.238 6.335 ( 8.669 2.072 -8.527) 12.335 6.640 ( 5.845 -0.563 0.385) 5.884 6.831 ( 4.879 -4.568 -5.789) 8.842 7.337 ( 5.911 1.789 -6.992) 9.328 8.608 ( 2.941 -1.221 5.510) 6.364 9.022 ( -2.871 3.207 -6.774) 8.026 10.023 ( 2.492 0.094 3.062) 3.949 10.145 ( 2.599 -1.288 0.952) 3.053 10.247 ( -1.578 -1.554 -4.775) 5.263 10.536 ( 0.561 4.984 -6.093) 7.892 10.883 ( -4.383 -6.840 -9.660) 12.622 10.970 ( -1.385 3.302 -0.950) 3.704 11.326 ( -1.828 -4.169 9.805) 10.810 11.602 ( -7.573 -0.821 -1.692) 7.803 11.717 ( -2.721 -0.160 5.698) 6.317 11.867 ( -9.346 0.276 5.271) 10.733 13.686 ( 7.179 0.192 -1.857) 7.418 13.695 ( 6.383 -0.349 -2.882) 7.012 16.517 ( -22.809 0.124 -8.873) 24.474 17.862 ( 30.678 -4.151 9.240) 32.307 19.259 ( 4.734 0.021 -7.723) 9.059 19.363 ( -0.697 1.060 1.075) 1.662 19.738 ( -7.561 1.167 -3.953) 8.611 19.868 ( 1.874 0.153 5.871) 6.165 20.413 ( 12.417 -0.701 -4.965) 13.392 20.666 ( 6.631 -0.339 5.697) 8.748 21.140 ( 10.706 1.319 -10.984) 15.395 21.468 ( 6.110 -1.252 -0.833) 6.292 22.260 ( -7.955 0.022 8.224) 11.442 22.818 ( -10.767 -0.501 -3.013) 11.192 24.217 ( 1.459 0.168 -2.031) 2.507 24.337 ( 0.569 -1.308 -3.692) 3.958 24.701 ( -4.720 0.071 3.233) 5.722 25.215 ( 5.868 -0.555 1.409) 6.061 25.622 ( -0.748 2.012 -3.069) 3.745 25.821 ( -5.293 -1.954 -5.868) 8.140 25.938 ( -6.567 -0.690 -0.175) 6.606 26.636 ( 7.085 2.820 2.512) 8.028 47.337 ( -6.659 -0.656 10.669) 12.594 47.622 ( -6.591 0.242 13.297) 14.842 49.037 ( 4.346 0.239 -8.978) 9.977 49.368 ( 4.066 -0.004 -8.311) 9.252 98.677 ( -3.881 1.151 -0.014) 4.048 98.847 ( -1.095 -1.359 2.967) 3.443 98.981 ( -0.476 -0.381 10.403) 10.421 99.456 ( -8.006 -1.014 0.103) 8.070 100.561 ( 0.159 -0.614 1.882) 1.987 101.050 ( -4.336 -1.534 12.850) 13.648 101.253 ( 6.021 -1.347 -0.577) 6.197 102.397 ( -17.682 10.435 -22.988) 30.822 ======================= Grid point 216 (105/230) ======================= q-point: (-0.11 0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.938 ( 10.164 1.149 11.621) 15.481 2.011 ( -15.278 -6.867 3.201) 17.054 2.303 ( -7.429 -7.446 -1.837) 10.677 2.460 ( -3.595 -7.154 -2.411) 8.362 2.680 ( 13.950 1.583 9.865) 17.159 2.798 ( 1.123 -2.652 -0.118) 2.882 3.087 ( -5.565 -1.082 10.533) 11.962 3.126 ( -5.423 -0.374 11.350) 12.585 3.216 ( 3.570 -0.519 -5.182) 6.314 3.480 ( 2.599 -4.981 0.247) 5.623 3.721 ( 0.557 1.391 -6.889) 7.050 3.976 ( -1.118 -1.538 -3.170) 3.697 4.110 ( 0.191 5.818 -1.789) 6.090 4.319 ( -4.896 -0.233 -0.002) 4.901 4.640 ( -4.260 7.454 15.763) 17.949 4.843 ( -4.344 -1.868 -9.201) 10.344 5.001 ( 6.979 9.808 -0.656) 12.055 5.317 ( 3.783 4.188 1.641) 5.877 5.588 ( -0.007 -4.917 2.057) 5.330 5.626 ( 6.039 -1.503 2.588) 6.740 5.930 ( 1.585 0.799 -1.127) 2.102 6.060 ( -0.616 -2.794 -1.997) 3.489 6.367 ( 6.533 -0.836 -12.145) 13.816 6.725 ( 4.547 1.000 -1.219) 4.813 6.915 ( 6.529 -1.116 -4.981) 8.287 7.342 ( 4.706 3.473 -7.684) 9.657 8.656 ( -0.881 2.349 0.338) 2.531 8.929 ( -0.294 -0.401 -3.551) 3.585 10.061 ( 1.540 4.174 2.520) 5.113 10.205 ( -1.488 -3.985 -3.859) 5.744 10.251 ( 3.662 -4.551 5.313) 7.896 10.521 ( 3.392 -1.497 -3.136) 4.856 10.775 ( -3.743 -3.376 -7.084) 8.695 10.890 ( -2.633 2.798 -3.766) 5.380 11.386 ( -3.049 -2.347 7.350) 8.296 11.494 ( -4.518 -2.255 0.073) 5.050 11.717 ( -3.699 0.727 7.857) 8.714 11.798 ( -5.196 0.064 7.424) 9.062 13.673 ( 2.617 1.940 -7.965) 8.605 13.848 ( 6.778 -0.952 -0.545) 6.867 16.187 ( -9.642 -0.136 -2.560) 9.977 18.324 ( 12.398 -2.083 2.299) 12.780 19.308 ( 4.243 0.081 -3.142) 5.281 19.327 ( -2.472 1.372 0.223) 2.836 19.597 ( 1.761 0.476 -7.723) 7.936 19.909 ( -2.427 -0.198 5.721) 6.217 20.502 ( 3.858 -1.743 -7.511) 8.622 20.927 ( 16.514 -0.620 5.347) 17.369 21.192 ( 7.640 2.758 -10.490) 13.267 21.634 ( 13.015 -1.915 -0.318) 13.159 22.175 ( -11.936 -0.539 9.831) 15.473 22.603 ( -12.842 -1.473 -2.047) 13.087 24.238 ( 2.582 -0.033 -1.658) 3.069 24.323 ( 0.654 -0.403 -3.329) 3.417 24.635 ( -5.466 -0.429 1.557) 5.699 25.302 ( 4.480 2.504 -1.323) 5.300 25.473 ( -5.936 4.545 -4.729) 8.847 25.699 ( -8.372 -1.168 1.424) 8.572 25.967 ( 6.206 -8.402 -5.776) 11.936 26.756 ( 5.193 4.094 7.075) 9.685 47.324 ( -6.190 -0.589 10.972) 12.611 47.616 ( -6.907 0.303 12.841) 14.584 49.041 ( 4.881 0.259 -7.972) 9.352 49.359 ( 3.574 -0.096 -9.117) 9.793 98.601 ( -3.567 1.704 -0.151) 3.956 98.868 ( -1.019 -0.706 4.449) 4.618 99.054 ( -1.772 -0.699 10.028) 10.208 99.318 ( -6.983 0.013 -2.729) 7.498 100.582 ( 0.034 -0.376 1.680) 1.722 101.074 ( -6.264 -1.676 11.210) 12.950 101.367 ( 6.587 -1.573 -2.506) 7.222 101.947 ( -9.908 4.818 -10.995) 15.565 ======================= Grid point 222 (106/230) ======================= q-point: ( 0.56 -0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.659 ( 5.837 0.000 8.245) 10.102 1.732 ( 18.336 0.000 14.173) 23.175 2.091 ( 4.898 0.000 -7.464) 8.928 2.493 ( -13.293 -0.000 -8.691) 15.882 2.784 ( -15.162 -0.000 -3.188) 15.493 2.829 ( 18.002 0.000 1.188) 18.041 2.934 ( -3.456 -0.000 5.718) 6.681 3.118 ( -5.757 -0.000 10.166) 11.683 3.134 ( -6.799 -0.000 3.985) 7.881 3.526 ( -8.388 -0.000 0.294) 8.393 3.755 ( 5.576 0.000 -2.352) 6.051 3.981 ( 1.775 0.000 -5.119) 5.418 4.334 ( -4.925 -0.000 6.646) 8.272 4.342 ( 6.322 0.000 2.399) 6.762 4.581 ( 3.932 0.000 2.566) 4.695 4.670 ( -1.319 -0.000 10.209) 10.294 5.116 ( 0.418 0.000 -3.117) 3.145 5.291 ( 12.543 0.000 -2.498) 12.789 5.482 ( 8.029 0.000 1.735) 8.214 5.552 ( -2.674 -0.000 1.459) 3.046 5.576 ( -4.851 -0.000 9.821) 10.954 6.031 ( -2.384 -0.000 1.563) 2.850 6.278 ( 8.600 0.000 -2.303) 8.903 6.541 ( 4.091 0.000 -1.167) 4.254 6.773 ( 1.761 0.000 -9.716) 9.874 7.279 ( 7.781 0.000 -5.367) 9.452 8.461 ( 4.222 0.000 7.570) 8.668 9.184 ( -2.626 -0.000 -8.081) 8.497 9.950 ( 1.340 0.000 3.127) 3.402 10.096 ( 1.414 0.000 -1.717) 2.224 10.325 ( -2.427 -0.000 -6.248) 6.702 10.806 ( 0.386 0.000 -10.078) 10.085 10.822 ( -2.535 -0.000 -9.027) 9.376 10.984 ( 2.258 0.000 7.734) 8.057 11.233 ( -1.656 -0.000 2.980) 3.409 11.696 ( -1.314 -0.000 4.132) 4.336 11.747 ( -7.956 -0.000 -1.288) 8.060 12.021 ( -11.396 -0.000 2.436) 11.653 13.468 ( 11.272 0.000 2.558) 11.559 13.697 ( 1.097 0.000 -2.189) 2.448 17.081 ( -31.131 -0.000 -12.588) 33.579 17.159 ( 32.949 0.000 10.507) 34.583 19.271 ( 2.312 0.000 -6.969) 7.343 19.309 ( 9.003 0.000 1.502) 9.128 19.735 ( 6.751 0.000 5.810) 8.907 19.911 ( -8.136 -0.000 -0.681) 8.164 20.235 ( 8.275 0.000 -0.316) 8.281 20.574 ( -0.898 -0.000 5.815) 5.884 21.059 ( 10.131 0.000 -10.784) 14.797 21.397 ( 2.594 0.000 -1.558) 3.026 22.318 ( -4.891 -0.000 4.412) 6.588 23.006 ( -7.458 -0.000 -3.918) 8.425 24.239 ( -0.784 -0.000 -3.845) 3.924 24.336 ( 0.502 0.000 -2.659) 2.706 24.739 ( -2.810 -0.000 4.596) 5.387 25.059 ( 7.596 0.000 2.934) 8.143 25.565 ( 7.094 0.000 -4.443) 8.371 26.001 ( -6.398 -0.000 -6.870) 9.388 26.136 ( -15.904 -0.000 4.215) 16.453 26.528 ( 9.579 0.000 -3.387) 10.160 47.353 ( -7.000 -0.000 10.826) 12.892 47.617 ( -5.916 -0.000 13.484) 14.725 49.051 ( 3.817 0.000 -9.875) 10.587 49.362 ( 4.680 0.000 -7.728) 9.035 98.733 ( -0.919 -0.000 0.610) 1.103 98.821 ( -0.522 -0.000 1.772) 1.847 98.910 ( -2.566 -0.000 10.062) 10.384 99.546 ( -6.686 -0.000 4.513) 8.067 100.530 ( -0.039 -0.000 3.186) 3.187 100.980 ( -2.483 -0.000 12.456) 12.701 101.164 ( 4.003 0.000 -1.077) 4.145 103.094 ( -16.013 -0.000 -35.909) 39.318 ======================= Grid point 224 (107/230) ======================= q-point: (-0.33 0.56 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.812 ( 8.225 7.586 7.896) 13.694 2.114 ( -6.041 -4.375 -1.025) 7.529 2.194 ( 20.450 -0.287 7.580) 21.812 2.263 ( -1.578 -5.119 -6.204) 8.197 2.525 ( -12.791 -1.122 -0.328) 12.844 2.867 ( -6.550 0.356 2.050) 6.872 3.085 ( -2.241 2.511 8.772) 9.395 3.105 ( -3.960 -0.426 14.334) 14.877 3.141 ( 9.590 -2.541 -4.620) 10.944 3.401 ( -5.641 -0.880 -0.575) 5.738 3.788 ( 2.629 1.510 -4.545) 5.464 3.960 ( 0.790 -1.059 -3.907) 4.124 4.274 ( -3.696 4.129 1.169) 5.663 4.387 ( -3.904 -1.659 0.787) 4.314 4.701 ( -3.246 0.923 9.340) 9.931 4.794 ( 15.360 -0.261 6.016) 16.498 5.001 ( -5.630 0.153 -8.991) 10.609 5.473 ( 5.806 1.869 0.496) 6.119 5.521 ( 5.441 10.772 2.901) 12.412 5.536 ( -4.815 -1.053 3.119) 5.833 5.697 ( 6.494 -11.120 2.473) 13.112 6.020 ( -0.667 -1.335 0.086) 1.495 6.379 ( 7.588 2.330 -7.302) 10.785 6.640 ( 7.400 0.376 1.517) 7.563 6.770 ( 4.526 -2.961 -5.222) 7.518 7.353 ( 6.516 0.506 -6.001) 8.873 8.596 ( 3.664 -0.419 6.887) 7.812 9.053 ( -3.693 1.119 -8.094) 8.967 10.023 ( 3.273 -0.018 4.123) 5.264 10.124 ( 2.115 -1.108 0.017) 2.388 10.234 ( -2.039 -0.312 -5.954) 6.301 10.636 ( -1.355 8.336 -8.648) 12.088 10.765 ( -2.562 -8.885 -9.950) 13.584 11.008 ( -2.068 1.468 -0.458) 2.577 11.286 ( -0.744 -1.411 10.682) 10.801 11.593 ( -8.056 -0.317 -2.144) 8.342 11.716 ( -1.901 0.023 6.287) 6.568 11.866 ( -9.650 -0.178 4.421) 10.616 13.676 ( 10.527 -0.527 1.095) 10.597 13.704 ( 3.107 0.460 -4.923) 5.840 16.518 ( -22.929 0.049 -9.043) 24.648 17.820 ( 30.784 -1.558 10.531) 32.573 19.259 ( 4.524 0.038 -7.727) 8.954 19.375 ( -0.478 0.407 1.138) 1.300 19.751 ( -7.778 0.551 -4.272) 8.891 19.869 ( 1.806 -0.035 5.915) 6.185 20.405 ( 11.854 -0.341 -5.187) 12.944 20.663 ( 6.909 -0.100 5.374) 8.754 21.153 ( 11.499 0.446 -11.079) 15.974 21.456 ( 5.706 -0.425 -0.491) 5.743 22.261 ( -8.062 -0.006 7.780) 11.204 22.813 ( -11.080 -0.218 -3.773) 11.707 24.220 ( 1.410 0.179 -1.881) 2.358 24.322 ( 0.580 -0.640 -3.205) 3.319 24.702 ( -4.903 0.008 2.840) 5.666 25.212 ( 7.675 0.019 1.927) 7.913 25.633 ( 3.308 0.020 -2.368) 4.068 25.806 ( -8.247 -0.333 -8.190) 11.627 25.937 ( -9.316 0.112 0.755) 9.347 26.662 ( 7.250 0.858 2.268) 7.645 47.330 ( -6.579 -0.245 10.714) 12.575 47.624 ( -6.553 0.102 13.278) 14.808 49.040 ( 4.341 0.090 -8.970) 9.966 49.368 ( 4.045 -0.011 -8.354) 9.282 98.689 ( -3.551 0.431 0.018) 3.578 98.834 ( -0.759 -0.443 3.443) 3.553 98.977 ( -0.799 -0.092 10.514) 10.545 99.447 ( -7.109 -0.300 0.013) 7.116 100.555 ( 0.213 -0.252 2.107) 2.133 101.035 ( -4.349 -0.486 13.058) 13.772 101.238 ( 5.564 -0.603 -1.045) 5.693 102.501 ( -19.091 3.675 -25.984) 32.452 ======================= Grid point 225 (108/230) ======================= q-point: (-0.22 0.56 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.922 ( -14.777 -4.175 5.803) 16.416 1.989 ( 7.131 4.347 7.887) 11.487 2.191 ( -12.401 -5.903 -6.274) 15.100 2.351 ( 3.140 -8.030 -4.582) 9.764 2.691 ( 15.552 -0.182 6.896) 17.013 2.765 ( -4.475 -1.357 -1.707) 4.978 3.084 ( -6.068 0.501 11.698) 13.188 3.116 ( -4.939 -1.099 10.692) 11.829 3.242 ( 5.072 3.703 -3.252) 7.072 3.397 ( 2.529 -5.962 -0.951) 6.546 3.758 ( 0.676 2.886 -4.483) 5.374 3.951 ( -1.488 -1.779 -2.835) 3.663 4.185 ( -2.276 4.299 -0.955) 4.957 4.309 ( -5.408 -1.146 0.532) 5.554 4.722 ( -3.523 3.771 13.483) 14.437 4.820 ( -4.951 -1.019 -10.811) 11.934 5.098 ( 11.720 3.053 5.353) 13.241 5.422 ( -0.875 9.154 -2.910) 9.645 5.527 ( 1.789 -3.014 1.141) 3.686 5.618 ( 4.124 0.728 2.684) 4.974 5.890 ( 6.472 -7.582 -2.173) 10.203 6.012 ( -2.240 -1.142 1.202) 2.787 6.387 ( 5.414 2.110 -11.230) 12.644 6.758 ( 6.982 3.542 -0.037) 7.829 6.880 ( 7.993 -3.502 -2.314) 9.028 7.382 ( 4.581 1.975 -7.020) 8.612 8.683 ( 0.981 1.353 3.347) 3.741 8.925 ( -2.715 -0.190 -6.549) 7.092 10.109 ( 1.593 1.981 3.824) 4.591 10.148 ( -0.682 -3.001 -3.132) 4.391 10.205 ( 2.300 -1.997 2.245) 3.784 10.529 ( 1.117 2.827 -5.523) 6.304 10.700 ( -2.067 -6.405 -8.362) 10.734 10.929 ( -3.336 2.108 -2.999) 4.956 11.366 ( -1.733 -0.558 9.618) 9.789 11.463 ( -5.153 -1.783 -1.559) 5.671 11.729 ( -3.273 0.933 7.876) 8.579 11.791 ( -5.217 -0.857 6.713) 8.545 13.698 ( 2.862 1.292 -7.592) 8.216 13.836 ( 7.057 -0.658 -0.074) 7.088 16.185 ( -9.707 -0.094 -2.713) 10.080 18.298 ( 14.224 -1.376 3.749) 14.774 19.310 ( 5.117 0.125 -3.009) 5.938 19.344 ( -2.698 0.884 0.383) 2.865 19.605 ( 0.780 0.463 -7.920) 7.971 19.906 ( -2.761 -0.228 5.632) 6.276 20.480 ( 3.708 -1.135 -8.232) 9.099 20.919 ( 16.290 -0.372 4.971) 17.036 21.226 ( 8.400 1.720 -10.556) 13.599 21.611 ( 12.501 -1.193 0.068) 12.558 22.168 ( -12.053 -0.328 9.436) 15.310 22.584 ( -13.004 -1.063 -2.719) 13.328 24.243 ( 2.761 0.585 -1.190) 3.063 24.312 ( 0.815 -0.898 -2.909) 3.152 24.630 ( -5.376 -0.220 1.105) 5.492 25.339 ( 6.821 2.312 -0.362) 7.211 25.534 ( -7.348 3.841 -6.226) 10.369 25.670 ( -6.690 -2.853 1.263) 7.381 25.873 ( 2.862 -4.240 -5.355) 7.406 26.800 ( 5.649 1.963 6.839) 9.085 47.317 ( -6.109 -0.373 10.990) 12.579 47.620 ( -6.901 0.204 12.839) 14.578 49.045 ( 4.851 0.164 -7.954) 9.318 49.358 ( 3.528 -0.072 -9.178) 9.833 98.622 ( -3.461 1.101 0.012) 3.632 98.860 ( -0.743 -0.303 5.099) 5.161 99.046 ( -1.864 -0.438 9.913) 10.097 99.319 ( -6.320 0.065 -2.913) 6.959 100.577 ( 0.188 -0.274 1.814) 1.844 101.056 ( -6.236 -0.815 11.710) 13.292 101.339 ( 6.377 -1.879 -2.159) 6.990 102.009 ( -13.663 3.330 -15.145) 20.668 ======================= Grid point 226 (109/230) ======================= q-point: (-0.11 -0.44 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( -16.997 -5.684 4.165) 18.399 1.951 ( -17.658 -16.018 1.282) 23.875 2.218 ( 10.519 0.555 6.028) 12.136 2.421 ( 3.491 -1.917 -1.128) 4.140 2.638 ( -5.429 -1.121 -4.172) 6.937 2.872 ( 0.382 -9.307 -8.297) 12.474 3.024 ( -9.834 0.512 8.412) 12.951 3.207 ( -0.709 1.642 13.599) 13.716 3.342 ( 9.600 1.951 0.978) 9.845 3.476 ( 2.102 -3.564 1.919) 4.561 3.711 ( 1.609 3.498 -1.726) 4.219 3.850 ( -6.484 -3.069 -4.620) 8.533 4.146 ( 0.241 1.569 -0.673) 1.724 4.271 ( -0.330 1.020 1.947) 2.222 4.671 ( -3.806 -2.116 -6.058) 7.461 4.774 ( -1.822 3.437 12.433) 13.027 5.123 ( -0.280 14.552 -4.989) 15.386 5.346 ( -2.647 -1.941 0.183) 3.288 5.644 ( 4.096 -1.054 0.100) 4.231 5.681 ( 1.680 -3.707 -1.159) 4.232 5.958 ( 1.760 -0.845 -4.136) 4.573 5.993 ( -1.466 2.091 3.687) 4.485 6.368 ( 6.058 -0.200 -13.024) 14.365 6.840 ( 6.729 6.090 0.414) 9.085 6.985 ( 5.992 2.001 -5.042) 8.083 7.373 ( 4.271 2.031 -7.952) 9.252 8.640 ( -2.867 5.716 -2.469) 6.855 8.894 ( 1.157 -5.047 -1.966) 5.538 10.060 ( -5.467 -4.104 -1.510) 7.001 10.194 ( 3.371 4.411 3.198) 6.407 10.311 ( 2.491 -5.132 4.838) 7.480 10.537 ( 4.112 -2.763 -4.709) 6.835 10.664 ( 0.099 -4.393 -4.144) 6.040 10.824 ( -3.558 2.128 -3.766) 5.601 11.362 ( -1.622 -0.896 0.206) 1.864 11.474 ( -0.278 -2.009 7.735) 7.997 11.728 ( -4.419 1.205 8.500) 9.655 11.805 ( -1.361 -0.702 7.841) 7.989 13.642 ( 0.690 2.266 -10.061) 10.336 13.920 ( 2.757 -0.219 -0.512) 2.812 16.157 ( 5.100 -0.224 4.825) 7.024 18.349 ( -4.792 1.387 -8.590) 9.933 19.273 ( -3.591 0.921 -1.682) 4.071 19.288 ( -2.845 1.007 -0.834) 3.131 19.757 ( 18.152 0.046 -2.590) 18.335 19.887 ( -4.735 -0.714 4.379) 6.489 20.440 ( -0.730 -2.083 -8.494) 8.776 21.231 ( 6.008 2.674 -7.124) 9.695 21.261 ( 16.272 -0.724 2.728) 16.515 21.890 ( 17.471 -1.915 1.041) 17.606 22.004 ( -16.823 -0.821 8.768) 18.989 22.345 ( -13.831 -1.662 -2.086) 14.085 24.274 ( 2.569 0.876 -1.374) 3.043 24.318 ( 1.695 -0.371 -1.647) 2.392 24.548 ( -4.713 -0.349 -0.389) 4.742 25.276 ( -6.385 2.912 -9.035) 11.440 25.454 ( 4.322 3.912 -1.177) 5.947 25.598 ( -4.593 -0.994 3.491) 5.855 25.956 ( 5.966 -8.905 -6.381) 12.475 26.935 ( 4.111 3.700 9.756) 11.214 47.316 ( -5.659 -0.440 11.651) 12.960 47.607 ( -7.032 0.264 12.233) 14.112 49.066 ( 5.253 0.189 -7.018) 8.769 49.333 ( 3.215 -0.187 -10.063) 10.566 98.561 ( -2.427 1.669 0.086) 2.947 98.899 ( -0.583 0.031 6.220) 6.247 99.086 ( -3.485 -0.806 9.074) 9.754 99.193 ( -4.657 0.494 -3.396) 5.785 100.594 ( -0.205 -0.042 1.930) 1.941 101.036 ( -7.489 -0.951 9.563) 12.184 101.380 ( -0.457 -0.463 -7.098) 7.128 101.817 ( 2.977 -4.359 -3.554) 6.364 ======================= Grid point 233 (110/230) ======================= q-point: (-0.33 -0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.889 ( -16.764 -0.000 6.898) 18.127 2.028 ( 2.743 0.000 5.286) 5.955 2.165 ( -11.802 -0.000 -3.905) 12.431 2.264 ( 8.856 0.000 -8.784) 12.473 2.686 ( 15.534 0.000 5.282) 16.407 2.757 ( -6.275 -0.000 -2.082) 6.612 3.096 ( -3.112 -0.000 11.848) 12.250 3.099 ( -7.756 -0.000 11.550) 13.912 3.303 ( 8.743 0.000 -3.922) 9.582 3.321 ( -0.916 -0.000 -0.043) 0.917 3.784 ( 0.859 0.000 -4.081) 4.170 3.935 ( -1.706 -0.000 -2.478) 3.008 4.222 ( -3.548 -0.000 -1.236) 3.757 4.296 ( -5.292 -0.000 1.650) 5.543 4.749 ( -2.903 -0.000 12.673) 13.002 4.814 ( -5.591 -0.000 -11.089) 12.418 5.115 ( 12.907 0.000 5.587) 14.064 5.486 ( 0.272 0.000 -0.588) 0.648 5.524 ( 0.835 0.000 -4.104) 4.188 5.649 ( -0.469 -0.000 5.245) 5.266 5.791 ( 9.801 0.000 -2.126) 10.029 6.010 ( -1.097 -0.000 2.078) 2.349 6.404 ( 4.714 0.000 -11.623) 12.543 6.817 ( 10.771 0.000 0.309) 10.776 6.823 ( 6.007 0.000 -0.941) 6.080 7.397 ( 4.566 0.000 -6.723) 8.127 8.693 ( 1.742 0.000 4.609) 4.927 8.924 ( -3.667 -0.000 -7.770) 8.592 10.114 ( -2.824 -0.000 -4.091) 4.971 10.134 ( 4.665 0.000 5.950) 7.561 10.190 ( 1.328 0.000 1.045) 1.690 10.587 ( -2.686 -0.000 -4.569) 5.300 10.616 ( 1.198 0.000 -10.845) 10.911 10.945 ( -3.544 -0.000 -3.052) 4.677 11.363 ( -0.907 -0.000 11.228) 11.264 11.449 ( -5.715 -0.000 -2.940) 6.427 11.738 ( -3.026 -0.000 7.965) 8.520 11.782 ( -5.295 -0.000 6.409) 8.313 13.708 ( 2.966 0.000 -7.441) 8.011 13.831 ( 7.166 0.000 0.101) 7.166 16.185 ( -9.733 -0.000 -2.775) 10.121 18.288 ( 14.904 0.000 4.316) 15.516 19.311 ( 5.416 0.000 -2.967) 6.176 19.351 ( -2.755 -0.000 0.433) 2.789 19.609 ( 0.441 0.000 -8.030) 8.042 19.904 ( -2.891 -0.000 5.622) 6.322 20.472 ( 3.674 0.000 -8.489) 9.250 20.917 ( 16.185 0.000 4.823) 16.888 21.239 ( 8.747 0.000 -10.609) 13.750 21.602 ( 12.261 0.000 0.243) 12.263 22.166 ( -12.107 -0.000 9.302) 15.268 22.575 ( -13.072 -0.000 -3.005) 13.413 24.249 ( 2.968 0.000 -0.832) 3.082 24.304 ( 0.756 0.000 -2.934) 3.030 24.629 ( -5.341 -0.000 0.948) 5.424 25.358 ( 7.868 0.000 0.147) 7.869 25.573 ( -9.376 -0.000 -8.821) 12.873 25.636 ( -3.691 -0.000 2.685) 4.565 25.844 ( 0.579 0.000 -4.892) 4.926 26.814 ( 5.801 0.000 6.833) 8.964 47.314 ( -6.078 -0.000 10.992) 12.560 47.622 ( -6.900 -0.000 12.839) 14.576 49.046 ( 4.840 0.000 -7.946) 9.304 49.357 ( 3.511 0.000 -9.200) 9.847 98.631 ( -3.405 -0.000 0.071) 3.406 98.858 ( -0.646 -0.000 5.330) 5.369 99.042 ( -1.920 -0.000 9.860) 10.045 99.319 ( -6.095 -0.000 -2.977) 6.784 100.575 ( 0.247 0.000 1.875) 1.891 101.050 ( -6.260 -0.000 11.955) 13.494 101.324 ( 6.086 0.000 -2.172) 6.462 102.035 ( -14.837 -0.000 -16.606) 22.269 ======================= Grid point 234 (111/230) ======================= q-point: (-0.22 -0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.682 ( -18.797 0.087 7.945) 20.407 1.758 ( -21.046 -9.227 -0.702) 22.991 2.258 ( 9.450 3.914 5.373) 11.554 2.376 ( 8.578 -3.849 -4.578) 10.457 2.623 ( -5.874 -0.648 -5.442) 8.034 2.772 ( -2.044 -3.735 -8.939) 9.901 3.028 ( -10.756 0.107 8.997) 14.023 3.227 ( 1.605 0.831 13.813) 13.931 3.370 ( 5.220 1.698 -0.987) 5.578 3.432 ( 6.701 -2.267 3.484) 7.886 3.761 ( 0.603 3.090 -2.095) 3.782 3.809 ( -7.627 -2.589 -3.763) 8.890 4.159 ( -2.211 0.433 -0.482) 2.304 4.284 ( 0.538 0.531 4.035) 4.106 4.647 ( -3.335 -0.879 -9.525) 10.130 4.810 ( -2.332 1.408 13.140) 13.419 5.231 ( -1.153 1.014 2.498) 2.932 5.406 ( -2.238 8.833 -8.014) 12.135 5.560 ( 2.228 -7.354 -4.086) 8.703 5.693 ( 2.452 2.020 2.170) 3.847 5.902 ( 3.675 -3.647 -4.607) 6.931 6.035 ( 1.181 1.720 7.710) 7.988 6.371 ( 4.757 0.308 -13.364) 14.189 6.916 ( 6.662 3.353 0.929) 7.516 7.001 ( 11.316 0.346 -3.919) 11.980 7.391 ( 2.565 0.512 -7.837) 8.262 8.715 ( -1.064 4.107 0.470) 4.268 8.826 ( -1.283 -3.842 -5.111) 6.522 10.010 ( -5.651 -2.004 -3.583) 6.985 10.235 ( 0.378 -0.205 4.957) 4.976 10.277 ( 5.372 0.973 6.656) 8.609 10.526 ( 2.237 1.558 -5.087) 5.772 10.586 ( 1.094 -5.391 -6.317) 8.376 10.847 ( -4.066 0.889 -3.817) 5.647 11.360 ( -1.861 0.220 -1.553) 2.434 11.449 ( 0.111 -1.129 9.372) 9.441 11.742 ( -4.493 0.626 8.406) 9.552 11.794 ( -0.853 -0.541 7.416) 7.484 13.666 ( 0.962 0.913 -9.897) 9.985 13.917 ( 3.065 -0.103 -0.293) 3.081 16.154 ( 5.098 -0.091 4.779) 6.988 18.363 ( -3.026 0.535 -7.955) 8.528 19.283 ( -3.530 0.405 -1.697) 3.938 19.298 ( -3.032 0.371 -0.624) 3.117 19.758 ( 18.793 0.111 -2.800) 19.001 19.879 ( -5.050 -0.319 4.343) 6.669 20.419 ( -0.772 -0.798 -9.034) 9.102 21.243 ( 16.065 -0.227 4.550) 16.698 21.270 ( 6.148 0.999 -8.939) 10.895 21.870 ( 17.590 -0.738 1.311) 17.654 21.995 ( -17.275 -0.346 8.514) 19.262 22.327 ( -13.724 -0.711 -2.344) 13.941 24.290 ( 2.292 1.235 -1.271) 2.897 24.307 ( 2.232 -1.020 -1.268) 2.762 24.545 ( -4.569 -0.138 -0.658) 4.618 25.308 ( -8.395 1.278 -9.657) 12.859 25.503 ( 7.057 2.171 -1.266) 7.491 25.586 ( -4.916 -0.494 4.155) 6.456 25.858 ( 4.638 -3.949 -6.640) 9.011 26.972 ( 4.735 1.252 9.793) 10.950 47.312 ( -5.627 -0.172 11.629) 12.920 47.610 ( -7.046 0.107 12.248) 14.131 49.068 ( 5.211 0.072 -6.994) 8.722 49.331 ( 3.164 -0.078 -10.097) 10.581 98.579 ( -2.424 0.666 0.276) 2.529 98.900 ( -0.569 0.062 6.685) 6.710 99.077 ( -3.516 -0.344 8.776) 9.460 99.198 ( -4.459 0.197 -3.445) 5.638 100.594 ( 0.028 -0.015 1.984) 1.984 101.027 ( -7.514 -0.264 9.993) 12.506 101.367 ( 0.848 -0.822 -6.396) 6.504 101.776 ( -2.235 -1.324 -6.019) 6.556 ======================= Grid point 235 (112/230) ======================= q-point: (-0.11 -0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.326 ( -21.274 -10.986 -9.128) 25.624 1.619 ( -19.006 -10.745 20.405) 29.884 2.421 ( 5.172 -0.245 -2.569) 5.780 2.485 ( -1.351 1.667 -1.266) 2.492 2.507 ( 1.936 -2.536 2.059) 3.797 2.674 ( -2.037 -8.236 -9.106) 12.446 2.906 ( -9.668 -1.116 4.703) 10.809 3.267 ( -8.214 5.141 4.634) 10.741 3.406 ( -0.611 -2.975 7.743) 8.317 3.478 ( -4.403 -2.277 0.367) 4.970 3.645 ( -2.527 -2.650 -4.217) 5.585 3.942 ( 15.301 2.087 0.993) 15.475 4.134 ( -1.742 -0.400 2.063) 2.730 4.332 ( 1.811 1.887 3.764) 4.583 4.575 ( 0.937 -1.562 -3.823) 4.235 4.870 ( -2.018 2.293 12.195) 12.571 5.126 ( -3.714 10.789 -8.070) 13.975 5.252 ( -5.196 -0.621 -3.994) 6.583 5.558 ( -4.135 -6.459 -2.420) 8.042 5.684 ( -0.441 1.526 -3.281) 3.645 5.867 ( -2.713 0.831 -7.900) 8.395 6.153 ( 3.945 3.494 9.643) 10.989 6.347 ( 5.061 -1.018 -12.135) 13.188 7.004 ( 4.983 2.636 0.557) 5.665 7.084 ( 8.080 11.999 -7.073) 16.103 7.380 ( 5.313 -1.878 -8.889) 10.525 8.621 ( -1.883 7.886 -3.189) 8.712 8.856 ( 1.557 -8.308 -1.251) 8.545 9.905 ( -6.575 -4.452 -1.601) 8.100 10.273 ( -2.092 -1.615 5.971) 6.530 10.395 ( 4.555 4.519 4.637) 7.916 10.526 ( 3.338 -3.015 -7.747) 8.958 10.653 ( 2.729 -4.034 0.967) 4.966 10.744 ( -1.840 -1.249 -3.310) 3.988 11.356 ( 1.457 -0.728 0.514) 1.708 11.550 ( 2.173 -1.156 7.788) 8.167 11.724 ( -5.229 0.478 8.342) 9.857 11.870 ( 1.651 -0.134 6.972) 7.167 13.555 ( -1.898 2.120 -11.647) 11.990 13.933 ( -0.728 0.324 -0.292) 0.849 16.427 ( 18.009 -0.171 11.450) 21.341 18.092 ( -13.442 3.563 -16.394) 21.498 19.233 ( -2.554 0.826 -1.451) 3.051 19.251 ( 2.135 0.866 -2.489) 3.391 19.812 ( -6.607 -0.918 2.016) 6.968 20.045 ( 14.941 1.098 -0.392) 14.986 20.322 ( -2.890 -1.856 -7.570) 8.312 21.256 ( 3.666 3.422 -8.028) 9.466 21.546 ( 8.719 -2.674 6.705) 11.319 21.739 ( -16.683 -0.056 5.183) 17.470 22.055 ( -13.373 -1.040 -0.524) 13.423 22.240 ( 18.509 -1.872 1.247) 18.645 24.299 ( 0.497 0.156 -0.198) 0.558 24.353 ( 3.626 0.430 -1.153) 3.829 24.475 ( -2.528 -0.184 -1.149) 2.783 25.079 ( -7.762 0.410 -9.556) 12.318 25.523 ( -0.855 3.949 0.874) 4.134 25.616 ( 5.550 0.468 -0.378) 5.582 25.932 ( 5.094 -8.229 -6.414) 11.610 27.111 ( 3.183 3.592 10.272) 11.338 47.325 ( -5.251 -0.318 12.709) 13.755 47.591 ( -7.020 0.195 11.557) 13.523 49.100 ( 5.318 0.093 -6.327) 8.266 49.296 ( 3.188 -0.251 -10.808) 11.271 98.547 ( -0.980 1.355 0.759) 1.837 98.939 ( -0.765 0.493 3.983) 4.085 99.078 ( -4.873 -0.731 7.029) 8.584 99.135 ( -1.583 0.363 3.753) 4.089 100.606 ( -0.705 0.405 2.189) 2.335 100.974 ( -7.797 -0.363 7.868) 11.083 101.262 ( -4.126 -0.175 -7.348) 8.429 101.885 ( 11.567 -10.322 -1.317) 15.559 ======================= Grid point 243 (113/230) ======================= q-point: (-0.22 -0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.235 ( -24.824 -0.000 -9.518) 26.586 1.540 ( -19.415 -0.000 23.481) 30.468 2.429 ( -5.760 -0.000 -9.474) 11.088 2.473 ( 7.496 0.000 6.753) 10.089 2.518 ( 8.142 0.000 0.099) 8.143 2.593 ( -4.883 -0.000 -11.259) 12.272 2.899 ( -10.969 -0.000 6.002) 12.504 3.324 ( -11.842 -0.000 2.116) 12.030 3.366 ( 1.306 0.000 10.650) 10.730 3.460 ( -5.056 -0.000 -1.115) 5.177 3.627 ( -0.642 -0.000 -4.601) 4.646 3.959 ( 15.072 0.000 0.672) 15.087 4.131 ( -2.252 -0.000 2.640) 3.470 4.346 ( 1.023 0.000 4.782) 4.890 4.564 ( 2.040 0.000 -4.138) 4.613 4.887 ( -1.805 -0.000 12.136) 12.270 5.178 ( -6.116 -0.000 -0.981) 6.194 5.297 ( -3.847 -0.000 -13.827) 14.352 5.485 ( -2.209 -0.000 -1.186) 2.507 5.700 ( -1.477 -0.000 -3.221) 3.543 5.871 ( -1.291 -0.000 -5.708) 5.852 6.175 ( 4.180 0.000 7.450) 8.543 6.344 ( 4.229 0.000 -10.540) 11.357 7.023 ( 4.333 0.000 0.304) 4.344 7.198 ( 15.641 0.000 -7.389) 17.298 7.346 ( 0.762 0.000 -8.490) 8.524 8.735 ( -0.058 -0.000 -5.963) 5.963 8.738 ( -0.625 -0.000 1.422) 1.553 9.871 ( -6.659 -0.000 -1.882) 6.920 10.251 ( -2.791 -0.000 5.425) 6.101 10.457 ( 6.177 0.000 8.224) 10.286 10.513 ( 1.417 0.000 -7.812) 7.939 10.585 ( 4.957 0.000 0.515) 4.984 10.743 ( -4.210 -0.000 -4.786) 6.374 11.352 ( 1.574 0.000 0.211) 1.588 11.540 ( 2.111 0.000 8.033) 8.306 11.727 ( -5.507 -0.000 7.960) 9.679 11.869 ( 2.149 0.000 6.809) 7.140 13.571 ( -1.699 -0.000 -11.683) 11.806 13.936 ( -0.537 -0.000 -0.230) 0.585 16.425 ( 18.010 0.000 11.464) 21.349 18.120 ( -12.230 -0.000 -16.391) 20.451 19.240 ( -2.970 -0.000 -1.584) 3.366 19.258 ( 2.841 0.000 -2.237) 3.616 19.805 ( -6.763 -0.000 1.939) 7.035 20.054 ( 15.752 0.000 -0.709) 15.767 20.308 ( -2.946 -0.000 -7.817) 8.354 21.284 ( 4.472 0.000 -8.063) 9.220 21.524 ( 6.591 0.000 7.064) 9.662 21.739 ( -15.623 -0.000 5.094) 16.433 22.047 ( -13.369 -0.000 -0.451) 13.376 22.225 ( 18.477 0.000 1.264) 18.520 24.300 ( 0.069 0.000 -0.283) 0.292 24.357 ( 3.769 0.000 -0.900) 3.875 24.473 ( -2.303 -0.000 -1.393) 2.691 25.082 ( -8.309 -0.000 -9.594) 12.692 25.552 ( -2.838 -0.000 3.746) 4.700 25.628 ( 8.181 0.000 -3.621) 8.947 25.863 ( 4.360 0.000 -6.039) 7.449 27.138 ( 3.858 0.000 10.283) 10.983 47.322 ( -5.246 -0.000 12.701) 13.742 47.592 ( -7.025 -0.000 11.572) 13.537 49.101 ( 5.283 0.000 -6.305) 8.226 49.294 ( 3.125 0.000 -10.819) 11.262 98.557 ( -1.003 -0.000 0.897) 1.346 98.943 ( -0.596 -0.000 4.390) 4.430 99.072 ( -4.943 -0.000 7.267) 8.789 99.137 ( -1.560 -0.000 3.396) 3.737 100.609 ( -0.411 -0.000 2.177) 2.216 100.972 ( -7.793 -0.000 8.119) 11.254 101.260 ( -4.048 -0.000 -7.500) 8.522 101.805 ( 7.933 0.000 -1.514) 8.076 ======================= Grid point 244 (114/230) ======================= q-point: (-0.11 -0.22 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.784 ( -22.482 -11.141 -7.069) 26.068 1.438 ( -20.102 -4.857 25.582) 32.895 2.150 ( -23.059 -3.280 2.147) 23.390 2.438 ( -2.783 -0.258 -7.027) 7.562 2.636 ( 5.299 -0.724 4.586) 7.045 2.734 ( 12.540 -2.300 2.212) 12.939 2.808 ( -3.735 -0.064 3.944) 5.432 3.093 ( -13.535 0.423 1.878) 13.671 3.282 ( -8.279 -2.804 -4.430) 9.800 3.515 ( 1.305 -0.882 9.861) 9.986 3.659 ( 5.198 0.424 -2.118) 5.629 4.112 ( -2.513 -0.297 4.172) 4.880 4.151 ( 7.596 0.225 -4.589) 8.878 4.388 ( -0.353 0.152 3.819) 3.838 4.668 ( 8.901 1.017 4.729) 10.131 4.929 ( -1.136 3.449 -2.250) 4.272 4.990 ( -11.057 1.349 -6.661) 12.979 5.123 ( -3.222 1.062 -0.499) 3.429 5.477 ( -1.366 -2.535 2.361) 3.724 5.635 ( 0.789 1.229 -8.300) 8.427 5.753 ( -5.306 1.713 -5.949) 8.153 6.256 ( 2.251 -0.338 -0.546) 2.341 6.334 ( 1.610 0.492 -4.133) 4.463 7.065 ( 2.482 3.191 -3.069) 5.075 7.237 ( 3.104 10.496 -6.752) 12.861 7.403 ( 11.171 -3.702 -12.331) 17.045 8.646 ( 0.386 9.834 -2.955) 10.275 8.803 ( 1.326 -10.454 -0.753) 10.565 9.769 ( -5.625 -2.522 0.947) 6.237 10.250 ( -3.638 -2.493 5.845) 7.322 10.470 ( 0.930 -1.083 -6.525) 6.679 10.585 ( 4.494 5.458 4.168) 8.207 10.615 ( -2.915 3.977 -3.968) 6.330 10.761 ( 6.353 -9.541 5.848) 12.868 11.408 ( 3.210 0.199 2.446) 4.041 11.653 ( 3.256 -0.828 6.679) 7.477 11.702 ( -4.882 -0.823 7.184) 8.725 11.961 ( 2.469 0.502 4.516) 5.171 13.417 ( -3.667 1.306 -11.623) 12.258 13.899 ( -3.248 0.395 -0.231) 3.280 16.927 ( 26.457 -0.082 15.419) 30.622 17.699 ( -16.243 3.526 -22.382) 27.879 19.164 ( -4.153 0.254 -2.767) 4.997 19.324 ( 7.565 1.465 -3.885) 8.629 19.682 ( -8.086 -0.729 -1.283) 8.219 20.197 ( -2.976 -0.285 -4.842) 5.690 20.247 ( 7.724 0.696 -2.591) 8.177 21.262 ( -4.794 4.958 -3.661) 7.809 21.332 ( -17.514 -3.831 3.206) 18.213 21.778 ( -13.109 0.694 -2.492) 13.362 21.850 ( 9.494 -2.408 3.678) 10.463 22.577 ( 17.674 -0.908 4.249) 18.200 24.285 ( -1.419 -0.771 -0.685) 1.754 24.415 ( 4.118 0.280 -0.114) 4.129 24.457 ( 0.816 0.206 0.679) 1.081 24.879 ( -6.523 -0.188 -7.768) 10.145 25.538 ( -0.932 2.404 1.734) 3.108 25.719 ( 7.641 0.394 -4.926) 9.100 25.911 ( 4.293 -5.121 -4.859) 8.263 27.254 ( 1.405 2.946 6.734) 7.483 47.352 ( -4.754 -0.130 14.396) 15.161 47.569 ( -6.826 0.112 10.855) 12.823 49.133 ( 4.654 0.022 -6.552) 8.037 49.260 ( 3.885 -0.268 -10.643) 11.333 98.562 ( 0.563 0.776 1.918) 2.145 98.953 ( 1.230 1.133 -0.987) 1.942 99.036 ( -5.817 -0.471 5.620) 8.102 99.238 ( 3.075 0.555 18.701) 18.960 100.610 ( -1.664 0.754 2.233) 2.885 100.909 ( -6.836 0.110 6.787) 9.634 101.146 ( -2.614 -0.276 -5.374) 5.982 101.993 ( 11.850 -11.689 -2.207) 16.790 ======================= Grid point 253 (115/230) ======================= q-point: (-0.11 -0.11 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.422 ( -11.795 -0.000 14.491) 18.684 1.245 ( -24.205 -0.000 16.243) 29.150 1.780 ( -28.373 -0.000 26.443) 38.785 2.364 ( -1.216 -0.000 -0.116) 1.222 2.695 ( -0.505 -0.000 -0.764) 0.915 2.827 ( 2.333 0.000 3.410) 4.131 2.905 ( -3.966 -0.000 -1.043) 4.101 3.031 ( 9.588 0.000 12.637) 15.863 3.147 ( -1.313 -0.000 -1.989) 2.384 3.582 ( -1.394 -0.000 5.659) 5.828 3.718 ( 2.335 0.000 -2.818) 3.660 4.078 ( -6.436 -0.000 6.771) 9.341 4.208 ( 5.512 0.000 -5.990) 8.140 4.390 ( -3.470 -0.000 2.733) 4.417 4.709 ( -13.217 -0.000 -6.550) 14.751 4.710 ( -6.195 -0.000 -16.141) 17.289 4.944 ( 11.495 0.000 2.023) 11.671 5.244 ( 5.186 0.000 15.637) 16.475 5.457 ( -2.395 -0.000 -1.176) 2.668 5.599 ( -7.527 -0.000 -5.018) 9.046 5.647 ( 8.929 0.000 -7.537) 11.685 6.266 ( 2.828 0.000 -4.692) 5.479 6.299 ( -2.914 -0.000 -3.113) 4.263 7.091 ( 2.850 0.000 -5.328) 6.042 7.231 ( 0.210 0.000 -6.139) 6.142 7.375 ( -0.204 -0.000 -24.113) 24.114 8.711 ( 3.139 0.000 -3.775) 4.910 8.750 ( -0.189 -0.000 1.210) 1.225 9.708 ( -3.089 -0.000 4.842) 5.743 10.234 ( -2.731 -0.000 5.815) 6.424 10.419 ( 0.507 0.000 -6.299) 6.319 10.493 ( -3.856 -0.000 -7.069) 8.052 10.765 ( 3.353 0.000 5.729) 6.638 10.936 ( 12.479 0.000 12.029) 17.332 11.505 ( 3.910 0.000 5.871) 7.054 11.671 ( -5.710 -0.000 9.070) 10.717 11.756 ( 4.253 0.000 2.478) 4.922 12.015 ( 0.493 0.000 0.609) 0.784 13.273 ( -3.118 -0.000 -8.376) 8.938 13.830 ( -4.440 -0.000 -0.649) 4.488 17.196 ( -20.316 -0.000 -27.332) 34.055 17.535 ( 27.855 0.000 15.370) 31.814 19.016 ( -10.068 -0.000 -5.989) 11.715 19.422 ( 7.572 0.000 -7.918) 10.956 19.536 ( -5.669 -0.000 -1.939) 5.991 20.111 ( -2.822 -0.000 -2.178) 3.564 20.278 ( -2.067 -0.000 -4.676) 5.112 20.938 ( -23.449 -0.000 7.629) 24.659 21.251 ( -1.271 -0.000 -10.713) 10.788 21.550 ( -7.224 -0.000 -2.886) 7.779 22.032 ( 6.982 0.000 5.135) 8.667 22.865 ( 11.766 0.000 3.808) 12.367 24.241 ( -1.539 -0.000 -1.775) 2.349 24.502 ( 1.826 0.000 3.587) 4.025 24.507 ( 5.479 0.000 0.531) 5.504 24.767 ( 0.327 0.000 0.202) 0.385 25.547 ( -0.595 -0.000 0.443) 0.742 25.778 ( 6.414 0.000 -8.723) 10.828 25.942 ( 4.579 0.000 -1.172) 4.727 27.262 ( -6.035 -0.000 -2.667) 6.598 47.413 ( -3.403 -0.000 16.153) 16.508 47.547 ( -6.386 -0.000 10.295) 12.115 49.134 ( 3.196 0.000 -8.976) 9.528 49.257 ( 5.376 0.000 -8.227) 9.827 98.609 ( 1.912 0.000 3.416) 3.915 98.972 ( -6.365 -0.000 4.296) 7.679 98.988 ( 3.698 0.000 -2.954) 4.733 99.632 ( 19.423 0.000 31.035) 36.612 100.588 ( -3.793 -0.000 1.831) 4.212 100.875 ( -3.920 -0.000 8.071) 8.972 101.081 ( -0.500 -0.000 -3.657) 3.691 102.085 ( 8.220 0.000 -3.378) 8.887 ======================= Grid point 254 (116/230) ======================= q-point: ( 0.00 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.438 ( 7.029 0.000 22.306) 23.387 1.564 ( 5.095 0.000 29.141) 29.583 2.446 ( -10.784 -0.000 25.417) 27.610 2.478 ( 2.534 0.000 -4.512) 5.175 2.707 ( 1.875 0.000 6.188) 6.465 2.910 ( -1.628 -0.000 5.406) 5.646 3.154 ( 7.898 0.000 -1.606) 8.060 3.264 ( 6.657 0.000 -2.708) 7.186 3.315 ( -9.237 -0.000 5.669) 10.838 3.497 ( -6.879 -0.000 -1.006) 6.952 3.781 ( -4.504 -0.000 -2.295) 5.054 3.891 ( 6.697 0.000 -2.000) 6.989 4.205 ( -6.424 -0.000 6.864) 9.401 4.231 ( -6.966 -0.000 15.265) 16.780 4.348 ( 8.678 0.000 -1.959) 8.896 4.961 ( 6.390 0.000 12.997) 14.483 5.051 ( -3.618 -0.000 -10.830) 11.418 5.191 ( -7.991 -0.000 -1.447) 8.121 5.328 ( -1.503 -0.000 -18.177) 18.239 5.566 ( 11.092 0.000 3.680) 11.687 5.861 ( 2.181 0.000 6.494) 6.850 6.036 ( 3.762 0.000 -2.935) 4.771 6.218 ( -2.735 -0.000 -6.491) 7.043 6.550 ( 0.305 0.000 1.606) 1.635 6.812 ( 3.176 0.000 -14.215) 14.565 7.064 ( 3.293 0.000 -7.470) 8.163 8.747 ( 4.073 0.000 -1.244) 4.259 8.749 ( -2.004 -0.000 -0.032) 2.004 10.050 ( -3.708 -0.000 -4.433) 5.779 10.065 ( 1.963 0.000 10.827) 11.004 10.305 ( 0.428 0.000 0.540) 0.689 10.407 ( 1.978 0.000 0.523) 2.046 10.846 ( -0.607 -0.000 -1.401) 1.527 11.196 ( -1.890 -0.000 -9.933) 10.111 11.665 ( 0.967 0.000 -4.424) 4.528 11.775 ( -1.607 -0.000 -1.776) 2.395 11.893 ( -3.676 -0.000 8.705) 9.449 12.091 ( -5.489 -0.000 4.014) 6.799 13.326 ( 10.186 0.000 1.216) 10.258 13.611 ( -2.625 -0.000 -4.337) 5.070 16.830 ( 28.920 0.000 6.056) 29.547 17.468 ( -32.237 -0.000 -10.379) 33.866 19.106 ( 17.112 0.000 1.873) 17.214 19.227 ( -2.850 -0.000 -2.910) 4.074 19.650 ( 5.223 0.000 6.895) 8.650 20.007 ( -8.809 -0.000 0.218) 8.811 20.137 ( 1.938 0.000 4.389) 4.798 20.734 ( -7.365 -0.000 8.461) 11.218 20.808 ( 4.319 0.000 -11.843) 12.606 21.369 ( 3.065 0.000 -6.435) 7.128 22.403 ( -0.181 -0.000 9.643) 9.644 23.021 ( -1.612 -0.000 -2.493) 2.969 24.156 ( 0.885 0.000 -1.459) 1.707 24.348 ( 0.080 0.000 -6.939) 6.939 24.788 ( -0.440 -0.000 8.638) 8.649 25.448 ( -3.118 -0.000 -1.591) 3.500 25.463 ( 12.051 0.000 -1.487) 12.142 25.555 ( 6.804 0.000 -10.040) 12.128 26.243 ( 7.947 0.000 5.054) 9.418 26.483 ( -21.720 -0.000 0.409) 21.724 47.666 ( -9.015 -0.000 12.898) 15.736 47.897 ( -6.983 -0.000 16.914) 18.299 48.832 ( 5.521 0.000 -13.432) 14.522 49.155 ( 6.975 0.000 -11.020) 13.042 98.794 ( -3.818 -0.000 0.777) 3.896 98.930 ( 1.423 0.000 -3.678) 3.944 99.007 ( 0.045 0.000 11.323) 11.323 99.991 ( -8.623 -0.000 -10.695) 13.738 100.620 ( -2.771 -0.000 4.155) 4.994 101.038 ( 4.643 0.000 -3.522) 5.827 101.397 ( -0.813 -0.000 10.217) 10.249 102.016 ( -0.112 -0.000 -6.915) 6.916 ======================= Grid point 255 (117/230) ======================= q-point: ( 0.11 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.850 ( 12.621 4.788 20.645) 24.666 1.873 ( 13.507 0.695 20.023) 24.163 2.479 ( -4.764 -2.444 9.668) 11.051 2.494 ( -2.512 -1.767 4.762) 5.667 2.694 ( -5.471 1.024 0.309) 5.575 2.918 ( -2.890 -0.828 3.224) 4.408 3.217 ( 6.541 7.791 -3.102) 10.635 3.272 ( -3.304 0.766 7.784) 8.490 3.364 ( 3.409 -4.787 -1.614) 6.095 3.419 ( -1.152 -1.055 1.789) 2.375 3.752 ( 0.966 6.660 0.076) 6.730 3.890 ( 0.175 -3.970 -7.648) 8.619 4.126 ( -7.782 2.427 7.134) 10.832 4.324 ( -2.961 -5.210 14.686) 15.861 4.490 ( 5.123 -4.723 3.457) 7.778 4.838 ( -4.146 3.902 -9.987) 11.496 5.055 ( -5.682 0.464 -5.334) 7.808 5.095 ( -2.211 -3.445 -1.610) 4.399 5.336 ( 11.845 0.371 6.176) 13.363 5.752 ( 7.892 -0.589 -0.041) 7.915 5.911 ( -0.693 1.594 3.630) 4.025 6.003 ( -6.243 -0.636 1.976) 6.579 6.190 ( 9.601 2.619 -14.040) 17.209 6.612 ( 4.240 0.957 1.239) 4.519 6.739 ( 3.272 0.292 -14.465) 14.833 7.068 ( 4.200 -1.435 -8.015) 9.161 8.692 ( -2.049 2.012 -0.824) 2.988 8.821 ( 3.075 -3.193 -1.072) 4.561 9.981 ( -1.985 -0.820 -0.258) 2.163 10.174 ( 2.635 0.509 4.849) 5.542 10.337 ( 2.276 1.892 3.444) 4.540 10.449 ( 2.775 0.541 -0.178) 2.833 10.828 ( -1.321 -2.175 -0.575) 2.609 11.030 ( -5.521 1.390 -10.188) 11.671 11.627 ( -1.444 3.465 -0.434) 3.779 11.693 ( -4.608 -0.150 -3.860) 6.013 11.909 ( -3.735 1.729 9.968) 10.784 12.008 ( -8.507 -2.415 5.256) 10.287 13.525 ( 12.014 0.272 -0.363) 12.023 13.549 ( 0.195 -0.720 -6.135) 6.180 16.850 ( -28.772 -0.049 -9.493) 30.297 17.476 ( 37.761 1.034 6.384) 38.311 19.148 ( -1.854 0.146 -5.350) 5.664 19.307 ( 5.712 -0.110 -0.076) 5.713 19.817 ( 6.385 0.122 5.560) 8.467 19.844 ( -9.380 -0.623 -1.317) 9.492 20.254 ( 6.980 -0.153 4.407) 8.256 20.724 ( -1.624 0.533 7.317) 7.514 20.816 ( 7.824 -0.679 -11.504) 13.929 21.384 ( 5.197 0.537 -5.192) 7.366 22.461 ( -3.270 0.149 10.630) 11.122 22.934 ( -5.380 0.157 -3.684) 6.522 24.170 ( 1.829 -0.046 -1.012) 2.091 24.292 ( 0.253 -0.032 -6.552) 6.557 24.828 ( -3.402 0.093 7.646) 8.369 25.342 ( -2.376 7.062 -3.009) 8.036 25.450 ( -3.055 -6.028 -5.827) 8.923 25.746 ( 14.274 0.711 -7.467) 16.125 26.166 ( -16.809 -0.289 2.354) 16.975 26.436 ( 7.906 -1.477 7.174) 10.777 47.627 ( -8.711 0.256 13.501) 16.070 47.910 ( -8.212 0.005 16.697) 18.607 48.821 ( 6.182 -0.098 -12.550) 13.990 49.170 ( 6.229 -0.024 -11.786) 13.331 98.719 ( -5.123 -0.381 0.467) 5.158 98.919 ( 0.461 0.618 -1.555) 1.736 99.120 ( 0.379 0.096 12.672) 12.678 99.714 ( -12.341 2.264 -7.226) 14.479 100.615 ( -1.518 0.159 3.315) 3.649 101.102 ( 6.385 -0.182 -3.699) 7.382 101.414 ( -5.404 2.282 10.913) 12.389 101.955 ( -3.574 -6.583 -7.603) 10.674 ======================= Grid point 256 (118/230) ======================= q-point: ( 0.22 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.057 ( 3.544 8.529 16.165) 18.617 2.283 ( 8.079 3.176 1.756) 8.857 2.461 ( -0.316 1.493 -2.301) 2.761 2.515 ( 2.745 -0.493 13.431) 13.718 2.633 ( -2.890 -2.481 7.514) 8.425 2.864 ( -5.012 -0.587 -1.315) 5.215 3.188 ( 2.349 7.889 -7.434) 11.092 3.334 ( -0.111 1.966 14.322) 14.457 3.390 ( -4.044 -0.997 3.425) 5.392 3.493 ( 4.130 -0.913 3.677) 5.605 3.641 ( -1.437 5.315 -9.827) 11.264 3.887 ( -0.635 -7.433 -6.201) 9.701 4.051 ( -4.103 2.629 5.177) 7.110 4.351 ( -2.546 0.513 -2.131) 3.360 4.645 ( -1.539 -13.714 8.310) 16.109 4.761 ( 0.082 -0.098 5.062) 5.064 4.893 ( -5.577 1.427 -6.015) 8.326 5.153 ( 8.109 -1.792 -0.637) 8.329 5.591 ( 9.523 1.588 7.424) 12.179 5.786 ( -1.967 5.061 -0.494) 5.452 5.901 ( -0.367 1.145 -0.039) 1.204 5.972 ( -0.751 -5.660 0.515) 5.732 6.179 ( 6.139 3.637 -15.387) 16.961 6.646 ( 3.430 1.885 -7.196) 8.191 6.723 ( 5.337 -2.055 -6.264) 8.482 7.087 ( 4.613 -2.769 -8.841) 10.350 8.630 ( -3.605 -1.732 -2.455) 4.692 8.883 ( 3.496 -0.109 -0.386) 3.518 9.994 ( 0.218 -2.279 4.003) 4.612 10.226 ( 2.751 1.353 -1.160) 3.278 10.398 ( 2.694 5.581 5.493) 8.281 10.481 ( 3.446 2.351 -2.490) 4.858 10.808 ( -4.218 -3.030 -0.820) 5.258 10.862 ( -3.694 0.589 -5.256) 6.451 11.545 ( -4.391 3.169 -1.970) 5.762 11.600 ( -3.093 0.771 0.578) 3.240 11.900 ( -5.555 0.796 9.410) 10.956 11.960 ( -5.195 -1.165 7.563) 9.249 13.511 ( 1.414 -1.233 -7.905) 8.125 13.708 ( 10.084 0.437 -1.008) 10.143 16.383 ( -17.919 0.122 -5.000) 18.604 18.092 ( 26.760 1.622 4.763) 27.229 19.102 ( 5.345 0.212 -8.142) 9.742 19.340 ( -1.049 -0.762 0.031) 1.297 19.639 ( -10.920 -0.509 -3.796) 11.573 19.954 ( 3.305 -0.061 3.335) 4.696 20.410 ( 6.272 0.841 2.102) 6.668 20.811 ( 7.082 1.162 5.565) 9.082 20.877 ( 8.717 -1.763 -9.675) 13.142 21.464 ( 9.393 0.808 -3.175) 9.948 22.464 ( -7.193 0.623 10.763) 12.960 22.777 ( -8.482 0.895 -4.500) 9.643 24.194 ( 2.022 0.756 -1.174) 2.458 24.255 ( 0.906 -1.041 -4.676) 4.875 24.788 ( -6.824 0.939 4.347) 8.145 25.250 ( -1.048 2.537 -3.381) 4.355 25.388 ( -3.298 -4.912 -4.739) 7.581 25.843 ( 3.025 3.053 -3.993) 5.866 25.971 ( -4.625 1.265 -1.604) 5.056 26.651 ( 7.294 -2.755 8.906) 11.837 47.599 ( -8.178 0.371 14.392) 16.557 47.906 ( -8.794 -0.124 16.332) 18.549 48.829 ( 6.813 -0.171 -11.607) 13.460 49.165 ( 5.473 0.041 -12.714) 13.842 98.643 ( -4.924 -0.991 0.744) 5.077 98.919 ( 0.403 0.356 1.074) 1.201 99.220 ( -1.312 0.490 12.644) 12.721 99.451 ( -10.542 1.349 -5.101) 11.788 100.621 ( -0.897 0.224 3.216) 3.346 101.185 ( 6.891 0.200 -4.134) 8.038 101.388 ( -7.018 0.668 10.555) 12.693 101.858 ( -4.161 -3.874 -7.195) 9.170 ======================= Grid point 257 (119/230) ======================= q-point: ( 0.33 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.075 ( -7.583 3.711 1.010) 8.502 2.229 ( -0.253 7.546 2.893) 8.085 2.412 ( -2.629 1.907 1.590) 3.616 2.571 ( -3.964 7.405 6.471) 10.603 2.720 ( -6.295 -0.543 -2.195) 6.689 2.910 ( 13.826 8.202 -1.154) 16.117 3.128 ( 5.514 0.637 -0.996) 5.639 3.301 ( -9.788 1.238 6.753) 11.956 3.415 ( -3.915 2.557 11.691) 12.591 3.532 ( 2.319 2.497 -2.908) 4.480 3.601 ( 1.452 -3.776 2.636) 4.828 3.864 ( 0.479 -4.996 -8.450) 9.828 4.053 ( 0.710 0.121 4.055) 4.118 4.268 ( -1.633 1.142 -4.430) 4.857 4.721 ( -4.916 -3.977 -4.066) 7.518 4.749 ( -2.164 -8.648 -3.321) 9.513 4.890 ( -2.209 -4.390 17.602) 18.275 5.352 ( 12.305 1.322 0.827) 12.403 5.683 ( -3.195 4.834 -1.248) 5.928 5.719 ( 2.637 2.768 3.035) 4.881 5.879 ( 0.161 0.294 -5.641) 5.651 5.990 ( -3.745 -3.682 -0.024) 5.252 6.126 ( 6.618 1.101 -12.798) 14.450 6.652 ( 4.715 -1.670 -5.403) 7.363 6.779 ( 4.267 -2.924 -5.306) 7.410 7.111 ( 4.965 -3.673 -10.147) 11.878 8.555 ( -4.679 -4.218 -3.433) 7.174 8.933 ( 3.760 2.913 -0.092) 4.758 10.079 ( 1.545 -3.990 6.206) 7.538 10.228 ( 0.297 3.955 -1.090) 4.113 10.427 ( 2.711 5.505 0.907) 6.203 10.493 ( 4.531 4.917 -3.721) 7.652 10.717 ( -4.511 -0.444 -1.004) 4.643 10.809 ( -3.029 -1.982 -0.405) 3.642 11.440 ( -2.421 3.400 -1.743) 4.523 11.577 ( -1.416 0.675 3.739) 4.055 11.894 ( -5.034 -1.899 9.939) 11.302 11.955 ( -3.259 1.678 7.675) 8.506 13.469 ( 0.840 -1.893 -9.457) 9.682 13.838 ( 6.463 0.325 -0.903) 6.534 16.185 ( -3.339 0.286 2.045) 3.926 18.311 ( -0.363 0.308 -5.337) 5.358 19.238 ( 11.093 -0.268 -3.409) 11.608 19.308 ( -2.978 -1.068 -0.196) 3.170 19.474 ( 1.273 -0.045 -4.677) 4.848 19.990 ( -1.232 0.318 1.705) 2.128 20.451 ( -0.322 2.479 -0.167) 2.506 20.934 ( 8.227 -2.563 -11.305) 14.215 21.071 ( 14.736 0.825 7.589) 16.595 21.649 ( 15.466 1.249 -0.741) 15.534 22.380 ( -12.552 1.018 9.653) 15.867 22.562 ( -11.022 1.576 -4.844) 12.142 24.208 ( 2.071 0.258 -1.679) 2.679 24.262 ( 1.833 -1.100 -1.785) 2.785 24.674 ( -7.632 1.291 1.141) 7.824 25.180 ( -2.957 -2.395 -7.472) 8.385 25.355 ( -0.006 -1.932 -1.092) 2.220 25.754 ( -7.485 0.393 2.491) 7.899 25.953 ( 7.259 6.657 -8.127) 12.770 26.867 ( 5.886 -3.575 9.903) 12.062 47.590 ( -7.556 0.424 15.447) 17.201 47.893 ( -9.092 -0.228 15.723) 18.164 48.856 ( 7.336 -0.223 -10.731) 13.001 49.139 ( 4.874 0.134 -13.688) 14.531 98.583 ( -4.117 -1.550 1.136) 4.543 98.944 ( 0.550 -0.149 2.259) 2.330 99.258 ( -7.047 0.187 -2.524) 7.487 99.279 ( -3.419 0.874 11.298) 11.837 100.634 ( -0.762 0.173 3.377) 3.466 101.238 ( 2.597 0.683 -3.154) 4.142 101.343 ( -7.264 -0.557 6.748) 9.930 101.786 ( 2.106 1.242 -5.176) 5.725 ======================= Grid point 258 (120/230) ======================= q-point: (-0.56 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.803 ( -15.382 9.671 -5.897) 19.103 2.187 ( -3.784 1.180 0.105) 3.965 2.375 ( -2.456 2.329 3.839) 5.118 2.542 ( 1.441 9.439 10.182) 13.959 2.603 ( -3.528 2.299 -1.916) 4.626 2.807 ( 1.630 14.398 -15.701) 21.366 3.163 ( -11.030 -0.856 7.205) 13.203 3.314 ( -2.158 -2.238 -0.167) 3.113 3.432 ( 1.924 -1.506 7.826) 8.199 3.617 ( 8.819 2.128 4.263) 10.024 3.695 ( 2.433 -1.811 8.541) 9.063 3.809 ( -2.249 2.674 -4.767) 5.910 4.114 ( 1.548 -1.881 1.814) 3.038 4.234 ( 1.509 -2.190 -2.706) 3.794 4.600 ( -1.774 3.249 -4.531) 5.851 4.782 ( -4.071 -15.237 -1.390) 15.832 5.001 ( -3.962 -2.709 12.600) 13.483 5.431 ( -1.453 4.964 -0.163) 5.174 5.615 ( -2.207 -1.007 -1.046) 2.642 5.741 ( -0.906 7.567 -7.946) 11.010 5.769 ( -1.456 -1.675 -6.232) 6.616 5.987 ( 4.025 -6.276 -0.276) 7.461 6.172 ( 6.650 0.385 -4.541) 8.061 6.732 ( 4.174 -5.039 -2.098) 6.871 6.820 ( 3.824 -4.872 -6.245) 8.796 7.133 ( 5.548 -3.548 -12.119) 13.792 8.483 ( -4.300 -5.677 -3.331) 7.862 8.962 ( 3.580 5.706 -0.395) 6.748 10.144 ( -4.967 6.614 0.671) 8.299 10.200 ( 2.074 -6.019 6.149) 8.851 10.437 ( 4.581 3.710 -5.688) 8.192 10.518 ( 4.189 7.500 2.096) 8.843 10.655 ( -4.021 -3.222 -0.682) 5.198 10.766 ( -0.840 0.861 -1.288) 1.762 11.394 ( 0.353 3.296 0.619) 3.372 11.600 ( 0.559 0.570 4.108) 4.185 11.920 ( -4.474 -1.309 11.290) 12.214 11.956 ( -1.516 1.657 5.577) 6.012 13.401 ( -0.861 -2.453 -10.226) 10.552 13.907 ( 2.530 -0.076 -0.535) 2.587 16.300 ( 10.898 0.296 9.586) 14.517 18.083 ( -14.020 -1.995 -15.292) 20.842 19.216 ( -3.793 -1.266 -2.253) 4.590 19.259 ( -3.264 -0.896 -0.501) 3.422 19.717 ( 20.808 0.301 -1.873) 20.894 19.942 ( -4.441 0.934 -0.570) 4.574 20.391 ( -3.585 3.231 0.098) 4.827 20.983 ( 6.117 -3.749 -10.660) 12.849 21.400 ( 16.475 1.302 7.273) 18.056 21.946 ( 19.285 1.599 1.583) 19.416 22.182 ( -17.932 1.256 7.509) 19.481 22.303 ( -13.059 1.707 -4.955) 14.071 24.246 ( 3.226 -0.764 -0.126) 3.318 24.288 ( 1.721 -0.632 -0.946) 2.063 24.553 ( -5.767 1.011 -0.019) 5.855 25.050 ( -4.939 -1.764 -10.102) 11.382 25.387 ( 1.911 -2.611 -0.359) 3.255 25.673 ( -4.223 0.366 3.049) 5.222 25.946 ( 6.652 8.078 -8.571) 13.526 27.063 ( 3.856 -4.178 9.465) 11.041 47.600 ( -6.948 0.442 16.644) 18.041 47.870 ( -9.227 -0.265 14.979) 17.595 48.896 ( 7.610 -0.241 -10.046) 12.605 49.097 ( 4.624 0.231 -14.555) 15.273 98.549 ( -2.727 -1.974 1.750) 3.794 98.947 ( -1.227 -0.258 -2.246) 2.572 99.191 ( -1.655 -0.841 5.083) 5.412 99.291 ( -4.819 1.176 9.895) 11.068 100.649 ( -1.032 -0.053 3.758) 3.898 101.206 ( -3.254 0.534 -0.727) 3.377 101.256 ( -7.697 -0.259 2.389) 8.063 101.844 ( 12.478 6.809 -4.504) 14.911 ======================= Grid point 259 (121/230) ======================= q-point: (-0.44 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.363 ( -17.331 14.353 -7.393) 23.686 2.063 ( -14.188 0.966 8.257) 16.444 2.379 ( 0.585 0.210 -2.855) 2.922 2.544 ( -1.161 10.597 4.567) 11.598 2.595 ( 5.842 5.495 -2.422) 8.378 2.668 ( 5.762 5.669 -1.538) 8.229 3.021 ( -12.432 -0.154 6.415) 13.990 3.244 ( -8.620 -5.405 2.195) 10.409 3.513 ( 0.962 1.364 3.395) 3.783 3.640 ( -6.958 7.838 1.270) 10.557 3.707 ( 1.147 6.578 4.472) 8.036 3.927 ( 12.045 -0.845 2.502) 12.331 4.148 ( 0.505 -1.589 -0.019) 1.667 4.305 ( 4.707 -5.653 -2.108) 7.652 4.580 ( 3.053 -0.089 1.456) 3.383 4.792 ( -6.689 -11.798 0.479) 13.571 4.998 ( -5.705 -2.462 1.921) 6.504 5.316 ( -6.569 3.734 0.122) 7.557 5.536 ( -4.885 1.270 -7.725) 9.228 5.579 ( -3.812 -0.991 -2.642) 4.743 5.712 ( -1.890 0.390 -1.783) 2.627 6.117 ( 9.924 2.974 -8.540) 13.426 6.274 ( 2.629 -5.884 5.063) 8.196 6.770 ( 0.698 -7.410 -7.691) 10.703 6.920 ( 6.852 -6.414 -2.921) 9.830 7.139 ( 5.838 -2.694 -14.605) 15.957 8.445 ( -2.402 -6.862 -2.508) 7.691 8.964 ( 3.003 7.891 -0.804) 8.481 10.007 ( -6.071 6.895 2.385) 9.492 10.337 ( 1.930 -7.181 5.031) 8.978 10.438 ( 4.566 3.445 -4.826) 7.484 10.515 ( -0.825 8.087 3.990) 9.055 10.585 ( -5.486 -3.842 -3.253) 7.445 10.804 ( 7.045 1.215 -0.303) 7.155 11.406 ( 1.283 1.482 2.343) 3.055 11.652 ( 2.332 1.036 3.229) 4.115 11.937 ( -3.700 0.635 9.121) 9.863 11.985 ( -0.156 0.872 5.586) 5.656 13.306 ( -2.367 -2.436 -9.405) 10.000 13.919 ( -0.929 -0.575 -0.218) 1.114 16.686 ( 21.475 0.160 15.003) 26.197 17.664 ( -18.929 -4.182 -20.536) 28.241 19.182 ( 0.587 -1.815 -2.065) 2.812 19.204 ( -3.347 -0.550 -0.372) 3.412 19.816 ( -7.138 1.575 -3.700) 8.193 20.006 ( 14.625 -0.190 -2.323) 14.809 20.301 ( -4.853 3.130 1.732) 6.028 21.018 ( 4.694 -4.570 -9.665) 11.676 21.713 ( 14.115 1.916 6.853) 15.808 21.852 ( -23.348 1.011 5.136) 23.927 22.010 ( -14.490 1.176 -5.238) 15.453 22.325 ( 20.787 1.738 3.246) 21.110 24.300 ( 0.575 -0.115 -0.043) 0.588 24.328 ( 4.339 -0.885 0.159) 4.431 24.480 ( -2.038 0.854 1.132) 2.482 24.882 ( -5.217 -0.403 -9.825) 11.132 25.434 ( 1.293 -3.910 -1.286) 4.314 25.661 ( 0.808 1.103 2.094) 2.501 25.920 ( 5.572 7.881 -7.854) 12.444 27.209 ( 1.017 -4.694 6.820) 8.342 47.632 ( -6.390 0.361 17.934) 19.042 47.839 ( -9.172 -0.241 14.209) 16.914 48.941 ( 7.124 -0.226 -9.937) 12.229 49.050 ( 5.222 0.349 -14.856) 15.751 98.552 ( -0.893 -2.213 2.757) 3.646 98.892 ( -0.940 -0.681 -4.548) 4.693 99.222 ( -5.075 0.914 7.289) 8.928 99.332 ( 2.158 -1.314 12.087) 12.348 100.663 ( -1.716 -0.477 4.495) 4.835 101.128 ( -3.889 0.643 -1.444) 4.198 101.144 ( -7.961 0.129 3.337) 8.634 101.996 ( 18.195 12.645 -6.396) 23.062 ======================= Grid point 260 (122/230) ======================= q-point: (-0.33 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.968 ( -12.396 13.739 4.146) 18.964 1.832 ( -19.714 3.037 8.429) 21.654 2.314 ( -3.042 -0.200 -0.503) 3.090 2.512 ( 0.179 10.148 10.190) 14.382 2.678 ( 4.250 1.400 -1.975) 4.891 2.802 ( 6.703 3.795 2.731) 8.172 2.898 ( -3.765 -3.466 6.715) 8.443 3.138 ( -10.472 -2.573 5.093) 11.925 3.384 ( -7.901 10.874 3.924) 14.002 3.631 ( 3.897 0.034 0.359) 3.913 3.712 ( 0.760 6.663 3.483) 7.557 4.069 ( 6.460 3.473 -3.163) 7.988 4.188 ( 0.474 -2.555 3.835) 4.633 4.386 ( 0.894 -6.662 -2.565) 7.195 4.629 ( -5.152 -4.511 -6.167) 9.216 4.794 ( 1.603 -2.170 8.857) 9.258 4.872 ( -9.017 -1.187 -2.246) 9.368 5.224 ( -0.834 -6.506 -6.288) 9.086 5.435 ( -0.925 0.261 0.665) 1.169 5.525 ( -3.029 0.587 1.514) 3.437 5.659 ( -2.235 1.408 -2.284) 3.493 6.149 ( 6.489 5.114 -7.493) 11.153 6.352 ( -2.566 -2.776 2.887) 4.757 6.773 ( 0.242 -11.366 -9.008) 14.505 7.044 ( 5.744 -5.191 -4.964) 9.197 7.111 ( 4.545 -2.115 -17.829) 18.521 8.464 ( 0.116 -8.185 -1.089) 8.258 8.936 ( 2.100 9.282 -1.148) 9.586 9.902 ( -4.558 5.341 5.579) 8.968 10.374 ( 1.690 2.747 -6.384) 7.152 10.419 ( -3.463 5.570 3.812) 7.586 10.487 ( -4.870 -2.086 -3.259) 6.220 10.583 ( 5.191 -7.713 5.677) 10.893 10.932 ( 8.694 2.444 0.260) 9.034 11.451 ( 0.812 -2.851 3.071) 4.269 11.714 ( 3.383 1.684 1.966) 4.260 11.958 ( -1.460 1.454 8.297) 8.549 12.008 ( -0.872 2.055 3.495) 4.148 13.211 ( -2.149 -1.668 -6.444) 6.994 13.884 ( -3.440 -0.692 -0.293) 3.522 17.181 ( -19.655 -4.958 -22.149) 30.024 17.241 ( 26.639 0.002 16.575) 31.375 19.122 ( -6.695 -0.245 -0.987) 6.772 19.224 ( 3.537 -2.662 -2.339) 5.007 19.628 ( -7.555 1.841 -5.944) 9.787 20.169 ( 6.598 -0.056 -2.448) 7.038 20.219 ( -4.142 2.473 2.471) 5.420 21.036 ( 2.178 -5.093 -9.167) 10.711 21.466 ( -24.390 1.775 4.522) 24.869 21.698 ( -13.776 0.635 -5.866) 14.987 21.982 ( 10.861 2.079 6.083) 12.621 22.673 ( 17.199 0.939 3.148) 17.510 24.280 ( -1.183 1.592 -1.766) 2.656 24.412 ( 4.483 -0.207 -0.493) 4.515 24.506 ( 2.137 -0.207 4.619) 5.094 24.746 ( -1.950 -0.676 -5.441) 5.819 25.463 ( 0.004 -4.706 -1.685) 4.998 25.702 ( 4.762 3.796 -1.532) 6.279 25.901 ( 4.907 5.401 -4.709) 8.685 27.263 ( -3.666 -4.655 1.779) 6.187 47.684 ( -5.957 -0.039 18.954) 19.868 47.806 ( -8.745 -0.095 13.599) 16.169 48.948 ( 4.719 -0.034 -12.878) 13.715 49.040 ( 7.751 0.324 -12.038) 14.321 98.599 ( 1.025 -2.199 4.168) 4.823 98.869 ( 1.616 -1.600 -3.971) 4.576 99.156 ( -7.015 1.567 5.162) 8.850 99.561 ( 8.362 -4.395 14.457) 17.270 100.672 ( -3.040 -0.928 5.677) 6.506 101.053 ( -2.135 0.764 -2.894) 3.677 101.057 ( -6.485 -0.272 6.466) 9.162 102.137 ( 18.877 18.697 -9.294) 28.147 ======================= Grid point 261 (123/230) ======================= q-point: (-0.22 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.910 ( -0.966 3.829 24.284) 24.603 1.525 ( -21.917 4.263 12.231) 25.458 2.328 ( -3.063 -2.375 13.072) 13.634 2.527 ( -4.341 6.305 13.764) 15.750 2.638 ( -3.335 6.287 -1.242) 7.225 2.815 ( 4.867 -2.710 -2.743) 6.209 2.991 ( -6.129 0.302 6.524) 8.957 3.155 ( 4.720 -1.389 5.862) 7.653 3.310 ( 4.905 5.449 7.275) 10.329 3.665 ( -0.325 1.574 -0.305) 1.636 3.692 ( -0.447 3.829 -0.183) 3.860 4.114 ( 5.024 1.459 -2.245) 5.693 4.197 ( -7.137 -1.803 2.254) 7.699 4.335 ( -6.298 -4.752 -6.708) 10.356 4.476 ( -7.536 2.755 -1.708) 8.204 4.674 ( -6.780 -0.840 4.457) 8.157 5.040 ( 10.918 -1.619 7.464) 13.324 5.250 ( 3.596 -8.547 -9.778) 13.476 5.429 ( -3.539 -5.180 -6.489) 9.026 5.538 ( 2.604 3.248 5.007) 6.512 5.590 ( -0.273 3.184 2.466) 4.036 6.139 ( 2.128 3.923 -6.341) 7.754 6.301 ( -3.499 0.362 -0.285) 3.529 6.770 ( -3.479 -13.177 -8.755) 16.199 6.999 ( -0.089 0.093 -18.571) 18.571 7.093 ( 3.312 -1.629 -6.949) 7.869 8.545 ( 2.204 -8.916 -0.024) 9.185 8.882 ( 0.990 9.685 -1.229) 9.813 9.880 ( -2.033 2.654 9.206) 9.794 10.289 ( -2.656 0.825 -6.790) 7.338 10.357 ( -2.451 4.328 1.486) 5.191 10.411 ( -1.416 1.085 -2.271) 2.887 10.780 ( 4.116 -7.006 4.379) 9.231 11.069 ( 10.188 1.195 -0.984) 10.305 11.532 ( 0.721 -8.974 2.927) 9.467 11.768 ( 3.102 2.085 0.482) 3.769 11.974 ( -2.588 6.123 3.306) 7.424 12.012 ( 0.760 0.269 6.727) 6.775 13.163 ( 0.194 -0.643 -2.250) 2.349 13.810 ( -4.763 -0.020 -1.140) 4.898 16.724 ( -15.661 -3.105 -16.995) 23.318 17.819 ( 23.292 0.106 13.448) 26.895 18.911 ( -15.108 -0.283 -4.461) 15.755 19.279 ( 2.966 -2.493 -3.509) 5.227 19.499 ( -0.638 1.379 -2.527) 2.948 20.147 ( -4.603 1.602 4.213) 6.442 20.213 ( 0.092 0.348 -2.611) 2.635 20.980 ( -4.811 -4.171 -7.605) 9.918 21.112 ( -18.412 2.457 2.960) 18.810 21.465 ( -5.947 -0.007 -5.959) 8.419 22.172 ( 6.744 1.750 6.767) 9.713 22.921 ( 10.076 0.502 1.009) 10.139 24.220 ( -1.464 2.300 -2.542) 3.728 24.444 ( 1.333 -0.702 -5.306) 5.516 24.603 ( 2.679 -0.312 6.855) 7.366 24.809 ( 10.027 -2.170 3.881) 10.968 25.477 ( -0.800 -5.385 -1.922) 5.774 25.704 ( 4.444 8.250 -6.503) 11.406 25.952 ( 6.223 1.385 0.448) 6.391 27.159 ( -11.633 -3.096 -3.446) 12.521 47.733 ( -7.874 -0.905 16.108) 17.952 47.794 ( -5.972 0.346 15.984) 17.067 48.905 ( 4.449 0.139 -14.298) 14.975 49.081 ( 8.071 0.243 -10.584) 13.312 98.686 ( 2.404 -1.783 5.571) 6.324 98.894 ( 3.348 -2.013 -4.049) 5.626 99.063 ( -7.051 1.437 4.082) 8.273 99.898 ( 12.618 -8.970 6.835) 16.923 100.665 ( -4.920 -0.909 6.745) 8.398 101.010 ( 0.870 0.691 -3.767) 3.927 101.060 ( -2.211 -2.428 11.997) 12.439 102.183 ( 14.161 22.382 -11.489) 28.870 ======================= Grid point 262 (124/230) ======================= q-point: (-0.11 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.199 ( 3.601 -3.950 30.634) 31.097 1.321 ( -12.134 4.159 21.206) 24.784 2.412 ( -10.329 0.950 27.699) 29.577 2.507 ( -2.028 -1.114 -3.586) 4.268 2.586 ( 3.701 5.588 7.737) 10.236 2.898 ( 0.559 0.676 1.943) 2.131 3.004 ( 4.346 -4.097 3.135) 6.745 3.207 ( 3.679 4.317 0.316) 5.681 3.446 ( -6.379 -3.077 3.590) 7.940 3.601 ( -4.418 1.880 0.254) 4.808 3.710 ( 8.982 1.807 4.100) 10.037 3.977 ( -12.778 -3.738 -8.459) 15.773 4.197 ( 5.678 1.668 -0.192) 5.921 4.264 ( -4.793 -1.513 4.580) 6.800 4.314 ( -6.416 5.093 3.241) 8.809 4.742 ( 3.539 -0.677 12.002) 12.531 5.206 ( -1.427 -0.948 -11.039) 11.171 5.302 ( 6.809 -3.838 1.010) 7.881 5.345 ( -3.016 -2.579 1.279) 4.169 5.487 ( 4.637 3.697 -15.824) 16.899 5.730 ( 4.219 -0.655 10.278) 11.129 6.045 ( -1.979 1.855 -5.028) 5.713 6.279 ( 0.248 -0.540 -1.499) 1.612 6.643 ( -10.932 -6.372 -5.695) 13.876 6.873 ( 3.113 0.401 -14.034) 14.381 7.081 ( 2.575 0.471 -7.355) 7.807 8.652 ( 2.997 -7.914 -0.352) 8.470 8.814 ( -0.049 8.561 -0.749) 8.594 9.946 ( 0.299 0.222 11.483) 11.489 10.168 ( -3.986 0.331 -6.697) 7.801 10.312 ( -1.322 1.537 0.846) 2.196 10.386 ( 0.620 0.914 -0.482) 1.205 10.858 ( 0.519 -0.620 -0.042) 0.810 11.215 ( 7.407 -1.487 -5.688) 9.456 11.640 ( 1.723 -10.215 -1.955) 10.542 11.788 ( 1.183 2.047 -0.601) 2.440 11.910 ( -3.699 3.687 4.735) 7.050 12.087 ( 1.216 1.834 6.458) 6.822 13.193 ( 3.998 0.004 0.960) 4.112 13.708 ( -4.702 0.598 -2.680) 5.445 16.520 ( 3.188 -0.701 -2.471) 4.094 17.999 ( -15.593 0.445 -2.938) 15.874 18.788 ( 10.752 -0.622 1.988) 10.952 19.283 ( -0.627 -0.955 -3.321) 3.512 19.531 ( 3.836 0.631 3.176) 5.020 20.111 ( -2.560 0.699 4.301) 5.054 20.140 ( -6.416 0.404 -0.143) 6.430 20.836 ( -11.745 -1.167 5.145) 12.875 20.885 ( -3.379 1.251 -8.546) 9.275 21.385 ( 1.055 -0.665 -6.570) 6.687 22.307 ( 2.929 0.720 8.194) 8.732 23.026 ( 3.220 0.321 -1.065) 3.407 24.170 ( -0.428 1.038 -2.069) 2.354 24.404 ( 0.070 -0.516 -6.665) 6.685 24.705 ( 1.503 -0.044 8.131) 8.269 25.127 ( 18.642 -3.703 3.525) 19.330 25.479 ( -1.788 -5.468 -1.975) 6.083 25.635 ( 2.467 8.820 -8.255) 12.330 26.080 ( 7.515 0.506 2.901) 8.071 26.863 ( -20.104 -0.661 -3.607) 20.436 47.709 ( -9.051 -0.420 12.999) 15.845 47.854 ( -5.277 -0.113 17.534) 18.311 48.861 ( 4.905 0.112 -14.110) 14.939 49.123 ( 7.608 0.135 -10.558) 13.014 98.786 ( 1.811 -0.959 5.088) 5.485 98.925 ( 2.825 -1.159 -4.452) 5.399 98.981 ( -5.536 0.902 5.675) 7.979 100.109 ( 3.748 -6.819 -8.614) 11.608 100.639 ( -4.775 -0.316 6.116) 7.765 101.006 ( 2.796 0.384 -3.599) 4.574 101.234 ( 4.064 -5.649 13.853) 15.503 102.106 ( 5.423 16.667 -9.641) 20.003 ======================= Grid point 264 (125/230) ======================= q-point: ( 0.11 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.131 ( 0.350 0.000 16.212) 16.216 2.311 ( 12.694 0.000 3.447) 13.153 2.466 ( -0.367 -0.000 -5.005) 5.018 2.506 ( 3.519 0.000 18.965) 19.288 2.608 ( -4.900 -0.000 6.250) 7.942 2.859 ( -4.259 -0.000 -1.158) 4.414 3.259 ( -1.460 -0.000 -1.949) 2.436 3.354 ( -0.279 -0.000 -1.601) 1.625 3.369 ( 3.056 0.000 10.266) 10.711 3.485 ( 4.411 0.000 3.540) 5.656 3.710 ( -4.280 -0.000 -13.756) 14.407 3.804 ( 0.652 0.000 -4.068) 4.120 4.083 ( -5.086 -0.000 6.832) 8.517 4.357 ( -2.487 -0.000 3.640) 4.409 4.525 ( -2.879 -0.000 5.844) 6.514 4.763 ( -1.523 -0.000 3.329) 3.661 4.904 ( -5.394 -0.000 -5.773) 7.901 5.138 ( 9.640 0.000 0.127) 9.641 5.604 ( 9.992 0.000 8.165) 12.904 5.835 ( 2.392 0.000 -3.194) 3.990 5.910 ( -1.414 -0.000 0.308) 1.447 5.917 ( -4.976 -0.000 3.071) 5.848 6.208 ( 6.592 0.000 -17.080) 18.308 6.673 ( 4.019 0.000 -14.266) 14.821 6.694 ( 4.108 0.000 -0.557) 4.146 7.065 ( 4.494 0.000 -8.702) 9.794 8.617 ( -4.264 -0.000 -3.321) 5.405 8.882 ( 4.359 0.000 0.657) 4.408 9.977 ( -0.092 -0.000 4.157) 4.158 10.236 ( 3.107 0.000 -1.011) 3.268 10.443 ( 3.152 0.000 5.581) 6.410 10.500 ( 3.761 0.000 -1.924) 4.225 10.779 ( -3.869 -0.000 0.693) 3.931 10.868 ( -4.544 -0.000 -6.813) 8.189 11.574 ( -4.559 -0.000 -3.816) 5.945 11.602 ( -3.089 -0.000 1.727) 3.539 11.908 ( -7.561 -0.000 7.087) 10.364 11.948 ( -3.387 -0.000 10.381) 10.920 13.501 ( 1.369 0.000 -7.901) 8.018 13.712 ( 10.100 0.000 -1.163) 10.167 16.384 ( -17.894 -0.000 -4.917) 18.557 18.104 ( 26.640 0.000 4.180) 26.966 19.103 ( 5.282 0.000 -8.016) 9.600 19.334 ( -1.223 -0.000 0.156) 1.233 19.635 ( -10.908 -0.000 -3.785) 11.546 19.954 ( 3.358 0.000 3.465) 4.825 20.416 ( 6.775 0.000 2.317) 7.160 20.823 ( 6.484 0.000 7.683) 10.053 20.860 ( 8.933 0.000 -11.760) 14.768 21.470 ( 9.481 0.000 -3.345) 10.054 22.468 ( -7.181 -0.000 10.942) 13.089 22.784 ( -8.381 -0.000 -4.315) 9.427 24.201 ( 2.499 0.000 -0.672) 2.588 24.244 ( 0.465 0.000 -5.518) 5.537 24.795 ( -6.828 -0.000 4.879) 8.392 25.284 ( -4.379 -0.000 -7.092) 8.335 25.336 ( -0.880 -0.000 -1.096) 1.406 25.863 ( -0.413 -0.000 -2.318) 2.354 25.985 ( 0.100 0.000 -4.131) 4.133 26.628 ( 6.788 0.000 9.696) 11.836 47.602 ( -8.179 -0.000 14.321) 16.492 47.906 ( -8.829 -0.000 16.333) 18.566 48.828 ( 6.805 0.000 -11.585) 13.436 49.165 ( 5.493 0.000 -12.691) 13.829 98.636 ( -5.030 -0.000 0.787) 5.091 98.922 ( 0.317 0.000 0.679) 0.749 99.224 ( -1.274 -0.000 12.766) 12.829 99.462 ( -11.181 -0.000 -5.463) 12.444 100.623 ( -0.910 -0.000 3.169) 3.297 101.187 ( 7.401 0.000 -4.606) 8.717 101.393 ( -7.992 -0.000 10.293) 13.032 101.829 ( -2.427 -0.000 -4.989) 5.548 ======================= Grid point 265 (126/230) ======================= q-point: ( 0.22 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.120 ( -7.452 1.936 3.264) 8.362 2.310 ( -3.555 3.019 -1.728) 4.974 2.425 ( -3.192 0.302 0.792) 3.302 2.657 ( 0.198 4.203 9.548) 10.434 2.705 ( -4.128 -1.515 0.639) 4.443 2.964 ( 18.916 0.153 7.266) 20.264 3.175 ( -2.478 3.930 -4.381) 6.386 3.309 ( -6.860 -0.182 2.910) 7.454 3.476 ( -3.988 4.645 7.872) 9.973 3.545 ( 1.482 -1.106 -9.126) 9.312 3.554 ( 1.525 -1.932 3.603) 4.363 3.806 ( 5.606 -2.320 -7.783) 9.868 4.072 ( -1.799 1.631 6.020) 6.491 4.282 ( -3.136 0.556 -5.833) 6.646 4.540 ( -5.201 -8.803 6.052) 11.881 4.762 ( -2.650 0.929 -6.385) 6.975 4.856 ( -1.768 -0.919 16.232) 16.354 5.362 ( 13.810 0.249 1.301) 13.873 5.737 ( 0.124 1.643 -0.930) 1.892 5.760 ( -3.427 2.866 -1.334) 4.662 5.877 ( -1.541 -0.202 -3.632) 3.951 5.929 ( -1.895 -3.568 4.752) 6.237 6.150 ( 6.019 1.330 -15.578) 16.753 6.643 ( 5.370 0.068 -10.417) 11.720 6.741 ( 2.265 -1.858 -3.058) 4.235 7.071 ( 4.923 -1.541 -10.008) 11.259 8.511 ( -5.069 -1.608 -3.637) 6.443 8.963 ( 4.819 1.098 0.544) 4.973 10.039 ( 0.846 -1.453 6.591) 6.802 10.270 ( 2.690 1.583 -1.886) 3.647 10.494 ( 1.802 3.232 -0.972) 3.826 10.544 ( 4.961 1.504 -3.279) 6.134 10.697 ( -6.823 -1.345 0.269) 6.960 10.793 ( -1.502 -0.461 0.444) 1.633 11.484 ( -2.216 2.065 -1.595) 3.423 11.579 ( -1.813 -0.254 3.165) 3.656 11.872 ( -5.034 -0.937 9.006) 10.360 11.972 ( -3.409 0.658 9.052) 9.695 13.450 ( 0.645 -0.740 -9.400) 9.451 13.842 ( 6.311 0.112 -1.055) 6.400 16.188 ( -3.361 0.109 2.131) 3.981 18.314 ( -1.422 0.128 -5.853) 6.024 19.235 ( 9.916 -0.110 -3.554) 10.534 19.297 ( -3.030 -0.434 0.103) 3.062 19.474 ( 2.433 0.016 -4.625) 5.226 19.993 ( -1.071 0.102 1.889) 2.173 20.478 ( 0.131 1.087 0.193) 1.111 20.905 ( 7.488 -1.117 -11.560) 13.819 21.080 ( 14.994 0.325 7.751) 16.883 21.663 ( 15.803 0.513 -1.053) 15.846 22.391 ( -12.558 0.430 9.878) 15.983 22.578 ( -11.005 0.584 -4.846) 12.039 24.216 ( 1.561 0.748 -2.768) 3.264 24.244 ( 2.307 -1.094 -1.220) 2.830 24.689 ( -8.115 0.559 1.597) 8.289 25.155 ( -3.634 -0.872 -7.726) 8.583 25.334 ( 0.372 -0.817 0.029) 0.898 25.756 ( -7.845 0.031 2.633) 8.275 26.028 ( 9.133 3.035 -10.149) 13.987 26.825 ( 5.050 -1.743 11.103) 12.322 47.594 ( -7.550 0.165 15.368) 17.124 47.890 ( -9.116 -0.086 15.748) 18.197 48.853 ( 7.326 -0.090 -10.705) 12.972 49.140 ( 4.909 0.052 -13.676) 14.530 98.567 ( -4.275 -0.606 1.251) 4.495 98.943 ( 0.501 -0.034 1.989) 2.051 99.261 ( -7.626 0.099 -3.100) 8.232 99.288 ( -3.408 0.335 11.822) 12.308 100.636 ( -0.812 0.069 3.285) 3.385 101.247 ( 3.994 0.456 -5.402) 6.733 101.332 ( -8.811 -0.614 8.681) 12.385 101.801 ( 4.808 0.620 -3.935) 6.244 ======================= Grid point 266 (127/230) ======================= q-point: (-0.67 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.941 ( -11.042 8.662 -2.403) 14.238 2.186 ( -4.994 -1.597 -6.459) 8.319 2.382 ( -2.181 -0.250 1.256) 2.529 2.617 ( -1.902 1.349 0.423) 2.370 2.690 ( -2.530 7.519 7.911) 11.204 3.009 ( 0.382 11.115 -11.687) 16.133 3.164 ( -10.521 1.503 6.313) 12.361 3.281 ( 0.911 -1.934 -3.385) 4.004 3.422 ( 3.298 1.018 5.925) 6.857 3.599 ( 8.630 -4.375 -0.673) 9.699 3.691 ( 1.927 0.873 14.225) 14.381 3.849 ( 5.061 2.357 -6.515) 8.580 4.100 ( 0.022 0.122 3.983) 3.985 4.192 ( -2.706 -3.957 -3.851) 6.149 4.567 ( -5.093 -8.599 5.079) 11.210 4.660 ( -1.602 0.676 -5.196) 5.479 4.974 ( -2.366 -1.116 14.061) 14.302 5.502 ( 1.886 4.320 -3.376) 5.798 5.608 ( -6.476 0.502 -1.513) 6.669 5.728 ( -4.070 -3.126 -9.759) 11.026 5.837 ( 3.589 3.317 -1.567) 5.132 5.887 ( -3.359 -4.895 2.853) 6.587 6.193 ( 8.919 1.548 -6.483) 11.134 6.679 ( 4.518 -2.041 -4.089) 6.426 6.752 ( 1.595 -4.141 -5.641) 7.178 7.083 ( 5.465 -2.876 -11.920) 13.425 8.416 ( -4.759 -3.353 -2.863) 6.488 9.031 ( 4.910 3.450 -0.467) 6.019 10.126 ( 0.276 -3.422 6.949) 7.751 10.243 ( -1.657 5.796 -1.167) 6.140 10.488 ( 4.267 3.200 -4.957) 7.281 10.591 ( -3.992 -4.408 -1.807) 6.216 10.605 ( 3.704 3.473 -0.604) 5.113 10.782 ( -1.291 1.291 1.259) 2.218 11.442 ( -0.384 2.853 0.694) 2.961 11.602 ( 0.725 -0.354 3.492) 3.584 11.903 ( -2.514 -0.921 11.099) 11.418 11.976 ( -3.064 1.018 6.407) 7.175 13.371 ( -1.116 -1.545 -9.883) 10.065 13.906 ( 2.165 -0.088 -0.591) 2.246 16.304 ( 10.808 0.184 9.615) 14.467 18.059 ( -15.715 -1.244 -15.123) 21.845 19.201 ( -3.855 -0.794 -2.460) 4.641 19.247 ( -3.203 -0.599 -0.034) 3.259 19.722 ( 20.405 0.250 -1.942) 20.499 19.953 ( -4.119 0.549 -0.373) 4.172 20.434 ( -3.506 2.394 0.299) 4.256 20.934 ( 5.595 -2.687 -10.780) 12.440 21.416 ( 16.723 0.807 7.122) 18.195 21.967 ( 19.764 1.160 0.988) 19.823 22.197 ( -18.437 0.749 7.829) 20.045 22.324 ( -12.870 1.071 -5.283) 13.953 24.238 ( 3.013 -0.301 -0.479) 3.066 24.279 ( 2.132 -0.547 -1.089) 2.456 24.565 ( -6.301 0.618 0.419) 6.345 25.028 ( -3.974 -1.108 -9.329) 10.200 25.356 ( 0.984 -1.518 0.247) 1.826 25.677 ( -3.845 0.219 2.786) 4.754 26.050 ( 7.814 5.678 -10.836) 14.516 27.005 ( 2.625 -3.332 10.907) 11.703 47.606 ( -6.939 0.280 16.555) 17.953 47.866 ( -9.227 -0.160 15.020) 17.628 48.893 ( 7.612 -0.162 -10.034) 12.596 49.100 ( 4.681 0.145 -14.555) 15.290 98.525 ( -2.902 -1.238 1.895) 3.681 98.944 ( -1.381 -0.142 -2.040) 2.468 99.181 ( -1.610 -0.450 4.433) 4.737 99.305 ( -5.170 0.658 10.148) 11.408 100.649 ( -1.170 -0.016 3.602) 3.787 101.217 ( -2.486 0.792 -2.257) 3.450 101.249 ( -7.909 -0.674 3.886) 8.838 101.928 ( 16.052 4.262 -4.877) 17.309 ======================= Grid point 267 (128/230) ======================= q-point: (-0.56 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.587 ( -12.469 15.864 -8.863) 22.038 2.056 ( -9.882 -2.407 0.469) 10.182 2.376 ( -0.690 -0.422 -2.155) 2.302 2.592 ( 0.496 1.387 0.928) 1.741 2.685 ( -0.578 1.237 6.306) 6.452 2.830 ( 2.481 14.585 -9.967) 17.839 3.040 ( -9.784 2.688 8.990) 13.556 3.193 ( -5.347 -0.486 -1.494) 5.573 3.522 ( 2.623 0.690 3.784) 4.656 3.750 ( -2.800 5.253 -2.152) 6.329 3.804 ( 2.081 6.158 9.541) 11.545 3.893 ( 11.077 -2.806 3.489) 11.948 4.124 ( 1.279 -3.402 -2.744) 4.554 4.219 ( 3.048 -5.225 -1.019) 6.134 4.556 ( -3.128 -2.777 1.963) 4.621 4.651 ( -2.274 -6.421 4.313) 8.062 4.984 ( -6.054 0.424 3.323) 6.919 5.361 ( -8.092 2.105 -7.092) 10.964 5.522 ( -5.266 -3.868 2.261) 6.914 5.548 ( -7.917 -0.649 -5.381) 9.595 5.766 ( -0.627 5.530 -1.964) 5.902 6.078 ( 8.681 -7.543 1.383) 11.583 6.257 ( 5.650 2.894 -4.056) 7.533 6.687 ( -2.106 -3.956 -3.771) 5.857 6.822 ( 6.686 -6.578 -4.199) 10.277 7.087 ( 5.103 -3.939 -14.458) 15.830 8.358 ( -3.173 -4.868 -1.533) 6.010 9.067 ( 4.404 5.967 -1.744) 7.618 10.114 ( -5.088 7.397 1.531) 9.108 10.240 ( 1.545 -5.249 5.752) 7.938 10.485 ( -0.867 -1.251 -4.274) 4.537 10.528 ( 0.334 0.645 -3.153) 3.236 10.641 ( -0.122 7.546 1.897) 7.781 10.793 ( 5.570 -2.278 -2.455) 6.500 11.432 ( -0.263 1.855 1.640) 2.490 11.660 ( 2.709 0.158 2.882) 3.959 11.948 ( -3.237 0.771 6.797) 7.568 11.996 ( 0.369 0.607 8.449) 8.479 13.273 ( -2.431 -1.949 -8.511) 9.064 13.910 ( -1.403 -0.571 -0.102) 1.518 16.688 ( 21.357 0.126 14.944) 26.067 17.607 ( -20.952 -3.413 -19.360) 28.730 19.158 ( 0.162 -1.469 -2.108) 2.575 19.196 ( -3.440 -0.461 0.065) 3.471 19.838 ( -6.705 1.290 -3.620) 7.728 20.004 ( 14.401 -0.011 -2.017) 14.541 20.347 ( -5.071 2.959 1.755) 6.128 20.954 ( 4.140 -3.981 -9.613) 11.198 21.732 ( 13.205 0.702 5.931) 14.493 21.876 ( -22.141 2.050 5.559) 22.920 22.022 ( -14.481 0.379 -5.213) 15.395 22.350 ( 20.785 1.621 2.076) 20.952 24.299 ( 1.671 0.019 -0.333) 1.704 24.316 ( 4.411 -0.751 0.363) 4.489 24.491 ( -2.660 0.567 1.679) 3.197 24.876 ( -4.666 -0.316 -9.841) 10.896 25.386 ( 0.728 -2.554 -0.510) 2.705 25.674 ( 1.441 0.681 2.018) 2.571 26.032 ( 6.378 7.023 -10.549) 14.187 27.138 ( -0.629 -4.719 8.716) 9.932 47.637 ( -6.469 0.293 17.776) 18.918 47.836 ( -9.121 -0.165 14.273) 16.939 48.937 ( 7.163 -0.206 -9.978) 12.284 49.055 ( 5.297 0.269 -14.850) 15.769 98.522 ( -1.041 -1.785 2.858) 3.527 98.883 ( -1.600 -0.545 -4.388) 4.702 99.239 ( -2.943 1.272 8.177) 8.783 99.312 ( -0.382 -1.484 10.540) 10.651 100.657 ( -1.980 -0.344 4.293) 4.740 101.137 ( -7.096 0.496 4.224) 8.273 101.149 ( -4.039 0.411 -2.732) 4.893 102.165 ( 23.497 9.786 -8.326) 26.780 ======================= Grid point 268 (129/230) ======================= q-point: (-0.44 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.207 ( -9.326 18.493 -3.447) 20.997 1.872 ( -15.646 2.027 5.516) 16.713 2.300 ( -4.049 -2.489 -2.784) 5.508 2.594 ( -3.036 -0.097 0.816) 3.145 2.739 ( 3.732 5.734 -0.330) 6.849 2.829 ( 11.780 0.587 0.901) 11.829 2.937 ( -6.723 9.492 9.891) 15.269 3.105 ( -6.967 -0.962 4.006) 8.094 3.530 ( -4.804 7.609 2.517) 9.344 3.641 ( 0.400 2.512 2.064) 3.276 3.830 ( 0.460 8.683 4.558) 9.818 4.118 ( 7.424 0.985 0.833) 7.536 4.140 ( 1.615 -3.705 -0.721) 4.105 4.285 ( 2.580 -5.537 -6.542) 8.951 4.549 ( -5.542 -5.513 2.679) 8.263 4.734 ( -0.680 -5.955 7.213) 9.378 4.865 ( -5.795 0.319 1.429) 5.978 5.141 ( -6.978 -4.590 -10.882) 13.718 5.405 ( -5.691 -3.998 -3.096) 7.613 5.535 ( -2.653 0.849 10.604) 10.963 5.711 ( 0.708 5.617 -2.598) 6.229 6.213 ( 6.024 1.409 -5.958) 8.589 6.297 ( 0.335 -2.828 2.334) 3.682 6.637 ( -3.186 -6.665 -5.391) 9.145 6.953 ( 6.203 -6.897 -4.125) 10.152 7.057 ( 3.319 -4.857 -17.556) 18.515 8.358 ( -0.901 -6.274 0.254) 6.344 9.063 ( 3.383 7.884 -2.757) 9.012 9.995 ( -4.381 7.251 3.373) 9.118 10.362 ( 0.436 -4.686 1.163) 4.848 10.426 ( -2.243 -5.358 0.386) 5.821 10.511 ( 0.488 5.985 -1.310) 6.146 10.567 ( -0.168 5.335 -0.551) 5.366 10.927 ( 8.630 -3.020 -2.395) 9.452 11.426 ( -1.490 -0.609 1.509) 2.206 11.733 ( 3.764 0.916 1.668) 4.218 11.938 ( -2.694 -2.480 2.501) 4.435 12.076 ( 1.713 5.196 9.307) 10.796 13.186 ( -1.971 -1.561 -5.203) 5.779 13.871 ( -3.623 -0.912 0.138) 3.739 17.105 ( -21.117 -4.989 -19.746) 29.338 17.241 ( 26.714 -0.022 16.511) 31.405 19.118 ( -6.770 -0.234 -0.605) 6.801 19.184 ( 2.712 -2.504 -1.947) 4.173 19.657 ( -7.264 1.957 -6.101) 9.686 20.170 ( 7.325 0.198 -2.256) 7.667 20.258 ( -5.169 2.778 3.035) 6.606 20.963 ( 2.006 -4.693 -8.678) 10.068 21.483 ( -24.637 0.614 4.255) 25.010 21.708 ( -13.665 0.727 -6.046) 14.961 22.013 ( 11.362 2.048 5.202) 12.664 22.689 ( 17.333 1.236 2.072) 17.500 24.302 ( 0.491 1.247 -1.880) 2.309 24.409 ( 4.290 -0.168 0.409) 4.313 24.505 ( 1.513 0.134 4.633) 4.876 24.735 ( -2.490 -0.770 -6.737) 7.224 25.406 ( 0.077 -3.094 -1.293) 3.354 25.742 ( 6.244 1.931 -0.170) 6.538 25.993 ( 4.962 6.794 -8.551) 11.996 27.186 ( -5.257 -5.573 4.503) 8.886 47.683 ( -6.459 -0.087 18.608) 19.697 47.806 ( -8.483 0.030 13.811) 16.209 48.947 ( 4.913 -0.064 -12.757) 13.671 49.045 ( 7.731 0.272 -12.269) 14.504 98.566 ( 0.927 -2.209 4.146) 4.789 98.845 ( 0.444 -1.529 -3.507) 3.852 99.184 ( -6.835 2.219 5.735) 9.194 99.498 ( 5.861 -4.077 13.093) 14.913 100.659 ( -3.308 -0.868 5.510) 6.485 101.053 ( -7.683 0.113 7.595) 10.804 101.072 ( -0.574 1.224 -4.865) 5.049 102.404 ( 26.036 16.639 -13.815) 33.846 ======================= Grid point 269 (130/230) ======================= q-point: (-0.33 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.019 ( -2.758 11.525 12.166) 16.984 1.603 ( -19.417 6.047 11.401) 23.314 2.299 ( 0.021 -3.020 6.245) 6.937 2.532 ( -5.184 -3.119 -0.487) 6.070 2.774 ( 4.501 -1.633 -7.019) 8.497 2.830 ( -3.919 16.522 14.278) 22.186 3.012 ( -3.493 2.472 5.631) 7.073 3.113 ( 7.995 -3.640 6.553) 10.959 3.419 ( -1.998 8.411 4.108) 9.572 3.675 ( 0.654 -0.037 0.647) 0.920 3.779 ( -1.573 7.117 -0.202) 7.292 4.099 ( -6.760 -4.633 -3.176) 8.788 4.209 ( 1.622 4.671 0.759) 5.002 4.277 ( -0.396 -2.936 -2.775) 4.059 4.499 ( -3.695 0.129 -0.569) 3.741 4.655 ( -8.262 -1.621 5.505) 10.060 5.006 ( 7.979 -3.114 7.280) 11.241 5.094 ( 3.736 -11.916 -5.927) 13.823 5.339 ( -4.024 -6.759 -5.847) 9.801 5.584 ( 0.005 3.006 9.172) 9.652 5.657 ( 0.355 5.855 -1.353) 6.020 6.207 ( 2.208 4.595 -6.270) 8.081 6.297 ( -3.719 -1.387 0.808) 4.051 6.588 ( -5.517 -10.461 -4.211) 12.553 6.963 ( 0.432 -4.364 -17.918) 18.447 7.050 ( 5.112 -4.342 -6.757) 9.520 8.423 ( 1.284 -7.485 2.200) 7.906 9.021 ( 2.067 9.019 -3.405) 9.860 9.933 ( -2.704 4.474 6.505) 8.345 10.282 ( -4.238 -2.220 -6.742) 8.268 10.425 ( -3.827 5.026 1.003) 6.396 10.465 ( 2.593 6.005 -3.370) 7.358 10.666 ( 5.452 -7.799 7.095) 11.870 11.064 ( 7.900 -2.543 -3.380) 8.961 11.425 ( -2.140 -5.154 1.511) 5.781 11.794 ( 3.300 1.557 0.103) 3.650 11.936 ( -2.929 -5.010 1.045) 5.897 12.128 ( 2.122 8.747 7.551) 11.749 13.152 ( 0.470 -0.751 -1.305) 1.578 13.808 ( -4.225 -0.300 -0.461) 4.260 16.669 ( -15.109 -4.107 -14.346) 21.235 17.820 ( 23.793 0.121 13.370) 27.292 18.906 ( -15.583 -0.380 -4.512) 16.227 19.237 ( 2.731 -2.953 -2.429) 4.699 19.524 ( -0.744 1.954 -2.778) 3.477 20.177 ( -4.783 2.442 4.263) 6.856 20.221 ( 0.223 0.666 -2.008) 2.128 20.923 ( -2.522 -3.638 -7.679) 8.864 21.133 ( -19.252 0.445 3.489) 19.570 21.466 ( -6.941 0.126 -6.341) 9.403 22.201 ( 7.260 2.039 5.143) 9.128 22.931 ( 10.475 0.933 0.349) 10.523 24.261 ( -0.714 3.075 -3.208) 4.501 24.430 ( 0.216 -1.003 -4.860) 4.967 24.599 ( 3.025 -0.138 6.729) 7.379 24.770 ( 7.764 -3.059 2.961) 8.855 25.414 ( -0.196 -3.328 -1.962) 3.869 25.817 ( 7.615 6.693 -6.428) 12.004 25.984 ( 4.988 3.099 -1.752) 6.127 27.099 ( -11.984 -4.805 -0.323) 12.915 47.717 ( -8.368 -1.136 16.265) 18.327 47.801 ( -6.024 0.537 15.953) 17.061 48.907 ( 4.548 0.148 -14.308) 15.014 49.084 ( 8.166 0.234 -10.796) 13.539 98.653 ( 2.406 -2.487 5.376) 6.394 98.859 ( 2.234 -2.636 -2.819) 4.459 99.092 ( -6.954 2.446 4.574) 8.675 99.761 ( 7.337 -8.695 9.169) 14.612 100.649 ( -4.744 -1.139 6.635) 8.235 101.021 ( -1.159 0.537 1.475) 1.951 101.038 ( -1.463 -0.260 5.223) 5.430 102.532 ( 22.035 23.033 -20.199) 37.737 ======================= Grid point 270 (131/230) ======================= q-point: (-0.22 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.148 ( 2.091 -1.321 24.223) 24.349 1.404 ( -11.507 6.814 20.071) 24.119 2.421 ( 0.537 -0.751 14.637) 14.666 2.474 ( -2.363 -3.431 -2.334) 4.775 2.716 ( -4.701 9.190 10.488) 14.716 2.898 ( 7.161 0.272 -1.723) 7.370 2.966 ( -4.082 1.047 7.126) 8.279 3.273 ( 4.916 2.884 1.753) 5.963 3.401 ( -5.245 -1.098 4.237) 6.831 3.635 ( -3.648 2.281 -0.289) 4.312 3.750 ( 5.622 3.174 0.060) 6.456 3.887 ( -14.251 -7.568 -7.147) 17.647 4.236 ( -0.226 2.250 0.611) 2.342 4.275 ( 2.682 3.837 5.410) 7.155 4.403 ( -4.587 6.786 4.037) 9.131 4.720 ( 3.395 -2.526 11.819) 12.553 5.160 ( 6.357 -6.983 -7.451) 12.029 5.220 ( -5.774 -5.423 -10.454) 13.117 5.291 ( 5.641 -4.487 6.277) 9.558 5.560 ( 3.680 5.823 -10.002) 12.145 5.718 ( 2.160 -0.567 11.210) 11.430 6.093 ( -4.055 4.479 -4.429) 7.491 6.256 ( -2.999 -2.990 -1.988) 4.678 6.526 ( -6.253 -7.403 0.194) 9.693 6.858 ( 1.963 -2.745 -15.617) 15.978 7.083 ( 4.014 -0.632 -7.401) 8.443 8.535 ( 2.402 -7.567 2.885) 8.447 8.948 ( 0.850 9.209 -3.574) 9.915 9.953 ( -0.601 0.818 9.187) 9.243 10.170 ( -3.350 -0.437 -6.480) 7.307 10.345 ( -2.325 2.610 -0.611) 3.548 10.423 ( 0.797 4.596 -1.973) 5.065 10.838 ( 3.299 -2.193 2.769) 4.833 11.173 ( 5.910 -4.303 -6.159) 9.559 11.475 ( -0.184 -10.522 2.266) 10.765 11.814 ( 1.029 1.734 -1.485) 2.504 11.918 ( -4.108 -2.941 2.267) 5.538 12.154 ( 0.885 6.459 4.836) 8.117 13.193 ( 4.202 0.007 1.268) 4.389 13.722 ( -4.093 1.095 -2.457) 4.898 16.501 ( 3.828 -1.683 -1.875) 4.582 18.011 ( -15.443 1.110 -3.073) 15.785 18.772 ( 10.594 -1.545 1.789) 10.855 19.260 ( 0.003 -1.992 -2.619) 3.290 19.547 ( 3.793 1.537 2.979) 5.062 20.130 ( -2.860 1.798 4.331) 5.493 20.151 ( -6.189 1.057 -0.188) 6.282 20.817 ( -6.358 -1.190 -1.341) 6.606 20.901 ( -7.719 0.590 -2.520) 8.142 21.369 ( 0.405 -1.315 -6.330) 6.478 22.324 ( 3.071 1.398 6.615) 7.426 23.035 ( 3.454 0.825 -1.602) 3.896 24.197 ( -0.648 2.541 -2.970) 3.962 24.389 ( -0.214 -1.452 -6.019) 6.195 24.705 ( 1.918 0.131 7.815) 8.048 25.039 ( 13.573 -7.440 4.403) 16.092 25.417 ( 0.391 -2.885 -2.545) 3.867 25.777 ( 4.118 9.809 -9.793) 14.459 26.093 ( 7.824 1.245 2.816) 8.409 26.844 ( -19.112 -1.922 -2.026) 19.314 47.698 ( -9.181 -1.014 13.528) 16.381 47.852 ( -5.521 -0.056 17.546) 18.394 48.864 ( 4.959 0.226 -14.182) 15.026 49.126 ( 7.663 0.238 -10.757) 13.210 98.761 ( 2.104 -2.328 5.090) 5.980 98.896 ( 2.329 -2.633 -3.098) 4.685 99.005 ( -5.655 2.287 5.775) 8.400 99.959 ( 1.538 -11.674 -1.914) 11.930 100.631 ( -4.456 -0.773 5.992) 7.507 101.016 ( 2.538 0.927 -3.146) 4.147 101.147 ( 1.089 -4.791 14.745) 15.542 102.448 ( 10.402 25.712 -22.235) 35.549 ======================= Grid point 271 (132/230) ======================= q-point: (-0.11 0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.440 ( 7.033 -1.654 23.241) 24.338 1.527 ( 4.139 -1.687 25.463) 25.852 2.459 ( 2.081 -2.712 -4.307) 5.498 2.517 ( -6.859 7.244 21.556) 23.753 2.711 ( -1.296 0.904 6.934) 7.111 2.923 ( -1.703 1.625 5.036) 5.559 3.067 ( 7.179 -7.902 -3.085) 11.113 3.301 ( -7.667 -1.428 4.414) 8.961 3.332 ( 4.903 5.874 0.249) 7.656 3.522 ( -7.446 3.070 -0.847) 8.098 3.718 ( -4.958 -7.482 -1.141) 9.048 3.879 ( 6.774 -1.364 -2.088) 7.219 4.186 ( -6.476 0.629 6.121) 8.934 4.329 ( -3.197 7.541 7.585) 11.163 4.382 ( 6.756 5.729 5.128) 10.235 4.936 ( 3.045 -3.766 8.446) 9.736 5.037 ( -2.345 -0.713 -6.187) 6.655 5.201 ( -1.551 -0.291 -4.893) 5.141 5.301 ( -2.723 -2.332 -11.799) 12.332 5.604 ( 10.075 4.080 0.488) 10.881 5.844 ( 1.386 -2.048 7.249) 7.659 6.040 ( 3.298 0.390 -2.999) 4.475 6.179 ( -4.468 -4.609 -4.510) 7.845 6.532 ( 1.298 -1.980 2.552) 3.481 6.797 ( 3.088 -2.063 -14.115) 14.595 7.079 ( 3.896 1.634 -7.856) 8.920 8.646 ( 1.821 -6.284 2.128) 6.880 8.864 ( 0.414 8.129 -3.238) 8.760 10.032 ( -1.101 -1.622 3.668) 4.159 10.083 ( -0.282 1.465 1.777) 2.320 10.305 ( -0.283 0.043 -0.699) 0.755 10.412 ( 1.477 1.023 0.015) 1.796 10.864 ( 0.141 2.281 -0.733) 2.400 11.170 ( -1.835 -3.600 -9.761) 10.564 11.584 ( 1.425 -9.169 0.220) 9.282 11.781 ( -1.982 0.698 -2.340) 3.145 11.894 ( -4.136 -0.881 6.362) 7.639 12.119 ( -5.270 3.262 3.245) 6.996 13.325 ( 9.909 -0.043 1.346) 10.000 13.622 ( -2.601 1.368 -4.457) 5.339 16.820 ( 28.447 -1.291 6.260) 29.156 17.472 ( -32.336 0.487 -10.528) 34.011 19.100 ( 17.401 -0.849 1.860) 17.521 19.222 ( -2.418 -0.589 -2.980) 3.883 19.657 ( 5.089 0.914 6.746) 8.499 20.013 ( -8.825 0.772 0.130) 8.860 20.144 ( 1.767 0.927 4.312) 4.752 20.730 ( -6.403 -0.358 6.431) 9.082 20.814 ( 3.479 0.631 -10.144) 10.743 21.359 ( 3.054 -1.263 -6.188) 7.015 22.407 ( -0.222 0.374 8.963) 8.973 23.024 ( -1.670 0.309 -2.843) 3.312 24.164 ( 0.631 1.003 -1.795) 2.150 24.343 ( 0.099 -0.694 -6.507) 6.545 24.789 ( -0.281 0.168 8.338) 8.344 25.311 ( 3.551 -11.608 -0.580) 12.153 25.459 ( 7.641 -0.833 -2.314) 8.027 25.676 ( 3.729 9.861 -9.917) 14.474 26.254 ( 8.115 1.407 4.827) 9.546 26.489 ( -20.894 0.615 0.385) 20.906 47.661 ( -9.046 -0.623 13.101) 15.932 47.896 ( -6.965 -0.167 17.027) 18.397 48.833 ( 5.536 0.191 -13.477) 14.571 49.156 ( 6.972 0.138 -11.111) 13.118 98.793 ( -3.227 -0.292 1.087) 3.418 98.915 ( 1.308 -1.836 -2.890) 3.665 99.012 ( -0.399 0.662 10.942) 10.970 99.927 ( -7.992 -7.675 -7.781) 13.540 100.617 ( -2.751 -0.393 4.209) 5.043 101.043 ( 4.452 0.600 -3.303) 5.576 101.331 ( -0.478 -6.545 13.151) 14.698 102.186 ( -0.659 19.443 -15.000) 24.565 ======================= Grid point 274 (133/230) ======================= q-point: (-0.78 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.019 ( -8.923 -0.000 3.576) 9.612 2.161 ( -6.132 -0.000 -13.378) 14.717 2.380 ( -2.008 -0.000 0.850) 2.180 2.627 ( -1.869 -0.000 0.050) 1.870 2.749 ( -4.294 -0.000 7.082) 8.282 3.081 ( -5.365 -0.000 -3.247) 6.271 3.193 ( -10.316 -0.000 5.394) 11.641 3.266 ( 9.655 0.000 -7.750) 12.381 3.462 ( 8.384 0.000 -1.096) 8.456 3.532 ( 1.613 0.000 1.803) 2.420 3.699 ( 3.723 0.000 13.838) 14.330 3.867 ( 8.483 0.000 -7.484) 11.312 4.116 ( -0.268 -0.000 7.002) 7.007 4.139 ( -7.349 -0.000 -5.059) 8.922 4.501 ( -3.791 -0.000 9.012) 9.777 4.671 ( -1.954 -0.000 -6.255) 6.553 4.966 ( -1.731 -0.000 14.765) 14.866 5.535 ( 2.860 0.000 -4.673) 5.479 5.630 ( -6.223 -0.000 -6.245) 8.816 5.687 ( -4.927 -0.000 -3.368) 5.968 5.822 ( 0.653 0.000 1.677) 1.799 5.887 ( -3.203 -0.000 -0.509) 3.243 6.205 ( 9.411 0.000 -6.226) 11.284 6.668 ( 6.747 0.000 -7.786) 10.303 6.716 ( -1.092 -0.000 -2.966) 3.160 7.060 ( 5.321 0.000 -11.877) 13.014 8.391 ( -4.891 -0.000 -2.692) 5.583 9.057 ( 5.412 0.000 -0.499) 5.435 10.100 ( 0.121 0.000 6.927) 6.928 10.292 ( 0.212 0.000 -1.758) 1.771 10.525 ( 4.732 0.000 -4.783) 6.728 10.539 ( -7.368 -0.000 -0.596) 7.392 10.629 ( 5.363 0.000 -3.932) 6.650 10.794 ( -1.662 -0.000 3.262) 3.661 11.465 ( -1.099 -0.000 0.889) 1.413 11.597 ( 1.048 0.000 2.988) 3.167 11.896 ( -1.589 -0.000 11.056) 11.170 11.984 ( -3.710 -0.000 6.744) 7.697 13.360 ( -1.208 -0.000 -9.732) 9.806 13.905 ( 2.024 0.000 -0.616) 2.116 16.305 ( 10.773 0.000 9.627) 14.448 18.050 ( -16.366 -0.000 -15.049) 22.233 19.195 ( -3.879 -0.000 -2.535) 4.634 19.243 ( -3.171 -0.000 0.142) 3.174 19.724 ( 20.267 0.000 -1.990) 20.364 19.957 ( -3.990 -0.000 -0.298) 4.002 20.452 ( -3.530 -0.000 0.469) 3.561 20.913 ( 5.465 0.000 -10.927) 12.218 21.422 ( 16.792 0.000 7.057) 18.214 21.976 ( 20.100 0.000 0.751) 20.114 22.203 ( -18.877 -0.000 7.958) 20.486 22.332 ( -12.719 -0.000 -5.378) 13.809 24.236 ( 2.836 0.000 -0.665) 2.913 24.275 ( 2.421 0.000 -1.096) 2.658 24.570 ( -6.560 -0.000 0.582) 6.586 25.020 ( -3.594 -0.000 -9.053) 9.740 25.345 ( 0.709 0.000 0.449) 0.839 25.679 ( -3.691 -0.000 2.691) 4.568 26.094 ( 8.288 0.000 -11.907) 14.508 26.979 ( 2.058 0.000 11.710) 11.889 47.608 ( -6.936 -0.000 16.518) 17.915 47.865 ( -9.224 -0.000 15.038) 17.641 48.892 ( 7.612 0.000 -10.030) 12.591 49.101 ( 4.701 0.000 -14.554) 15.295 98.516 ( -2.967 -0.000 1.967) 3.560 98.943 ( -1.441 -0.000 -1.988) 2.455 99.178 ( -1.583 -0.000 4.202) 4.490 99.310 ( -5.316 -0.000 10.241) 11.539 100.648 ( -1.219 -0.000 3.540) 3.744 101.225 ( -0.481 -0.000 -6.134) 6.153 101.242 ( -9.642 -0.000 7.809) 12.408 101.960 ( 17.342 0.000 -5.069) 18.067 ======================= Grid point 276 (134/230) ======================= q-point: (-0.67 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.803 ( -10.230 12.844 -4.786) 17.103 1.983 ( -5.807 -7.463 -8.915) 12.996 2.370 ( -2.147 -0.337 -1.216) 2.490 2.610 ( -0.534 0.976 -0.233) 1.137 2.677 ( -5.491 -1.141 4.963) 7.490 2.952 ( -3.873 2.235 -5.323) 6.952 3.106 ( -5.713 4.381 10.923) 13.082 3.233 ( 2.501 4.136 -11.571) 12.540 3.559 ( 2.664 5.034 3.622) 6.750 3.717 ( 7.664 -8.239 4.497) 12.118 3.863 ( 3.881 3.095 4.135) 6.461 3.924 ( 3.138 4.890 0.549) 5.836 4.018 ( -0.482 -8.392 -5.492) 10.041 4.189 ( 0.658 -0.257 9.296) 9.323 4.527 ( -4.121 -0.903 9.356) 10.263 4.598 ( -1.372 -1.505 -3.138) 3.741 5.000 ( -5.219 1.119 4.817) 7.190 5.376 ( -10.082 0.159 -10.752) 14.740 5.463 ( -6.848 -2.717 -5.234) 9.037 5.558 ( -9.255 0.902 6.931) 11.598 5.845 ( 2.077 4.812 -3.474) 6.288 5.967 ( 6.797 -6.247 3.590) 9.905 6.296 ( 6.621 1.636 -4.633) 8.244 6.655 ( -3.131 -0.625 -2.400) 3.995 6.745 ( 6.906 -3.330 -4.914) 9.107 7.041 ( 4.553 -1.869 -14.344) 15.164 8.309 ( -3.481 -1.755 -0.948) 4.012 9.128 ( 5.221 2.251 -2.378) 6.163 10.166 ( -0.076 -1.021 7.314) 7.386 10.236 ( -2.321 4.575 -1.554) 5.361 10.414 ( -7.746 -4.842 -0.702) 9.162 10.584 ( 7.280 3.482 -4.465) 9.223 10.707 ( 6.234 0.606 -3.441) 7.146 10.765 ( -2.120 -0.199 -0.145) 2.135 11.453 ( -1.610 0.786 1.913) 2.621 11.659 ( 3.375 -0.152 2.172) 4.016 11.957 ( -4.249 0.367 3.933) 5.801 12.002 ( 1.952 0.193 11.479) 11.645 13.253 ( -2.434 -0.719 -7.876) 8.275 13.904 ( -1.717 -0.242 -0.036) 1.734 16.690 ( 21.280 0.046 14.905) 25.981 17.572 ( -22.137 -1.285 -18.636) 28.965 19.143 ( -0.103 -0.550 -2.148) 2.220 19.191 ( -3.411 -0.179 0.353) 3.434 19.851 ( -6.428 0.486 -3.559) 7.363 20.005 ( 14.334 0.026 -1.931) 14.463 20.379 ( -5.382 1.266 1.895) 5.845 20.911 ( 4.111 -1.619 -9.789) 10.739 21.737 ( 10.852 0.100 5.323) 12.088 21.902 ( -19.929 1.165 6.370) 20.955 22.022 ( -14.350 -0.140 -5.571) 15.394 22.368 ( 20.716 0.678 1.324) 20.769 24.301 ( 2.380 0.200 -0.872) 2.543 24.307 ( 4.332 -0.464 0.771) 4.424 24.496 ( -2.969 0.187 2.078) 3.629 24.873 ( -4.297 -0.113 -9.863) 10.759 25.361 ( 0.573 -0.886 -0.157) 1.067 25.681 ( 1.725 0.239 1.925) 2.595 26.108 ( 6.954 2.936 -12.489) 14.593 27.085 ( -1.778 -2.099 10.329) 10.689 47.640 ( -6.525 0.109 17.664) 18.831 47.835 ( -9.070 -0.053 14.321) 16.952 48.935 ( 7.189 -0.083 -9.999) 12.316 49.058 ( 5.322 0.098 -14.843) 15.768 98.504 ( -1.121 -0.668 2.982) 3.256 98.877 ( -1.946 -0.208 -4.377) 4.794 99.257 ( 0.992 1.101 9.499) 9.614 99.291 ( -4.489 -1.154 8.896) 10.031 100.653 ( -2.121 -0.124 4.131) 4.645 101.142 ( -8.890 0.187 6.494) 11.011 101.154 ( -1.729 0.202 -5.204) 5.487 102.265 ( 26.291 3.588 -9.488) 28.180 ======================= Grid point 277 (135/230) ======================= q-point: (-0.56 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.483 ( -7.432 18.389 -5.632) 20.619 1.875 ( -7.644 -2.248 -1.009) 8.032 2.233 ( -10.302 -6.006 -2.567) 12.198 2.571 ( -4.256 -1.588 -2.413) 5.144 2.766 ( 6.092 -0.316 6.428) 8.862 2.859 ( 2.881 1.473 -6.419) 7.189 3.104 ( -1.552 10.841 14.142) 17.887 3.136 ( -1.709 4.996 -3.872) 6.547 3.583 ( 0.340 2.055 1.448) 2.537 3.720 ( -4.832 6.190 0.584) 7.875 3.918 ( -1.809 0.140 8.294) 8.490 4.058 ( 6.446 -5.715 -6.110) 10.562 4.071 ( 8.117 -3.821 -4.222) 9.915 4.284 ( 1.986 2.847 6.489) 7.359 4.501 ( -5.033 -0.370 4.288) 6.622 4.634 ( -1.514 -7.233 6.412) 9.784 4.879 ( -7.479 1.393 2.312) 7.951 5.094 ( -10.271 -1.943 -12.145) 16.024 5.337 ( -6.442 -4.600 -4.107) 8.918 5.546 ( -4.575 0.569 16.733) 17.356 5.813 ( 3.045 7.998 -3.933) 9.419 6.134 ( 3.448 -8.780 0.457) 9.444 6.324 ( 3.518 3.266 -4.288) 6.437 6.579 ( -4.713 -1.837 -1.902) 5.405 6.860 ( 6.824 -5.261 -3.784) 9.410 6.989 ( 2.434 -3.855 -17.049) 17.648 8.287 ( -1.367 -3.369 1.197) 3.828 9.156 ( 4.253 4.637 -4.114) 7.517 10.106 ( -4.193 7.712 0.926) 8.826 10.289 ( 0.768 -4.176 5.186) 6.702 10.336 ( -3.606 -6.651 0.904) 7.620 10.613 ( 3.624 7.522 -3.871) 9.203 10.651 ( -2.339 4.832 -1.793) 5.660 10.855 ( 8.095 -6.297 -4.934) 11.381 11.427 ( -2.700 0.368 1.434) 3.079 11.741 ( 4.443 0.312 1.106) 4.589 11.905 ( -4.581 -1.802 1.288) 5.088 12.137 ( 3.753 3.053 10.106) 11.205 13.168 ( -1.800 -0.850 -4.153) 4.606 13.859 ( -3.825 -0.659 0.506) 3.915 17.046 ( -22.010 -2.941 -17.927) 28.539 17.241 ( 26.727 -0.029 16.400) 31.357 19.116 ( -6.865 -0.119 -0.231) 6.870 19.155 ( 2.345 -1.421 -1.805) 3.283 19.681 ( -7.018 1.214 -6.245) 9.472 20.173 ( 7.736 0.198 -2.150) 8.031 20.293 ( -5.853 1.905 3.408) 7.035 20.907 ( 2.519 -2.818 -8.705) 9.490 21.487 ( -25.149 -0.024 4.293) 25.513 21.718 ( -13.751 0.517 -6.423) 15.186 22.037 ( 11.386 1.126 4.941) 12.463 22.706 ( 17.491 0.902 1.150) 17.552 24.314 ( 1.354 0.466 -2.005) 2.464 24.407 ( 4.491 -0.082 1.268) 4.667 24.509 ( 1.206 0.365 4.876) 5.036 24.725 ( -3.026 -0.518 -8.091) 8.654 25.372 ( 0.345 -1.518 -1.081) 1.895 25.762 ( 6.939 0.879 0.293) 7.000 26.081 ( 5.418 4.751 -11.397) 13.484 27.113 ( -6.578 -3.966 7.089) 10.452 47.681 ( -6.862 -0.077 18.272) 19.518 47.807 ( -8.220 0.084 14.017) 16.249 48.946 ( 5.070 -0.052 -12.677) 13.654 49.048 ( 7.657 0.132 -12.399) 14.573 98.540 ( 0.854 -1.274 4.265) 4.532 98.827 ( -0.298 -0.900 -3.425) 3.554 99.216 ( -6.918 1.898 6.279) 9.533 99.448 ( 4.897 -2.641 12.023) 13.248 100.648 ( -3.454 -0.514 5.229) 6.288 101.056 ( -7.272 0.255 6.867) 10.005 101.087 ( -0.565 0.792 -4.738) 4.837 102.594 ( 29.840 9.091 -16.753) 35.408 ======================= Grid point 278 (136/230) ======================= q-point: (-0.44 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.235 ( -3.297 17.403 2.294) 17.860 1.692 ( -15.481 6.062 9.439) 19.119 2.200 ( 0.850 -11.414 -0.952) 11.485 2.471 ( -6.404 -4.208 -2.258) 7.989 2.787 ( 3.710 2.842 -8.028) 9.290 3.007 ( 0.918 3.673 8.651) 9.443 3.064 ( -0.751 -0.342 7.086) 7.134 3.122 ( 3.500 13.336 8.715) 16.311 3.526 ( -3.388 5.538 0.254) 6.497 3.669 ( -1.637 -0.526 2.682) 3.185 3.874 ( -3.434 5.201 -1.154) 6.338 4.017 ( -7.428 -5.128 -6.054) 10.868 4.232 ( 4.648 -2.768 -0.142) 5.411 4.313 ( 3.528 7.605 1.272) 8.480 4.477 ( -1.355 -2.755 3.130) 4.385 4.631 ( -8.259 -1.703 7.327) 11.171 4.931 ( -0.085 -8.605 -8.170) 11.866 4.953 ( 5.647 -4.808 10.403) 12.776 5.249 ( -4.194 -5.065 -4.340) 7.879 5.622 ( -1.784 2.078 14.206) 14.467 5.759 ( 1.129 8.303 -3.061) 8.921 6.201 ( -1.054 -7.251 -3.425) 8.088 6.300 ( -0.690 3.488 -2.115) 4.137 6.495 ( -5.076 -2.591 -0.995) 5.786 6.891 ( 0.462 -4.977 -17.431) 18.133 6.978 ( 6.446 -5.006 -5.311) 9.737 8.333 ( 0.854 -4.781 3.580) 6.033 9.136 ( 2.774 6.433 -5.225) 8.740 10.004 ( -3.769 5.243 3.240) 7.225 10.231 ( -4.788 -4.468 -4.448) 7.916 10.499 ( -2.591 3.460 1.457) 4.562 10.525 ( 5.750 -0.691 4.646) 7.425 10.611 ( 2.783 4.474 -2.952) 6.039 10.991 ( 6.929 -7.158 -5.609) 11.433 11.384 ( -3.435 -0.992 0.808) 3.666 11.813 ( 3.740 0.990 -0.328) 3.883 11.864 ( -3.839 -4.367 1.220) 5.941 12.233 ( 2.352 5.505 6.379) 8.748 13.143 ( 0.698 -0.511 -0.431) 0.966 13.802 ( -3.805 -0.466 0.347) 3.849 16.615 ( -14.414 -3.118 -12.073) 19.059 17.822 ( 24.337 0.067 13.261) 27.716 18.901 ( -16.094 -0.272 -4.552) 16.727 19.200 ( 2.750 -2.043 -1.792) 3.866 19.551 ( -0.805 1.628 -3.092) 3.586 20.212 ( -4.650 2.172 4.008) 6.512 20.231 ( 0.133 0.692 -1.292) 1.471 20.877 ( -0.100 -2.540 -8.274) 8.656 21.130 ( -20.582 -0.635 4.556) 21.090 21.468 ( -7.707 0.161 -6.761) 10.253 22.226 ( 7.370 1.304 4.045) 8.507 22.946 ( 10.869 0.952 -0.474) 10.921 24.300 ( 0.249 2.006 -3.086) 3.689 24.419 ( -1.328 -0.499 -4.895) 5.097 24.601 ( 3.505 0.504 6.707) 7.584 24.726 ( 5.960 -2.823 1.596) 6.785 25.378 ( 0.496 -1.731 -1.946) 2.651 25.889 ( 10.451 3.293 -4.100) 11.699 26.041 ( 3.692 4.295 -6.519) 8.635 27.029 ( -12.363 -4.489 3.010) 13.493 47.703 ( -8.748 -0.819 16.267) 18.488 47.809 ( -6.053 0.478 15.947) 17.064 48.909 ( 4.639 0.089 -14.314) 15.047 49.087 ( 8.182 0.103 -10.902) 13.632 98.621 ( 2.343 -1.811 5.422) 6.178 98.824 ( 1.284 -2.049 -2.119) 3.215 99.129 ( -6.936 2.460 5.102) 8.954 99.659 ( 4.777 -5.348 9.654) 12.026 100.634 ( -4.569 -0.920 6.326) 7.857 101.024 ( -3.782 0.121 8.566) 9.364 101.047 ( 0.746 0.880 -3.215) 3.416 102.810 ( 25.585 14.614 -25.556) 39.003 ======================= Grid point 279 (137/230) ======================= q-point: (-0.33 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.194 ( 1.548 8.048 13.792) 16.043 1.512 ( -10.756 7.815 17.510) 21.985 2.336 ( 2.005 -11.650 -1.097) 11.872 2.429 ( 1.138 -2.624 3.346) 4.402 2.758 ( 0.819 -0.250 -5.293) 5.362 2.987 ( -3.405 4.883 10.300) 11.897 3.036 ( -5.474 11.581 9.598) 16.006 3.271 ( 5.701 -1.783 2.481) 6.468 3.435 ( -4.689 4.164 2.147) 6.628 3.643 ( -4.152 -2.596 -0.441) 4.916 3.796 ( -2.001 1.500 -4.794) 5.407 3.803 ( -8.884 -0.491 -1.933) 9.105 4.258 ( -1.650 1.169 1.509) 2.523 4.354 ( 5.140 5.815 1.570) 7.918 4.503 ( -1.338 6.590 7.480) 10.058 4.667 ( 2.189 -4.684 11.860) 12.938 5.007 ( 7.166 -11.585 -9.273) 16.479 5.167 ( -3.452 -2.791 -6.594) 7.949 5.213 ( 7.241 -6.114 7.230) 11.920 5.652 ( 1.634 6.701 -4.607) 8.294 5.725 ( -1.363 1.736 11.394) 11.606 6.141 ( -5.761 -1.568 -4.797) 7.659 6.211 ( -4.897 0.391 -0.939) 5.002 6.460 ( -1.159 -1.977 1.963) 3.018 6.799 ( 1.678 -5.057 -15.762) 16.638 7.060 ( 5.652 -2.438 -6.196) 8.734 8.439 ( 2.466 -5.493 5.164) 7.932 9.071 ( 1.157 7.369 -5.736) 9.410 9.969 ( -1.933 1.415 5.885) 6.354 10.150 ( -2.764 -2.323 -4.915) 6.099 10.385 ( -3.611 2.804 -2.477) 5.200 10.516 ( 1.067 7.906 -5.213) 9.530 10.795 ( 6.961 -3.419 7.556) 10.827 11.087 ( 4.180 -7.596 -7.285) 11.324 11.362 ( -1.974 -4.758 2.208) 5.604 11.837 ( 0.898 1.088 -1.710) 2.217 11.856 ( -3.306 -4.459 2.832) 6.232 12.240 ( -1.414 4.895 2.693) 5.763 13.193 ( 4.388 -0.033 1.652) 4.689 13.736 ( -3.448 0.737 -1.800) 3.959 16.475 ( 4.595 -1.789 -1.150) 5.063 18.029 ( -15.210 1.238 -3.270) 15.606 18.747 ( 10.361 -1.703 1.470) 10.603 19.231 ( 0.852 -1.776 -2.122) 2.895 19.571 ( 3.773 1.680 2.687) 4.927 20.159 ( -3.284 2.098 4.361) 5.849 20.168 ( -5.848 1.265 -0.290) 5.991 20.804 ( -2.902 -0.619 -4.771) 5.619 20.897 ( -9.961 -1.113 0.928) 10.066 21.352 ( -0.334 -1.020 -6.344) 6.434 22.342 ( 3.114 1.040 4.970) 5.957 23.048 ( 3.728 0.944 -2.476) 4.574 24.238 ( -1.070 2.859 -4.027) 5.054 24.363 ( -0.643 -1.974 -5.047) 5.457 24.712 ( 2.605 0.816 7.327) 7.819 24.933 ( 9.497 -6.633 4.443) 12.407 25.388 ( 1.950 -1.393 -2.541) 3.493 25.907 ( 5.068 7.803 -12.038) 15.214 26.113 ( 8.298 1.358 2.671) 8.822 26.810 ( -17.914 -2.670 0.401) 18.116 47.682 ( -9.328 -1.032 14.135) 16.968 47.853 ( -5.773 0.168 17.401) 18.335 48.867 ( 5.027 0.189 -14.250) 15.112 49.129 ( 7.693 0.135 -10.902) 13.344 98.726 ( 2.332 -2.207 5.270) 6.171 98.855 ( 1.778 -2.752 -1.473) 3.592 99.043 ( -5.866 2.773 5.819) 8.715 99.811 ( 0.139 -8.174 2.531) 8.558 100.618 ( -4.152 -0.900 5.900) 7.271 101.031 ( 2.202 1.050 -2.712) 3.648 101.099 ( -0.261 -2.107 13.269) 13.438 102.778 ( 12.885 18.662 -30.817) 38.262 ======================= Grid point 280 (138/230) ======================= q-point: (-0.22 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.389 ( 5.956 -2.223 20.189) 21.167 1.567 ( 4.151 5.357 20.230) 21.335 2.386 ( 1.120 -7.998 -3.424) 8.772 2.580 ( 4.282 0.609 8.289) 9.350 2.724 ( -6.358 -1.194 4.733) 8.015 2.947 ( -2.769 1.892 2.660) 4.280 3.004 ( -0.051 1.208 4.509) 4.668 3.283 ( -5.959 -0.700 4.214) 7.332 3.406 ( 1.720 3.550 3.372) 5.190 3.564 ( -10.384 0.186 -2.268) 10.630 3.617 ( -1.091 -2.675 1.281) 3.160 3.865 ( 6.255 -0.338 -2.730) 6.833 4.215 ( -4.494 2.855 3.787) 6.534 4.404 ( 4.259 4.098 -1.469) 6.090 4.506 ( -0.866 8.208 13.667) 15.966 4.861 ( -0.119 -5.670 3.248) 6.536 5.035 ( 2.643 -0.169 -1.334) 2.965 5.158 ( 6.387 -4.113 -9.179) 11.915 5.291 ( -4.205 0.202 -2.440) 4.866 5.653 ( 7.662 2.097 -1.497) 8.084 5.812 ( -0.731 -2.048 9.070) 9.327 6.046 ( 0.524 0.335 -2.483) 2.559 6.121 ( -4.564 -1.838 -2.212) 5.395 6.507 ( 2.316 -1.278 3.088) 4.066 6.752 ( 3.138 -4.184 -13.518) 14.494 7.098 ( 5.161 0.762 -7.522) 9.154 8.566 ( 2.625 -4.679 4.858) 7.237 8.977 ( -0.034 7.151 -5.633) 9.103 10.008 ( -0.533 -1.604 4.936) 5.217 10.097 ( -0.151 0.280 -1.165) 1.208 10.305 ( -1.720 -0.017 -2.821) 3.304 10.446 ( 0.312 3.853 -2.390) 4.544 10.904 ( 2.001 2.921 0.874) 3.647 11.094 ( -1.642 -6.597 -9.075) 11.339 11.447 ( 1.630 -8.744 4.230) 9.849 11.793 ( -2.640 0.877 -3.193) 4.234 11.862 ( -3.629 -3.004 6.021) 7.646 12.166 ( -6.009 2.772 1.765) 6.849 13.324 ( 9.321 -0.107 1.611) 9.460 13.646 ( -2.550 1.645 -4.424) 5.364 16.796 ( 27.381 -1.900 6.719) 28.258 17.481 ( -32.609 0.701 -10.902) 34.390 19.084 ( 18.162 -1.247 1.788) 18.292 19.211 ( -1.497 -0.822 -3.242) 3.665 19.674 ( 4.792 1.392 6.398) 8.114 20.028 ( -8.862 1.224 -0.108) 8.947 20.162 ( 1.281 1.468 4.162) 4.596 20.725 ( -5.573 -0.292 4.331) 7.064 20.819 ( 3.004 -0.101 -8.462) 8.980 21.337 ( 3.049 -1.510 -5.788) 6.714 22.412 ( -0.306 0.331 7.550) 7.563 23.029 ( -1.841 0.386 -3.751) 4.196 24.182 ( -0.037 1.444 -2.548) 2.929 24.329 ( 0.161 -1.209 -5.389) 5.526 24.794 ( 0.031 0.622 7.534) 7.560 25.154 ( 4.661 -9.607 1.360) 10.765 25.444 ( 6.710 -1.171 -2.271) 7.180 25.803 ( 1.853 7.558 -11.461) 13.853 26.280 ( 8.580 2.091 4.223) 9.789 26.496 ( -19.145 0.221 0.635) 19.157 47.650 ( -9.108 -0.901 13.548) 16.350 47.894 ( -6.933 -0.061 17.174) 18.521 48.837 ( 5.578 0.244 -13.564) 14.669 49.158 ( 6.959 0.126 -11.264) 13.241 98.784 ( -1.733 -0.919 2.020) 2.816 98.884 ( 1.020 -2.198 -1.521) 2.861 99.026 ( -1.570 1.285 10.318) 10.515 99.808 ( -6.662 -7.693 -3.390) 10.727 100.609 ( -2.691 -0.640 4.350) 5.154 101.053 ( 4.083 0.782 -3.048) 5.155 101.249 ( -0.495 -4.442 15.089) 15.737 102.481 ( -1.094 19.126 -25.929) 32.238 ======================= Grid point 281 (139/230) ======================= q-point: (-0.11 0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( 7.080 -8.974 20.384) 23.370 1.894 ( 18.013 2.371 16.081) 24.263 2.442 ( 2.076 -5.329 -2.777) 6.357 2.581 ( -11.048 4.570 10.407) 15.851 2.671 ( -3.181 -1.235 2.021) 3.966 2.938 ( -3.206 1.497 3.577) 5.031 3.082 ( 6.243 -9.246 -3.923) 11.826 3.262 ( -3.164 -0.130 8.209) 8.799 3.417 ( -3.584 0.815 5.328) 6.473 3.448 ( -0.002 3.481 0.964) 3.612 3.653 ( 0.542 -5.265 -1.244) 5.437 3.924 ( 3.683 0.314 -3.797) 5.299 4.126 ( -7.117 2.866 3.818) 8.570 4.401 ( -1.039 4.797 2.403) 5.465 4.601 ( 6.132 7.088 7.735) 12.152 4.773 ( -4.843 -2.308 -3.225) 6.260 5.044 ( -5.974 -0.913 -5.658) 8.279 5.162 ( -1.351 4.947 -3.044) 5.964 5.326 ( 12.493 -0.899 5.504) 13.682 5.756 ( 3.697 -0.799 0.192) 3.788 5.872 ( -1.086 -3.444 4.926) 6.108 6.024 ( -2.029 2.472 -0.661) 3.266 6.130 ( 7.845 -4.600 -9.568) 13.200 6.592 ( 3.764 -1.459 1.232) 4.221 6.726 ( 4.316 -1.609 -12.431) 13.257 7.101 ( 4.818 2.763 -8.287) 9.976 8.658 ( 0.609 -2.237 2.441) 3.366 8.886 ( 0.437 4.972 -4.328) 6.606 10.001 ( -1.091 1.617 0.186) 1.959 10.160 ( 2.753 -1.421 4.488) 5.453 10.293 ( 0.750 -3.630 0.595) 3.754 10.439 ( 1.851 -0.561 -1.256) 2.307 10.882 ( -0.755 4.661 -0.421) 4.740 10.990 ( -5.086 -4.075 -9.255) 11.319 11.549 ( -0.614 -6.411 2.662) 6.968 11.691 ( -4.971 -0.372 -4.028) 6.409 11.881 ( -3.914 -1.864 9.164) 10.138 12.047 ( -8.034 2.233 4.056) 9.272 13.519 ( 11.664 -0.547 0.077) 11.677 13.566 ( 0.130 1.567 -6.248) 6.443 16.852 ( -28.879 0.122 -9.710) 30.468 17.448 ( 36.965 -2.524 7.452) 37.793 19.144 ( -1.521 -0.347 -5.753) 5.961 19.310 ( 6.572 0.201 -0.262) 6.581 19.818 ( 4.142 0.240 4.696) 6.267 19.857 ( -7.521 1.075 -0.734) 7.633 20.258 ( 6.392 0.381 4.148) 7.629 20.712 ( -1.380 -0.928 5.899) 6.128 20.831 ( 7.767 1.042 -10.382) 13.007 21.371 ( 5.261 -1.176 -4.847) 7.249 22.457 ( -3.334 -0.386 9.954) 10.505 22.930 ( -5.642 -0.492 -4.272) 7.094 24.172 ( 1.294 0.205 -1.328) 1.866 24.292 ( 0.512 -0.115 -5.669) 5.693 24.825 ( -3.537 -0.239 6.711) 7.590 25.241 ( 0.123 -6.398 -1.490) 6.571 25.518 ( 0.479 2.752 -4.626) 5.404 25.737 ( 8.071 0.037 -8.944) 12.048 26.175 ( -16.844 0.873 2.628) 17.070 26.471 ( 8.720 2.930 5.839) 10.896 47.620 ( -8.715 -0.635 13.725) 16.270 47.910 ( -8.113 0.042 16.762) 18.622 48.823 ( 6.202 0.231 -12.607) 14.052 49.170 ( 6.195 0.038 -11.869) 13.389 98.729 ( -4.739 0.847 0.532) 4.843 98.903 ( 0.610 -1.372 -0.486) 1.578 99.118 ( 0.088 -0.190 12.464) 12.465 99.661 ( -10.627 -4.384 -5.337) 12.674 100.610 ( -1.510 -0.416 3.435) 3.775 101.106 ( 5.876 0.343 -3.366) 6.780 101.366 ( -3.836 -3.633 12.989) 14.023 102.108 ( -6.487 12.873 -15.050) 20.840 ======================= Grid point 285 (140/230) ======================= q-point: (-0.67 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.669 ( -12.347 -0.000 2.090) 12.523 1.818 ( 5.120 0.000 -14.847) 15.705 2.177 ( -17.186 -0.000 0.581) 17.196 2.560 ( -4.913 -0.000 -2.751) 5.630 2.762 ( 8.510 0.000 7.244) 11.175 2.866 ( -1.196 -0.000 -4.466) 4.623 3.189 ( 0.230 0.000 13.422) 13.424 3.190 ( 0.445 0.000 -9.646) 9.656 3.616 ( 0.693 0.000 -0.687) 0.976 3.770 ( -6.731 -0.000 -1.261) 6.848 3.860 ( 1.341 0.000 10.522) 10.607 4.016 ( 4.566 0.000 -6.797) 8.189 4.067 ( 9.871 0.000 -3.192) 10.374 4.305 ( 0.266 0.000 13.938) 13.940 4.532 ( -0.738 -0.000 -5.347) 5.398 4.548 ( -5.150 -0.000 13.055) 14.034 4.893 ( -8.844 -0.000 1.872) 9.040 5.080 ( -10.869 -0.000 -12.282) 16.401 5.298 ( -6.180 -0.000 -3.290) 7.001 5.550 ( -5.668 -0.000 18.381) 19.235 5.903 ( 5.841 0.000 -6.207) 8.523 6.037 ( 1.337 0.000 2.375) 2.725 6.350 ( 3.463 0.000 -4.235) 5.471 6.568 ( -4.788 -0.000 -1.047) 4.901 6.819 ( 7.122 0.000 -3.548) 7.957 6.959 ( 2.198 0.000 -16.931) 17.073 8.262 ( -1.498 -0.000 1.550) 2.156 9.191 ( 4.586 0.000 -4.690) 6.559 10.196 ( -2.359 -0.000 -2.788) 3.652 10.247 ( -7.863 -0.000 -0.348) 7.871 10.264 ( 2.840 0.000 10.369) 10.751 10.683 ( -5.487 -0.000 -1.171) 5.610 10.704 ( 7.678 0.000 -3.158) 8.302 10.778 ( 7.260 0.000 -8.114) 10.888 11.430 ( -3.060 -0.000 1.639) 3.471 11.743 ( 4.789 0.000 0.841) 4.863 11.891 ( -5.309 -0.000 0.941) 5.392 12.160 ( 4.391 0.000 10.227) 11.130 13.162 ( -1.738 -0.000 -3.749) 4.132 13.854 ( -3.913 -0.000 0.649) 3.967 17.024 ( -22.293 -0.000 -17.282) 28.207 17.240 ( 26.729 0.000 16.352) 31.334 19.115 ( -6.953 -0.000 -0.052) 6.953 19.145 ( 2.310 0.000 -1.810) 2.935 19.690 ( -6.921 -0.000 -6.301) 9.360 20.175 ( 7.877 0.000 -2.127) 8.159 20.308 ( -6.128 -0.000 3.553) 7.084 20.886 ( 2.821 0.000 -8.785) 9.226 21.486 ( -25.352 -0.000 4.322) 25.718 21.722 ( -13.844 -0.000 -6.617) 15.344 22.045 ( 11.340 0.000 4.940) 12.369 22.713 ( 17.556 0.000 0.795) 17.574 24.317 ( 1.512 0.000 -2.058) 2.554 24.406 ( 4.654 0.000 1.597) 4.920 24.512 ( 1.206 0.000 5.081) 5.222 24.721 ( -3.271 -0.000 -8.709) 9.303 25.361 ( 0.472 0.000 -1.013) 1.117 25.768 ( 7.150 0.000 0.381) 7.160 26.118 ( 5.675 0.000 -12.580) 13.801 27.083 ( -7.122 -0.000 8.251) 10.900 47.681 ( -7.009 -0.000 18.135) 19.443 47.807 ( -8.114 -0.000 14.100) 16.268 48.946 ( 5.130 0.000 -12.651) 13.651 49.049 ( 7.617 0.000 -12.436) 14.583 98.530 ( 0.836 0.000 4.343) 4.423 98.820 ( -0.539 -0.000 -3.454) 3.495 99.231 ( -7.149 -0.000 6.501) 9.663 99.427 ( 4.862 0.000 11.636) 12.610 100.644 ( -3.501 -0.000 5.098) 6.184 101.059 ( -7.100 -0.000 6.577) 9.678 101.093 ( -0.566 -0.000 -4.665) 4.699 102.661 ( 30.920 0.000 -17.717) 35.636 ======================= Grid point 287 (141/230) ======================= q-point: (-0.56 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.473 ( -5.807 11.945 1.998) 13.431 1.788 ( -6.568 8.447 1.657) 10.828 1.985 ( -3.057 -16.271 -3.590) 16.940 2.428 ( -7.032 -1.467 -1.694) 7.381 2.827 ( 2.178 1.807 -6.722) 7.294 3.001 ( 9.801 -1.326 7.097) 12.173 3.097 ( -4.017 2.724 -0.110) 4.854 3.298 ( 1.286 7.423 11.606) 13.837 3.578 ( -3.248 2.576 -1.058) 4.279 3.652 ( -6.559 -2.386 0.430) 6.993 3.913 ( -2.452 1.039 0.194) 2.670 3.980 ( -4.875 -0.728 -3.386) 5.980 4.187 ( 7.582 -2.434 -4.685) 9.239 4.396 ( 0.896 1.829 9.085) 9.311 4.461 ( -0.752 1.998 -2.464) 3.261 4.598 ( -5.284 -2.662 11.727) 13.135 4.857 ( -0.596 -1.296 1.473) 2.050 4.889 ( 0.214 -3.591 0.388) 3.618 5.199 ( -3.440 -1.721 -2.622) 4.655 5.642 ( -2.528 0.702 18.170) 18.358 5.894 ( 2.201 9.681 -4.366) 10.846 6.065 ( -2.460 -9.994 -2.290) 10.544 6.344 ( -0.087 1.827 -2.593) 3.173 6.482 ( -4.340 -0.004 0.027) 4.340 6.834 ( 0.404 -2.278 -17.608) 17.760 6.921 ( 7.188 -2.214 -3.947) 8.494 8.286 ( 0.679 -1.633 4.266) 4.619 9.201 ( 3.166 2.362 -6.447) 7.560 10.081 ( -5.321 5.084 0.456) 7.374 10.161 ( -4.201 -4.872 -2.693) 6.974 10.469 ( 7.931 -2.167 12.745) 15.167 10.559 ( -5.589 1.902 -3.325) 6.776 10.728 ( 4.728 9.447 -6.668) 12.493 10.868 ( 5.982 -9.329 -7.133) 13.179 11.380 ( -3.724 0.089 0.536) 3.763 11.817 ( -3.652 -1.305 1.149) 4.045 11.824 ( 3.313 -0.069 -0.477) 3.348 12.286 ( 2.192 1.842 5.887) 6.547 13.138 ( 0.788 -0.177 0.050) 0.809 13.796 ( -3.601 -0.225 0.888) 3.716 16.583 ( -13.960 -1.130 -10.894) 17.743 17.822 ( 24.679 0.016 13.177) 27.977 18.899 ( -16.409 -0.090 -4.569) 17.034 19.180 ( 2.847 -0.705 -1.579) 3.331 19.568 ( -0.818 0.626 -3.306) 3.462 20.235 ( -0.933 0.734 0.535) 1.302 20.239 ( -3.539 0.436 2.393) 4.294 20.851 ( 1.308 -0.938 -8.623) 8.772 21.121 ( -21.448 -0.389 5.141) 22.059 21.470 ( -8.090 0.066 -7.015) 10.708 22.238 ( 7.285 0.415 3.604) 8.138 22.956 ( 11.084 0.404 -1.035) 11.139 24.317 ( 0.880 0.485 -2.368) 2.572 24.416 ( -2.374 0.032 -5.365) 5.867 24.612 ( 3.887 0.644 7.248) 8.250 24.693 ( 5.031 -1.444 0.036) 5.234 25.361 ( 0.886 -0.538 -1.929) 2.189 25.918 ( 11.322 0.899 -2.451) 11.619 26.091 ( 3.696 2.062 -9.959) 10.821 26.980 ( -12.680 -1.903 5.290) 13.871 47.695 ( -8.922 -0.288 16.213) 18.508 47.814 ( -6.065 0.190 15.949) 17.064 48.910 ( 4.693 0.027 -14.321) 15.070 49.088 ( 8.159 0.020 -10.919) 13.630 98.603 ( 2.324 -0.606 5.583) 6.078 98.803 ( 0.795 -0.772 -1.984) 2.273 99.156 ( -7.021 1.081 5.438) 8.946 99.606 ( 4.065 -1.827 9.549) 10.538 100.624 ( -4.477 -0.354 6.085) 7.563 101.026 ( -4.010 0.094 8.655) 9.539 101.057 ( 0.831 0.383 -4.039) 4.142 102.951 ( 26.524 4.824 -27.706) 38.658 ======================= Grid point 288 (142/230) ======================= q-point: (-0.44 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.367 ( 1.129 14.110 6.018) 15.381 1.621 ( -9.852 6.992 14.176) 18.625 2.112 ( 3.679 -17.644 -7.289) 19.442 2.390 ( 2.386 -2.469 2.275) 4.119 2.768 ( -0.968 1.271 -7.014) 7.194 3.037 ( -4.184 2.973 8.372) 9.820 3.182 ( -0.679 4.332 8.738) 9.777 3.266 ( -2.831 2.967 0.653) 4.152 3.485 ( -6.699 1.768 1.543) 7.098 3.581 ( -4.048 -3.401 1.634) 5.534 3.813 ( -8.487 2.775 -1.224) 9.013 3.847 ( 0.128 2.787 -3.425) 4.417 4.261 ( 1.317 -1.072 0.469) 1.762 4.428 ( 3.053 4.220 -1.485) 5.417 4.568 ( 7.586 0.475 7.868) 10.940 4.594 ( -5.971 -3.697 10.968) 13.024 4.890 ( 7.124 -2.895 -4.438) 8.879 5.096 ( 6.448 -6.886 5.472) 10.906 5.157 ( 0.872 -1.175 -1.186) 1.883 5.735 ( -1.520 3.292 12.476) 12.993 5.778 ( -4.332 6.372 -1.241) 7.805 6.055 ( -2.271 -7.386 -4.816) 9.105 6.263 ( -5.180 3.903 -0.293) 6.492 6.449 ( 0.059 0.011 1.252) 1.254 6.725 ( 1.515 -4.494 -16.194) 16.874 7.023 ( 6.795 -2.207 -4.483) 8.434 8.378 ( 2.567 -2.871 6.483) 7.541 9.156 ( 1.300 4.104 -7.366) 8.532 9.993 ( -3.489 1.657 2.857) 4.804 10.110 ( -2.056 -2.755 -2.919) 4.510 10.420 ( -4.639 1.890 -4.544) 6.763 10.645 ( 1.318 9.416 -7.750) 12.266 10.750 ( 9.386 -2.179 11.251) 14.813 10.958 ( 3.352 -9.813 -7.347) 12.708 11.325 ( -3.056 -0.987 0.652) 3.277 11.793 ( -2.968 -3.137 3.762) 5.727 11.856 ( 1.175 0.788 -2.341) 2.735 12.293 ( -3.237 2.332 1.772) 4.365 13.192 ( 4.465 -0.061 1.928) 4.864 13.743 ( -3.046 0.285 -1.052) 3.235 16.453 ( 5.106 -1.113 -0.644) 5.265 18.044 ( -14.995 0.798 -3.436) 15.404 18.726 ( 10.154 -1.081 1.173) 10.278 19.211 ( 1.495 -0.975 -2.009) 2.688 19.592 ( 3.781 1.070 2.433) 4.622 20.184 ( -5.376 0.935 0.180) 5.459 20.186 ( -3.812 1.338 3.800) 5.547 20.800 ( 0.424 0.005 -7.683) 7.695 20.875 ( -12.487 -1.569 4.186) 13.263 21.341 ( -0.796 -0.490 -6.527) 6.593 22.353 ( 3.054 0.449 4.026) 5.073 23.060 ( 3.893 0.612 -3.283) 5.129 24.276 ( -1.612 2.326 -4.686) 5.475 24.335 ( -0.904 -1.917 -4.253) 4.752 24.730 ( 3.191 1.606 7.177) 8.017 24.852 ( 7.593 -4.499 3.651) 9.551 25.373 ( 2.535 -0.632 -2.473) 3.598 25.998 ( 5.320 4.525 -13.904) 15.560 26.130 ( 8.787 0.860 2.512) 9.179 26.773 ( -17.185 -2.097 2.728) 17.526 47.670 ( -9.417 -0.602 14.481) 17.284 47.856 ( -5.924 0.186 17.238) 18.228 48.869 ( 5.081 0.098 -14.291) 15.168 49.130 ( 7.686 0.031 -10.926) 13.359 98.702 ( 2.435 -1.049 5.649) 6.240 98.821 ( 1.413 -1.798 -0.676) 2.384 99.079 ( -6.057 1.952 5.848) 8.643 99.724 ( -0.129 -3.860 4.049) 5.596 100.606 ( -3.960 -0.607 5.855) 7.094 101.045 ( 2.071 0.780 -2.782) 3.555 101.079 ( -0.978 -0.878 12.189) 12.260 102.979 ( 13.498 9.045 -34.380) 38.027 ======================= Grid point 289 (143/230) ======================= q-point: (-0.33 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.423 ( 5.968 7.233 11.269) 14.660 1.651 ( 3.330 5.645 17.666) 18.843 2.215 ( 1.794 -15.273 -5.109) 16.205 2.559 ( 11.242 -2.711 -0.150) 11.566 2.677 ( -6.786 -3.126 0.259) 7.475 2.985 ( -8.714 2.676 2.313) 9.404 3.059 ( -5.967 3.908 7.171) 10.114 3.281 ( -3.261 0.290 5.173) 6.122 3.393 ( -7.001 -4.643 6.643) 10.709 3.575 ( 0.352 4.667 0.141) 4.683 3.652 ( -5.081 3.662 0.606) 6.292 3.869 ( 5.288 0.770 -3.051) 6.153 4.256 ( -2.233 2.488 1.892) 3.841 4.459 ( 5.013 3.288 -0.769) 6.044 4.559 ( -5.195 -1.787 5.218) 7.577 4.804 ( 3.303 -1.489 7.939) 8.726 5.019 ( 10.001 -1.466 -0.586) 10.125 5.127 ( 2.490 -0.046 -4.874) 5.474 5.286 ( 2.649 -0.929 -0.450) 2.843 5.666 ( 0.193 0.129 -0.697) 0.734 5.792 ( -4.192 -0.637 10.486) 11.310 6.039 ( 2.157 -0.975 -3.958) 4.612 6.145 ( -3.868 4.177 -0.616) 5.726 6.494 ( 2.353 -0.575 3.140) 3.966 6.680 ( 3.368 -5.296 -12.803) 14.259 7.100 ( 6.378 -0.382 -6.128) 8.853 8.511 ( 3.325 -2.941 7.002) 8.291 9.065 ( -0.434 4.819 -7.541) 8.960 9.987 ( -0.671 -1.106 3.780) 3.996 10.089 ( 0.261 -1.143 -1.033) 1.562 10.306 ( -3.007 0.199 -4.707) 5.589 10.527 ( -0.390 7.165 -6.078) 9.404 10.927 ( 2.590 -1.781 0.056) 3.144 10.996 ( 0.373 -4.897 -4.606) 6.733 11.344 ( 0.784 -5.174 4.827) 7.119 11.803 ( -3.041 0.201 -2.621) 4.020 11.820 ( -2.584 -2.295 5.494) 6.491 12.195 ( -7.279 1.241 0.772) 7.424 13.322 ( 8.765 -0.167 1.851) 8.960 13.666 ( -2.463 1.146 -4.020) 4.852 16.769 ( 26.356 -1.606 7.168) 27.361 17.491 ( -32.950 0.576 -11.321) 34.845 19.066 ( 19.079 -1.042 1.653) 19.179 19.200 ( -0.714 -0.690 -3.631) 3.764 19.694 ( 4.529 1.226 6.041) 7.649 20.046 ( -8.913 1.119 -0.404) 8.992 20.183 ( 0.661 1.344 4.053) 4.321 20.723 ( -6.242 0.006 4.607) 7.758 20.810 ( 4.146 -1.010 -8.711) 9.700 21.319 ( 3.080 -0.986 -5.605) 6.471 22.415 ( -0.371 0.108 6.354) 6.366 23.034 ( -2.074 0.254 -4.819) 5.253 24.202 ( -0.849 1.192 -3.261) 3.574 24.310 ( 0.274 -1.198 -4.106) 4.286 24.807 ( 0.029 1.210 6.599) 6.710 25.037 ( 5.695 -6.471 2.191) 8.894 25.428 ( 5.866 -0.919 -2.145) 6.313 25.894 ( 0.438 4.872 -12.427) 13.356 26.311 ( 9.523 1.947 3.309) 10.268 26.493 ( -17.965 -0.608 1.557) 18.043 47.637 ( -9.158 -0.733 13.940) 16.695 47.894 ( -6.917 0.078 17.197) 18.536 48.840 ( 5.632 0.179 -13.634) 14.752 49.159 ( 6.941 0.046 -11.340) 13.296 98.770 ( -0.477 -0.803 3.036) 3.177 98.854 ( 0.991 -1.844 -0.068) 2.095 99.048 ( -2.802 1.564 9.400) 9.933 99.718 ( -5.435 -4.530 -1.133) 7.165 100.599 ( -2.615 -0.603 4.535) 5.270 101.064 ( 3.834 0.667 -3.171) 5.020 101.200 ( -0.929 -2.410 15.493) 15.706 102.711 ( -1.160 12.012 -32.266) 34.449 ======================= Grid point 290 (144/230) ======================= q-point: (-0.22 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.638 ( 7.981 -2.263 13.960) 16.239 1.935 ( 16.074 3.124 14.494) 21.868 2.317 ( 2.676 -11.933 -3.846) 12.820 2.566 ( -12.352 -4.674 4.030) 13.808 2.687 ( 0.547 2.152 0.844) 2.376 2.918 ( 1.455 -5.617 -1.786) 6.071 3.009 ( -3.094 0.546 3.628) 4.799 3.273 ( -3.286 1.460 8.649) 9.366 3.394 ( -6.119 -2.899 10.781) 12.731 3.502 ( -4.014 3.089 3.616) 6.223 3.626 ( 2.633 1.610 -3.958) 5.019 3.920 ( 3.656 -0.374 -3.091) 4.802 4.188 ( -4.331 4.946 1.459) 6.734 4.460 ( -2.661 2.633 -3.225) 4.941 4.604 ( 8.766 -3.515 -2.416) 9.749 4.830 ( -3.368 6.569 12.373) 14.408 5.031 ( -6.222 -0.852 -6.658) 9.153 5.234 ( 4.244 4.836 -3.476) 7.313 5.320 ( 10.534 0.710 5.140) 11.743 5.716 ( -0.628 -4.452 0.034) 4.497 5.816 ( -1.149 -4.072 5.378) 6.843 6.073 ( -0.138 -0.602 -1.387) 1.518 6.086 ( 6.515 3.348 -6.097) 9.530 6.574 ( 3.446 -0.879 1.594) 3.897 6.691 ( 5.314 -3.208 -9.488) 11.338 7.138 ( 5.807 2.098 -7.779) 9.932 8.631 ( 2.246 -1.363 5.182) 5.809 8.954 ( -1.159 4.085 -6.837) 8.048 10.018 ( 0.575 0.509 1.720) 1.883 10.135 ( 2.683 -1.884 3.239) 4.608 10.245 ( -1.139 -2.752 -2.725) 4.037 10.447 ( 0.408 2.199 -3.826) 4.432 10.909 ( -3.389 -6.125 -7.139) 9.999 10.955 ( -1.453 4.178 -1.231) 4.591 11.459 ( 0.671 -5.573 5.777) 8.055 11.685 ( -5.847 -0.441 -4.678) 7.501 11.857 ( -2.978 -1.352 9.296) 9.855 12.066 ( -8.283 0.431 2.678) 8.716 13.510 ( 11.235 -0.661 0.526) 11.267 13.591 ( 0.028 1.649 -6.118) 6.337 16.854 ( -29.064 0.142 -10.051) 30.753 17.409 ( 35.877 -2.738 8.879) 37.061 19.139 ( -1.055 -0.363 -6.365) 6.462 19.312 ( 7.908 0.095 -0.562) 7.928 19.825 ( 3.821 0.705 4.556) 5.988 19.872 ( -7.838 0.875 -1.039) 7.955 20.264 ( 5.400 0.438 3.885) 6.667 20.700 ( -1.666 -0.740 5.611) 5.900 20.842 ( 8.518 0.465 -10.318) 13.388 21.354 ( 5.335 -1.039 -4.482) 7.045 22.451 ( -3.386 -0.445 9.069) 9.691 22.921 ( -6.065 -0.715 -5.188) 8.013 24.176 ( 0.721 0.410 -1.560) 1.767 24.287 ( 0.672 -0.492 -4.505) 4.581 24.821 ( -3.918 -0.257 5.203) 6.519 25.162 ( 3.475 -4.356 0.103) 5.573 25.529 ( 5.235 -0.772 -2.658) 5.922 25.755 ( 0.061 2.136 -11.169) 11.372 26.189 ( -16.757 1.041 2.752) 17.014 26.511 ( 9.612 2.395 4.691) 10.961 47.610 ( -8.719 -0.698 14.019) 16.524 47.911 ( -7.995 0.125 16.803) 18.609 48.827 ( 6.242 0.238 -12.682) 14.137 49.171 ( 6.151 0.008 -11.954) 13.444 98.741 ( -4.031 0.751 0.780) 4.174 98.883 ( 0.774 -1.232 0.912) 1.718 99.116 ( -0.444 -0.023 12.079) 12.088 99.602 ( -8.693 -3.442 -3.825) 10.102 100.603 ( -1.496 -0.498 3.627) 3.955 101.111 ( 5.383 0.329 -3.258) 6.300 101.318 ( -3.266 -2.951 14.668) 15.314 102.290 ( -8.702 11.226 -22.525) 26.629 ======================= Grid point 291 (145/230) ======================= q-point: (-0.11 0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.931 ( 7.486 -7.488 13.073) 16.823 2.237 ( 1.810 -2.798 -0.179) 3.337 2.403 ( -0.084 -6.819 0.812) 6.868 2.502 ( 3.832 -2.747 8.692) 9.888 2.650 ( -2.875 -0.588 4.859) 5.676 2.871 ( -6.711 0.028 -0.910) 6.772 3.076 ( 4.867 -6.131 -6.208) 9.991 3.305 ( -3.086 -1.549 12.522) 12.989 3.396 ( -6.402 0.211 10.216) 12.058 3.491 ( -0.274 -2.146 3.384) 4.016 3.610 ( 2.353 1.743 -6.494) 7.124 3.951 ( 1.665 0.121 -2.272) 2.819 4.068 ( -4.403 5.932 -0.193) 7.390 4.346 ( -3.082 -0.085 -6.559) 7.247 4.763 ( 7.041 1.455 0.898) 7.245 4.846 ( -2.536 4.582 0.979) 5.327 4.882 ( -4.717 6.062 7.724) 10.893 5.191 ( 4.566 4.081 -3.174) 6.897 5.566 ( 8.858 -1.619 6.215) 10.942 5.704 ( -4.052 -6.023 0.525) 7.278 5.875 ( 1.494 -2.710 -0.906) 3.224 6.050 ( 0.081 3.551 -0.848) 3.652 6.127 ( 6.110 -1.904 -11.920) 13.529 6.629 ( 3.675 -0.323 -3.896) 5.365 6.742 ( 6.512 0.483 -5.611) 8.609 7.136 ( 5.069 3.716 -8.967) 10.950 8.662 ( -1.846 2.441 -0.003) 3.061 8.885 ( 1.258 0.233 -3.120) 3.372 10.038 ( 1.262 3.469 3.728) 5.247 10.200 ( 1.761 -2.116 -1.623) 3.196 10.302 ( 2.075 -6.964 5.071) 8.861 10.443 ( 2.535 -2.410 -3.997) 5.312 10.809 ( -5.034 -3.031 -5.061) 7.755 10.888 ( -2.268 3.785 -0.782) 4.481 11.499 ( -3.894 -2.816 0.026) 4.806 11.578 ( -3.174 -2.171 -0.016) 3.846 11.891 ( -3.991 -0.324 10.848) 11.563 11.971 ( -6.285 0.118 5.207) 8.163 13.534 ( 1.551 1.871 -7.892) 8.258 13.700 ( 10.037 -0.719 -0.634) 10.083 16.380 ( -17.986 -0.197 -5.212) 18.727 18.061 ( 27.049 -2.407 6.166) 27.847 19.098 ( 5.524 -0.291 -8.470) 10.117 19.354 ( -0.579 1.088 -0.300) 1.268 19.649 ( -10.960 0.868 -3.855) 11.651 19.955 ( 3.160 -0.004 3.034) 4.381 20.394 ( 5.039 -1.232 1.721) 5.466 20.795 ( 7.398 -0.927 5.641) 9.349 20.903 ( 9.358 1.679 -9.875) 13.708 21.449 ( 9.148 -1.082 -2.802) 9.628 22.452 ( -7.212 -0.866 10.342) 12.638 22.759 ( -8.742 -1.531 -4.958) 10.166 24.186 ( 1.658 -0.161 -1.182) 2.043 24.267 ( 1.191 0.474 -3.796) 4.006 24.771 ( -6.718 -1.347 3.139) 7.536 25.226 ( 2.127 -0.829 -1.367) 2.661 25.459 ( -4.061 4.652 -6.694) 9.107 25.775 ( 5.751 -5.816 -5.585) 9.904 25.962 ( -10.437 0.145 1.367) 10.527 26.696 ( 8.185 3.157 7.637) 11.631 47.592 ( -8.174 -0.567 14.557) 16.705 47.909 ( -8.716 0.217 16.322) 18.504 48.832 ( 6.838 0.252 -11.660) 13.519 49.164 ( 5.426 -0.072 -12.761) 13.867 98.662 ( -4.631 1.481 0.670) 4.908 98.913 ( 0.607 -0.392 2.023) 2.148 99.211 ( -1.433 -0.726 12.325) 12.429 99.428 ( -9.173 -1.586 -4.507) 10.343 100.617 ( -0.868 -0.358 3.348) 3.477 101.182 ( 6.073 -0.212 -3.494) 7.009 101.371 ( -5.742 -1.682 11.645) 13.093 101.931 ( -7.548 5.695 -12.179) 15.419 ======================= Grid point 296 (146/230) ======================= q-point: (-0.56 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.502 ( -0.337 -0.000 7.816) 7.823 1.703 ( -10.681 -0.000 10.065) 14.676 1.923 ( 7.001 0.000 -10.891) 12.947 2.369 ( 2.440 0.000 1.944) 3.120 2.779 ( -2.009 -0.000 -7.367) 7.636 3.064 ( -3.955 -0.000 7.638) 8.601 3.192 ( 5.360 0.000 6.633) 8.528 3.308 ( -11.785 -0.000 -2.166) 11.982 3.483 ( -10.651 -0.000 0.532) 10.664 3.569 ( 1.290 0.000 6.395) 6.524 3.843 ( -8.722 -0.000 0.825) 8.761 3.868 ( 0.306 0.000 -4.631) 4.641 4.244 ( 3.399 0.000 -0.765) 3.485 4.466 ( 3.191 0.000 -3.178) 4.504 4.537 ( 0.678 0.000 12.347) 12.365 4.584 ( 0.766 0.000 3.549) 3.630 4.894 ( 3.581 0.000 3.296) 4.867 5.028 ( 11.171 0.000 4.680) 12.111 5.150 ( -0.206 -0.000 -0.990) 1.011 5.756 ( -2.886 -0.000 16.494) 16.744 5.856 ( -10.667 -0.000 -2.190) 10.889 5.975 ( 5.077 0.000 -6.437) 8.198 6.295 ( -5.242 -0.000 0.699) 5.289 6.450 ( 0.151 0.000 0.701) 0.717 6.688 ( 1.426 0.000 -16.795) 16.856 7.005 ( 7.199 0.000 -3.713) 8.100 8.357 ( 2.607 0.000 6.896) 7.372 9.186 ( 1.334 0.000 -7.994) 8.105 10.009 ( -4.785 -0.000 1.368) 4.977 10.085 ( -1.111 -0.000 -1.840) 2.149 10.435 ( -5.010 -0.000 -5.369) 7.344 10.717 ( 6.218 0.000 7.354) 9.630 10.788 ( 6.748 0.000 -7.598) 10.162 10.828 ( 1.724 0.000 -3.110) 3.556 11.319 ( -3.357 -0.000 -0.045) 3.358 11.770 ( -2.784 -0.000 4.026) 4.894 11.862 ( 1.246 0.000 -2.501) 2.794 12.309 ( -3.911 -0.000 1.523) 4.197 13.192 ( 4.479 0.000 2.025) 4.915 13.745 ( -2.913 -0.000 -0.732) 3.004 16.445 ( 5.274 0.000 -0.468) 5.295 18.050 ( -14.906 -0.000 -3.501) 15.312 18.718 ( 10.069 0.000 1.052) 10.123 19.204 ( 1.726 0.000 -2.016) 2.654 19.600 ( 3.790 0.000 2.333) 4.450 20.191 ( -5.469 -0.000 -0.453) 5.488 20.197 ( -3.739 -0.000 4.395) 5.770 20.801 ( 2.927 0.000 -9.889) 10.313 20.862 ( -14.722 -0.000 6.563) 16.118 21.337 ( -0.942 -0.000 -6.615) 6.682 22.356 ( 3.015 0.000 3.742) 4.806 23.065 ( 3.941 0.000 -3.610) 5.345 24.302 ( -3.458 -0.000 -6.195) 7.094 24.311 ( 0.615 0.000 -2.653) 2.723 24.748 ( 3.101 0.000 8.006) 8.586 24.813 ( 7.388 0.000 2.380) 7.762 25.369 ( 2.671 0.000 -2.441) 3.618 26.032 ( 5.327 0.000 -14.709) 15.644 26.136 ( 9.050 0.000 2.425) 9.369 26.756 ( -16.997 -0.000 3.767) 17.409 47.665 ( -9.444 -0.000 14.578) 17.369 47.857 ( -5.972 -0.000 17.174) 18.183 48.870 ( 5.102 0.000 -14.305) 15.188 49.130 ( 7.678 0.000 -10.917) 13.347 98.695 ( 2.482 0.000 5.879) 6.381 98.807 ( 1.280 0.000 -0.541) 1.390 99.094 ( -6.145 -0.000 5.862) 8.493 99.697 ( -0.096 -0.000 4.371) 4.372 100.602 ( -3.894 -0.000 5.839) 7.019 101.051 ( 2.318 0.000 -3.746) 4.406 101.072 ( -1.502 -0.000 12.709) 12.798 103.044 ( 13.552 0.000 -35.253) 37.768 ======================= Grid point 298 (147/230) ======================= q-point: (-0.44 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.574 ( 5.845 10.824 5.576) 13.506 1.715 ( 2.374 2.761 15.467) 15.890 1.981 ( 3.677 -14.031 -7.682) 16.413 2.523 ( 12.493 -1.589 -2.013) 12.754 2.652 ( -7.934 -0.650 -0.485) 7.975 3.019 ( -13.960 1.729 -0.772) 14.088 3.083 ( -5.440 -0.227 7.386) 9.176 3.287 ( -0.982 0.293 6.889) 6.965 3.338 ( -7.799 -1.935 5.330) 9.642 3.647 ( 2.044 3.410 3.406) 5.235 3.695 ( -8.213 1.855 0.837) 8.461 3.879 ( 4.435 0.402 -3.246) 5.511 4.279 ( 1.162 0.690 0.477) 1.433 4.481 ( -3.034 -1.148 0.259) 3.254 4.516 ( 1.789 -0.695 -1.503) 2.438 4.795 ( 5.251 -0.413 10.952) 12.153 5.014 ( 9.427 0.411 3.647) 10.116 5.137 ( -0.302 0.778 -3.237) 3.343 5.269 ( 11.799 -1.056 -0.558) 11.860 5.666 ( -7.585 -0.041 0.137) 7.587 5.790 ( -6.409 0.128 10.222) 12.066 6.028 ( 5.519 -0.405 -4.634) 7.218 6.205 ( -3.893 2.879 0.626) 4.882 6.489 ( 2.132 -0.161 3.269) 3.906 6.614 ( 3.660 -2.985 -12.838) 13.679 7.093 ( 7.110 -0.361 -4.967) 8.681 8.482 ( 3.735 -1.016 8.139) 9.013 9.113 ( -0.708 1.690 -8.590) 8.783 9.977 ( -0.917 -0.346 2.517) 2.701 10.073 ( 0.395 -0.775 -0.275) 0.913 10.309 ( -3.689 0.144 -5.958) 7.009 10.641 ( -0.050 7.373 -10.256) 12.632 10.833 ( -1.317 -7.443 -4.343) 8.717 10.981 ( 5.809 0.236 4.809) 7.545 11.296 ( -0.321 -1.542 3.763) 4.079 11.787 ( -1.537 -0.982 6.954) 7.189 11.813 ( -3.523 0.165 -3.924) 5.276 12.205 ( -8.153 0.291 0.301) 8.164 13.320 ( 8.438 -0.089 1.991) 8.670 13.678 ( -2.382 0.398 -3.636) 4.365 16.753 ( 25.773 -0.620 7.429) 26.829 17.497 ( -33.187 0.218 -11.592) 35.154 19.056 ( 19.704 -0.399 1.543) 19.768 19.193 ( -0.329 -0.269 -3.917) 3.940 19.707 ( 4.397 0.487 5.824) 7.314 20.058 ( -8.959 0.454 -0.613) 8.992 20.198 ( 0.224 0.545 4.012) 4.056 20.725 ( -8.028 0.134 6.489) 10.324 20.796 ( 6.277 -0.671 -10.397) 12.163 21.309 ( 3.122 -0.321 -5.580) 6.403 22.416 ( -0.399 0.005 5.749) 5.763 23.036 ( -2.245 0.079 -5.536) 5.975 24.215 ( -1.434 0.455 -3.671) 3.967 24.297 ( 0.407 -0.506 -3.269) 3.333 24.825 ( -0.766 0.933 6.110) 6.228 24.969 ( 7.087 -2.614 2.228) 7.876 25.419 ( 5.389 -0.337 -2.040) 5.772 25.943 ( -0.356 1.735 -12.933) 13.054 26.333 ( 10.907 0.880 2.311) 11.184 26.483 ( -18.118 -0.519 2.757) 18.334 47.630 ( -9.182 -0.275 14.135) 16.858 47.895 ( -6.914 0.055 17.169) 18.509 48.842 ( 5.669 0.064 -13.670) 14.799 49.159 ( 6.928 0.005 -11.349) 13.297 98.763 ( -0.024 -0.179 3.608) 3.613 98.834 ( 1.198 -0.826 0.801) 1.661 99.066 ( -3.485 0.729 8.747) 9.443 99.675 ( -4.732 -1.441 -0.404) 4.963 100.593 ( -2.566 -0.249 4.673) 5.337 101.071 ( 3.814 0.282 -3.572) 5.233 101.177 ( -1.388 -0.799 15.724) 15.805 102.826 ( -1.118 3.954 -34.767) 35.009 ======================= Grid point 299 (148/230) ======================= q-point: (-0.33 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.673 ( 8.326 6.878 6.481) 12.595 1.977 ( 14.457 2.428 13.086) 19.650 2.110 ( 4.800 -15.571 -6.031) 17.374 2.495 ( -12.763 -4.179 5.364) 14.461 2.718 ( 2.164 2.314 -2.699) 4.162 2.831 ( 0.140 -5.592 -3.163) 6.426 3.031 ( -6.160 1.404 5.740) 8.536 3.296 ( -3.671 1.387 8.583) 9.438 3.355 ( -4.291 -2.158 13.647) 14.467 3.530 ( -8.671 0.976 1.441) 8.844 3.676 ( 2.763 4.077 -2.377) 5.468 3.915 ( 2.168 -0.332 -2.434) 3.277 4.263 ( -1.242 5.508 -0.342) 5.657 4.439 ( -2.382 -5.163 -5.717) 8.063 4.592 ( 9.596 1.698 0.090) 9.745 4.889 ( -3.140 1.472 12.933) 13.390 5.022 ( -6.365 -0.370 -7.875) 10.132 5.277 ( 15.162 1.018 2.039) 15.333 5.379 ( 5.149 6.951 -0.366) 8.658 5.642 ( -1.189 -5.303 0.159) 5.437 5.759 ( -4.200 -3.360 5.937) 8.012 6.052 ( 0.257 -0.856 -2.228) 2.400 6.163 ( 4.270 4.902 -4.709) 8.027 6.568 ( 3.567 0.123 2.447) 4.327 6.638 ( 5.965 -3.700 -6.501) 9.568 7.160 ( 6.715 0.908 -6.880) 9.657 8.617 ( 3.229 -0.613 7.104) 7.828 9.000 ( -2.104 2.193 -8.352) 8.887 10.016 ( 1.961 -0.477 2.974) 3.594 10.109 ( 2.162 -1.583 1.891) 3.280 10.216 ( -2.210 -1.233 -4.693) 5.332 10.507 ( -0.447 5.597 -7.755) 9.575 10.805 ( -3.722 -7.542 -4.805) 9.686 11.008 ( -0.836 2.716 -1.580) 3.252 11.395 ( 1.778 -3.041 7.839) 8.594 11.680 ( -6.647 -0.220 -5.258) 8.478 11.842 ( -1.826 -0.676 9.856) 10.046 12.064 ( -8.753 -0.404 1.672) 8.920 13.501 ( 10.802 -0.472 0.858) 10.846 13.611 ( 0.081 1.030 -5.883) 5.973 16.856 ( -29.260 0.099 -10.368) 31.043 17.375 ( 35.047 -1.729 9.978) 36.481 19.134 ( -0.685 -0.222 -6.902) 6.939 19.313 ( 9.096 -0.015 -0.839) 9.135 19.836 ( 4.695 0.678 4.868) 6.797 19.881 ( -9.313 0.405 -1.754) 9.485 20.269 ( 4.441 0.292 3.770) 5.832 20.691 ( -2.151 -0.381 6.091) 6.471 20.845 ( 9.565 -0.002 -10.817) 14.439 21.343 ( 5.392 -0.526 -4.298) 6.915 22.445 ( -3.391 -0.288 8.422) 9.084 22.911 ( -6.458 -0.552 -6.015) 8.842 24.183 ( 0.470 0.411 -1.552) 1.673 24.279 ( 0.576 -0.565 -3.665) 3.752 24.818 ( -4.428 -0.145 3.863) 5.878 25.115 ( 6.274 -2.116 1.003) 6.697 25.513 ( 6.275 -1.065 -1.704) 6.589 25.785 ( -3.459 1.741 -12.259) 12.856 26.202 ( -16.595 0.651 2.757) 16.835 26.537 ( 10.218 1.187 4.198) 11.110 47.601 ( -8.721 -0.440 14.231) 16.697 47.913 ( -7.918 0.116 16.801) 18.574 48.830 ( 6.283 0.144 -12.737) 14.203 49.171 ( 6.118 -0.012 -11.993) 13.463 98.750 ( -3.362 0.404 1.114) 3.564 98.869 ( 0.944 -0.677 1.996) 2.309 99.117 ( -1.018 0.163 11.569) 11.615 99.564 ( -7.422 -1.692 -3.246) 8.276 100.597 ( -1.485 -0.340 3.814) 4.107 101.116 ( 5.234 0.247 -3.597) 6.356 101.283 ( -3.528 -1.707 15.885) 16.361 102.418 ( -9.725 6.086 -27.063) 29.394 ======================= Grid point 300 (149/230) ======================= q-point: (-0.22 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.866 ( 9.565 -0.872 7.158) 11.979 2.199 ( 0.093 -4.161 -4.758) 6.321 2.276 ( 0.737 -8.048 3.850) 8.952 2.433 ( 0.223 -6.328 8.468) 10.573 2.624 ( -4.431 -2.383 4.287) 6.610 2.854 ( -4.732 -1.936 -2.851) 5.854 3.041 ( 5.813 0.910 -2.364) 6.341 3.293 ( -4.830 -0.438 9.864) 10.991 3.400 ( -5.511 0.303 12.843) 13.979 3.443 ( -3.991 -3.485 2.879) 6.030 3.663 ( 2.394 4.302 -3.007) 5.769 3.935 ( 1.743 -1.408 -1.170) 2.528 4.169 ( -3.209 6.529 -1.374) 7.404 4.349 ( -3.039 0.365 -7.180) 7.805 4.791 ( 8.934 2.155 1.087) 9.254 4.826 ( -4.044 -1.797 -8.570) 9.645 4.980 ( 1.339 1.943 14.437) 14.629 5.305 ( 1.109 11.534 -3.942) 12.239 5.548 ( 8.740 -0.876 5.246) 10.231 5.620 ( -4.587 -5.176 0.589) 6.941 5.816 ( 2.604 -5.619 -1.932) 6.488 6.045 ( 0.005 -1.756 -2.057) 2.705 6.159 ( 5.080 3.828 -8.807) 10.864 6.638 ( 4.772 1.450 -1.022) 5.091 6.736 ( 7.088 -1.223 -3.023) 7.802 7.185 ( 5.730 2.793 -8.794) 10.861 8.695 ( 0.249 1.988 3.151) 3.734 8.889 ( -1.320 0.260 -6.292) 6.434 10.084 ( 3.105 2.387 3.684) 5.377 10.168 ( 0.074 -2.142 -2.409) 3.224 10.210 ( 2.048 -5.285 4.205) 7.057 10.428 ( 1.183 0.909 -6.174) 6.352 10.745 ( -4.574 -5.520 -3.024) 7.781 10.939 ( -2.626 2.910 -1.977) 4.390 11.470 ( -2.621 -1.023 2.607) 3.835 11.543 ( -3.996 -2.472 -1.413) 4.906 11.891 ( -3.274 0.351 11.136) 11.613 11.963 ( -6.445 -1.081 4.250) 7.796 13.561 ( 1.749 1.648 -7.829) 8.189 13.689 ( 9.972 -0.698 -0.243) 10.000 16.377 ( -18.064 -0.183 -5.457) 18.871 18.028 ( 27.349 -2.050 7.655) 28.474 19.094 ( 5.762 -0.226 -8.857) 10.568 19.369 ( 0.012 0.880 -0.711) 1.131 19.662 ( -11.026 0.859 -3.983) 11.755 19.954 ( 2.979 -0.107 2.746) 4.052 20.377 ( 3.691 -1.028 1.541) 4.130 20.785 ( 7.385 -0.542 6.345) 9.751 20.923 ( 10.449 1.034 -10.765) 15.038 21.435 ( 8.844 -0.787 -2.484) 9.220 22.441 ( -7.213 -0.665 9.933) 12.293 22.736 ( -9.056 -1.511 -5.472) 10.688 24.189 ( 1.628 0.547 -0.813) 1.900 24.267 ( 1.155 -0.403 -3.168) 3.396 24.753 ( -6.490 -1.044 1.982) 6.866 25.223 ( 4.967 0.211 -0.601) 5.008 25.520 ( -3.546 3.731 -7.367) 8.987 25.690 ( 3.735 -5.502 -5.780) 8.811 25.969 ( -12.332 0.632 2.207) 12.544 26.735 ( 8.848 2.100 6.856) 11.388 47.584 ( -8.170 -0.497 14.724) 16.846 47.912 ( -8.642 0.213 16.299) 18.450 48.836 ( 6.870 0.212 -11.716) 13.583 49.163 ( 5.375 -0.072 -12.798) 13.881 98.683 ( -4.255 1.251 0.655) 4.483 98.909 ( 0.823 -0.169 3.008) 3.123 99.201 ( -1.627 -0.586 11.907) 12.032 99.408 ( -7.945 -1.057 -4.219) 9.058 100.611 ( -0.840 -0.331 3.521) 3.635 101.180 ( 5.843 -0.020 -3.657) 6.893 101.343 ( -5.810 -1.964 13.491) 14.820 102.010 ( -10.193 4.644 -16.901) 20.276 ======================= Grid point 301 (150/230) ======================= q-point: (-0.11 0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.029 ( -9.320 -2.187 -1.684) 9.720 2.118 ( 3.530 -6.795 3.869) 8.579 2.350 ( -2.383 -7.191 4.955) 9.052 2.450 ( -7.348 -8.817 4.987) 12.514 2.718 ( -7.620 -0.736 -3.164) 8.283 2.774 ( 7.645 -8.545 -8.094) 14.035 3.141 ( 9.455 1.815 3.318) 10.183 3.296 ( -6.865 0.930 10.290) 12.405 3.395 ( -4.597 -0.962 9.820) 10.886 3.481 ( 1.808 -4.060 2.335) 5.020 3.656 ( 1.395 3.522 0.813) 3.874 3.918 ( -4.019 1.642 -3.627) 5.658 4.088 ( 1.870 4.855 0.151) 5.205 4.258 ( -0.747 0.093 -4.499) 4.562 4.675 ( -4.312 -4.290 -8.140) 10.162 4.901 ( 1.675 6.204 4.957) 8.116 5.031 ( -4.842 13.811 8.953) 17.157 5.326 ( 10.028 -1.645 -0.600) 10.179 5.609 ( -0.803 -5.372 -0.438) 5.449 5.679 ( 1.355 -2.335 3.440) 4.372 5.855 ( 2.747 -3.223 -9.133) 10.067 6.024 ( -1.391 1.384 -1.190) 2.294 6.135 ( 4.921 2.152 -9.293) 10.734 6.693 ( 5.318 3.790 -1.549) 6.711 6.815 ( 5.960 1.802 -5.057) 8.021 7.167 ( 4.928 3.759 -10.430) 12.133 8.626 ( -3.911 5.358 -2.992) 7.277 8.883 ( 2.020 -3.811 -1.110) 4.454 10.141 ( 2.381 1.691 1.817) 3.439 10.172 ( -1.929 -1.024 3.972) 4.533 10.340 ( 3.842 -6.105 3.347) 7.952 10.425 ( 3.520 -3.649 -6.559) 8.291 10.696 ( -2.910 -3.159 -0.191) 4.299 10.846 ( -4.076 2.602 -1.824) 5.169 11.398 ( -2.837 -2.215 -2.370) 4.309 11.560 ( -0.892 -1.580 4.653) 4.994 11.918 ( -4.397 0.391 11.115) 11.959 11.930 ( -3.598 -0.751 5.977) 7.016 13.500 ( 1.159 2.197 -9.523) 9.841 13.832 ( 6.702 -0.450 -0.683) 6.752 16.180 ( -3.306 -0.341 1.913) 3.835 18.306 ( 1.253 -0.332 -4.506) 4.688 19.242 ( 12.893 0.293 -3.245) 13.298 19.325 ( -2.867 1.164 -0.673) 3.166 19.475 ( -0.467 0.202 -4.796) 4.823 19.984 ( -1.476 -0.470 1.420) 2.102 20.413 ( -0.993 -2.488 -0.414) 2.710 20.973 ( 9.344 2.610 -11.011) 14.675 21.058 ( 14.356 -0.966 7.185) 16.083 21.630 ( 14.930 -1.318 -0.294) 14.991 22.365 ( -12.585 -1.008 9.391) 15.735 22.535 ( -11.047 -1.993 -4.846) 12.227 24.211 ( 2.309 0.651 -1.002) 2.600 24.272 ( 1.729 0.225 -1.652) 2.402 24.655 ( -7.033 -1.271 0.497) 7.165 25.222 ( -1.908 3.231 -7.648) 8.519 25.385 ( -0.363 1.983 -2.630) 3.314 25.737 ( -4.031 -2.434 1.115) 4.839 25.860 ( 1.657 -5.030 -4.330) 6.841 26.918 ( 6.844 3.127 8.820) 11.593 47.583 ( -7.565 -0.489 15.557) 17.306 47.896 ( -9.056 0.274 15.685) 18.113 48.859 ( 7.351 0.247 -10.772) 13.043 49.137 ( 4.817 -0.156 -13.702) 14.525 98.608 ( -3.855 1.788 1.006) 4.367 98.947 ( 0.620 0.305 2.615) 2.705 99.256 ( -5.970 -0.237 -0.170) 5.977 99.265 ( -3.745 -0.938 8.928) 9.727 100.631 ( -0.676 -0.198 3.536) 3.606 101.231 ( 2.133 -0.226 -2.306) 3.149 101.341 ( -6.423 -0.911 7.141) 9.648 101.771 ( -2.127 -0.751 -7.684) 8.008 ======================= Grid point 307 (151/230) ======================= q-point: ( 0.56 -0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.778 ( 7.814 0.000 4.307) 8.923 1.940 ( 6.370 0.000 -7.917) 10.161 1.997 ( 13.935 0.000 12.489) 18.713 2.462 ( -13.260 -0.000 5.920) 14.522 2.759 ( 16.106 0.000 -7.522) 17.776 2.764 ( -14.300 -0.000 0.875) 14.326 3.041 ( -6.589 -0.000 5.950) 8.878 3.308 ( -4.325 -0.000 8.393) 9.442 3.337 ( -2.763 -0.000 14.289) 14.553 3.536 ( -10.099 -0.000 -0.106) 10.100 3.711 ( 2.127 0.000 -1.478) 2.590 3.911 ( 1.255 0.000 -1.718) 2.128 4.342 ( 4.615 0.000 -1.389) 4.819 4.358 ( -4.831 -0.000 -4.434) 6.558 4.610 ( 8.579 0.000 -0.174) 8.581 4.895 ( -3.483 -0.000 12.640) 13.111 5.019 ( -6.359 -0.000 -8.416) 10.548 5.283 ( 15.703 0.000 3.579) 16.106 5.454 ( 10.081 0.000 -3.797) 10.773 5.586 ( -2.977 -0.000 2.073) 3.628 5.733 ( -7.203 -0.000 6.211) 9.511 6.046 ( -0.446 -0.000 -1.803) 1.857 6.203 ( 3.923 0.000 -5.636) 6.867 6.575 ( 3.720 0.000 5.263) 6.445 6.601 ( 6.325 0.000 -7.257) 9.627 7.166 ( 7.087 0.000 -6.460) 9.590 8.613 ( 3.577 0.000 7.814) 8.594 9.016 ( -2.439 -0.000 -8.847) 9.177 10.012 ( 2.385 0.000 3.132) 3.937 10.096 ( 1.852 0.000 1.542) 2.410 10.207 ( -2.482 -0.000 -5.318) 5.869 10.569 ( 0.049 0.000 -12.313) 12.313 10.729 ( -4.418 -0.000 -0.753) 4.482 11.028 ( -0.833 -0.000 -1.935) 2.107 11.373 ( 2.240 0.000 8.596) 8.883 11.678 ( -6.976 -0.000 -5.479) 8.870 11.837 ( -1.282 -0.000 10.156) 10.237 12.060 ( -9.009 -0.000 1.271) 9.099 13.498 ( 10.629 0.000 0.988) 10.675 13.619 ( 0.123 0.000 -5.779) 5.780 16.856 ( -29.350 -0.000 -10.500) 31.172 17.362 ( 34.753 0.000 10.383) 36.271 19.133 ( -0.549 -0.000 -7.114) 7.135 19.313 ( 9.568 0.000 -0.951) 9.615 19.841 ( 5.472 0.000 5.164) 7.524 19.884 ( -10.336 -0.000 -2.213) 10.570 20.272 ( 4.040 0.000 3.753) 5.514 20.689 ( -2.379 -0.000 6.399) 6.827 20.844 ( 10.050 0.000 -11.098) 14.972 21.339 ( 5.418 0.000 -4.253) 6.888 22.443 ( -3.383 -0.000 8.197) 8.868 22.907 ( -6.619 -0.000 -6.347) 9.170 24.186 ( 0.454 0.000 -1.491) 1.559 24.274 ( 0.461 0.000 -3.390) 3.422 24.817 ( -4.675 -0.000 3.345) 5.748 25.100 ( 7.360 0.000 1.258) 7.467 25.504 ( 6.195 0.000 -1.437) 6.360 25.799 ( -4.298 -0.000 -12.570) 13.284 26.207 ( -16.512 -0.000 2.750) 16.739 26.546 ( 10.431 0.000 4.094) 11.205 47.598 ( -8.722 -0.000 14.304) 16.753 47.914 ( -7.892 -0.000 16.794) 18.556 48.831 ( 6.300 0.000 -12.757) 14.228 49.171 ( 6.106 0.000 -12.001) 13.465 98.753 ( -3.118 -0.000 1.249) 3.358 98.864 ( 1.050 0.000 2.425) 2.642 99.119 ( -1.274 -0.000 11.307) 11.378 99.552 ( -6.995 -0.000 -3.127) 7.662 100.594 ( -1.481 -0.000 3.894) 4.166 101.118 ( 5.274 0.000 -3.893) 6.555 101.270 ( -3.786 -0.000 16.433) 16.863 102.462 ( -9.992 -0.000 -28.512) 30.212 ======================= Grid point 309 (152/230) ======================= q-point: (-0.33 0.56 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.911 ( 9.576 6.760 1.447) 11.810 2.058 ( 7.302 -11.460 -6.201) 14.937 2.258 ( -3.649 3.030 5.310) 7.120 2.335 ( -6.366 -6.459 9.070) 12.826 2.595 ( -3.751 -1.185 5.369) 6.656 2.834 ( -2.390 -0.644 -5.084) 5.655 3.067 ( 7.146 1.607 0.211) 7.327 3.283 ( -6.102 -0.712 6.529) 8.965 3.401 ( -4.950 -0.330 6.586) 8.246 3.409 ( -6.102 -0.778 12.183) 13.648 3.712 ( 1.601 1.982 -3.091) 4.006 3.919 ( 1.307 -0.651 -0.441) 1.525 4.239 ( -3.168 2.680 -3.544) 5.457 4.354 ( -1.745 0.230 -3.368) 3.800 4.792 ( -6.656 -0.915 -10.849) 12.761 4.838 ( 16.313 1.907 0.240) 16.426 4.971 ( -2.085 -1.518 12.961) 13.215 5.472 ( 0.418 9.177 -2.932) 9.643 5.540 ( 6.319 -1.111 3.838) 7.476 5.568 ( 0.849 -0.622 -1.007) 1.457 5.717 ( 0.013 -6.807 0.225) 6.811 6.029 ( 0.363 -0.435 -0.648) 0.861 6.200 ( 4.163 1.497 -10.259) 11.172 6.669 ( 6.253 2.655 0.321) 6.801 6.708 ( 6.892 -2.503 -0.209) 7.336 7.213 ( 6.213 0.991 -8.546) 10.612 8.716 ( 1.626 0.756 5.353) 5.645 8.892 ( -2.976 0.113 -8.315) 8.832 10.104 ( 4.624 0.583 4.077) 6.192 10.139 ( -2.290 -1.536 -1.805) 3.296 10.161 ( 3.274 -1.424 1.757) 3.979 10.464 ( 0.670 2.894 -9.517) 9.970 10.665 ( -5.093 -4.309 0.515) 6.691 10.968 ( -2.794 1.030 -2.866) 4.133 11.466 ( -0.319 0.199 6.436) 6.447 11.512 ( -6.021 -1.375 -4.631) 7.719 11.900 ( -2.725 0.616 11.652) 11.982 11.945 ( -6.611 -1.016 3.430) 7.516 13.579 ( 1.897 0.662 -7.761) 8.017 13.681 ( 9.926 -0.302 -0.008) 9.930 16.375 ( -18.116 -0.075 -5.620) 18.968 18.006 ( 27.530 -0.795 8.573) 28.845 19.092 ( 5.938 -0.082 -9.115) 10.879 19.378 ( 0.433 0.328 -1.002) 1.140 19.671 ( -11.085 0.367 -4.107) 11.827 19.952 ( 2.850 -0.071 2.595) 3.855 20.366 ( 2.833 -0.392 1.550) 3.252 20.780 ( 7.283 -0.173 6.802) 9.967 20.933 ( 11.248 0.323 -11.355) 15.986 21.427 ( 8.644 -0.266 -2.339) 8.959 22.434 ( -7.197 -0.235 9.714) 12.092 22.719 ( -9.277 -0.642 -5.814) 10.967 24.198 ( 1.849 0.502 -0.371) 1.952 24.259 ( 0.905 -0.480 -2.970) 3.142 24.742 ( -6.310 -0.370 1.332) 6.460 25.227 ( 6.845 0.220 -0.543) 6.870 25.569 ( -1.341 3.212 -6.417) 7.301 25.621 ( -0.106 -3.968 -6.794) 7.869 25.977 ( -12.879 0.296 2.387) 13.101 26.756 ( 9.173 0.702 6.551) 11.294 47.579 ( -8.167 -0.195 14.820) 16.922 47.915 ( -8.602 0.089 16.280) 18.413 48.838 ( 6.893 0.082 -11.751) 13.624 49.162 ( 5.343 -0.030 -12.813) 13.883 98.696 ( -3.989 0.478 0.689) 4.076 98.908 ( 0.964 -0.020 3.607) 3.734 99.195 ( -1.797 -0.209 11.574) 11.715 99.398 ( -7.280 -0.357 -4.172) 8.398 100.608 ( -0.824 -0.135 3.647) 3.742 101.181 ( 6.215 0.069 -4.490) 7.668 101.321 ( -6.659 -0.906 15.279) 16.692 102.057 ( -11.465 1.734 -19.541) 22.722 ======================= Grid point 310 (153/230) ======================= q-point: (-0.22 -0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.014 ( -15.960 -0.442 -3.126) 16.269 2.058 ( 10.201 -0.604 -1.736) 10.365 2.229 ( -5.563 -7.534 10.759) 14.264 2.314 ( -3.733 -9.823 5.233) 11.739 2.690 ( 3.087 -3.017 -7.219) 8.411 2.704 ( -7.596 -1.032 -3.610) 8.473 3.177 ( 8.753 2.830 1.061) 9.260 3.312 ( -0.644 0.205 10.873) 10.894 3.378 ( -6.504 -0.936 8.021) 10.369 3.432 ( -0.593 -2.338 8.001) 8.357 3.697 ( 1.107 1.954 -2.016) 3.018 3.923 ( -3.855 -0.241 -0.147) 3.866 4.158 ( -0.698 3.500 -1.079) 3.729 4.279 ( -0.283 2.777 -3.013) 4.107 4.613 ( -4.383 -3.932 -10.575) 12.104 4.978 ( -0.072 4.671 10.428) 11.427 5.166 ( 6.919 2.237 3.847) 8.226 5.350 ( 0.211 6.502 -4.203) 7.745 5.533 ( -0.742 -4.831 -0.434) 4.907 5.657 ( 0.460 -0.589 1.211) 1.423 5.791 ( 5.479 -5.141 -7.306) 10.479 6.039 ( 0.948 0.697 -2.483) 2.747 6.170 ( 4.141 2.132 -7.001) 8.409 6.753 ( 6.360 4.038 -0.451) 7.547 6.828 ( 7.100 -0.159 -3.052) 7.730 7.212 ( 4.781 2.216 -10.679) 11.909 8.703 ( -2.841 4.983 -2.497) 6.256 8.826 ( 0.118 -3.905 -2.004) 4.390 10.097 ( -3.557 -3.262 -0.163) 4.829 10.223 ( 4.901 3.258 5.858) 8.304 10.264 ( 4.015 -3.868 3.329) 6.494 10.401 ( 2.128 0.637 -7.640) 7.956 10.633 ( -3.381 -5.045 1.668) 6.298 10.877 ( -4.071 1.523 -2.770) 5.154 11.378 ( -3.237 -0.639 -3.339) 4.694 11.537 ( -0.441 -1.367 5.636) 5.817 11.900 ( -3.009 -1.285 5.151) 6.102 11.941 ( -4.695 0.790 11.549) 12.492 13.528 ( 1.454 1.470 -9.566) 9.787 13.826 ( 6.920 -0.350 -0.494) 6.947 16.176 ( -3.278 -0.231 1.795) 3.744 18.302 ( 2.667 -0.210 -3.729) 4.589 19.246 ( 14.446 0.189 -3.168) 14.790 19.340 ( -2.735 0.732 -1.121) 3.045 19.479 ( -1.927 0.221 -4.927) 5.295 19.978 ( -1.690 -0.373 1.169) 2.088 20.383 ( -1.581 -1.483 -0.431) 2.210 21.005 ( 10.155 1.682 -10.722) 14.863 21.045 ( 14.214 -0.760 6.652) 15.711 21.614 ( 14.445 -0.788 0.062) 14.467 22.353 ( -12.656 -0.542 9.301) 15.716 22.509 ( -11.077 -1.451 -4.907) 12.202 24.225 ( 2.455 1.291 -0.552) 2.828 24.268 ( 1.779 -0.777 -1.388) 2.387 24.640 ( -6.628 -0.722 -0.043) 6.668 25.267 ( -0.772 2.674 -8.533) 8.975 25.408 ( -0.637 1.186 -3.928) 4.152 25.684 ( 1.861 -3.923 -0.882) 4.431 25.820 ( -6.152 -1.074 0.043) 6.245 26.953 ( 7.525 1.676 8.242) 11.285 47.577 ( -7.572 -0.322 15.645) 17.384 47.900 ( -9.026 0.187 15.652) 18.069 48.862 ( 7.366 0.157 -10.808) 13.080 49.135 ( 4.763 -0.104 -13.709) 14.513 98.631 ( -3.605 1.176 0.947) 3.908 98.952 ( 0.688 0.302 2.859) 2.956 99.248 ( -3.796 -0.643 9.499) 10.249 99.258 ( -5.377 -0.130 -0.835) 5.443 100.629 ( -0.591 -0.131 3.696) 3.746 101.232 ( 3.295 0.391 -3.953) 5.160 101.320 ( -7.463 -1.700 10.432) 12.939 101.765 ( -5.606 -0.107 -10.304) 11.731 ======================= Grid point 311 (154/230) ======================= q-point: (-0.11 -0.44 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.676 ( -20.688 -7.308 -6.127) 22.780 2.165 ( -5.246 -1.436 7.160) 8.992 2.278 ( 0.190 -9.439 7.692) 12.178 2.455 ( 5.181 -3.103 4.469) 7.513 2.571 ( -4.341 -2.562 -2.231) 5.513 2.626 ( -1.163 -9.276 -14.629) 17.361 3.184 ( -11.292 1.903 7.497) 13.687 3.339 ( 1.339 1.036 0.399) 1.739 3.455 ( 0.149 1.460 8.651) 8.774 3.564 ( 4.169 -4.342 6.053) 8.536 3.724 ( 6.643 1.688 2.435) 7.274 3.780 ( -9.304 -1.327 -2.092) 9.628 4.146 ( 0.799 2.082 0.703) 2.338 4.274 ( 3.661 3.762 -1.087) 5.360 4.540 ( 0.052 -4.575 -4.812) 6.640 4.994 ( -0.932 11.159 0.504) 11.209 5.058 ( -7.769 6.667 6.259) 11.999 5.365 ( -3.406 -3.997 1.718) 5.525 5.603 ( 2.215 -8.015 -4.879) 9.641 5.640 ( -0.987 -0.182 -3.663) 3.798 5.795 ( -0.119 1.278 -7.070) 7.186 6.024 ( 6.410 -0.737 -9.473) 11.462 6.212 ( 4.605 5.194 3.417) 7.737 6.812 ( 6.257 5.448 -4.098) 9.253 6.885 ( 5.197 3.901 -4.173) 7.723 7.175 ( 4.894 2.119 -12.400) 13.498 8.572 ( -3.348 6.274 -4.111) 8.215 8.874 ( 1.701 -6.181 -0.113) 6.412 10.052 ( -5.995 -5.498 1.293) 8.237 10.305 ( 3.155 7.906 6.542) 10.736 10.385 ( 3.585 -3.378 -2.852) 5.692 10.411 ( 3.112 -6.168 -0.144) 6.910 10.661 ( 0.550 -2.903 1.673) 3.396 10.765 ( -3.975 0.957 -3.080) 5.118 11.355 ( 0.561 -1.945 0.570) 2.103 11.587 ( 0.584 -1.083 4.344) 4.514 11.928 ( -1.779 -1.215 6.379) 6.733 11.942 ( -4.312 0.669 9.887) 10.807 13.437 ( -0.536 2.243 -10.558) 10.807 13.908 ( 2.957 0.001 -0.483) 2.997 16.296 ( 11.000 -0.275 9.551) 14.571 18.112 ( -12.004 1.845 -15.445) 19.648 19.235 ( -3.730 1.173 -1.967) 4.377 19.271 ( -3.289 0.760 -1.093) 3.548 19.714 ( 21.376 -0.165 -1.903) 21.462 19.928 ( -4.807 -0.921 -0.799) 4.959 20.347 ( -3.838 -2.564 0.096) 4.617 21.034 ( 6.993 3.083 -10.804) 13.234 21.381 ( 16.033 -1.221 7.426) 17.712 21.925 ( 19.274 -1.218 2.258) 19.444 22.164 ( -18.270 -1.093 7.333) 19.717 22.277 ( -12.987 -1.693 -4.600) 13.881 24.260 ( 3.116 1.145 0.131) 3.323 24.295 ( 1.801 0.198 -0.608) 1.912 24.538 ( -5.391 -0.972 -0.585) 5.509 25.076 ( -6.089 1.643 -11.145) 12.805 25.428 ( 3.630 2.896 -1.363) 4.840 25.667 ( -4.493 -0.383 3.368) 5.629 25.832 ( 4.838 -7.102 -6.101) 10.539 27.117 ( 5.079 3.066 8.375) 10.264 47.594 ( -6.960 -0.400 16.736) 18.130 47.874 ( -9.217 0.252 14.939) 17.555 48.900 ( 7.606 0.204 -10.060) 12.613 49.094 ( 4.544 -0.213 -14.548) 15.243 98.578 ( -2.505 1.821 1.660) 3.514 98.951 ( -1.029 0.295 -2.650) 2.858 99.205 ( -1.607 1.090 6.072) 6.375 99.272 ( -4.523 -1.427 9.471) 10.592 100.650 ( -0.839 0.083 3.937) 4.026 101.203 ( -3.062 0.120 -1.603) 3.458 101.255 ( -8.202 -0.509 3.743) 9.030 101.745 ( 7.745 -6.245 -4.455) 10.901 ======================= Grid point 318 (155/230) ======================= q-point: (-0.33 -0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.011 ( -15.775 -0.000 -3.960) 16.264 2.070 ( 10.304 0.000 -9.748) 14.185 2.188 ( -14.614 -0.000 19.849) 24.649 2.203 ( 5.121 0.000 4.350) 6.719 2.671 ( 2.340 0.000 -6.739) 7.134 2.696 ( -8.134 -0.000 -3.270) 8.767 3.205 ( 7.526 0.000 -1.956) 7.776 3.302 ( 5.352 0.000 9.174) 10.621 3.377 ( -11.018 -0.000 12.110) 16.372 3.414 ( -0.962 -0.000 9.056) 9.107 3.711 ( 1.121 0.000 -3.668) 3.835 3.921 ( -3.625 -0.000 0.792) 3.710 4.182 ( -1.490 -0.000 -1.506) 2.119 4.309 ( -0.586 -0.000 -0.320) 0.668 4.579 ( -4.290 -0.000 -12.820) 13.519 5.020 ( -3.523 -0.000 13.707) 14.152 5.161 ( 15.585 0.000 -0.047) 15.586 5.438 ( -5.666 -0.000 -4.642) 7.325 5.478 ( -1.737 -0.000 -0.676) 1.864 5.658 ( 0.091 0.000 -3.778) 3.779 5.740 ( 8.181 0.000 -1.862) 8.390 6.044 ( 1.382 0.000 -3.452) 3.718 6.187 ( 4.479 0.000 -6.007) 7.493 6.794 ( 6.446 0.000 -2.096) 6.778 6.817 ( 7.904 0.000 -0.331) 7.911 7.229 ( 4.689 0.000 -10.771) 11.747 8.768 ( -0.356 -0.000 3.430) 3.449 8.769 ( -2.694 -0.000 -8.052) 8.491 10.071 ( -4.289 -0.000 0.276) 4.298 10.234 ( 3.932 0.000 2.399) 4.607 10.246 ( 6.631 0.000 4.799) 8.185 10.421 ( 2.125 0.000 -7.891) 8.172 10.583 ( -4.731 -0.000 3.652) 5.977 10.888 ( -4.010 -0.000 -3.090) 5.062 11.374 ( -3.392 -0.000 -3.888) 5.159 11.526 ( -0.255 -0.000 6.153) 6.159 11.890 ( -2.934 -0.000 4.283) 5.192 11.947 ( -4.649 -0.000 12.274) 13.125 13.539 ( 1.574 0.000 -9.582) 9.711 13.824 ( 7.009 0.000 -0.418) 7.022 16.174 ( -3.267 -0.000 1.747) 3.705 18.300 ( 3.224 0.000 -3.410) 4.693 19.247 ( 15.048 0.000 -3.156) 15.375 19.345 ( -2.674 -0.000 -1.308) 2.976 19.481 ( -2.480 -0.000 -4.984) 5.567 19.975 ( -1.774 -0.000 1.071) 2.072 20.372 ( -1.816 -0.000 -0.398) 1.859 21.018 ( 9.898 0.000 -11.638) 15.277 21.038 ( 14.742 0.000 7.446) 16.516 21.608 ( 14.252 0.000 0.191) 14.253 22.349 ( -12.696 -0.000 9.328) 15.754 22.497 ( -11.092 -0.000 -4.972) 12.155 24.241 ( 2.790 0.000 0.012) 2.790 24.256 ( 1.543 0.000 -1.672) 2.275 24.635 ( -6.496 -0.000 -0.253) 6.500 25.288 ( -0.160 -0.000 -9.225) 9.227 25.417 ( -0.839 -0.000 -4.486) 4.563 25.651 ( 2.963 0.000 -0.669) 3.038 25.814 ( -8.045 -0.000 1.092) 8.119 26.966 ( 7.769 0.000 8.071) 11.202 47.574 ( -7.575 -0.000 15.677) 17.411 47.901 ( -9.015 -0.000 15.640) 18.052 48.864 ( 7.371 0.000 -10.822) 13.094 49.134 ( 4.741 0.000 -13.710) 14.506 98.640 ( -3.500 -0.000 0.940) 3.624 98.954 ( 0.720 0.000 2.936) 3.023 99.243 ( -3.590 -0.000 10.439) 11.039 99.257 ( -5.401 -0.000 -1.832) 5.704 100.628 ( -0.555 -0.000 3.765) 3.806 101.237 ( 5.163 0.000 -6.692) 8.452 101.304 ( -9.412 -0.000 13.895) 16.783 101.765 ( -6.848 -0.000 -11.382) 13.283 ======================= Grid point 319 (156/230) ======================= q-point: (-0.22 -0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.602 ( -24.749 -2.682 -5.101) 25.411 2.138 ( -16.100 -2.652 25.239) 30.054 2.189 ( 12.187 -1.336 -8.664) 15.012 2.398 ( 9.179 -3.887 2.287) 10.227 2.536 ( -6.014 -0.813 -4.458) 7.530 2.561 ( -3.787 -1.583 -8.914) 9.814 3.210 ( -11.948 1.214 8.491) 14.708 3.346 ( 4.028 0.188 0.014) 4.033 3.470 ( -0.417 0.486 8.460) 8.484 3.512 ( 2.399 -2.168 4.938) 5.902 3.741 ( 8.378 0.625 -0.534) 8.418 3.768 ( -13.165 -0.389 -0.053) 13.171 4.167 ( -0.110 0.743 1.270) 1.475 4.336 ( 3.513 3.766 1.265) 5.303 4.476 ( 1.754 -3.625 -6.835) 7.933 5.065 ( -3.555 1.730 11.884) 12.524 5.211 ( -5.218 10.299 -5.108) 12.625 5.312 ( -4.475 -3.961 -0.061) 5.976 5.481 ( 0.911 -6.467 -5.375) 8.458 5.652 ( 2.530 0.633 -5.062) 5.695 5.805 ( 2.053 0.199 -4.195) 4.675 6.006 ( 4.793 -0.899 -12.304) 13.235 6.277 ( 5.199 2.636 5.659) 8.124 6.873 ( 8.995 2.447 -7.256) 11.813 6.926 ( 5.923 1.545 -1.558) 6.316 7.193 ( 3.584 0.476 -12.543) 13.054 8.654 ( -1.657 4.286 -6.003) 7.559 8.793 ( -0.597 -4.215 1.445) 4.495 9.995 ( -6.632 -2.155 1.971) 7.247 10.330 ( 2.656 -2.434 3.935) 5.336 10.359 ( 4.394 -1.148 -5.383) 7.043 10.427 ( 3.816 6.909 4.828) 9.252 10.588 ( 0.597 -5.739 3.294) 6.644 10.780 ( -5.004 0.691 -3.592) 6.198 11.338 ( 0.637 -0.484 0.433) 0.910 11.574 ( 0.595 -0.549 4.391) 4.465 11.912 ( 0.327 -0.646 4.557) 4.614 11.951 ( -6.349 0.370 11.364) 13.023 13.461 ( -0.307 0.909 -10.749) 10.791 13.907 ( 3.245 -0.019 -0.451) 3.276 16.293 ( 11.067 -0.113 9.528) 14.604 18.132 ( -10.633 0.752 -15.518) 18.826 19.247 ( -3.704 0.482 -1.721) 4.113 19.279 ( -3.268 0.290 -1.547) 3.628 19.713 ( 21.829 -0.035 -1.994) 21.920 19.918 ( -5.046 -0.391 -0.949) 5.149 20.321 ( -4.079 -0.962 0.171) 4.195 21.066 ( 7.735 1.182 -11.025) 13.520 21.368 ( 15.625 -0.505 7.525) 17.350 21.913 ( 19.543 -0.427 2.693) 19.732 22.153 ( -18.992 -0.392 7.506) 20.425 22.258 ( -12.780 -0.759 -4.546) 13.585 24.277 ( 2.420 0.967 0.214) 2.615 24.293 ( 2.635 -0.403 -0.267) 2.679 24.527 ( -5.312 -0.410 -1.014) 5.423 25.094 ( -6.907 0.680 -11.946) 13.816 25.463 ( 5.625 1.540 -2.500) 6.346 25.662 ( -4.027 -0.224 3.478) 5.326 25.754 ( 2.302 -3.036 -3.957) 5.493 27.148 ( 5.836 1.095 7.830) 9.827 47.590 ( -6.970 -0.160 16.791) 18.180 47.876 ( -9.204 0.105 14.915) 17.527 48.902 ( 7.602 0.078 -10.070) 12.617 49.092 ( 4.482 -0.087 -14.540) 15.215 98.598 ( -2.346 0.742 1.657) 2.967 98.954 ( -0.870 0.143 -3.050) 3.175 99.221 ( -1.004 0.922 7.179) 7.307 99.252 ( -4.911 -1.073 8.827) 10.158 100.651 ( -0.681 0.045 4.056) 4.113 101.209 ( -1.296 0.541 -6.363) 6.517 101.244 ( -9.896 -0.764 9.297) 13.599 101.679 ( 4.143 -2.510 -4.868) 6.867 ======================= Grid point 320 (157/230) ======================= q-point: (-0.11 -0.33 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.190 ( -22.487 -8.786 -3.640) 24.415 2.042 ( -18.504 -1.506 16.215) 24.649 2.339 ( 6.276 -6.785 -0.467) 9.254 2.405 ( -4.029 -2.892 -7.576) 9.055 2.560 ( 7.083 -1.979 1.552) 7.517 2.599 ( 7.046 -3.283 3.231) 8.418 3.041 ( -13.666 2.132 8.246) 16.102 3.322 ( -8.843 4.688 1.941) 10.196 3.454 ( -7.091 -6.208 1.765) 9.589 3.573 ( -0.922 -1.341 1.025) 1.923 3.624 ( -0.934 -4.461 4.322) 6.281 3.927 ( 11.210 -0.368 -1.831) 11.364 4.174 ( 0.164 1.557 1.970) 2.516 4.382 ( 3.795 4.750 1.446) 6.249 4.563 ( 7.315 -1.988 1.776) 7.785 4.941 ( -10.354 7.061 -4.603) 13.351 5.060 ( -4.662 6.289 1.253) 7.928 5.259 ( -5.397 -4.101 4.760) 8.283 5.477 ( 0.712 -5.419 -10.164) 11.540 5.590 ( -4.487 0.907 -1.439) 4.798 5.743 ( -2.435 2.962 -4.150) 5.650 6.056 ( 9.066 -4.029 -10.660) 14.562 6.359 ( 1.007 4.501 5.869) 7.464 6.891 ( 5.034 8.588 -10.483) 14.456 6.994 ( 7.648 3.184 -3.539) 9.009 7.155 ( 5.403 -0.485 -13.877) 14.899 8.549 ( -0.838 7.042 -3.854) 8.072 8.848 ( 0.996 -7.609 0.475) 7.689 9.925 ( -6.665 -4.135 3.601) 8.631 10.368 ( 2.712 -1.909 -6.554) 7.346 10.399 ( -2.722 -4.994 5.177) 7.691 10.497 ( 5.770 8.336 5.752) 11.656 10.630 ( -5.138 2.126 -3.333) 6.483 10.752 ( 6.541 -5.885 2.037) 9.032 11.394 ( 2.550 -0.253 3.787) 4.572 11.634 ( 2.181 -1.201 2.827) 3.767 11.930 ( -5.667 -0.263 10.133) 11.613 11.973 ( 0.942 -0.696 3.915) 4.086 13.338 ( -2.240 1.714 -10.118) 10.504 13.926 ( -0.520 0.329 -0.336) 0.701 16.684 ( 21.580 -0.115 15.053) 26.311 17.718 ( -16.919 2.917 -21.635) 27.619 19.205 ( -0.613 1.061 -1.916) 2.275 19.212 ( -1.493 0.598 -0.881) 1.834 19.796 ( -7.530 -1.096 -3.756) 8.485 20.010 ( 15.037 0.277 -2.847) 15.307 20.262 ( -4.907 -2.005 1.854) 5.616 21.077 ( 5.827 3.168 -10.058) 12.048 21.683 ( 11.304 -1.940 7.542) 13.727 21.846 ( -21.614 -0.056 5.320) 22.259 21.992 ( -14.379 -1.056 -5.295) 15.359 22.303 ( 20.811 -1.131 4.255) 21.271 24.302 ( -0.370 0.126 0.224) 0.451 24.340 ( 3.979 0.691 -0.199) 4.043 24.468 ( -1.269 -0.740 0.763) 1.656 24.887 ( -5.686 0.283 -9.833) 11.362 25.496 ( 2.884 4.428 -2.709) 5.938 25.640 ( -0.696 -1.854 2.017) 2.827 25.818 ( 4.811 -5.559 -4.884) 8.826 27.265 ( 2.481 2.815 5.424) 6.595 47.627 ( -6.328 -0.249 18.062) 19.140 47.843 ( -9.185 0.189 14.163) 16.882 48.944 ( 7.094 0.142 -9.892) 12.174 49.046 ( 5.109 -0.256 -14.853) 15.709 98.581 ( -0.746 1.561 2.778) 3.272 98.901 ( -0.169 0.514 -4.897) 4.927 99.212 ( -6.272 -0.453 6.737) 9.216 99.348 ( 3.934 0.827 13.446) 14.035 100.670 ( -1.395 0.395 4.604) 4.827 101.120 ( -2.205 -0.461 -5.875) 6.292 101.146 ( -10.110 0.303 8.324) 13.099 101.827 ( 12.141 -9.480 -4.607) 16.078 ======================= Grid point 328 (158/230) ======================= q-point: (-0.22 -0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.124 ( -24.905 -0.000 -1.533) 24.952 2.029 ( -20.461 -0.000 20.499) 28.964 2.279 ( 5.066 0.000 -3.624) 6.229 2.392 ( -1.082 -0.000 -8.406) 8.475 2.541 ( 8.112 0.000 3.482) 8.828 2.578 ( 6.120 0.000 3.492) 7.046 3.062 ( -13.773 -0.000 10.091) 17.074 3.374 ( -8.733 -0.000 3.081) 9.261 3.383 ( -9.235 -0.000 -2.044) 9.459 3.571 ( -2.421 -0.000 -1.205) 2.704 3.586 ( 1.348 0.000 6.913) 7.043 3.923 ( 10.844 0.000 -3.508) 11.397 4.186 ( -0.090 -0.000 2.994) 2.995 4.424 ( 1.757 0.000 3.747) 4.138 4.542 ( 10.324 0.000 0.498) 10.336 4.988 ( -10.688 -0.000 -4.910) 11.762 5.139 ( -10.494 -0.000 -3.183) 10.966 5.209 ( -0.475 -0.000 9.101) 9.113 5.428 ( 2.794 0.000 -8.766) 9.200 5.598 ( -4.130 -0.000 -3.343) 5.313 5.768 ( -2.478 -0.000 -4.170) 4.851 6.023 ( 8.950 0.000 -11.274) 14.395 6.392 ( 0.125 0.000 5.385) 5.386 6.988 ( 3.145 0.000 -4.698) 5.654 6.995 ( 13.545 0.000 -12.432) 18.385 7.144 ( 3.549 0.000 -11.686) 12.213 8.617 ( 1.215 0.000 -5.949) 6.072 8.775 ( -1.214 -0.000 2.551) 2.825 9.894 ( -6.861 -0.000 4.111) 7.998 10.351 ( 2.591 0.000 -6.814) 7.289 10.359 ( -2.487 -0.000 4.980) 5.567 10.610 ( 3.514 0.000 5.182) 6.262 10.642 ( 6.665 0.000 3.540) 7.547 10.664 ( -3.316 -0.000 -2.755) 4.312 11.393 ( 3.103 0.000 4.593) 5.543 11.624 ( 2.082 0.000 2.414) 3.188 11.929 ( -6.981 -0.000 10.449) 12.566 11.967 ( 1.936 0.000 3.315) 3.839 13.351 ( -2.168 -0.000 -10.383) 10.607 13.928 ( -0.361 -0.000 -0.385) 0.528 16.683 ( 21.621 0.000 15.072) 26.356 17.741 ( -16.060 -0.000 -22.084) 27.306 19.211 ( -3.411 -0.000 -1.384) 3.681 19.218 ( 1.625 0.000 -1.559) 2.252 19.787 ( -7.689 -0.000 -3.773) 8.565 20.012 ( 15.298 0.000 -3.150) 15.619 20.247 ( -5.019 -0.000 1.948) 5.383 21.101 ( 6.527 0.000 -10.342) 12.229 21.667 ( 9.599 0.000 7.837) 12.392 21.846 ( -20.678 -0.000 5.504) 21.398 21.984 ( -14.315 -0.000 -5.288) 15.260 22.294 ( 20.866 0.000 4.642) 21.377 24.303 ( -0.744 -0.000 0.346) 0.821 24.346 ( 3.728 0.000 -0.426) 3.753 24.462 ( -0.873 -0.000 0.672) 1.101 24.889 ( -5.868 -0.000 -9.841) 11.458 25.541 ( 6.046 0.000 -4.836) 7.742 25.617 ( -3.832 -0.000 2.798) 4.745 25.775 ( 4.533 0.000 -2.994) 5.433 27.286 ( 3.080 0.000 4.906) 5.793 47.625 ( -6.305 -0.000 18.109) 19.176 47.844 ( -9.181 -0.000 14.147) 16.865 48.945 ( 7.083 0.000 -9.872) 12.151 49.044 ( 5.050 0.000 -14.849) 15.684 98.593 ( -0.689 -0.000 2.821) 2.904 98.905 ( 0.207 0.000 -5.111) 5.115 99.209 ( -6.665 -0.000 6.554) 9.348 99.355 ( 4.638 0.000 14.027) 14.774 100.673 ( -1.228 -0.000 4.622) 4.783 101.116 ( -1.866 -0.000 -7.228) 7.465 101.149 ( -10.533 -0.000 10.019) 14.536 101.753 ( 9.246 0.000 -3.931) 10.047 ======================= Grid point 329 (159/230) ======================= q-point: (-0.11 -0.22 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.827 ( -14.681 -5.175 11.990) 19.649 1.796 ( -21.872 -1.449 10.121) 24.143 2.324 ( -2.839 1.691 5.047) 6.033 2.382 ( 0.416 -6.518 8.409) 10.648 2.667 ( 2.365 -0.363 -1.710) 2.942 2.760 ( 6.774 -1.675 5.064) 8.622 2.965 ( -2.336 4.065 9.088) 10.226 3.166 ( -12.413 1.454 4.944) 13.440 3.244 ( -8.013 -7.139 1.552) 10.844 3.629 ( 5.219 -0.225 -0.883) 5.298 3.651 ( 0.425 -1.760 3.055) 3.551 4.034 ( 7.059 -1.207 -5.273) 8.893 4.213 ( -1.052 0.890 5.628) 5.794 4.459 ( -0.517 2.867 3.538) 4.583 4.670 ( -4.102 1.256 -13.776) 14.429 4.809 ( 4.065 0.332 8.231) 9.186 4.887 ( -13.549 0.629 -3.876) 14.106 5.314 ( 3.027 5.094 5.039) 7.778 5.406 ( 3.771 -2.992 -7.438) 8.860 5.515 ( -3.372 -0.550 0.315) 3.431 5.661 ( -5.233 0.768 -3.321) 6.245 6.090 ( 6.861 -2.386 -7.641) 10.543 6.375 ( -4.137 0.676 1.138) 4.344 6.930 ( 2.441 8.424 -10.488) 13.672 7.084 ( 7.706 -0.772 -12.893) 15.040 7.120 ( 3.633 0.290 -11.231) 11.808 8.582 ( 2.162 6.788 -3.365) 7.879 8.808 ( 0.011 -7.135 1.210) 7.237 9.847 ( -4.720 -1.983 6.978) 8.655 10.336 ( 1.083 -1.481 -5.539) 5.835 10.353 ( -3.191 -2.739 3.724) 5.617 10.512 ( -5.386 0.945 -4.603) 7.148 10.715 ( 5.510 8.918 5.529) 11.851 10.861 ( 9.138 -6.581 2.990) 11.651 11.497 ( 3.530 2.461 6.060) 7.433 11.688 ( 3.155 -1.512 1.171) 3.690 11.912 ( -5.266 -2.414 9.810) 11.393 12.012 ( 0.703 0.652 1.399) 1.696 13.229 ( -2.227 0.745 -7.280) 7.650 13.890 ( -3.358 0.241 -0.583) 3.416 17.235 ( -16.534 2.101 -22.287) 27.830 17.241 ( 24.716 0.021 14.913) 28.866 19.125 ( -6.643 0.106 -1.226) 6.756 19.254 ( 4.394 1.213 -2.759) 5.328 19.608 ( -7.768 -0.768 -5.855) 9.758 20.173 ( 6.138 0.453 -2.950) 6.825 20.190 ( -3.432 -1.361 2.270) 4.334 21.097 ( 3.609 2.627 -10.371) 11.290 21.439 ( -25.313 -1.403 5.476) 25.936 21.691 ( -13.874 -0.276 -5.903) 15.080 21.959 ( 10.042 -0.861 7.073) 12.313 22.664 ( 17.169 -0.333 3.859) 17.600 24.261 ( -2.560 -0.741 -1.685) 3.153 24.414 ( 4.795 0.094 -1.010) 4.901 24.509 ( 2.586 0.142 4.674) 5.343 24.753 ( -1.600 0.271 -4.684) 4.957 25.541 ( 0.454 5.959 -2.104) 6.336 25.630 ( 2.738 -5.879 -3.010) 7.150 25.848 ( 5.369 -1.763 -1.537) 5.856 27.312 ( -2.488 1.817 -0.039) 3.081 47.684 ( -5.614 0.004 19.146) 19.952 47.808 ( -8.867 0.075 13.480) 16.135 48.948 ( 4.579 0.005 -12.980) 13.764 49.037 ( 7.713 -0.154 -11.820) 14.115 98.623 ( 1.050 0.923 4.290) 4.512 98.887 ( 2.656 0.737 -4.578) 5.344 99.140 ( -7.183 -0.546 4.817) 8.666 99.613 ( 11.319 2.180 15.396) 19.233 100.683 ( -2.720 0.455 5.605) 6.247 101.042 ( -0.568 -0.436 -5.386) 5.433 101.069 ( -7.934 0.757 9.692) 12.548 101.918 ( 11.292 -9.133 -5.353) 15.478 ======================= Grid point 338 (160/230) ======================= q-point: (-0.11 -0.11 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.886 ( 0.468 0.000 29.640) 29.644 1.491 ( -22.954 -0.000 12.436) 26.106 2.385 ( -13.446 -0.000 29.620) 32.529 2.413 ( 4.545 0.000 4.308) 6.262 2.615 ( -2.942 -0.000 -6.338) 6.988 2.834 ( 4.367 0.000 0.104) 4.368 2.996 ( -7.087 -0.000 7.320) 10.189 3.154 ( -0.718 -0.000 1.873) 2.006 3.276 ( 13.202 0.000 11.137) 17.272 3.644 ( -2.046 -0.000 0.576) 2.125 3.671 ( 0.093 0.000 -1.896) 1.898 4.101 ( 6.611 0.000 -4.014) 7.734 4.213 ( -6.963 -0.000 5.310) 8.756 4.390 ( -8.630 -0.000 -13.384) 15.925 4.438 ( -9.019 -0.000 2.840) 9.456 4.679 ( -6.303 -0.000 4.126) 7.534 5.052 ( 12.115 0.000 7.248) 14.117 5.317 ( 1.764 0.000 -13.918) 14.030 5.486 ( -3.195 -0.000 3.568) 4.790 5.491 ( 3.522 0.000 -7.114) 7.938 5.568 ( 0.813 0.000 7.267) 7.312 6.108 ( 2.193 0.000 -6.609) 6.963 6.297 ( -3.433 -0.000 -0.764) 3.517 6.917 ( 3.374 0.000 -12.131) 12.591 6.955 ( -5.589 -0.000 -17.360) 18.238 7.104 ( 2.338 0.000 -7.380) 7.741 8.641 ( 4.230 0.000 -3.326) 5.381 8.780 ( -1.061 -0.000 1.909) 2.184 9.860 ( -1.810 -0.000 10.278) 10.436 10.281 ( -1.833 -0.000 -6.363) 6.622 10.321 ( -2.535 -0.000 2.757) 3.745 10.407 ( -2.535 -0.000 -2.916) 3.864 10.839 ( 1.795 0.000 2.059) 2.732 11.054 ( 12.977 0.000 0.549) 12.989 11.632 ( 4.536 0.000 3.743) 5.881 11.736 ( 2.582 0.000 0.644) 2.661 11.893 ( -4.174 -0.000 8.077) 9.092 12.030 ( -0.372 -0.000 2.810) 2.834 13.168 ( 0.074 0.000 -2.683) 2.684 13.810 ( -5.042 -0.000 -1.394) 5.231 16.749 ( -15.840 -0.000 -18.268) 24.179 17.818 ( 23.089 0.000 13.473) 26.732 18.914 ( -14.916 -0.000 -4.436) 15.561 19.299 ( 3.174 0.000 -4.151) 5.226 19.488 ( -0.580 -0.000 -2.435) 2.503 20.134 ( -4.509 -0.000 4.174) 6.145 20.210 ( 0.059 0.000 -2.931) 2.931 21.026 ( -2.544 -0.000 -11.634) 11.909 21.079 ( -21.453 -0.000 6.847) 22.520 21.465 ( -5.426 -0.000 -5.824) 7.960 22.158 ( 6.367 0.000 7.658) 9.960 22.917 ( 9.909 0.000 1.245) 9.987 24.202 ( -1.764 -0.000 -2.117) 2.755 24.449 ( 1.720 0.000 -5.544) 5.804 24.606 ( 2.564 0.000 6.901) 7.362 24.826 ( 11.166 0.000 4.172) 11.920 25.550 ( -2.182 -0.000 0.167) 2.188 25.609 ( 4.282 0.000 -8.134) 9.192 25.942 ( 6.545 0.000 0.919) 6.609 27.182 ( -11.465 -0.000 -4.797) 12.429 47.740 ( -7.625 -0.000 15.975) 17.702 47.792 ( -5.934 -0.000 16.014) 17.078 48.904 ( 4.401 0.000 -14.289) 14.951 49.079 ( 8.003 0.000 -10.456) 13.167 98.700 ( 2.364 0.000 5.721) 6.190 98.910 ( 3.862 0.000 -4.714) 6.094 99.052 ( -7.103 -0.000 3.879) 8.093 99.974 ( 16.336 0.000 4.659) 16.987 100.672 ( -4.961 -0.000 6.663) 8.307 101.005 ( 1.122 0.000 -4.254) 4.399 101.086 ( -0.736 -0.000 13.079) 13.100 101.993 ( 7.860 0.000 -5.861) 9.804 ======================= Grid point 339 (161/230) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.840 ( 4.529 0.000 18.907) 19.442 2.101 ( 0.188 0.000 23.705) 23.706 2.397 ( 3.298 0.000 -2.611) 4.207 2.768 ( -8.816 -0.000 7.070) 11.301 2.797 ( -2.949 -0.000 3.647) 4.690 2.955 ( 4.344 0.000 -2.728) 5.130 3.082 ( 1.552 0.000 -3.618) 3.936 3.174 ( 7.677 0.000 -5.345) 9.354 3.431 ( -4.692 -0.000 6.225) 7.796 3.496 ( -5.291 -0.000 1.198) 5.425 3.761 ( 1.613 0.000 -1.432) 2.157 3.786 ( 1.526 0.000 -6.072) 6.261 4.359 ( 9.588 0.000 4.577) 10.625 4.388 ( -8.514 -0.000 10.728) 13.696 4.547 ( -6.954 -0.000 10.381) 12.495 4.830 ( -0.080 -0.000 -5.049) 5.050 4.971 ( 2.952 0.000 -17.876) 18.118 5.128 ( -6.606 -0.000 -5.561) 8.635 5.288 ( 4.116 0.000 17.081) 17.570 5.605 ( 7.579 0.000 0.133) 7.580 5.967 ( -0.012 -0.000 4.429) 4.429 5.974 ( 2.793 0.000 -1.355) 3.104 6.153 ( -5.392 -0.000 -1.168) 5.517 6.497 ( 4.171 0.000 -17.807) 18.289 6.618 ( -1.161 -0.000 5.073) 5.204 6.902 ( 3.978 0.000 -8.780) 9.640 8.731 ( 4.760 0.000 -0.387) 4.775 8.743 ( -3.568 -0.000 -0.587) 3.616 10.028 ( -2.438 -0.000 1.912) 3.099 10.184 ( -0.700 -0.000 -0.916) 1.153 10.335 ( 3.481 0.000 4.678) 5.831 10.426 ( 0.656 0.000 1.007) 1.202 10.833 ( -0.000 -0.000 0.463) 0.463 11.011 ( -3.243 -0.000 -8.582) 9.174 11.618 ( 2.584 0.000 -0.475) 2.627 11.713 ( -2.648 -0.000 -3.878) 4.696 12.048 ( -0.997 -0.000 6.550) 6.626 12.147 ( -4.205 -0.000 1.417) 4.438 13.360 ( 8.188 0.000 2.511) 8.564 13.519 ( -4.208 -0.000 -5.009) 6.542 16.958 ( 31.278 0.000 7.160) 32.087 17.277 ( -33.357 -0.000 -9.341) 34.640 19.133 ( 13.417 0.000 1.111) 13.463 19.182 ( -5.544 -0.000 -1.774) 5.821 19.785 ( 6.316 0.000 6.829) 9.302 19.984 ( -8.281 -0.000 -2.685) 8.706 20.246 ( 0.629 0.000 6.706) 6.736 20.586 ( 3.327 0.000 -10.821) 11.321 20.898 ( -7.406 -0.000 8.561) 11.320 21.227 ( 4.944 0.000 -8.005) 9.409 22.600 ( 0.445 0.000 10.334) 10.344 22.939 ( -1.348 -0.000 -6.047) 6.195 24.139 ( 0.951 0.000 -0.127) 0.959 24.228 ( -0.378 -0.000 -5.083) 5.097 24.967 ( -1.363 -0.000 9.745) 9.840 25.356 ( 1.983 0.000 -9.988) 10.183 25.427 ( -4.870 -0.000 -0.567) 4.903 25.442 ( 11.929 0.000 -1.206) 11.989 26.338 ( 10.721 0.000 4.611) 11.670 26.469 ( -17.277 -0.000 -1.784) 17.369 47.941 ( -9.551 -0.000 15.196) 17.949 48.241 ( -8.164 -0.000 18.235) 19.979 48.551 ( 7.536 0.000 -15.357) 17.106 48.903 ( 8.044 0.000 -14.783) 16.830 98.810 ( -4.568 -0.000 0.878) 4.651 98.869 ( 2.783 0.000 -2.520) 3.754 99.247 ( 1.695 0.000 13.137) 13.246 99.763 ( -5.364 -0.000 -12.678) 13.766 100.719 ( -4.730 -0.000 5.818) 7.499 100.951 ( 5.334 0.000 -5.345) 7.551 101.582 ( -0.902 -0.000 8.813) 8.860 101.880 ( 0.366 0.000 -7.047) 7.056 ======================= Grid point 340 (162/230) ======================= q-point: ( 0.11 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( 12.398 0.382 11.135) 16.668 2.272 ( 5.490 4.729 11.141) 13.290 2.376 ( -3.390 4.070 -2.058) 5.683 2.690 ( -4.654 -0.675 2.026) 5.120 2.757 ( -3.288 2.239 6.366) 7.507 2.936 ( -5.327 -1.315 -1.340) 5.648 3.063 ( 5.636 5.079 -9.218) 11.938 3.286 ( 6.236 -6.486 -5.185) 10.385 3.460 ( 0.175 0.435 8.199) 8.213 3.491 ( 0.543 -2.667 5.470) 6.110 3.684 ( -5.035 2.536 -4.752) 7.373 3.794 ( 0.261 -4.819 -3.766) 6.122 4.303 ( -10.527 4.307 10.415) 15.422 4.399 ( -6.047 3.184 -4.183) 8.013 4.587 ( 7.808 -1.876 6.201) 10.146 4.837 ( -1.446 0.346 -5.557) 5.753 4.932 ( 1.040 -2.277 7.262) 7.681 5.015 ( 0.198 -3.622 -6.192) 7.176 5.507 ( 8.193 0.603 7.370) 11.037 5.697 ( 5.548 -0.367 -6.065) 8.228 5.971 ( -2.077 1.667 2.217) 3.465 6.014 ( 2.411 0.462 -1.863) 3.081 6.052 ( -5.845 0.221 2.669) 6.429 6.427 ( 5.016 -0.663 -15.880) 16.666 6.658 ( 1.014 -0.187 3.437) 3.588 6.903 ( 4.265 -1.180 -8.729) 9.787 8.667 ( -4.332 -0.772 -1.467) 4.638 8.810 ( 4.409 -0.282 -0.172) 4.422 10.040 ( -0.270 -0.589 5.563) 5.600 10.167 ( 1.633 0.426 -3.536) 3.918 10.426 ( 2.843 2.446 2.784) 4.671 10.430 ( 1.390 1.432 -1.487) 2.489 10.851 ( -1.179 -1.304 2.766) 3.277 10.878 ( -3.861 0.242 -4.799) 6.164 11.606 ( -4.618 1.379 -3.570) 5.998 11.644 ( -0.124 0.586 1.383) 1.508 12.071 ( -3.941 0.957 4.895) 6.357 12.090 ( -2.975 -0.876 4.427) 5.405 13.424 ( -1.541 -0.524 -6.489) 6.690 13.535 ( 9.959 0.036 1.424) 10.061 16.690 ( -25.920 0.108 -7.088) 26.872 17.613 ( 35.950 0.444 7.493) 36.725 19.046 ( -6.045 0.404 -5.182) 7.972 19.295 ( 5.704 0.078 -1.168) 5.823 19.791 ( -11.186 -0.248 -3.635) 11.765 19.927 ( 3.921 -0.148 5.428) 6.698 20.361 ( 5.689 0.038 6.429) 8.585 20.590 ( 7.625 -0.289 -11.075) 13.449 20.884 ( -2.617 0.264 8.686) 9.075 21.270 ( 7.854 0.303 -6.455) 10.171 22.668 ( -2.898 0.449 10.303) 10.712 22.830 ( -4.628 0.485 -7.062) 8.457 24.163 ( 1.432 0.303 0.280) 1.490 24.189 ( 0.359 -0.730 -3.729) 3.817 24.976 ( -6.572 1.066 7.369) 9.932 25.246 ( -1.897 2.799 -7.388) 8.125 25.365 ( -2.900 -3.052 -2.267) 4.781 25.624 ( 11.536 0.902 -5.075) 12.635 26.190 ( -14.854 -0.439 0.145) 14.861 26.573 ( 10.722 -0.802 6.777) 12.709 47.915 ( -9.026 0.125 16.073) 18.434 48.247 ( -9.182 -0.025 17.706) 19.945 48.558 ( 8.206 -0.046 -14.395) 16.570 48.903 ( 7.154 0.011 -15.614) 17.175 98.738 ( -5.051 -0.324 1.457) 5.267 98.898 ( 2.327 0.039 -0.664) 2.420 99.381 ( 0.133 0.378 13.955) 13.961 99.541 ( -7.982 0.946 -10.237) 13.015 100.700 ( -3.022 0.087 5.306) 6.106 101.008 ( 6.843 -0.099 -5.769) 8.950 101.606 ( -4.659 0.141 9.031) 10.162 101.812 ( -2.177 -1.901 -7.323) 7.872 ======================= Grid point 341 (163/230) ======================= q-point: ( 0.22 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.207 ( -4.506 4.539 -7.238) 9.659 2.302 ( -0.488 5.468 3.102) 6.305 2.420 ( 4.176 2.248 3.570) 5.936 2.688 ( 9.221 6.323 -11.754) 16.222 2.746 ( -0.558 8.819 5.507) 10.412 2.817 ( -7.461 -3.482 2.381) 8.571 3.071 ( 2.580 -1.374 2.100) 3.599 3.371 ( 3.429 -7.020 -5.266) 9.422 3.529 ( -7.042 1.668 -0.732) 7.274 3.535 ( 2.681 2.320 4.148) 5.457 3.629 ( 2.824 -3.481 11.064) 11.937 3.756 ( -3.942 -6.859 -6.557) 10.275 4.177 ( -5.020 6.163 5.308) 9.558 4.282 ( -4.323 1.155 0.189) 4.479 4.722 ( -1.791 -2.444 -1.732) 3.490 4.735 ( -2.485 -1.842 -1.140) 3.297 5.013 ( 7.121 0.945 3.078) 7.815 5.157 ( 5.974 -5.227 7.494) 10.917 5.643 ( 6.198 0.454 -4.823) 7.866 5.673 ( 1.225 1.680 -11.692) 11.876 5.915 ( -3.545 4.273 0.895) 5.623 5.992 ( -1.040 0.165 -0.791) 1.317 6.044 ( -1.565 -0.355 6.574) 6.767 6.433 ( 7.044 -4.280 -9.952) 12.922 6.702 ( 1.059 -0.665 1.598) 2.029 6.908 ( 3.897 -2.082 -9.312) 10.308 8.584 ( -5.075 -2.521 -1.924) 5.985 8.879 ( 4.124 1.137 -0.231) 4.284 10.108 ( 1.219 -0.703 6.011) 6.173 10.185 ( 3.355 -0.226 -1.194) 3.569 10.400 ( 2.110 3.940 -5.336) 6.960 10.458 ( 1.098 3.084 -0.156) 3.278 10.793 ( -2.664 1.442 1.244) 3.275 10.856 ( -3.758 -2.092 1.888) 4.697 11.492 ( -3.352 3.027 -1.975) 4.930 11.644 ( -1.532 0.278 3.181) 3.541 12.034 ( -3.794 -1.628 4.023) 5.764 12.097 ( -2.557 1.523 6.124) 6.809 13.357 ( -0.176 -1.053 -7.603) 7.678 13.705 ( 8.781 0.148 0.784) 8.817 16.323 ( -12.078 0.330 -1.098) 12.132 18.167 ( 18.416 0.492 2.455) 18.586 18.955 ( 6.428 0.583 -6.756) 9.343 19.325 ( -0.021 -0.201 -1.656) 1.669 19.562 ( -11.438 -0.537 -3.904) 12.097 20.003 ( 0.890 0.089 2.518) 2.672 20.495 ( 2.545 1.332 5.902) 6.564 20.647 ( 9.076 -1.463 -10.765) 14.156 20.978 ( 6.284 0.631 8.719) 10.766 21.393 ( 12.609 0.426 -4.060) 13.254 22.652 ( -7.606 1.483 -0.610) 7.773 22.669 ( -7.276 0.447 2.455) 7.692 24.166 ( 1.037 0.052 -1.593) 1.902 24.211 ( 1.892 -0.993 0.233) 2.149 24.855 ( -9.845 2.405 2.342) 10.402 25.138 ( -3.260 -1.342 -7.900) 8.651 25.341 ( -0.317 -0.866 -0.004) 0.922 25.730 ( 8.279 2.896 -6.091) 10.678 25.977 ( -11.180 -0.610 0.789) 11.224 26.820 ( 9.476 -1.576 8.281) 12.683 47.908 ( -8.394 0.211 17.168) 19.112 48.234 ( -9.842 -0.103 17.125) 19.752 48.584 ( 8.798 -0.091 -13.563) 16.167 48.880 ( 6.304 0.060 -16.540) 17.701 98.672 ( -4.922 -0.695 2.186) 5.430 98.934 ( 1.802 -0.122 0.097) 1.809 99.333 ( -6.612 0.344 -6.489) 9.271 99.471 ( -2.543 1.053 12.985) 13.273 100.703 ( -1.956 0.024 5.074) 5.438 101.077 ( 7.086 0.290 -6.500) 9.620 101.582 ( -7.850 -1.179 9.126) 12.095 101.719 ( -1.523 -0.230 -7.308) 7.468 ======================= Grid point 342 (164/230) ======================= q-point: ( 0.33 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.998 ( -9.481 6.246 -9.747) 14.963 2.194 ( -3.521 1.502 -5.282) 6.524 2.437 ( -0.546 3.126 1.306) 3.431 2.605 ( 2.720 6.534 -12.512) 14.375 2.673 ( 1.431 9.233 -7.277) 11.843 2.813 ( -4.807 3.903 11.423) 12.994 3.231 ( 6.015 -3.636 5.599) 8.986 3.400 ( -7.835 -2.396 2.761) 8.646 3.454 ( 5.280 -1.936 -0.819) 5.682 3.555 ( -3.511 -0.929 2.474) 4.394 3.683 ( 2.269 -5.045 -8.546) 10.180 3.817 ( 2.022 -0.095 13.481) 13.633 4.162 ( -0.280 1.184 5.399) 5.534 4.220 ( -2.317 2.064 1.317) 3.371 4.601 ( -2.176 3.367 -6.173) 7.361 4.761 ( -3.031 -8.924 2.021) 9.639 5.149 ( 0.165 -1.713 7.051) 7.258 5.354 ( 9.552 -0.910 0.244) 9.598 5.549 ( 0.551 2.294 -14.142) 14.337 5.648 ( 2.713 0.241 -8.891) 9.299 5.817 ( -3.761 5.326 0.995) 6.595 5.950 ( -2.947 0.010 -0.760) 3.044 6.116 ( 1.495 -0.766 8.804) 8.963 6.548 ( 8.055 -7.491 -4.836) 12.016 6.724 ( -0.202 -1.080 0.000) 1.099 6.901 ( 3.597 -2.301 -11.099) 11.892 8.502 ( -5.060 -3.364 -1.959) 6.384 8.927 ( 3.569 2.666 -0.565) 4.490 10.176 ( 2.707 0.910 2.013) 3.494 10.244 ( -0.045 -2.223 3.028) 3.757 10.363 ( 1.793 4.580 -3.680) 6.143 10.458 ( 4.447 2.275 -1.651) 5.260 10.746 ( -6.039 -0.601 3.005) 6.772 10.799 ( -2.627 1.768 -0.959) 3.308 11.429 ( -0.399 4.167 0.898) 4.281 11.651 ( -1.093 -0.298 3.851) 4.014 12.033 ( -1.382 0.280 3.694) 3.954 12.087 ( -3.640 -0.386 5.925) 6.965 13.296 ( -0.405 -1.507 -8.006) 8.157 13.835 ( 5.781 0.144 0.539) 5.808 16.273 ( 3.412 0.473 7.233) 8.011 18.146 ( -11.253 -0.160 -11.439) 16.047 19.183 ( 13.500 -0.495 -2.358) 13.714 19.290 ( -1.855 -0.148 -1.815) 2.600 19.414 ( 2.687 -0.116 -1.366) 3.016 19.996 ( -2.826 0.469 0.138) 2.868 20.515 ( -3.173 2.786 5.433) 6.881 20.722 ( 7.872 -2.834 -9.982) 13.025 21.230 ( 14.099 0.803 8.585) 16.527 21.630 ( 18.500 0.660 -1.270) 18.556 22.436 ( -10.054 1.512 -7.261) 12.494 22.552 ( -13.528 0.903 7.244) 15.372 24.190 ( 2.501 -0.697 0.016) 2.596 24.252 ( 1.590 -0.877 0.715) 1.952 24.686 ( -8.607 2.008 0.098) 8.839 25.008 ( -4.507 -1.697 -9.735) 10.861 25.357 ( 0.784 -0.592 1.046) 1.434 25.763 ( 3.021 3.245 -3.687) 5.766 25.836 ( -4.703 0.479 -1.384) 4.926 27.046 ( 7.010 -2.054 8.240) 11.011 47.921 ( -7.721 0.269 18.347) 19.908 48.207 ( -10.244 -0.166 16.446) 19.376 48.625 ( 9.237 -0.134 -12.946) 15.904 48.836 ( 5.726 0.115 -17.444) 18.360 98.622 ( -4.096 -1.070 2.786) 5.067 98.933 ( -0.949 0.273 -3.502) 3.639 99.240 ( -0.907 -1.128 0.846) 1.676 99.497 ( -5.039 1.634 10.520) 11.778 100.718 ( -1.489 -0.152 5.214) 5.425 101.114 ( 4.135 0.796 -7.416) 8.528 101.511 ( -9.744 -1.349 7.835) 12.576 101.672 ( 3.855 1.856 -5.944) 7.323 ======================= Grid point 343 (165/230) ======================= q-point: (-0.56 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.628 ( -14.780 7.326 -11.305) 19.998 2.153 ( 0.700 -1.155 -2.037) 2.444 2.401 ( 1.481 2.441 -3.402) 4.441 2.484 ( -1.163 8.187 -10.914) 13.693 2.587 ( 0.665 3.154 -1.432) 3.527 2.794 ( -3.719 6.915 12.349) 14.634 3.266 ( -8.287 -2.712 -0.656) 8.744 3.331 ( -2.644 -1.324 6.263) 6.926 3.531 ( -1.483 -2.509 2.676) 3.957 3.604 ( 7.286 -0.675 -4.432) 8.555 3.735 ( 5.720 -1.290 -2.128) 6.238 3.925 ( 1.093 5.442 11.722) 12.970 4.172 ( -3.476 -3.074 1.913) 5.019 4.206 ( 0.014 0.773 1.070) 1.320 4.554 ( 3.102 2.009 0.471) 3.725 4.808 ( -1.407 -8.249 3.271) 8.984 5.127 ( -7.389 -1.803 0.406) 7.617 5.334 ( -4.072 -0.085 -13.527) 14.127 5.528 ( 3.395 0.366 -3.309) 4.755 5.619 ( 1.732 5.097 -0.679) 5.426 5.748 ( -1.728 2.053 -1.702) 3.178 5.926 ( 2.371 0.505 0.119) 2.427 6.242 ( 2.585 -4.018 8.147) 9.445 6.700 ( 1.605 -3.458 -0.831) 3.902 6.709 ( 3.970 -5.139 -4.873) 8.118 6.875 ( 3.954 -2.004 -13.802) 14.496 8.436 ( -3.616 -3.741 -1.528) 5.422 8.950 ( 2.713 4.029 -0.740) 4.914 10.166 ( -3.757 4.251 1.755) 5.939 10.287 ( 2.199 -2.196 -1.210) 3.335 10.361 ( 3.409 1.103 1.677) 3.956 10.555 ( 5.848 1.898 1.249) 6.273 10.650 ( -6.536 -2.937 -0.860) 7.217 10.735 ( -1.105 3.732 -0.829) 3.980 11.427 ( 1.096 2.761 2.391) 3.813 11.676 ( 0.092 0.159 3.572) 3.577 12.021 ( -1.237 2.223 1.266) 2.842 12.100 ( -2.408 -1.681 6.729) 7.342 13.230 ( -1.089 -1.588 -7.052) 7.310 13.906 ( 2.227 -0.049 0.341) 2.253 16.533 ( 15.727 0.432 14.507) 21.400 17.749 ( -18.882 -1.386 -18.795) 26.678 19.181 ( -3.064 -1.394 -1.209) 3.577 19.243 ( -2.148 0.055 -1.286) 2.504 19.685 ( 19.650 0.159 -1.316) 19.695 19.904 ( -6.606 0.895 -1.923) 6.939 20.465 ( -5.525 3.154 6.231) 8.905 20.783 ( 6.572 -3.540 -9.605) 12.164 21.552 ( 15.338 0.897 8.273) 17.450 21.973 ( 21.407 0.597 0.962) 21.437 22.172 ( -12.387 1.305 -7.256) 14.415 22.314 ( -19.324 1.028 4.863) 19.953 24.258 ( 3.810 -0.954 0.985) 4.050 24.287 ( 0.828 -1.023 0.989) 1.646 24.557 ( -4.803 1.742 0.630) 5.148 24.851 ( -4.717 -0.716 -10.155) 11.220 25.386 ( 0.993 -1.341 0.243) 1.686 25.723 ( -3.882 0.003 2.033) 4.382 25.796 ( 4.516 4.391 -6.304) 8.912 27.216 ( 3.643 -2.270 6.133) 7.485 47.954 ( -7.076 0.277 19.478) 20.726 48.170 ( -10.430 -0.183 15.731) 18.875 48.676 ( 9.284 -0.193 -12.609) 15.659 48.779 ( 5.740 0.196 -18.108) 18.997 98.601 ( -2.433 -1.484 3.429) 4.459 98.859 ( -1.765 0.333 -5.584) 5.865 99.312 ( 3.105 -1.818 5.682) 6.725 99.464 ( -5.691 1.651 7.457) 9.524 100.743 ( -1.421 -0.484 5.869) 6.057 101.077 ( 0.424 1.222 -7.636) 7.744 101.415 ( -11.136 -1.728 8.722) 14.251 101.724 ( 11.676 5.353 -7.431) 14.839 ======================= Grid point 344 (166/230) ======================= q-point: (-0.44 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.287 ( -11.411 7.348 0.688) 13.590 2.121 ( -7.252 -3.085 0.661) 7.909 2.312 ( -2.895 3.327 -5.031) 6.690 2.451 ( 10.498 5.209 -4.455) 12.537 2.598 ( 1.863 -0.480 -0.683) 2.042 2.826 ( 1.318 3.431 10.875) 11.479 3.140 ( -9.254 -0.073 4.691) 10.376 3.324 ( -6.857 -3.197 6.240) 9.807 3.557 ( 0.480 1.098 0.337) 1.245 3.609 ( -0.177 1.919 -3.317) 3.836 3.749 ( 1.184 9.348 -0.225) 9.425 4.028 ( 4.652 7.313 6.090) 10.593 4.162 ( 0.530 -4.973 1.826) 5.324 4.244 ( 1.618 -9.141 -3.073) 9.778 4.635 ( 1.708 0.216 3.379) 3.792 4.887 ( -0.192 -5.094 7.126) 8.761 4.982 ( -7.906 -0.118 -0.842) 7.952 5.125 ( -5.820 -1.174 -14.160) 15.354 5.498 ( -4.589 -1.649 -0.013) 4.876 5.612 ( 0.537 6.009 3.252) 6.854 5.694 ( -2.242 0.280 -0.468) 2.307 5.998 ( 7.227 3.084 -2.683) 8.303 6.380 ( 0.743 -5.710 6.202) 8.463 6.646 ( -1.839 -1.490 -4.296) 4.905 6.824 ( 4.162 -1.885 -13.328) 14.089 6.845 ( 6.451 -6.092 -8.232) 12.103 8.417 ( -0.889 -4.322 -0.480) 4.438 8.947 ( 1.578 5.125 -0.755) 5.415 10.080 ( -5.020 3.930 4.909) 8.046 10.301 ( 2.670 2.171 -3.950) 5.238 10.491 ( 3.571 -5.440 4.323) 7.812 10.507 ( -3.381 -0.170 -3.116) 4.601 10.586 ( -4.445 4.759 2.049) 6.826 10.781 ( 7.630 -1.774 -1.668) 8.009 11.455 ( 0.688 -0.533 2.007) 2.188 11.710 ( 1.271 0.886 2.428) 2.880 12.002 ( -0.951 -0.530 0.979) 1.465 12.124 ( -1.160 2.081 5.596) 6.083 13.169 ( -1.167 -1.060 -4.405) 4.678 13.918 ( -1.102 -0.317 -0.011) 1.146 17.007 ( 22.857 0.190 17.951) 29.064 17.253 ( -20.020 -2.383 -21.329) 29.349 19.160 ( -0.266 -1.489 -0.187) 1.524 19.203 ( -1.825 0.078 0.170) 1.834 19.727 ( -10.102 1.198 -4.246) 11.023 19.949 ( 13.618 0.085 -3.205) 13.990 20.397 ( -6.432 2.959 7.116) 10.038 20.832 ( 5.435 -3.874 -9.292) 11.440 21.847 ( 2.505 0.901 2.605) 3.725 21.882 ( -4.839 -0.058 -1.353) 5.025 21.944 ( -22.675 1.628 2.156) 22.835 22.376 ( 20.936 0.296 1.637) 21.002 24.289 ( -0.815 -0.334 -0.751) 1.158 24.341 ( 3.383 0.212 0.264) 3.400 24.530 ( 0.797 0.920 4.243) 4.414 24.709 ( -2.756 -0.829 -7.379) 7.921 25.411 ( 0.764 -2.245 -0.990) 2.570 25.690 ( -1.270 0.938 0.818) 1.779 25.800 ( 4.976 3.731 -3.967) 7.377 27.296 ( -0.583 -2.216 2.190) 3.170 48.007 ( -6.584 0.148 20.366) 21.404 48.126 ( -10.333 -0.132 15.063) 18.267 48.699 ( 5.817 -0.196 -16.166) 17.182 48.750 ( 9.406 0.253 -14.760) 17.504 98.623 ( -0.201 -1.908 4.244) 4.658 98.799 ( 0.308 -0.054 -4.678) 4.689 99.339 ( -6.282 1.744 4.322) 7.821 99.520 ( 6.094 -2.608 6.199) 9.076 100.776 ( -1.763 -0.921 7.083) 7.357 101.004 ( -0.083 1.374 -6.809) 6.946 101.313 ( -11.100 -1.843 9.448) 14.692 101.838 ( 15.652 9.184 -9.412) 20.443 ======================= Grid point 345 (167/230) ======================= q-point: (-0.33 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.215 ( -2.758 2.191 20.144) 20.450 1.961 ( -13.562 1.878 6.039) 14.964 2.304 ( 3.482 -2.866 -0.003) 4.510 2.550 ( 4.896 -0.038 -1.705) 5.184 2.616 ( 3.005 -0.001 -3.635) 4.716 2.998 ( 7.340 -3.922 6.018) 10.270 3.041 ( -7.779 4.444 12.285) 15.205 3.259 ( -7.637 -0.700 7.019) 10.396 3.444 ( -6.500 6.822 0.738) 9.452 3.628 ( 3.487 2.206 -0.997) 4.244 3.703 ( 2.251 7.280 -3.117) 8.233 4.060 ( 3.288 6.281 1.557) 7.259 4.251 ( -1.385 -6.349 -1.962) 6.788 4.308 ( 0.259 -7.535 0.386) 7.549 4.581 ( -5.362 -0.285 -1.533) 5.584 4.863 ( -8.716 0.191 1.251) 8.808 4.989 ( 1.248 -1.135 1.440) 2.219 5.034 ( 5.915 -1.836 3.371) 7.051 5.411 ( -6.561 -4.825 -4.754) 9.430 5.601 ( -2.784 1.159 1.018) 3.182 5.673 ( 1.364 4.465 5.502) 7.216 6.058 ( 4.984 3.377 -2.499) 6.518 6.390 ( -5.571 1.002 1.801) 5.940 6.627 ( 1.362 -5.478 -6.094) 8.307 6.765 ( 2.611 -3.408 -15.505) 16.089 6.922 ( 4.958 -3.342 -7.387) 9.503 8.461 ( 1.992 -4.746 0.471) 5.169 8.917 ( 0.279 5.668 -0.635) 5.710 10.042 ( -3.357 2.094 8.312) 9.206 10.272 ( -1.172 1.307 -4.075) 4.438 10.408 ( -1.986 0.959 -2.542) 3.366 10.471 ( -5.018 3.960 -0.327) 6.401 10.685 ( 6.185 -6.981 4.149) 10.208 10.903 ( 7.613 -0.207 -2.830) 8.124 11.490 ( 0.064 -5.078 0.301) 5.087 11.742 ( 1.939 1.463 0.300) 2.447 12.016 ( -0.818 -2.989 2.045) 3.713 12.124 ( -0.150 5.772 4.569) 7.363 13.140 ( -0.011 -0.305 -0.866) 0.918 13.874 ( -3.857 -0.209 -0.763) 3.937 16.778 ( -16.430 -2.286 -18.701) 24.998 17.568 ( 24.443 -0.082 16.843) 29.684 19.119 ( -8.765 0.195 0.633) 8.790 19.208 ( 1.326 -1.945 0.720) 2.462 19.507 ( -6.705 1.378 -5.744) 8.936 20.097 ( 7.982 0.289 -4.170) 9.011 20.329 ( -6.748 2.410 7.688) 10.509 20.855 ( 2.775 -3.623 -9.211) 10.280 21.540 ( -21.856 0.633 1.891) 21.947 21.565 ( -15.243 0.463 -6.388) 16.534 22.120 ( 9.824 0.631 7.925) 12.638 22.705 ( 16.106 -0.101 -0.119) 16.107 24.242 ( -2.357 1.519 -1.995) 3.442 24.365 ( 1.556 0.570 -3.968) 4.300 24.622 ( 3.536 -0.852 6.569) 7.509 24.696 ( 4.732 -1.221 0.699) 4.937 25.427 ( 0.224 -3.138 -1.978) 3.716 25.666 ( 0.126 3.380 -1.240) 3.602 25.854 ( 6.257 1.742 -0.785) 6.542 27.256 ( -5.990 -1.664 -2.287) 6.624 48.061 ( -9.092 -0.601 18.084) 20.250 48.092 ( -7.250 0.435 17.135) 18.611 48.646 ( 5.631 0.025 -17.575) 18.455 48.798 ( 9.813 0.104 -13.357) 16.575 98.693 ( 1.960 -2.296 4.686) 5.575 98.792 ( 2.519 -0.331 -3.230) 4.109 99.235 ( -7.009 2.120 2.763) 7.826 99.720 ( 9.094 -4.331 1.986) 10.266 100.810 ( -3.273 -1.228 8.010) 8.739 100.947 ( 0.906 1.144 -5.825) 6.005 101.251 ( -7.153 -2.058 11.042) 13.317 101.937 ( 14.684 12.082 -10.849) 21.893 ======================= Grid point 346 (168/230) ======================= q-point: (-0.22 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.458 ( 1.945 -5.368 30.470) 31.001 1.790 ( -13.325 4.256 15.028) 20.531 2.410 ( 4.088 -2.802 -2.508) 5.555 2.555 ( -0.963 -2.929 4.110) 5.138 2.714 ( 8.837 -3.921 -4.620) 10.715 2.954 ( -8.797 4.703 12.534) 16.019 3.104 ( -3.935 1.179 4.798) 6.316 3.249 ( -3.383 4.570 2.760) 6.321 3.418 ( 8.602 -1.014 4.681) 9.846 3.638 ( 1.442 2.951 -2.058) 3.876 3.656 ( -0.146 2.300 -3.153) 3.906 4.051 ( -6.784 -0.694 -8.364) 10.791 4.127 ( -0.682 2.830 -0.116) 2.913 4.381 ( -1.261 -2.751 6.922) 7.554 4.533 ( -4.146 0.246 5.315) 6.745 4.792 ( 1.177 -2.107 0.124) 2.417 5.047 ( 2.173 -0.852 1.921) 3.023 5.224 ( 8.419 3.074 6.417) 11.023 5.267 ( -6.306 -7.388 -8.987) 13.233 5.498 ( -6.477 2.028 -2.294) 7.164 5.772 ( 3.703 0.679 8.669) 9.451 6.058 ( -0.356 3.336 -2.535) 4.206 6.283 ( -3.836 1.559 -1.229) 4.319 6.622 ( 3.127 -2.739 -11.854) 12.562 6.697 ( -3.260 -4.693 -6.328) 8.526 6.937 ( 3.654 -0.491 -8.780) 9.523 8.550 ( 3.801 -4.076 0.397) 5.588 8.867 ( -1.001 5.120 -0.250) 5.223 10.077 ( -1.347 -0.247 10.521) 10.609 10.182 ( -4.235 -0.426 -3.935) 5.796 10.353 ( -2.619 2.787 -2.203) 4.414 10.390 ( -0.320 1.382 0.273) 1.445 10.830 ( 2.298 -3.120 1.164) 4.046 11.007 ( 8.584 -0.921 -4.757) 9.858 11.535 ( 0.434 -7.625 -2.133) 7.930 11.757 ( 1.977 1.770 -1.618) 3.108 12.023 ( -2.675 -0.775 3.113) 4.177 12.142 ( 1.923 3.668 4.368) 6.019 13.160 ( 1.781 0.144 1.782) 2.523 13.779 ( -5.799 0.345 -2.043) 6.158 16.470 ( -5.177 -1.230 -9.507) 10.895 18.044 ( 13.306 0.110 9.377) 16.278 18.848 ( -16.842 -0.471 -1.764) 16.940 19.251 ( 0.993 -1.447 0.412) 1.803 19.471 ( 5.283 1.080 -0.098) 5.393 20.149 ( 2.592 0.418 -3.971) 4.760 20.267 ( -6.503 1.575 7.779) 10.260 20.800 ( -2.795 -2.175 -9.163) 9.823 21.209 ( -18.796 0.761 5.346) 19.556 21.326 ( -5.412 -0.342 -8.248) 9.871 22.323 ( 6.314 0.129 8.627) 10.691 22.906 ( 8.911 -0.070 -2.648) 9.296 24.176 ( -1.719 1.445 -1.888) 2.934 24.332 ( 0.002 -0.165 -5.512) 5.514 24.755 ( 3.304 -0.951 8.334) 9.016 24.879 ( 12.569 -1.642 3.151) 13.062 25.431 ( -0.300 -3.915 -2.935) 4.902 25.618 ( -0.744 5.072 -1.807) 5.435 25.970 ( 8.220 0.796 1.015) 8.321 27.078 ( -12.136 -0.622 -4.945) 13.119 48.023 ( -10.277 -0.331 14.736) 17.969 48.153 ( -5.926 0.024 19.709) 20.581 48.597 ( 6.180 0.066 -17.144) 18.224 48.847 ( 9.418 0.085 -13.591) 16.536 98.786 ( 3.278 -2.407 1.028) 4.195 98.828 ( 2.725 0.011 0.705) 2.815 99.137 ( -5.400 1.739 3.718) 6.782 99.884 ( 7.244 -4.775 -6.162) 10.642 100.805 ( -5.954 -0.986 7.286) 9.461 100.920 ( 2.216 0.794 -5.262) 5.764 101.314 ( 0.044 -3.112 12.966) 13.334 101.966 ( 9.970 12.024 -10.666) 18.914 ======================= Grid point 347 (169/230) ======================= q-point: (-0.11 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.697 ( -6.761 -0.885 20.430) 21.538 1.840 ( 0.273 -2.814 31.521) 31.648 2.393 ( 0.415 -0.435 -5.371) 5.405 2.703 ( 4.590 -3.822 8.335) 10.254 2.837 ( 1.856 -6.147 -2.447) 6.871 2.890 ( -2.137 7.208 8.617) 11.436 3.075 ( -2.604 -1.379 3.085) 4.266 3.170 ( 1.452 6.307 -4.391) 7.821 3.497 ( -6.182 -1.462 2.603) 6.865 3.595 ( -3.037 1.970 -0.697) 3.686 3.723 ( 9.143 -0.743 -1.890) 9.366 3.822 ( -7.069 -0.741 -6.588) 9.691 4.192 ( 6.786 1.057 1.312) 6.992 4.412 ( -5.197 -1.457 9.663) 11.068 4.525 ( -4.213 4.205 14.558) 15.728 4.875 ( 8.418 -1.498 -11.908) 14.660 5.054 ( -3.128 -2.388 -3.958) 5.582 5.154 ( -2.503 -4.005 3.197) 5.703 5.307 ( -5.597 5.164 -5.032) 9.128 5.449 ( 7.119 -0.120 5.499) 8.996 5.896 ( 2.354 -0.788 6.796) 7.235 5.982 ( -2.135 1.995 -1.201) 3.159 6.229 ( -1.672 -0.585 -2.899) 3.397 6.572 ( 4.216 -0.818 -16.949) 17.485 6.629 ( -5.206 -1.622 3.389) 6.420 6.918 ( 3.455 0.554 -9.002) 9.658 8.645 ( 4.414 -2.517 -0.274) 5.089 8.808 ( -2.196 3.393 0.014) 4.042 10.085 ( -4.122 -0.141 -1.700) 4.461 10.162 ( -0.604 -1.048 9.561) 9.637 10.287 ( -0.001 0.402 -2.882) 2.910 10.401 ( 0.636 0.508 1.971) 2.132 10.844 ( -0.252 0.509 -1.041) 1.186 11.083 ( 3.451 -1.515 -7.464) 8.362 11.575 ( 2.141 -3.846 -2.905) 5.274 11.757 ( 0.735 0.496 -2.616) 2.763 12.018 ( -1.820 0.055 5.162) 5.474 12.176 ( -0.304 0.973 2.400) 2.607 13.229 ( 4.380 0.180 2.898) 5.255 13.647 ( -6.129 0.475 -3.504) 7.076 16.515 ( 14.298 -0.422 1.669) 14.401 17.899 ( -27.824 0.251 -6.637) 28.605 18.855 ( 13.384 -0.663 4.392) 14.102 19.253 ( -2.084 -0.560 -0.086) 2.160 19.609 ( 8.094 0.466 4.770) 9.406 20.110 ( -3.398 0.289 -2.972) 4.524 20.226 ( -4.565 0.649 7.348) 8.675 20.668 ( -2.678 -0.509 -9.776) 10.149 20.996 ( -12.484 0.277 7.536) 14.585 21.236 ( 1.923 -0.499 -8.617) 8.843 22.482 ( 3.277 -0.181 9.636) 10.180 22.973 ( 2.940 -0.069 -4.603) 5.463 24.139 ( -0.291 0.545 -0.974) 1.153 24.281 ( -0.418 -0.074 -5.567) 5.583 24.879 ( 1.513 -0.446 9.535) 9.664 25.159 ( 16.012 -2.422 -0.208) 16.196 25.421 ( -0.673 -3.880 -4.262) 5.802 25.534 ( -2.950 5.572 -1.532) 6.488 26.135 ( 9.796 0.457 2.591) 10.143 26.789 ( -16.622 0.127 -4.265) 17.161 47.979 ( -9.951 -0.161 14.696) 17.749 48.211 ( -6.879 -0.046 18.926) 20.137 48.564 ( 6.839 0.046 -16.325) 17.700 48.883 ( 8.818 0.039 -14.098) 16.628 98.840 ( 3.230 -0.970 -3.244) 4.679 98.861 ( -1.592 0.113 1.688) 2.323 99.129 ( -0.371 0.546 9.481) 9.504 99.904 ( 0.927 -2.682 -12.127) 12.455 100.760 ( -6.306 -0.395 6.443) 9.024 100.921 ( 3.673 0.418 -5.164) 6.351 101.473 ( 2.452 -2.698 10.892) 11.486 101.931 ( 4.327 6.977 -8.511) 11.825 ======================= Grid point 349 (170/230) ======================= q-point: ( 0.11 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.247 ( -3.980 -0.000 -8.406) 9.300 2.320 ( 0.203 0.000 -2.380) 2.389 2.457 ( 0.391 0.000 9.888) 9.896 2.731 ( 10.529 0.000 -6.766) 12.515 2.786 ( -6.650 -0.000 -0.883) 6.708 2.829 ( -0.695 -0.000 13.616) 13.634 3.073 ( 3.664 0.000 -9.053) 9.766 3.294 ( 3.617 0.000 -4.466) 5.747 3.541 ( -7.068 -0.000 -1.249) 7.177 3.551 ( 2.727 0.000 2.993) 4.049 3.613 ( 4.266 0.000 11.205) 11.990 3.699 ( -3.416 -0.000 -6.413) 7.266 4.257 ( -7.864 -0.000 11.221) 13.703 4.264 ( -3.355 -0.000 -6.771) 7.557 4.673 ( -4.539 -0.000 7.808) 9.031 4.740 ( -2.374 -0.000 -7.939) 8.287 5.054 ( -0.314 -0.000 15.315) 15.318 5.090 ( 15.495 0.000 -3.740) 15.940 5.647 ( 6.208 0.000 -5.831) 8.517 5.685 ( 2.106 0.000 -12.636) 12.811 5.951 ( -3.723 -0.000 3.145) 4.873 5.992 ( -1.062 -0.000 -1.956) 2.226 6.040 ( -2.399 -0.000 8.405) 8.741 6.400 ( 6.795 0.000 -12.134) 13.907 6.698 ( 0.979 0.000 1.526) 1.813 6.892 ( 3.724 0.000 -8.726) 9.487 8.565 ( -5.298 -0.000 -1.705) 5.565 8.887 ( 4.624 0.000 -0.291) 4.633 10.102 ( 0.708 0.000 7.737) 7.769 10.185 ( 3.683 0.000 -3.082) 4.802 10.433 ( 2.763 0.000 -5.174) 5.866 10.478 ( 0.439 0.000 -1.823) 1.875 10.815 ( -0.721 -0.000 0.551) 0.908 10.829 ( -5.453 -0.000 4.045) 6.789 11.517 ( -2.909 -0.000 -1.478) 3.263 11.645 ( -2.022 -0.000 2.735) 3.401 12.019 ( -4.087 -0.000 4.042) 5.748 12.109 ( -2.390 -0.000 5.983) 6.442 13.349 ( -0.274 -0.000 -7.477) 7.482 13.706 ( 8.827 0.000 0.681) 8.853 16.325 ( -12.090 -0.000 -1.013) 12.132 18.171 ( 18.353 0.000 2.124) 18.476 18.959 ( 6.195 0.000 -6.628) 9.072 19.323 ( -0.217 -0.000 -1.356) 1.373 19.558 ( -11.409 -0.000 -3.951) 12.073 20.004 ( 1.019 0.000 2.499) 2.698 20.506 ( 3.135 0.000 6.363) 7.094 20.636 ( 8.654 0.000 -11.275) 14.213 20.983 ( 6.232 0.000 8.793) 10.777 21.396 ( 12.684 0.000 -4.215) 13.366 22.667 ( -7.355 -0.000 -7.538) 10.532 22.668 ( -7.504 -0.000 9.348) 11.988 24.167 ( 1.031 0.000 -2.430) 2.639 24.202 ( 1.888 0.000 0.904) 2.093 24.875 ( -10.465 -0.000 3.079) 10.908 25.127 ( -3.632 -0.000 -8.899) 9.612 25.334 ( -0.077 -0.000 1.038) 1.041 25.752 ( 8.952 0.000 -6.898) 11.302 25.972 ( -10.936 -0.000 0.660) 10.956 26.807 ( 9.245 0.000 8.643) 12.656 47.909 ( -8.374 -0.000 17.110) 19.050 48.233 ( -9.864 -0.000 17.138) 19.774 48.583 ( 8.773 0.000 -13.521) 16.118 48.880 ( 6.320 0.000 -16.543) 17.709 98.666 ( -5.050 -0.000 2.397) 5.590 98.933 ( 1.819 0.000 0.132) 1.824 99.336 ( -6.927 -0.000 -6.981) 9.835 99.479 ( -2.603 -0.000 13.323) 13.575 100.703 ( -1.947 -0.000 4.946) 5.316 101.079 ( 7.152 0.000 -6.269) 9.511 101.573 ( -7.674 -0.000 8.442) 11.409 101.718 ( -0.873 -0.000 -6.751) 6.807 ======================= Grid point 350 (171/230) ======================= q-point: ( 0.22 0.11 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.093 ( -7.324 6.493 -9.166) 13.410 2.173 ( -5.702 -3.935 -8.523) 10.984 2.465 ( -4.526 0.848 3.131) 5.569 2.645 ( -1.773 0.790 -5.300) 5.644 2.810 ( 6.980 6.111 -19.026) 21.167 2.901 ( -2.292 5.826 12.100) 13.624 3.172 ( 7.450 -2.639 5.559) 9.663 3.337 ( -0.170 -5.056 -0.601) 5.094 3.433 ( -3.409 -0.655 1.370) 3.732 3.531 ( -3.130 -1.360 -1.629) 3.782 3.664 ( 4.928 0.741 -5.513) 7.431 3.807 ( 3.988 -0.783 13.670) 14.262 4.175 ( -1.959 0.529 -1.874) 2.762 4.248 ( -3.917 1.141 9.770) 10.587 4.631 ( -2.290 0.999 -6.567) 7.027 4.669 ( -3.435 -3.429 6.245) 7.909 5.139 ( -2.223 -0.004 8.855) 9.130 5.336 ( 12.593 -1.064 -3.186) 13.033 5.568 ( -0.087 0.463 -15.022) 15.030 5.651 ( 2.761 0.293 -6.318) 6.901 5.889 ( -4.155 3.907 1.429) 5.880 5.938 ( -3.110 -1.625 -2.800) 4.489 6.117 ( 0.493 0.385 11.188) 11.206 6.462 ( 8.476 -3.550 -7.052) 11.584 6.713 ( -0.507 -0.423 0.737) 0.989 6.876 ( 3.029 -0.964 -9.514) 10.031 8.466 ( -5.454 -1.324 -0.887) 5.682 8.955 ( 4.582 1.038 -1.489) 4.929 10.176 ( 0.532 -0.477 6.191) 6.233 10.233 ( 3.267 0.152 -1.071) 3.441 10.425 ( 1.936 3.704 -4.581) 6.201 10.464 ( 3.535 -1.340 -4.613) 5.964 10.730 ( -9.094 -0.867 2.620) 9.504 10.828 ( -0.003 1.405 1.746) 2.241 11.484 ( -0.565 2.644 1.742) 3.216 11.639 ( -1.468 -0.955 3.068) 3.533 12.017 ( -1.434 -1.083 5.533) 5.817 12.100 ( -3.334 0.881 3.867) 5.181 13.280 ( -0.565 -0.575 -7.642) 7.685 13.836 ( 5.725 0.038 0.462) 5.743 16.278 ( 3.314 0.184 7.379) 8.091 18.144 ( -11.827 -0.052 -11.474) 16.478 19.177 ( 12.090 -0.200 -2.454) 12.338 19.288 ( -2.145 -0.079 -1.150) 2.435 19.413 ( 3.925 -0.028 -1.549) 4.220 20.001 ( -2.590 0.172 0.056) 2.596 20.550 ( -2.974 1.671 6.233) 7.106 20.686 ( 7.568 -1.675 -10.752) 13.254 21.238 ( 14.150 0.311 8.451) 16.484 21.637 ( 18.740 0.257 -1.640) 18.813 22.452 ( -10.005 0.640 -7.756) 12.675 22.561 ( -13.572 0.337 7.385) 15.455 24.184 ( 2.472 -0.188 -0.454) 2.520 24.242 ( 1.563 -0.446 0.896) 1.857 24.709 ( -9.444 0.882 0.469) 9.496 24.989 ( -3.998 -0.766 -9.230) 10.088 25.350 ( 0.216 -0.276 1.649) 1.686 25.790 ( -2.285 0.635 -0.852) 2.520 25.851 ( 1.940 1.014 -6.176) 6.552 27.023 ( 6.523 -0.933 9.086) 11.223 47.923 ( -7.688 0.102 18.257) 19.810 48.206 ( -10.264 -0.062 16.485) 19.419 48.624 ( 9.188 -0.056 -12.875) 15.818 48.837 ( 5.763 0.047 -17.472) 18.398 98.611 ( -4.385 -0.388 3.247) 5.470 98.936 ( -0.953 0.096 -3.024) 3.172 99.229 ( -1.196 -0.420 0.000) 1.268 99.514 ( -5.281 0.636 11.059) 12.271 100.716 ( -1.487 -0.059 4.946) 5.165 101.122 ( 4.090 0.305 -6.989) 8.103 101.496 ( -9.660 -0.563 7.893) 12.488 101.691 ( 5.979 0.712 -7.392) 9.534 ======================= Grid point 351 (172/230) ======================= q-point: (-0.67 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.748 ( -10.423 8.335 -15.702) 20.608 2.109 ( -3.632 -4.378 -1.683) 5.933 2.400 ( -3.116 -0.765 0.324) 3.225 2.590 ( 0.552 3.412 -4.531) 5.699 2.673 ( 3.064 8.611 -15.284) 17.808 2.871 ( -6.354 2.721 7.696) 10.345 3.246 ( -2.477 0.261 -0.484) 2.538 3.304 ( -6.188 -1.810 7.756) 10.086 3.503 ( 4.264 -1.162 1.874) 4.800 3.585 ( 6.796 -2.096 -1.664) 7.304 3.716 ( 8.921 -0.806 -5.964) 10.761 3.959 ( 1.041 -1.070 9.857) 9.970 4.124 ( -5.142 -1.525 1.393) 5.541 4.268 ( -1.045 5.486 8.242) 9.956 4.564 ( 0.434 -0.420 -2.162) 2.245 4.720 ( -1.376 -3.942 8.392) 9.374 5.111 ( -5.225 -0.355 -0.312) 5.247 5.325 ( -3.107 -0.950 -15.974) 16.301 5.520 ( 0.556 -0.787 -3.164) 3.308 5.673 ( 2.546 2.393 2.549) 4.325 5.793 ( -2.511 3.253 -4.693) 6.238 5.917 ( 1.897 -1.439 2.066) 3.152 6.213 ( 1.295 -0.122 8.017) 8.122 6.598 ( 8.232 -6.230 -4.071) 11.097 6.697 ( -2.466 -0.275 0.584) 2.549 6.845 ( 2.753 -1.822 -11.802) 12.255 8.391 ( -4.448 -2.312 0.272) 5.021 8.999 ( 4.201 2.455 -2.731) 5.580 10.226 ( -1.454 3.647 -0.492) 3.957 10.240 ( 0.795 -2.839 3.102) 4.279 10.412 ( 4.036 4.457 -1.969) 6.327 10.546 ( 6.364 -2.613 -2.126) 7.201 10.604 ( -7.702 -3.010 0.249) 8.273 10.797 ( -2.464 3.902 0.177) 4.618 11.475 ( -0.074 3.531 2.424) 4.283 11.665 ( 0.172 -1.525 2.903) 3.283 12.048 ( -2.791 1.423 1.372) 3.420 12.078 ( -0.032 -1.162 6.345) 6.450 13.211 ( -1.117 -0.910 -6.271) 6.434 13.905 ( 1.958 -0.081 0.397) 1.999 16.539 ( 15.498 0.277 14.702) 21.364 17.732 ( -19.979 -0.855 -18.278) 27.092 19.165 ( -3.255 -0.850 -1.074) 3.532 19.243 ( -2.219 -0.015 -0.661) 2.316 19.687 ( 19.519 0.104 -1.508) 19.577 19.915 ( -6.232 0.556 -2.209) 6.635 20.511 ( -5.513 2.877 6.433) 8.947 20.732 ( 6.104 -3.154 -9.655) 11.850 21.563 ( 15.401 0.530 7.903) 17.318 21.980 ( 21.150 0.387 0.143) 21.154 22.191 ( -11.512 1.117 -7.759) 13.928 22.325 ( -19.767 0.527 4.856) 20.361 24.247 ( 4.115 -0.532 1.104) 4.294 24.274 ( 0.921 -0.701 0.651) 1.328 24.578 ( -5.244 1.073 1.080) 5.461 24.841 ( -4.362 -0.516 -9.768) 10.710 25.369 ( 0.036 -0.910 1.048) 1.388 25.723 ( -3.871 -0.040 1.796) 4.268 25.854 ( 6.051 3.242 -8.758) 11.128 27.185 ( 2.851 -1.732 7.505) 8.213 47.958 ( -7.069 0.167 19.361) 20.612 48.168 ( -10.430 -0.103 15.793) 18.926 48.673 ( 9.190 -0.136 -12.573) 15.574 48.781 ( 5.846 0.131 -18.135) 19.054 98.584 ( -2.834 -0.817 4.036) 4.998 98.862 ( -2.245 0.107 -5.295) 5.753 99.291 ( 3.876 -1.027 5.268) 6.620 99.484 ( -6.738 0.988 7.867) 10.405 100.737 ( -1.492 -0.307 5.471) 5.679 101.092 ( 0.418 0.772 -7.235) 7.288 101.395 ( -10.640 -1.036 7.706) 13.178 101.788 ( 14.832 3.211 -9.210) 17.752 ======================= Grid point 352 (173/230) ======================= q-point: (-0.56 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.423 ( -7.329 10.992 -5.832) 14.441 2.045 ( -6.998 -7.301 -1.023) 10.165 2.350 ( -5.151 1.676 -0.946) 5.498 2.544 ( 10.467 6.713 -11.942) 17.241 2.595 ( -0.538 0.567 -2.810) 2.916 2.829 ( -3.555 -2.434 5.975) 7.366 3.194 ( -2.829 5.548 5.369) 8.223 3.286 ( -6.387 -1.037 9.718) 11.675 3.568 ( 1.081 0.643 0.449) 1.336 3.639 ( 5.058 2.323 -5.842) 8.069 3.848 ( 7.107 2.914 -3.417) 8.407 4.045 ( -0.878 -8.809 -1.411) 8.964 4.081 ( -0.671 -1.188 8.031) 8.146 4.245 ( 0.290 9.057 1.973) 9.274 4.611 ( -0.320 -3.371 3.983) 5.228 4.816 ( -0.568 -4.299 10.696) 11.542 4.998 ( -5.741 1.826 0.587) 6.053 5.107 ( -6.942 -1.261 -14.451) 16.081 5.456 ( -6.847 -3.282 -1.271) 7.698 5.688 ( -1.812 3.300 -1.681) 4.123 5.726 ( 1.415 4.323 4.328) 6.279 6.023 ( 8.126 -0.336 -3.796) 8.975 6.305 ( 0.151 -3.403 7.914) 8.615 6.644 ( -3.700 0.640 -0.094) 3.756 6.745 ( 7.150 -6.548 -3.829) 10.424 6.791 ( 2.188 -2.821 -14.899) 15.321 8.361 ( -2.196 -3.166 1.765) 4.238 9.014 ( 3.347 3.816 -3.490) 6.160 10.145 ( -3.913 4.660 1.822) 6.351 10.309 ( 3.212 -1.661 -1.178) 3.804 10.450 ( -0.020 -0.114 2.508) 2.511 10.488 ( -2.458 -0.968 -1.521) 3.048 10.662 ( -0.346 3.273 0.059) 3.291 10.735 ( 3.715 -2.957 -2.877) 5.551 11.466 ( -0.818 1.779 1.285) 2.342 11.709 ( 1.434 -0.920 1.774) 2.460 11.993 ( -3.246 -0.594 0.402) 3.324 12.153 ( 2.124 1.764 5.613) 6.256 13.156 ( -0.989 -0.661 -3.321) 3.528 13.913 ( -1.404 -0.360 0.193) 1.462 17.010 ( 22.523 0.162 18.097) 28.893 17.220 ( -21.111 -1.967 -20.124) 29.232 19.139 ( -0.354 -1.296 0.322) 1.382 19.205 ( -2.345 0.150 0.576) 2.419 19.744 ( -9.603 1.012 -4.810) 10.788 19.950 ( 13.756 0.072 -3.266) 14.138 20.443 ( -6.524 3.140 7.068) 10.118 20.774 ( 4.902 -3.942 -8.780) 10.801 21.854 ( 5.702 -0.092 4.726) 7.407 21.878 ( -13.170 -0.016 -5.417) 14.240 21.976 ( -17.568 2.288 2.640) 17.912 22.380 ( 21.127 0.238 0.685) 21.140 24.285 ( 0.139 -0.229 -0.515) 0.580 24.341 ( 4.448 -0.125 1.167) 4.600 24.546 ( -0.184 1.095 4.055) 4.205 24.696 ( -3.342 -0.853 -8.105) 8.808 25.381 ( -0.270 -1.738 0.037) 1.759 25.700 ( 0.080 0.484 0.528) 0.721 25.858 ( 5.462 3.770 -6.750) 9.466 27.262 ( -1.535 -2.246 4.068) 4.893 48.009 ( -6.768 0.085 20.212) 21.315 48.124 ( -10.216 -0.051 15.166) 18.286 48.696 ( 6.065 -0.197 -15.969) 17.084 48.753 ( 9.221 0.222 -14.999) 17.608 98.599 ( -0.621 -1.258 4.870) 5.068 98.796 ( -0.455 -0.348 -4.353) 4.391 99.368 ( -4.624 2.277 4.809) 7.049 99.481 ( 3.746 -2.751 5.888) 7.501 100.763 ( -1.941 -0.802 6.622) 6.947 101.024 ( -0.101 1.191 -6.742) 6.847 101.291 ( -10.185 -1.226 8.181) 13.121 101.960 ( 19.583 7.000 -12.249) 24.136 ======================= Grid point 353 (174/230) ======================= q-point: (-0.44 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.283 ( -3.496 7.535 11.894) 14.507 1.968 ( -8.753 -2.062 4.526) 10.068 2.262 ( -1.313 -2.948 -1.108) 3.412 2.539 ( -0.768 -1.194 -4.596) 4.810 2.598 ( 3.724 -1.195 -6.709) 7.766 2.937 ( 7.465 -3.508 4.452) 9.374 3.163 ( -2.822 8.518 10.929) 14.141 3.259 ( -5.982 2.467 10.152) 12.039 3.515 ( -2.611 3.353 -3.703) 5.636 3.669 ( 3.075 3.258 0.534) 4.512 3.821 ( 0.309 7.880 -4.560) 9.109 4.072 ( -0.446 -9.005 -3.865) 9.810 4.207 ( 1.151 -1.437 -0.085) 1.843 4.227 ( 4.315 2.798 5.080) 7.229 4.570 ( -6.224 -0.997 -2.095) 6.643 4.866 ( -7.839 0.359 3.556) 8.615 4.932 ( -1.663 -5.430 -1.366) 5.841 5.029 ( 3.560 -0.090 12.333) 12.837 5.338 ( -7.703 -4.783 -3.853) 9.852 5.624 ( -0.921 2.319 -3.672) 4.440 5.756 ( 1.432 6.494 6.109) 9.030 6.096 ( 5.508 1.172 -5.376) 7.785 6.377 ( -3.375 -2.839 6.384) 7.760 6.577 ( -2.873 -0.618 -0.272) 2.951 6.707 ( 1.281 -4.343 -17.203) 17.789 6.860 ( 5.767 -4.776 -4.977) 8.991 8.396 ( 0.543 -4.015 3.324) 5.241 8.997 ( 2.085 4.967 -3.815) 6.602 10.080 ( -3.462 3.069 5.024) 6.830 10.285 ( -3.626 0.093 -4.491) 5.773 10.424 ( 1.620 1.354 -2.258) 3.091 10.535 ( -4.505 4.022 -0.883) 6.103 10.600 ( 4.267 -3.888 5.159) 7.742 10.863 ( 7.310 -5.048 -3.695) 9.622 11.444 ( -1.886 -1.370 -0.246) 2.344 11.751 ( 2.239 0.040 -0.143) 2.243 11.967 ( -2.487 -3.484 1.580) 4.562 12.207 ( 2.290 5.192 3.761) 6.808 13.137 ( 0.107 -0.114 0.062) 0.169 13.870 ( -3.728 -0.363 -0.460) 3.773 16.743 ( -16.872 -2.408 -17.158) 24.184 17.567 ( 24.244 -0.118 16.864) 29.533 19.123 ( -8.985 0.301 0.990) 9.044 19.178 ( 0.596 -2.001 1.273) 2.445 19.529 ( -6.186 1.436 -6.307) 8.950 20.102 ( 8.304 0.325 -4.284) 9.350 20.369 ( -6.914 2.941 7.562) 10.660 20.798 ( 2.620 -4.014 -8.239) 9.532 21.548 ( -20.785 0.396 0.309) 20.791 21.570 ( -16.304 0.127 -5.816) 17.311 22.131 ( 9.935 0.887 6.835) 12.092 22.704 ( 16.352 0.011 -0.810) 16.372 24.265 ( -1.028 1.400 -1.906) 2.579 24.375 ( 0.533 0.840 -3.772) 3.901 24.610 ( 3.361 -0.727 4.271) 5.483 24.675 ( 3.930 -1.616 2.506) 4.933 25.385 ( -0.693 -2.452 -0.848) 2.686 25.710 ( 2.716 2.522 -2.714) 4.593 25.887 ( 5.959 2.598 -2.545) 6.981 27.227 ( -6.662 -2.172 -0.148) 7.009 48.051 ( -9.482 -0.640 17.949) 20.310 48.099 ( -7.062 0.507 17.300) 18.692 48.646 ( 5.722 -0.013 -17.625) 18.531 48.800 ( 9.822 0.106 -13.407) 16.620 98.663 ( 1.570 -1.692 5.225) 5.712 98.782 ( 1.653 -1.017 -2.590) 3.236 99.272 ( -6.804 2.818 3.040) 7.967 99.654 ( 7.282 -4.381 2.798) 8.947 100.790 ( -3.395 -1.366 7.696) 8.522 100.966 ( 0.872 1.283 -6.004) 6.202 101.226 ( -6.809 -1.330 10.015) 12.184 102.111 ( 19.155 11.002 -15.619) 27.054 ======================= Grid point 354 (175/230) ======================= q-point: (-0.33 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.391 ( -1.017 -2.786 24.147) 24.328 1.856 ( -11.495 4.561 14.462) 19.029 2.340 ( 4.204 -8.479 -2.297) 9.739 2.502 ( -2.401 -4.169 1.737) 5.115 2.622 ( 4.802 -4.701 -7.732) 10.244 3.077 ( 3.740 7.852 3.063) 9.220 3.148 ( -5.086 4.866 10.236) 12.422 3.263 ( -1.985 -0.497 8.113) 8.367 3.444 ( 2.242 3.924 0.312) 4.530 3.676 ( -1.288 2.386 -2.053) 3.401 3.714 ( 0.258 4.959 -4.050) 6.408 4.008 ( -10.375 -4.489 -4.786) 12.276 4.199 ( 2.989 5.706 -0.202) 6.444 4.337 ( 1.565 -2.828 4.889) 5.860 4.523 ( 1.866 -1.839 0.455) 2.659 4.778 ( -1.568 0.971 1.784) 2.566 4.999 ( -1.892 -6.926 8.146) 10.858 5.174 ( -4.948 -3.435 -6.314) 8.726 5.250 ( 4.994 -0.640 8.664) 10.020 5.540 ( -2.559 4.163 -4.732) 6.802 5.800 ( 2.157 3.283 6.224) 7.360 6.101 ( 1.097 1.543 -5.181) 5.516 6.311 ( -6.491 2.100 1.184) 6.924 6.572 ( -0.536 -3.431 -0.071) 3.473 6.620 ( -0.273 -5.475 -12.787) 13.912 6.920 ( 4.571 -1.724 -6.893) 8.448 8.487 ( 2.586 -4.213 4.021) 6.373 8.949 ( 0.668 5.613 -3.803) 6.813 10.075 ( -2.178 -0.004 7.651) 7.955 10.174 ( -4.490 -0.724 -4.132) 6.145 10.401 ( -4.146 3.409 -3.346) 6.325 10.422 ( 1.136 3.114 -0.905) 3.436 10.776 ( 5.442 -3.990 3.931) 7.810 10.972 ( 6.267 -4.213 -5.469) 9.324 11.435 ( -1.022 -5.433 -0.672) 5.569 11.776 ( 2.001 0.912 -2.066) 3.017 11.979 ( -2.341 -4.460 3.341) 6.044 12.221 ( 1.503 6.044 1.995) 6.540 13.163 ( 1.795 0.258 2.328) 2.951 13.784 ( -5.165 0.363 -1.961) 5.536 16.447 ( -4.988 -1.784 -8.561) 10.068 18.046 ( 14.056 0.117 9.434) 16.929 18.840 ( -18.004 -0.648 -2.057) 18.133 19.225 ( 1.002 -1.952 1.097) 2.453 19.490 ( 5.268 1.504 -0.409) 5.493 20.157 ( 2.939 0.662 -4.207) 5.174 20.297 ( -6.734 2.460 7.623) 10.465 20.761 ( -1.947 -2.884 -8.161) 8.872 21.218 ( -18.697 0.338 4.644) 19.268 21.319 ( -6.059 -0.474 -8.581) 10.515 22.326 ( 6.372 0.169 7.473) 9.822 22.905 ( 9.239 -0.041 -3.196) 9.776 24.204 ( -1.594 2.307 -2.564) 3.799 24.328 ( -0.639 -0.474 -4.989) 5.052 24.738 ( 4.375 -1.327 6.505) 7.951 24.847 ( 9.645 -2.526 5.302) 11.293 25.380 ( -0.903 -2.878 -1.540) 3.387 25.693 ( 2.135 4.889 -5.037) 7.337 25.986 ( 8.107 1.306 0.768) 8.248 27.064 ( -12.177 -1.221 -3.225) 12.656 48.017 ( -10.415 -0.530 15.119) 18.367 48.155 ( -6.036 0.147 19.527) 20.439 48.598 ( 6.254 0.059 -17.241) 18.341 48.848 ( 9.436 0.107 -13.634) 16.581 98.753 ( 2.909 -2.035 2.554) 4.373 98.818 ( 2.355 -1.281 0.691) 2.768 99.171 ( -5.403 2.769 3.603) 7.060 99.803 ( 5.372 -5.790 -3.563) 8.665 100.787 ( -5.729 -1.379 7.262) 9.352 100.934 ( 2.220 1.106 -5.502) 6.035 101.272 ( -0.902 -2.350 13.032) 13.273 102.163 ( 13.773 13.588 -17.457) 26.059 ======================= Grid point 355 (176/230) ======================= q-point: (-0.22 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.638 ( -1.135 -7.466 24.295) 25.442 1.819 ( -6.687 1.539 22.957) 23.961 2.370 ( -0.082 -3.481 -4.915) 6.024 2.612 ( 3.234 -10.782 2.301) 11.490 2.719 ( 7.923 -4.941 -3.097) 9.838 3.024 ( -4.971 8.215 3.815) 10.333 3.110 ( -4.355 6.343 9.513) 12.235 3.250 ( 2.104 3.750 -4.502) 6.226 3.477 ( -4.773 -0.331 4.187) 6.358 3.628 ( -0.093 1.694 -1.030) 1.985 3.720 ( 5.361 0.759 -0.913) 5.491 3.797 ( -9.701 -2.090 -1.954) 10.114 4.227 ( 4.956 3.687 -1.268) 6.306 4.390 ( -3.527 -1.243 7.989) 8.821 4.605 ( 0.922 4.809 10.864) 11.917 4.837 ( 8.937 -2.844 -8.040) 12.353 4.964 ( -6.847 -8.868 -13.434) 17.493 5.130 ( -0.472 0.779 13.611) 13.642 5.371 ( -7.165 1.231 -2.005) 7.541 5.468 ( 9.321 4.300 2.911) 10.670 5.881 ( 1.922 -0.866 5.508) 5.897 6.025 ( -2.440 3.023 -2.794) 4.785 6.215 ( -4.318 -1.050 -1.392) 4.657 6.547 ( 3.756 -2.829 -16.390) 17.051 6.595 ( -3.569 -2.336 6.487) 7.764 6.929 ( 4.067 0.875 -8.281) 9.267 8.598 ( 3.156 -3.378 3.420) 5.750 8.877 ( -0.544 5.408 -3.539) 6.486 10.081 ( -3.658 -0.505 -1.179) 3.877 10.136 ( -0.429 -2.277 7.504) 7.854 10.298 ( -1.811 0.896 -3.900) 4.392 10.415 ( 0.225 1.481 0.685) 1.647 10.857 ( 1.688 1.189 -0.392) 2.101 11.040 ( 2.910 -4.325 -6.723) 8.507 11.489 ( 2.309 -6.831 0.129) 7.212 11.767 ( 0.250 0.747 -3.399) 3.490 12.002 ( -2.231 -2.568 5.229) 6.238 12.208 ( -0.532 3.235 0.648) 3.342 13.234 ( 4.295 0.407 3.093) 5.308 13.659 ( -5.706 1.084 -3.825) 6.955 16.504 ( 14.323 -1.059 1.912) 14.489 17.906 ( -27.967 0.627 -7.002) 28.837 18.838 ( 13.453 -1.659 4.444) 14.265 19.238 ( -1.936 -1.355 0.224) 2.374 19.621 ( 8.031 1.150 4.547) 9.301 20.118 ( -3.247 0.764 -3.174) 4.605 20.243 ( -4.845 1.679 7.193) 8.834 20.656 ( -2.031 -1.093 -9.250) 9.534 21.001 ( -12.525 0.258 6.885) 14.295 21.223 ( 1.678 -1.187 -8.530) 8.774 22.477 ( 3.279 -0.476 8.875) 9.473 22.971 ( 2.994 -0.192 -5.124) 5.938 24.154 ( -0.498 1.405 -1.394) 2.041 24.279 ( -0.501 -0.290 -5.020) 5.054 24.867 ( 2.156 -0.984 8.484) 8.808 25.096 ( 11.376 -5.666 1.741) 12.827 25.374 ( 0.128 -2.213 -1.840) 2.881 25.625 ( 0.003 6.249 -5.686) 8.449 26.147 ( 9.977 1.121 2.555) 10.360 26.792 ( -16.351 0.117 -3.530) 16.728 47.974 ( -10.042 -0.415 14.923) 17.992 48.210 ( -6.905 -0.050 18.957) 20.175 48.565 ( 6.886 0.091 -16.409) 17.795 48.884 ( 8.813 0.084 -14.139) 16.661 98.820 ( 2.730 -1.603 -1.109) 3.354 98.859 ( -0.662 -0.455 1.273) 1.505 99.144 ( -1.050 1.467 8.616) 8.802 99.839 ( 0.247 -5.554 -9.350) 10.878 100.750 ( -6.024 -0.873 6.472) 8.885 100.931 ( 3.685 0.857 -5.398) 6.592 101.423 ( 1.687 -3.438 13.023) 13.574 102.088 ( 5.860 12.734 -15.476) 20.881 ======================= Grid point 356 (177/230) ======================= q-point: (-0.11 0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.848 ( 4.457 0.261 18.756) 19.280 2.018 ( -0.292 -9.427 23.563) 25.380 2.372 ( 2.591 -2.785 -4.586) 5.958 2.719 ( -0.050 -7.680 -1.214) 7.775 2.819 ( -4.329 -0.971 2.455) 5.071 2.933 ( 2.535 -0.024 -2.029) 3.247 3.066 ( -3.729 2.755 3.785) 5.985 3.249 ( 7.061 5.542 -5.283) 10.415 3.436 ( -3.700 1.600 6.857) 7.955 3.529 ( -5.414 3.796 1.644) 6.813 3.734 ( -1.419 -1.715 -0.074) 2.227 3.812 ( 4.191 0.638 -2.611) 4.979 4.310 ( 2.630 -3.472 4.538) 6.290 4.383 ( -4.298 -0.017 7.787) 8.894 4.595 ( -5.685 1.683 0.428) 5.944 4.839 ( -0.131 2.714 2.940) 4.003 4.929 ( 7.083 -3.739 -17.563) 19.303 5.173 ( -7.162 3.794 -4.380) 9.213 5.290 ( 3.455 0.482 16.328) 16.696 5.617 ( 7.798 1.526 -0.310) 7.952 5.952 ( 0.016 -2.024 3.920) 4.412 5.982 ( 1.669 0.989 -1.587) 2.506 6.136 ( -5.599 -1.990 -0.351) 5.953 6.489 ( 4.328 -1.057 -16.820) 17.400 6.617 ( -0.915 -0.073 5.684) 5.758 6.916 ( 4.224 1.753 -8.735) 9.860 8.690 ( 1.594 -2.517 2.352) 3.796 8.799 ( -0.302 4.531 -3.335) 5.634 10.032 ( -2.039 0.515 1.777) 2.754 10.177 ( -0.712 -1.018 -0.422) 1.312 10.309 ( 2.785 -3.118 3.630) 5.537 10.420 ( 0.161 -0.725 0.217) 0.774 10.853 ( 0.583 2.585 0.093) 2.651 10.995 ( -3.092 -2.186 -7.691) 8.572 11.585 ( 2.757 -4.104 0.902) 5.026 11.711 ( -2.732 -0.211 -4.325) 5.120 12.036 ( -1.621 -1.525 6.859) 7.211 12.160 ( -3.760 1.418 0.662) 4.072 13.361 ( 8.025 0.167 2.583) 8.432 13.527 ( -4.103 0.972 -5.226) 6.715 16.952 ( 31.108 -0.824 7.338) 31.972 17.277 ( -33.397 0.073 -9.513) 34.726 19.127 ( 13.613 -0.872 1.109) 13.686 19.176 ( -5.389 -0.775 -1.827) 5.743 19.790 ( 6.193 0.606 6.739) 9.172 19.988 ( -8.243 0.555 -2.752) 8.708 20.251 ( 0.399 0.698 6.597) 6.646 20.586 ( 3.524 -0.028 -10.600) 11.171 20.898 ( -7.496 -0.113 8.253) 11.150 21.221 ( 5.000 -0.855 -7.874) 9.367 22.595 ( 0.457 -0.701 10.094) 10.129 22.935 ( -1.417 -0.516 -6.316) 6.494 24.143 ( 0.740 0.532 -0.192) 0.931 24.230 ( -0.262 0.200 -4.847) 4.858 24.960 ( -1.270 -0.875 9.179) 9.307 25.265 ( 1.620 -8.178 -4.545) 9.495 25.431 ( 6.615 -0.356 -0.569) 6.649 25.515 ( 0.556 6.617 -6.233) 9.108 26.346 ( 10.756 1.069 4.543) 11.725 26.476 ( -17.026 0.793 -1.716) 17.131 47.939 ( -9.584 -0.273 15.295) 18.052 48.241 ( -8.140 -0.025 18.260) 19.992 48.552 ( 7.558 0.081 -15.401) 17.156 48.904 ( 8.031 0.027 -14.802) 16.840 98.812 ( -4.317 0.270 0.967) 4.432 98.865 ( 2.739 -0.473 -2.099) 3.483 99.246 ( 1.500 -0.088 12.804) 12.892 99.737 ( -5.207 -3.306 -11.435) 12.992 100.716 ( -4.627 -0.371 5.867) 7.481 100.955 ( 5.294 0.518 -5.531) 7.674 101.560 ( -0.667 -2.352 10.639) 10.917 101.944 ( -0.041 7.691 -10.674) 13.157 ======================= Grid point 359 (178/230) ======================= q-point: ( 0.22 0.22 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( -7.422 -0.000 -19.787) 21.133 2.062 ( -6.482 -0.000 0.821) 6.534 2.393 ( -3.320 -0.000 0.507) 3.358 2.611 ( 0.010 0.000 -1.900) 1.900 2.755 ( 4.894 0.000 -20.890) 21.456 2.877 ( -9.750 -0.000 4.852) 10.891 3.259 ( -3.508 -0.000 5.389) 6.430 3.288 ( -3.195 -0.000 4.382) 5.423 3.497 ( 10.666 0.000 0.901) 10.704 3.559 ( 3.504 0.000 1.011) 3.647 3.713 ( 8.403 0.000 -8.234) 11.765 3.940 ( -0.006 -0.000 6.950) 6.950 4.117 ( -4.707 -0.000 3.893) 6.108 4.318 ( -0.782 -0.000 13.256) 13.279 4.556 ( -0.610 -0.000 -5.538) 5.571 4.691 ( -1.630 -0.000 10.513) 10.638 5.110 ( -4.187 -0.000 -0.674) 4.241 5.316 ( -2.532 -0.000 -17.218) 17.403 5.514 ( -0.377 -0.000 -2.972) 2.996 5.691 ( 3.046 0.000 3.656) 4.759 5.820 ( -3.533 -0.000 -6.280) 7.206 5.902 ( 1.089 0.000 4.279) 4.416 6.218 ( 1.408 0.000 7.339) 7.473 6.548 ( 8.639 0.000 -4.373) 9.683 6.695 ( -2.526 -0.000 1.651) 3.018 6.831 ( 2.123 0.000 -11.027) 11.230 8.373 ( -4.691 -0.000 0.910) 4.778 9.017 ( 4.724 0.000 -3.486) 5.871 10.218 ( 0.417 0.000 3.756) 3.779 10.256 ( -0.300 -0.000 -1.582) 1.610 10.463 ( 4.929 0.000 -1.109) 5.052 10.507 ( 5.869 0.000 -4.701) 7.520 10.578 ( -9.218 -0.000 1.324) 9.313 10.828 ( -2.291 -0.000 0.011) 2.291 11.508 ( -1.014 -0.000 3.108) 3.269 11.648 ( 0.541 0.000 2.132) 2.200 12.060 ( -4.222 -0.000 1.240) 4.400 12.068 ( 1.797 0.000 6.362) 6.611 13.204 ( -1.113 -0.000 -5.942) 6.045 13.904 ( 1.853 0.000 0.417) 1.899 16.541 ( 15.406 0.000 14.782) 21.351 17.725 ( -20.399 -0.000 -18.083) 27.260 19.158 ( -3.322 -0.000 -1.029) 3.478 19.243 ( -2.245 -0.000 -0.407) 2.282 19.688 ( 19.472 0.000 -1.592) 19.537 19.919 ( -6.089 -0.000 -2.307) 6.512 20.536 ( -5.955 -0.000 7.193) 9.338 20.706 ( 6.369 0.000 -10.378) 12.177 21.566 ( 15.390 0.000 7.755) 17.233 21.983 ( 21.072 0.000 -0.254) 21.073 22.200 ( -11.065 -0.000 -7.883) 13.586 22.329 ( -20.046 -0.000 4.875) 20.630 24.243 ( 4.212 0.000 1.121) 4.358 24.268 ( 1.001 0.000 0.537) 1.136 24.587 ( -5.464 -0.000 1.270) 5.610 24.837 ( -4.183 -0.000 -9.638) 10.507 25.362 ( -0.276 -0.000 1.303) 1.332 25.722 ( -3.760 -0.000 1.685) 4.120 25.880 ( 6.491 0.000 -9.684) 11.658 27.172 ( 2.526 0.000 8.097) 8.482 47.959 ( -7.069 -0.000 19.314) 20.567 48.167 ( -10.426 -0.000 15.818) 18.944 48.672 ( 9.155 0.000 -12.563) 15.545 48.782 ( 5.884 0.000 -18.140) 19.071 98.578 ( -2.993 -0.000 4.317) 5.253 98.862 ( -2.434 -0.000 -5.227) 5.766 99.284 ( 4.152 0.000 5.110) 6.584 99.491 ( -7.117 -0.000 8.046) 10.742 100.734 ( -1.520 -0.000 5.310) 5.523 101.097 ( 0.418 0.000 -7.074) 7.087 101.387 ( -10.392 -0.000 7.266) 12.680 101.812 ( 15.989 0.000 -9.883) 18.797 ======================= Grid point 360 (179/230) ======================= q-point: (-0.67 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.580 ( -1.369 8.694 -12.047) 14.919 1.926 ( -10.706 -7.268 -0.592) 12.954 2.365 ( -4.012 0.434 0.811) 4.117 2.589 ( -0.699 0.516 -1.737) 1.943 2.646 ( 5.182 4.112 -18.028) 19.203 2.785 ( -3.515 -2.633 3.882) 5.862 3.231 ( -4.586 0.315 6.332) 7.824 3.313 ( -0.386 2.551 9.568) 9.910 3.578 ( 0.866 0.545 -2.127) 2.360 3.676 ( 9.495 2.441 -4.401) 10.746 3.835 ( 9.989 -2.608 -4.999) 11.471 3.939 ( -2.354 -4.423 0.184) 5.014 4.080 ( -5.245 0.551 6.316) 8.228 4.396 ( 0.691 9.704 7.877) 12.518 4.539 ( -0.953 -6.281 1.524) 6.533 4.770 ( -2.142 -1.720 13.400) 13.678 5.023 ( -4.448 1.257 0.453) 4.644 5.091 ( -6.815 -0.750 -15.193) 16.668 5.419 ( -8.360 -1.515 -0.381) 8.505 5.719 ( -0.523 1.203 -7.098) 7.218 5.787 ( 2.465 2.947 8.170) 9.028 5.994 ( 5.478 -2.355 -0.742) 6.009 6.288 ( 0.497 0.155 6.001) 6.023 6.654 ( -4.121 0.583 2.560) 4.886 6.670 ( 7.637 -3.055 -2.989) 8.752 6.757 ( 0.984 -1.513 -13.778) 13.896 8.329 ( -2.785 -1.147 2.964) 4.225 9.053 ( 4.315 1.391 -5.147) 6.858 10.203 ( -2.728 2.677 -1.143) 3.989 10.279 ( 3.190 -1.484 2.040) 4.066 10.430 ( -8.976 -1.770 2.299) 9.434 10.531 ( 5.830 5.574 -1.734) 8.250 10.620 ( 7.107 -6.087 -3.080) 9.851 10.748 ( -4.852 1.818 -2.160) 5.614 11.493 ( -2.377 1.382 1.562) 3.162 11.692 ( 2.382 -0.950 0.966) 2.740 11.987 ( -4.708 -0.269 0.032) 4.716 12.171 ( 3.977 0.673 5.580) 6.885 13.150 ( -0.877 -0.191 -2.604) 2.754 13.908 ( -1.606 -0.163 0.322) 1.646 17.011 ( 22.315 0.064 18.213) 28.804 17.199 ( -21.785 -0.748 -19.409) 29.187 19.125 ( -0.502 -0.499 0.547) 0.894 19.206 ( -2.528 0.068 0.918) 2.691 19.754 ( -9.300 0.390 -5.152) 10.639 19.951 ( 13.853 0.027 -3.325) 14.246 20.480 ( -7.071 1.579 7.530) 10.449 20.728 ( 5.153 -1.896 -9.030) 10.568 21.849 ( 4.484 -0.296 5.872) 7.395 21.881 ( -14.312 0.216 -8.197) 16.494 22.001 ( -15.598 0.934 3.530) 16.019 22.383 ( 21.470 0.102 -0.030) 21.470 24.283 ( 0.577 -0.090 -0.366) 0.689 24.339 ( 5.116 -0.103 1.561) 5.350 24.558 ( -0.492 0.517 4.480) 4.537 24.686 ( -3.842 -0.391 -8.953) 9.750 25.364 ( -0.658 -0.642 0.464) 1.030 25.705 ( 0.656 0.153 0.381) 0.774 25.899 ( 5.812 1.592 -8.435) 10.367 27.237 ( -2.160 -0.975 5.363) 5.864 48.010 ( -6.909 0.021 20.097) 21.252 48.124 ( -10.109 -0.004 15.246) 18.292 48.694 ( 6.209 -0.082 -15.877) 17.048 48.756 ( 9.106 0.086 -15.115) 17.646 98.587 ( -0.890 -0.410 5.447) 5.534 98.791 ( -0.893 -0.197 -4.342) 4.438 99.404 ( -2.722 2.509 5.214) 6.394 99.441 ( 1.518 -2.634 5.607) 6.378 100.755 ( -2.055 -0.317 6.304) 6.638 101.036 ( -0.106 0.467 -6.691) 6.708 101.278 ( -9.543 -0.436 7.369) 12.065 102.031 ( 21.775 2.560 -13.966) 25.996 ======================= Grid point 361 (180/230) ======================= q-point: (-0.56 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.436 ( -1.954 13.242 3.366) 13.802 1.870 ( -3.107 -11.421 0.084) 11.836 2.233 ( -10.635 -0.797 2.481) 10.950 2.517 ( -4.340 -1.409 -3.660) 5.850 2.607 ( 6.115 1.801 -11.945) 13.540 2.896 ( 8.902 -2.037 4.447) 10.157 3.210 ( -4.594 0.677 7.809) 9.086 3.368 ( -0.157 8.377 10.982) 13.813 3.551 ( 0.253 1.784 -4.611) 4.950 3.713 ( 1.340 1.855 -0.170) 2.295 3.892 ( 1.215 0.802 -6.050) 6.223 3.967 ( 1.114 -1.232 -4.740) 5.022 4.108 ( 2.228 -8.404 4.545) 9.811 4.351 ( 0.587 8.444 -0.451) 8.476 4.554 ( -5.118 -1.333 0.804) 5.350 4.852 ( -4.562 -3.606 11.620) 12.993 4.884 ( -5.797 0.777 -2.974) 6.561 5.015 ( -0.367 -1.819 10.521) 10.684 5.282 ( -7.891 -2.663 -1.860) 8.533 5.667 ( 2.625 3.125 -6.699) 7.844 5.849 ( 1.134 5.900 6.501) 8.852 6.075 ( 3.724 -3.994 -5.284) 7.599 6.343 ( -1.679 -0.947 8.273) 8.495 6.590 ( -5.021 1.429 2.959) 6.000 6.648 ( 0.098 -3.476 -17.186) 17.534 6.796 ( 6.481 -3.623 -2.607) 7.869 8.349 ( -0.270 -2.223 4.985) 5.465 9.055 ( 3.289 2.799 -6.015) 7.404 10.126 ( -3.394 3.033 1.256) 4.721 10.270 ( -6.385 -1.885 -2.032) 6.960 10.435 ( 6.329 -0.265 1.055) 6.422 10.568 ( 2.906 2.790 0.953) 4.140 10.605 ( -5.130 2.500 -2.859) 6.383 10.771 ( 6.415 -7.023 -2.766) 9.906 11.440 ( -3.236 0.447 -0.611) 3.324 11.748 ( 3.203 -0.398 -0.692) 3.301 11.923 ( -3.974 -2.285 1.215) 4.743 12.266 ( 3.725 2.879 3.264) 5.728 13.136 ( 0.110 0.035 0.810) 0.818 13.865 ( -3.639 -0.300 -0.185) 3.656 16.714 ( -17.200 -1.474 -15.960) 23.510 17.565 ( 24.055 -0.090 16.893) 29.395 19.127 ( -9.188 0.343 1.342) 9.292 19.153 ( 0.139 -1.319 1.597) 2.076 19.546 ( -5.805 0.882 -6.781) 8.970 20.106 ( 8.601 0.210 -4.396) 9.661 20.408 ( -7.365 2.183 7.683) 10.864 20.746 ( 3.083 -2.771 -7.852) 8.879 21.552 ( -22.283 0.191 1.207) 22.317 21.569 ( -14.947 -0.154 -7.333) 16.649 22.143 ( 9.708 0.636 5.997) 11.429 22.705 ( 16.605 0.087 -1.464) 16.669 24.280 ( 0.088 0.678 -1.541) 1.685 24.387 ( -0.236 0.694 -3.680) 3.752 24.604 ( 3.084 -0.128 0.674) 3.159 24.652 ( 3.316 -1.374 5.409) 6.492 25.358 ( -0.864 -1.275 -0.420) 1.597 25.737 ( 4.333 1.200 -2.990) 5.399 25.923 ( 5.704 2.060 -4.543) 7.577 27.198 ( -7.249 -1.597 1.750) 7.627 48.044 ( -9.716 -0.395 17.912) 20.381 48.106 ( -6.971 0.335 17.344) 18.696 48.646 ( 5.801 -0.028 -17.670) 18.598 48.801 ( 9.806 0.062 -13.429) 16.629 98.645 ( 1.209 -0.706 6.259) 6.414 98.766 ( 1.057 -0.916 -2.700) 3.041 99.311 ( -6.876 2.263 3.216) 7.921 99.600 ( 6.499 -2.897 3.242) 7.820 100.773 ( -3.463 -0.887 7.395) 8.213 100.982 ( 0.826 0.830 -6.163) 6.273 101.212 ( -6.337 -0.622 9.152) 11.150 102.238 ( 21.963 6.156 -19.015) 29.696 ======================= Grid point 362 (181/230) ======================= q-point: (-0.44 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.404 ( -2.353 5.043 14.714) 15.731 1.906 ( -6.542 0.947 11.567) 13.322 2.159 ( -2.398 -13.836 -1.992) 14.183 2.445 ( -3.278 -3.526 -0.654) 4.859 2.612 ( 6.592 2.077 -7.096) 9.906 3.114 ( 9.822 -1.086 1.761) 10.037 3.196 ( -3.688 1.259 7.704) 8.633 3.331 ( -5.813 7.884 5.708) 11.337 3.514 ( 1.334 5.782 1.660) 6.162 3.697 ( -4.267 -0.268 -3.048) 5.251 3.787 ( -0.779 5.063 -2.548) 5.721 3.943 ( -5.858 -3.467 -2.586) 7.282 4.232 ( 2.888 -3.211 1.361) 4.528 4.332 ( 3.214 3.271 -0.402) 4.603 4.486 ( 2.715 -2.701 -5.129) 6.401 4.823 ( -0.203 3.230 3.596) 4.837 4.879 ( -8.666 -5.970 11.064) 15.269 5.161 ( -1.397 0.127 1.653) 2.168 5.198 ( 0.606 -5.814 9.693) 11.319 5.624 ( 2.456 6.975 -6.114) 9.595 5.863 ( 0.409 4.916 4.233) 6.500 6.082 ( 0.064 -4.167 -7.100) 8.233 6.342 ( -6.353 2.108 5.285) 8.528 6.537 ( -2.442 -3.351 -2.775) 4.989 6.548 ( 0.452 -2.166 -7.233) 7.563 6.891 ( 5.500 -2.151 -4.249) 7.276 8.433 ( 1.963 -2.971 6.396) 7.320 9.021 ( 1.797 4.035 -6.272) 7.672 10.079 ( -3.013 0.699 4.225) 5.236 10.158 ( -5.149 -1.613 -2.845) 6.100 10.443 ( -5.598 2.428 -4.513) 7.589 10.482 ( 3.290 4.913 -4.591) 7.486 10.723 ( 7.378 -3.074 6.664) 10.407 10.889 ( 4.789 -6.692 -4.136) 9.210 11.383 ( -2.522 -1.876 -0.987) 3.295 11.785 ( 2.596 0.412 -2.595) 3.694 11.913 ( -2.523 -4.154 3.662) 6.086 12.298 ( 1.026 4.264 0.532) 4.418 13.167 ( 1.698 0.228 2.879) 3.350 13.788 ( -4.514 0.191 -1.787) 4.858 16.423 ( -4.794 -1.482 -7.630) 9.133 18.047 ( 14.877 0.052 9.512) 17.658 18.831 ( -19.296 -0.495 -2.396) 19.451 19.199 ( 1.002 -1.534 1.645) 2.463 19.511 ( 5.320 1.230 -0.728) 5.509 20.167 ( 3.362 0.605 -4.462) 5.620 20.333 ( -7.092 2.267 7.536) 10.594 20.722 ( -0.779 -2.342 -7.493) 7.889 21.218 ( -18.843 -0.283 4.423) 19.358 21.313 ( -6.665 -0.374 -9.027) 11.227 22.328 ( 6.304 0.113 6.339) 8.940 22.905 ( 9.548 0.028 -3.864) 10.301 24.239 ( -1.326 2.367 -3.083) 4.106 24.318 ( -1.533 -0.888 -4.591) 4.921 24.720 ( 5.886 -1.003 4.090) 7.237 24.811 ( 6.474 -2.216 7.708) 10.308 25.348 ( -0.554 -1.542 -1.064) 1.954 25.754 ( 4.243 3.450 -7.154) 9.005 26.006 ( 7.793 1.284 0.326) 7.904 27.044 ( -12.258 -1.345 -1.275) 12.397 48.009 ( -10.546 -0.473 15.524) 18.773 48.157 ( -6.137 0.210 19.290) 20.244 48.599 ( 6.336 0.017 -17.348) 18.469 48.849 ( 9.434 0.073 -13.646) 16.590 98.732 ( 2.412 -0.764 4.328) 5.014 98.794 ( 2.119 -1.832 0.468) 2.840 99.212 ( -5.511 2.639 3.373) 6.979 99.728 ( 4.227 -4.214 -1.783) 6.229 100.768 ( -5.433 -1.159 7.243) 9.128 100.949 ( 2.154 0.919 -5.788) 6.243 101.247 ( -1.299 -1.238 12.654) 12.780 102.333 ( 16.340 9.360 -22.816) 29.583 ======================= Grid point 363 (182/230) ======================= q-point: (-0.33 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.535 ( -0.173 -4.894 19.897) 20.491 1.868 ( -7.912 4.465 18.715) 20.804 2.242 ( 1.039 -15.204 -6.090) 16.411 2.460 ( 2.513 -6.935 -3.115) 8.007 2.698 ( 6.622 0.397 1.570) 6.817 3.111 ( -6.336 4.848 0.614) 8.002 3.214 ( -6.374 5.318 7.765) 11.367 3.275 ( 4.763 0.302 -2.736) 5.502 3.502 ( -3.296 2.899 4.403) 6.217 3.626 ( 2.526 -0.994 -0.573) 2.774 3.754 ( -5.603 4.112 1.728) 7.161 3.788 ( -4.788 0.734 -0.044) 4.844 4.283 ( 3.449 3.034 -0.306) 4.603 4.378 ( -0.227 -0.309 3.716) 3.736 4.596 ( 7.450 -6.099 -6.390) 11.555 4.824 ( -4.221 -5.886 -3.354) 7.982 4.867 ( 4.094 3.953 3.287) 6.572 5.154 ( -1.486 1.928 10.753) 11.025 5.338 ( -2.560 -4.779 4.347) 6.949 5.568 ( 4.724 8.370 -1.676) 9.756 5.881 ( 0.673 0.970 3.114) 3.331 6.031 ( -1.858 -3.045 -6.055) 7.028 6.224 ( -7.215 2.940 2.131) 8.077 6.491 ( 3.271 -4.575 -14.248) 15.318 6.574 ( -1.844 -0.627 8.432) 8.654 6.939 ( 4.851 0.309 -6.502) 8.118 8.554 ( 2.912 -2.622 6.355) 7.466 8.952 ( 0.267 4.657 -6.158) 7.725 10.067 ( -3.485 -1.449 1.028) 3.912 10.105 ( -0.529 -1.635 3.240) 3.667 10.310 ( -3.641 0.761 -4.723) 6.012 10.446 ( 0.103 2.771 -2.878) 3.996 10.874 ( 4.111 0.795 0.575) 4.226 10.963 ( 2.598 -5.768 -4.300) 7.649 11.398 ( 1.478 -5.232 1.864) 5.748 11.777 ( 0.126 0.616 -4.278) 4.324 11.952 ( -1.580 -3.877 5.996) 7.313 12.256 ( -2.067 3.070 -1.059) 3.850 13.240 ( 4.135 0.372 3.394) 5.362 13.676 ( -5.097 1.070 -4.143) 6.655 16.487 ( 14.342 -1.189 2.258) 14.567 17.916 ( -28.201 0.699 -7.556) 29.204 18.811 ( 13.554 -1.853 4.514) 14.406 19.217 ( -1.733 -1.456 0.546) 2.329 19.640 ( 7.970 1.267 4.234) 9.114 20.131 ( -3.014 0.928 -3.483) 4.698 20.271 ( -5.263 1.979 6.978) 8.962 20.640 ( -1.032 -1.018 -8.713) 8.832 21.000 ( -12.717 -0.364 6.461) 14.269 21.205 ( 1.425 -1.204 -8.568) 8.769 22.469 ( 3.257 -0.566 7.834) 8.503 22.967 ( 3.014 -0.247 -5.919) 6.647 24.177 ( -0.922 1.699 -2.038) 2.808 24.272 ( -0.535 -0.575 -4.140) 4.214 24.854 ( 3.388 -0.715 6.621) 7.472 25.011 ( 6.754 -5.672 3.921) 9.652 25.353 ( 1.637 -0.884 -0.854) 2.047 25.707 ( 1.658 4.907 -8.442) 9.905 26.164 ( 10.185 1.218 2.504) 10.559 26.791 ( -15.973 -0.202 -2.330) 16.143 47.967 ( -10.171 -0.478 15.257) 18.343 48.210 ( -6.938 0.041 18.945) 20.175 48.567 ( 6.965 0.064 -16.534) 17.941 48.885 ( 8.796 0.073 -14.170) 16.679 98.799 ( 2.499 -0.999 0.554) 2.748 98.847 ( 0.081 -1.164 2.056) 2.364 99.169 ( -1.974 1.876 7.321) 7.811 99.760 ( -0.280 -4.875 -6.638) 8.240 100.737 ( -5.655 -0.889 6.547) 8.697 100.943 ( 3.621 0.793 -5.713) 6.811 101.382 ( 1.137 -2.159 14.447) 14.652 102.264 ( 7.210 10.704 -22.396) 25.849 ======================= Grid point 364 (183/230) ======================= q-point: (-0.22 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.780 ( 2.662 -9.720 19.174) 21.661 1.945 ( 1.055 1.030 18.380) 18.439 2.299 ( 1.664 -9.060 -5.697) 10.831 2.562 ( 6.924 -10.362 -9.430) 15.628 2.786 ( -2.668 -2.503 4.424) 5.741 2.960 ( -4.581 1.885 -1.284) 5.117 3.137 ( -6.590 5.243 6.237) 10.479 3.302 ( 5.062 2.189 -2.821) 6.195 3.493 ( -0.636 5.509 6.350) 8.431 3.593 ( -6.430 4.794 2.857) 8.514 3.704 ( -3.296 -3.276 6.374) 7.888 3.801 ( 5.295 -0.503 -1.836) 5.627 4.304 ( -1.078 2.016 2.326) 3.261 4.389 ( -0.670 1.014 3.755) 3.947 4.544 ( -5.394 -7.192 -11.253) 14.403 4.886 ( 10.460 -2.137 -14.815) 18.262 4.925 ( 2.004 7.671 10.210) 12.926 5.202 ( -5.162 0.424 1.339) 5.349 5.307 ( 0.737 1.510 11.803) 11.922 5.646 ( 6.607 2.327 -0.465) 7.021 5.916 ( -0.285 -2.616 2.075) 3.351 5.986 ( 0.058 -1.296 -3.464) 3.698 6.118 ( -5.731 0.660 2.214) 6.180 6.466 ( 5.009 -2.151 -14.418) 15.414 6.620 ( -0.638 0.544 7.153) 7.202 6.946 ( 4.739 2.198 -8.244) 9.760 8.662 ( 2.042 -1.322 4.938) 5.505 8.864 ( -0.493 4.254 -5.762) 7.179 10.039 ( -1.128 0.225 1.610) 1.979 10.153 ( -0.226 -2.265 1.003) 2.487 10.261 ( 0.659 -3.045 0.802) 3.217 10.410 ( -0.616 -0.470 -2.239) 2.369 10.894 ( 1.296 1.995 -1.272) 2.698 10.954 ( -2.496 -2.559 -4.855) 6.029 11.514 ( 3.196 -5.183 3.545) 7.046 11.707 ( -3.138 -0.262 -5.329) 6.190 12.008 ( -1.498 -2.174 7.702) 8.142 12.179 ( -4.123 1.007 -0.717) 4.304 13.364 ( 7.622 0.194 2.785) 8.118 13.545 ( -3.829 1.420 -5.689) 7.003 16.937 ( 30.725 -1.242 7.773) 31.718 17.279 ( -33.540 0.081 -9.940) 34.982 19.110 ( 14.141 -1.346 1.087) 14.247 19.161 ( -5.073 -1.191 -1.982) 5.575 19.802 ( 5.935 0.954 6.516) 8.865 19.999 ( -8.182 0.869 -2.926) 8.733 20.265 ( -0.180 1.151 6.323) 6.430 20.586 ( 4.059 0.121 -10.144) 10.926 20.893 ( -7.760 -0.612 7.740) 10.977 21.205 ( 5.174 -1.183 -7.643) 9.305 22.582 ( 0.501 -1.043 9.517) 9.587 22.925 ( -1.622 -0.868 -6.968) 7.207 24.153 ( 0.262 0.830 -0.349) 0.938 24.233 ( -0.029 0.173 -4.243) 4.246 24.944 ( -1.183 -1.122 7.708) 7.878 25.149 ( 2.613 -7.391 -1.897) 8.065 25.425 ( 6.073 -0.439 0.441) 6.105 25.602 ( -0.308 5.248 -8.946) 10.376 26.366 ( 10.921 1.531 4.367) 11.861 26.489 ( -16.534 0.916 -1.441) 16.622 47.933 ( -9.666 -0.425 15.540) 18.306 48.241 ( -8.088 0.021 18.299) 20.007 48.553 ( 7.620 0.099 -15.514) 17.285 48.904 ( 7.997 0.032 -14.833) 16.851 98.816 ( -3.518 0.238 1.342) 3.773 98.858 ( 2.465 -0.454 -1.145) 2.755 99.245 ( 0.985 -0.017 11.905) 11.946 99.680 ( -4.809 -4.061 -9.111) 11.073 100.709 ( -4.417 -0.510 5.999) 7.467 100.963 ( 5.176 0.552 -5.892) 7.862 101.528 ( -0.537 -1.909 13.476) 13.621 102.071 ( -0.530 8.899 -17.239) 19.407 ======================= Grid point 365 (184/230) ======================= q-point: (-0.11 0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.077 ( 5.727 -11.123 14.275) 18.982 2.175 ( 6.875 -2.613 13.558) 15.425 2.321 ( 2.525 -4.977 -10.085) 11.526 2.634 ( 3.625 -7.990 -10.243) 13.487 2.720 ( -8.062 -1.660 6.933) 10.762 2.954 ( -0.972 -0.110 -0.838) 1.288 3.034 ( -2.926 1.936 1.915) 3.997 3.369 ( 6.369 3.593 -1.967) 7.572 3.478 ( -1.862 2.682 3.997) 5.161 3.540 ( -0.445 4.103 6.515) 7.712 3.657 ( -6.850 -0.739 1.998) 7.173 3.868 ( 2.579 3.608 -2.836) 5.264 4.224 ( -10.164 -3.629 4.846) 11.831 4.355 ( -5.169 -3.021 -1.839) 6.263 4.582 ( 11.376 -2.136 -0.136) 11.575 4.834 ( -0.707 -0.629 -11.176) 11.216 5.019 ( -0.978 9.164 12.115) 15.222 5.077 ( -0.057 3.842 -3.874) 5.456 5.494 ( 7.343 -0.995 8.357) 11.169 5.700 ( 3.702 -0.304 -6.058) 7.106 5.930 ( -2.068 -3.729 0.357) 4.279 5.995 ( 1.285 -2.022 -1.638) 2.902 6.054 ( -3.691 0.785 2.588) 4.576 6.444 ( 6.010 1.533 -12.964) 14.371 6.665 ( 0.841 0.847 4.172) 4.340 6.933 ( 4.581 2.732 -9.087) 10.536 8.687 ( -2.933 1.907 0.242) 3.507 8.818 ( 2.825 0.760 -2.053) 3.574 10.054 ( 0.359 1.292 4.734) 4.920 10.155 ( 1.600 -1.154 -2.927) 3.530 10.364 ( 2.577 -5.533 4.503) 7.585 10.395 ( 0.431 -2.994 -3.538) 4.655 10.862 ( -4.479 -1.040 -3.649) 5.870 10.888 ( -0.211 2.511 1.271) 2.822 11.575 ( -4.227 -2.532 -2.070) 5.344 11.626 ( -0.395 -1.871 0.463) 1.968 12.057 ( -2.221 -0.856 8.078) 8.421 12.100 ( -4.459 0.205 1.184) 4.618 13.438 ( -1.365 1.314 -6.747) 7.008 13.533 ( 9.705 -0.117 1.636) 9.843 16.687 ( -25.965 -0.281 -7.304) 26.975 17.601 ( 35.753 -1.119 8.105) 36.677 19.035 ( -5.851 -1.000 -5.481) 8.079 19.292 ( 6.380 -0.278 -1.483) 6.556 19.798 ( -11.116 0.672 -3.569) 11.694 19.931 ( 3.530 0.366 5.353) 6.423 20.361 ( 5.050 -0.026 6.177) 7.979 20.598 ( 7.906 0.822 -10.652) 13.291 20.876 ( -2.653 -0.851 8.299) 8.754 21.262 ( 7.944 -0.728 -6.212) 10.111 22.656 ( -2.861 -1.083 10.141) 10.592 22.816 ( -4.760 -1.291 -7.307) 8.815 24.160 ( 0.698 0.027 -0.008) 0.699 24.203 ( 1.001 0.980 -3.081) 3.385 24.948 ( -6.719 -2.597 5.453) 9.035 25.196 ( 0.998 -3.473 -3.277) 4.878 25.420 ( -3.356 3.953 -5.102) 7.274 25.603 ( 9.140 -1.842 -4.442) 10.327 26.201 ( -14.924 1.072 0.206) 14.964 26.593 ( 11.100 1.773 6.335) 12.902 47.912 ( -9.070 -0.323 16.214) 18.582 48.248 ( -9.126 0.083 17.708) 19.922 48.559 ( 8.252 0.106 -14.477) 16.664 48.903 ( 7.123 -0.028 -15.627) 17.174 98.746 ( -4.829 0.822 1.263) 5.059 98.897 ( 2.403 -0.018 -0.204) 2.412 99.371 ( 0.051 -0.924 13.349) 13.381 99.517 ( -7.354 -2.115 -9.020) 11.828 100.698 ( -2.978 -0.213 5.486) 6.246 101.010 ( 6.671 0.137 -6.145) 9.071 101.603 ( -4.266 -0.204 11.525) 12.291 101.860 ( -3.530 4.308 -11.140) 12.454 ======================= Grid point 369 (185/230) ======================= q-point: (-0.67 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.621 ( 7.532 0.000 -3.469) 8.292 1.695 ( -10.662 -0.000 1.229) 10.732 2.230 ( -13.450 -0.000 4.832) 14.292 2.506 ( -5.175 -0.000 -3.587) 6.297 2.624 ( 7.116 0.000 -13.899) 15.615 2.881 ( 8.997 0.000 4.472) 10.047 3.216 ( -4.269 -0.000 7.605) 8.721 3.433 ( 1.485 0.000 9.255) 9.374 3.565 ( 2.428 0.000 -4.145) 4.804 3.712 ( -2.252 -0.000 -3.799) 4.416 3.927 ( 5.246 0.000 -1.172) 5.375 3.968 ( 6.517 0.000 -5.292) 8.395 4.013 ( -5.024 -0.000 3.373) 6.051 4.425 ( -1.905 -0.000 -4.992) 5.343 4.537 ( -3.081 -0.000 5.015) 5.886 4.822 ( -5.481 -0.000 10.096) 11.488 4.897 ( -3.733 -0.000 2.876) 4.713 4.995 ( -3.666 -0.000 7.655) 8.487 5.263 ( -7.640 -0.000 -0.574) 7.661 5.695 ( 4.636 0.000 -7.961) 9.212 5.905 ( 1.864 0.000 6.203) 6.477 6.025 ( 1.017 0.000 -2.570) 2.764 6.341 ( -0.777 -0.000 7.164) 7.206 6.603 ( -5.709 -0.000 4.379) 7.195 6.619 ( -0.139 -0.000 -17.407) 17.408 6.767 ( 6.814 0.000 -1.629) 7.006 8.333 ( -0.531 -0.000 5.514) 5.539 9.075 ( 3.724 0.000 -6.819) 7.769 10.154 ( -2.808 -0.000 -1.273) 3.083 10.250 ( -7.832 -0.000 0.029) 7.832 10.429 ( 7.338 0.000 4.326) 8.518 10.617 ( 4.344 0.000 -5.950) 7.367 10.625 ( -6.128 -0.000 -4.301) 7.486 10.694 ( 5.464 0.000 1.512) 5.669 11.445 ( -3.822 -0.000 -0.717) 3.888 11.744 ( 3.763 0.000 -0.938) 3.878 11.906 ( -4.547 -0.000 1.085) 4.674 12.288 ( 4.186 0.000 3.101) 5.210 13.137 ( 0.081 0.000 1.088) 1.091 13.862 ( -3.608 -0.000 -0.074) 3.609 16.703 ( -17.316 -0.000 -15.524) 23.256 17.564 ( 23.977 0.000 16.907) 29.338 19.131 ( -10.541 -0.000 1.535) 10.652 19.142 ( 1.266 0.000 1.645) 2.075 19.553 ( -5.667 -0.000 -6.963) 8.978 20.107 ( 8.721 0.000 -4.442) 9.788 20.425 ( -7.716 -0.000 7.868) 11.021 20.725 ( 3.491 0.000 -7.878) 8.617 21.553 ( -23.960 -0.000 2.651) 24.106 21.568 ( -13.345 -0.000 -8.985) 16.088 22.148 ( 9.550 0.000 5.704) 11.123 22.706 ( 16.710 0.000 -1.733) 16.799 24.285 ( 0.461 0.000 -1.328) 1.406 24.393 ( -0.432 -0.000 -3.630) 3.656 24.604 ( 2.892 0.000 -2.450) 3.790 24.640 ( 3.130 0.000 8.165) 8.744 25.348 ( -0.856 -0.000 -0.309) 0.911 25.746 ( 4.859 0.000 -2.981) 5.701 25.939 ( 5.635 0.000 -5.402) 7.807 27.186 ( -7.484 -0.000 2.516) 7.895 48.041 ( -9.793 -0.000 17.905) 20.408 48.108 ( -6.943 -0.000 17.351) 18.688 48.645 ( 5.833 0.000 -17.688) 18.625 48.802 ( 9.794 0.000 -13.433) 16.625 98.640 ( 1.079 0.000 6.808) 6.893 98.759 ( 0.845 0.000 -2.907) 3.027 99.329 ( -7.083 -0.000 3.262) 7.798 99.577 ( 6.466 0.000 3.387) 7.299 100.766 ( -3.482 -0.000 7.270) 8.061 100.988 ( 0.806 0.000 -6.225) 6.277 101.208 ( -6.130 -0.000 8.817) 10.738 102.284 ( 22.866 0.000 -20.196) 30.508 ======================= Grid point 371 (186/230) ======================= q-point: (-0.56 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.531 ( -2.819 10.908 5.390) 12.489 1.807 ( 4.371 -12.610 1.206) 13.400 2.053 ( -13.747 -0.870 9.482) 16.723 2.406 ( -3.667 -1.616 -1.462) 4.266 2.646 ( 7.095 1.638 -7.748) 10.633 3.091 ( 10.429 -1.241 2.464) 10.788 3.213 ( -3.812 0.853 8.457) 9.315 3.411 ( -4.902 2.765 -3.554) 6.657 3.597 ( -1.205 4.664 2.386) 5.376 3.663 ( -2.454 -3.432 2.277) 4.794 3.844 ( -4.154 1.550 -5.425) 7.007 3.947 ( -1.183 4.312 0.532) 4.503 4.143 ( 5.778 -6.913 1.013) 9.067 4.383 ( 2.113 2.484 -3.114) 4.509 4.455 ( 0.644 -1.392 -7.553) 7.707 4.774 ( -8.076 -3.131 6.000) 10.537 4.946 ( -1.061 8.351 13.226) 15.678 5.080 ( 0.663 -8.575 11.922) 14.700 5.176 ( -2.985 0.422 2.039) 3.639 5.719 ( 6.864 4.833 -7.327) 11.142 5.929 ( -1.285 4.078 2.403) 4.905 6.000 ( -2.855 -5.884 -3.819) 7.574 6.369 ( -4.222 1.355 7.550) 8.755 6.479 ( 1.017 -2.805 -17.170) 17.427 6.550 ( -4.592 0.531 6.518) 7.990 6.866 ( 6.081 -1.007 -2.412) 6.619 8.403 ( 1.701 -1.080 7.468) 7.735 9.061 ( 2.392 1.465 -7.495) 8.003 10.096 ( -3.163 1.420 1.084) 3.633 10.130 ( -5.944 -1.954 -0.670) 6.293 10.469 ( -6.322 0.951 -5.511) 8.440 10.551 ( 5.734 3.573 -9.548) 11.697 10.692 ( 7.746 -1.026 7.886) 11.101 10.799 ( 3.369 -4.466 -0.052) 5.594 11.370 ( -3.349 -0.319 -1.704) 3.772 11.789 ( 3.094 0.117 -2.943) 4.272 11.869 ( -2.702 -1.644 3.805) 4.948 12.340 ( 0.673 1.486 -0.069) 1.633 13.169 ( 1.577 0.084 3.209) 3.577 13.790 ( -4.115 0.049 -1.637) 4.429 16.407 ( -4.680 -0.565 -7.093) 8.517 18.047 ( 15.392 0.008 9.569) 18.124 18.826 ( -20.119 -0.176 -2.622) 20.289 19.183 ( 1.005 -0.570 1.906) 2.229 19.524 ( 5.377 0.469 -0.925) 5.476 20.173 ( 3.658 0.245 -4.625) 5.901 20.357 ( -7.439 0.943 7.559) 10.648 20.698 ( 0.125 -0.920 -7.238) 7.297 21.213 ( -19.048 -0.224 4.439) 19.560 21.309 ( -6.986 -0.142 -9.332) 11.658 22.329 ( 6.198 0.035 5.693) 8.415 22.905 ( 9.711 0.026 -4.320) 10.628 24.269 ( -0.471 1.580 -2.734) 3.192 24.303 ( -2.815 -1.031 -5.003) 5.832 24.710 ( 7.237 -0.339 2.044) 7.527 24.788 ( 4.291 -0.882 9.583) 10.537 25.334 ( -0.230 -0.470 -0.862) 1.009 25.789 ( 5.471 1.239 -8.160) 9.902 26.020 ( 7.460 0.558 -0.124) 7.482 27.029 ( -12.331 -0.604 0.018) 12.345 48.004 ( -10.619 -0.186 15.761) 19.006 48.160 ( -6.193 0.099 19.136) 20.113 48.599 ( 6.390 -0.001 -17.418) 18.553 48.850 ( 9.423 0.024 -13.637) 16.576 98.729 ( 2.028 0.189 6.621) 6.927 98.771 ( 2.079 -1.139 -0.907) 2.538 99.241 ( -5.662 1.128 3.165) 6.584 99.685 ( 3.881 -1.548 -0.990) 4.294 100.756 ( -5.234 -0.452 7.240) 8.945 100.959 ( 2.090 0.355 -5.978) 6.343 101.235 ( -1.420 -0.382 12.323) 12.410 102.426 ( 17.464 3.232 -25.490) 31.067 ======================= Grid point 372 (187/230) ======================= q-point: (-0.44 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.527 ( 0.639 3.998 10.582) 11.330 1.928 ( -6.080 2.051 15.968) 17.209 1.988 ( -0.243 -16.247 -4.586) 16.884 2.395 ( 2.006 -2.951 -2.146) 4.164 2.709 ( 3.930 0.826 1.432) 4.263 3.177 ( -7.640 4.156 -0.020) 8.697 3.239 ( -0.749 -0.364 2.139) 2.295 3.281 ( 1.214 -0.116 1.753) 2.136 3.500 ( -5.504 -2.562 -0.616) 6.102 3.664 ( 0.519 5.359 4.491) 7.011 3.795 ( -1.198 -0.237 -1.147) 1.676 3.835 ( -6.881 6.310 3.332) 9.913 4.280 ( 3.478 -3.599 2.598) 5.639 4.392 ( 3.181 2.129 -2.419) 4.528 4.499 ( 5.317 -5.371 -10.804) 13.185 4.734 ( 0.242 -4.672 0.627) 4.720 4.983 ( 2.564 9.305 8.518) 12.873 5.178 ( -2.123 1.269 9.071) 9.402 5.245 ( -0.334 -7.752 7.272) 10.635 5.696 ( 2.131 8.907 -3.048) 9.652 5.899 ( -0.558 0.159 -0.119) 0.592 5.957 ( -2.033 -5.397 -5.125) 7.715 6.282 ( -6.815 4.217 2.298) 8.337 6.423 ( 3.397 -4.557 -12.742) 13.953 6.572 ( -1.840 0.175 10.237) 10.403 6.939 ( 5.426 -0.180 -4.598) 7.114 8.523 ( 3.045 -1.488 8.158) 8.834 9.007 ( 0.605 2.699 -7.583) 8.071 10.044 ( -3.566 -1.323 1.619) 4.133 10.088 ( -0.860 -0.894 1.288) 1.788 10.319 ( -4.828 0.441 -5.394) 7.253 10.493 ( 0.904 3.336 -8.247) 8.942 10.856 ( 1.145 -3.939 -0.772) 4.174 10.906 ( 7.014 -0.839 2.509) 7.496 11.342 ( 0.207 -2.526 1.725) 3.066 11.784 ( 0.212 0.389 -4.891) 4.911 11.902 ( -0.832 -2.668 6.567) 7.137 12.291 ( -3.562 1.617 -1.938) 4.366 13.244 ( 3.972 0.187 3.670) 5.411 13.688 ( -4.592 0.629 -4.289) 6.315 16.472 ( 14.342 -0.769 2.540) 14.586 17.925 ( -28.422 0.448 -8.040) 29.541 18.788 ( 13.641 -1.191 4.568) 14.434 19.199 ( -1.576 -0.913 0.712) 1.955 19.655 ( 7.943 0.809 3.978) 8.921 20.143 ( -2.804 0.643 -3.754) 4.729 20.296 ( -5.637 1.341 6.816) 8.946 20.628 ( -0.113 -0.584 -8.386) 8.407 20.992 ( -13.001 -0.558 6.469) 14.532 21.191 ( 1.298 -0.709 -8.736) 8.861 22.462 ( 3.220 -0.381 7.027) 7.739 22.964 ( 2.972 -0.179 -6.608) 7.248 24.200 ( -1.588 1.301 -2.672) 3.370 24.263 ( -0.285 -0.656 -3.262) 3.340 24.850 ( 5.386 0.138 4.065) 6.749 24.940 ( 3.242 -3.770 6.172) 7.925 25.345 ( 2.234 -0.317 -0.199) 2.265 25.763 ( 2.512 2.745 -10.236) 10.891 26.179 ( 10.301 0.768 2.463) 10.619 26.787 ( -15.675 -0.317 -1.191) 15.723 47.961 ( -10.274 -0.312 15.532) 18.625 48.211 ( -6.963 0.073 18.896) 20.138 48.567 ( 7.039 0.023 -16.645) 18.072 48.886 ( 8.774 0.037 -14.170) 16.666 98.793 ( 2.285 0.166 1.315) 2.641 98.827 ( 0.615 -1.479 3.265) 3.636 99.194 ( -2.683 1.379 6.180) 6.876 99.704 ( -0.402 -2.661 -5.159) 5.819 100.726 ( -5.366 -0.553 6.655) 8.567 100.953 ( 3.520 0.463 -5.981) 6.956 101.359 ( 0.831 -1.014 15.108) 15.165 102.385 ( 7.958 5.702 -26.615) 28.359 ======================= Grid point 373 (188/230) ======================= q-point: (-0.33 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.663 ( 2.853 -4.600 12.914) 14.003 1.981 ( 1.191 2.473 14.906) 15.156 2.096 ( 2.272 -16.594 -6.287) 17.890 2.473 ( 8.992 -2.832 -7.434) 12.005 2.749 ( -4.537 -2.418 6.122) 7.994 2.978 ( -8.147 0.694 -2.524) 8.557 3.197 ( -7.163 2.939 6.033) 9.815 3.329 ( 4.359 1.808 -0.197) 4.723 3.532 ( 0.232 -2.034 6.599) 6.909 3.666 ( -3.823 1.913 6.435) 7.726 3.674 ( -5.508 4.499 1.625) 7.296 3.814 ( 3.389 1.601 -1.437) 4.014 4.330 ( -3.588 0.611 5.615) 6.692 4.419 ( 2.779 2.623 -3.507) 5.187 4.435 ( -1.420 -6.201 -9.901) 11.769 4.860 ( 11.156 -1.555 -11.767) 16.289 5.027 ( 0.842 5.779 7.767) 9.718 5.205 ( -1.849 0.559 3.741) 4.210 5.316 ( 0.562 -0.658 10.281) 10.317 5.681 ( 1.552 2.200 1.172) 2.936 5.884 ( -1.246 -1.506 -1.113) 2.250 5.945 ( 1.580 -3.552 -4.916) 6.267 6.158 ( -6.067 3.899 2.482) 7.627 6.430 ( 6.258 -2.661 -11.504) 13.363 6.631 ( -0.742 0.918 9.062) 9.139 6.974 ( 5.213 1.460 -7.203) 9.011 8.649 ( 2.705 -0.575 7.043) 7.566 8.918 ( -0.862 3.048 -7.374) 8.026 10.034 ( -0.340 -0.877 1.844) 2.070 10.117 ( 0.473 -2.295 1.592) 2.833 10.227 ( -1.783 -1.580 -1.678) 2.914 10.414 ( -0.623 1.131 -6.202) 6.335 10.868 ( -1.761 -4.117 -1.243) 4.647 10.962 ( 1.217 2.277 -2.493) 3.589 11.446 ( 3.659 -3.868 5.803) 7.876 11.705 ( -3.623 -0.090 -6.299) 7.267 11.977 ( -0.391 -1.930 8.604) 8.826 12.187 ( -5.351 0.205 -1.766) 5.639 13.366 ( 7.180 0.109 3.054) 7.803 13.564 ( -3.509 1.194 -6.093) 7.132 16.919 ( 30.362 -1.076 8.243) 31.479 17.280 ( -33.757 0.042 -10.412) 35.326 19.091 ( 14.848 -1.180 1.030) 14.931 19.144 ( -4.892 -1.064 -2.182) 5.461 19.815 ( 5.730 0.864 6.268) 8.536 20.011 ( -8.180 0.784 -3.131) 8.794 20.282 ( -0.832 1.094 6.016) 6.171 20.589 ( 4.769 0.275 -9.786) 10.889 20.880 ( -8.153 -0.967 7.577) 11.172 21.189 ( 5.413 -0.922 -7.545) 9.332 22.567 ( 0.572 -0.886 8.908) 8.970 22.912 ( -1.906 -0.835 -7.656) 7.934 24.165 ( -0.179 0.746 -0.520) 0.926 24.234 ( 0.123 0.007 -3.541) 3.544 24.932 ( -1.588 -0.493 5.902) 6.132 25.056 ( 4.018 -5.355 -0.288) 6.701 25.419 ( 5.200 -0.259 1.516) 5.423 25.665 ( -0.704 3.384 -10.645) 11.192 26.387 ( 11.309 1.271 4.133) 12.108 26.500 ( -16.262 0.518 -0.942) 16.298 47.927 ( -9.756 -0.378 15.804) 18.577 48.242 ( -8.042 0.069 18.310) 19.998 48.554 ( 7.702 0.064 -15.645) 17.438 48.904 ( 7.956 0.021 -14.845) 16.843 98.819 ( -2.648 0.209 1.940) 3.289 98.853 ( 2.202 -0.318 -0.142) 2.230 99.246 ( 0.355 0.150 10.735) 10.742 99.628 ( -4.354 -2.878 -7.441) 9.089 100.702 ( -4.234 -0.419 6.171) 7.496 100.970 ( 5.018 0.350 -6.208) 7.991 101.506 ( -0.623 -1.116 15.582) 15.634 102.184 ( -0.764 6.286 -22.493) 23.367 ======================= Grid point 374 (189/230) ======================= q-point: (-0.22 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.894 ( 4.359 -11.409 12.125) 17.210 2.165 ( 1.862 -4.807 0.863) 5.227 2.190 ( 9.599 -8.135 -1.570) 12.680 2.554 ( 6.993 -2.330 -12.886) 14.845 2.700 ( -8.649 -0.936 8.222) 11.970 2.923 ( -0.509 -4.043 2.821) 4.956 3.084 ( -7.389 3.897 3.908) 9.223 3.400 ( 4.234 1.349 2.176) 4.948 3.507 ( -4.697 0.657 -0.220) 4.748 3.603 ( -3.897 3.549 2.693) 5.919 3.661 ( -3.738 0.973 10.223) 10.929 3.881 ( 4.483 -0.513 -0.050) 4.513 4.236 ( -8.574 4.297 0.956) 9.638 4.310 ( -3.767 -2.780 -4.974) 6.830 4.559 ( 12.640 -0.549 -0.706) 12.671 4.814 ( -1.845 -1.966 -13.196) 13.469 5.104 ( 1.908 1.025 5.647) 6.048 5.173 ( 0.266 9.991 2.144) 10.221 5.480 ( 6.278 -1.002 9.351) 11.308 5.685 ( -0.326 -1.697 -3.364) 3.782 5.869 ( -2.297 -4.520 -1.458) 5.276 5.965 ( 2.627 -1.839 -3.333) 4.625 6.075 ( -3.102 1.834 1.004) 3.741 6.468 ( 7.742 1.665 -8.755) 11.805 6.683 ( 0.408 1.451 5.565) 5.765 6.974 ( 5.013 2.745 -9.301) 10.917 8.718 ( -0.746 2.128 3.100) 3.833 8.831 ( 0.357 0.952 -4.989) 5.091 10.071 ( 1.428 0.717 3.362) 3.722 10.135 ( 1.713 -1.652 -2.054) 3.144 10.280 ( 1.448 -5.609 5.055) 7.688 10.357 ( -0.233 -1.689 -5.605) 5.858 10.835 ( -4.138 -2.446 -0.450) 4.828 10.927 ( -0.428 2.389 -1.449) 2.827 11.542 ( -3.151 -1.758 0.010) 3.609 11.594 ( -1.281 -2.350 -0.873) 2.815 12.047 ( -1.593 -0.486 8.911) 9.066 12.094 ( -4.682 -0.892 0.331) 4.778 13.459 ( -1.079 1.486 -7.098) 7.332 13.531 ( 9.293 -0.184 1.963) 9.500 16.682 ( -26.038 -0.330 -7.639) 27.138 17.583 ( 35.469 -1.265 9.021) 36.620 19.019 ( -5.541 -1.105 -5.943) 8.200 19.287 ( 7.379 -0.452 -1.948) 7.646 19.809 ( -11.053 0.851 -3.567) 11.645 19.936 ( 2.958 0.394 5.327) 6.106 20.361 ( 4.117 0.089 5.841) 7.146 20.613 ( 8.373 1.152 -10.175) 13.227 20.860 ( -2.756 -1.337 7.983) 8.551 21.251 ( 8.093 -0.763 -5.985) 10.094 22.639 ( -2.759 -1.135 9.913) 10.352 22.795 ( -5.008 -1.578 -7.632) 9.264 24.164 ( 0.419 0.534 0.180) 0.702 24.214 ( 1.137 0.470 -2.711) 2.977 24.907 ( -6.681 -2.676 3.298) 7.917 25.150 ( 3.881 -2.783 -1.386) 4.973 25.471 ( -2.216 2.983 -4.894) 6.145 25.578 ( 4.993 -1.426 -4.590) 6.930 26.218 ( -14.953 1.145 0.279) 15.000 26.619 ( 11.523 1.656 5.831) 13.021 47.907 ( -9.137 -0.378 16.425) 18.799 48.249 ( -9.051 0.126 17.699) 19.880 48.561 ( 8.329 0.104 -14.607) 16.815 48.902 ( 7.074 -0.031 -15.634) 17.160 98.760 ( -4.473 0.936 1.081) 4.696 98.898 ( 2.498 0.131 0.432) 2.538 99.356 ( -0.103 -0.988 12.428) 12.468 99.485 ( -6.523 -2.023 -7.629) 10.239 100.695 ( -2.929 -0.236 5.750) 6.457 101.012 ( 6.419 0.022 -6.561) 9.179 101.600 ( -4.206 -0.170 14.461) 15.061 101.925 ( -4.891 4.265 -15.745) 17.030 ======================= Grid point 375 (190/230) ======================= q-point: (-0.11 0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.112 ( -2.723 -9.968 -1.211) 10.404 2.175 ( 2.727 -8.377 0.340) 8.816 2.393 ( 4.378 -4.235 -0.916) 6.159 2.560 ( 5.427 -6.456 -13.725) 16.110 2.663 ( -2.045 -3.750 2.364) 4.882 2.870 ( -9.115 3.082 4.637) 10.681 3.091 ( 3.455 0.531 7.919) 8.656 3.436 ( 0.285 0.311 -4.607) 4.626 3.482 ( -1.069 -1.432 5.769) 6.040 3.535 ( -2.276 1.138 1.017) 2.740 3.693 ( -0.102 4.386 11.767) 12.558 3.872 ( -2.745 7.762 -6.599) 10.551 4.109 ( -3.770 -2.205 5.117) 6.728 4.249 ( -2.833 -2.543 -1.416) 4.062 4.690 ( -3.654 -3.804 -8.834) 10.288 4.792 ( 8.677 2.308 3.133) 9.510 5.063 ( 4.429 7.184 -5.128) 9.876 5.221 ( 1.038 3.712 12.360) 12.947 5.633 ( 3.491 -2.754 -7.021) 8.311 5.641 ( 1.980 -0.614 -4.534) 4.985 5.840 ( -3.823 -5.692 -0.881) 6.913 5.985 ( -0.125 -0.788 -1.464) 1.667 6.051 ( 0.098 0.620 3.211) 3.272 6.511 ( 7.872 5.863 -6.143) 11.579 6.717 ( 0.990 1.327 1.925) 2.539 6.947 ( 4.311 3.000 -10.573) 11.805 8.633 ( -4.473 3.926 -2.716) 6.542 8.857 ( 2.805 -1.755 0.141) 3.312 10.115 ( 2.119 0.081 1.577) 2.642 10.196 ( 3.357 1.196 3.731) 5.160 10.336 ( 1.480 -4.212 -5.858) 7.365 10.388 ( 1.097 -6.141 2.637) 6.773 10.776 ( -3.519 -1.055 1.017) 3.812 10.882 ( -3.298 1.417 -0.101) 3.591 11.445 ( -3.961 -3.096 -3.039) 5.875 11.634 ( -0.848 -1.164 4.159) 4.402 12.040 ( -3.140 -1.774 1.771) 4.018 12.088 ( -2.898 1.268 8.595) 9.159 13.378 ( 0.089 1.628 -7.922) 8.088 13.702 ( 8.652 -0.288 1.046) 8.720 16.316 ( -12.049 -0.518 -1.310) 12.131 18.157 ( 18.591 -0.740 3.283) 18.893 18.944 ( 6.999 -0.862 -7.080) 9.993 19.328 ( 0.496 0.199 -2.412) 2.471 19.573 ( -11.502 0.857 -3.808) 12.146 20.002 ( 0.527 -0.165 2.600) 2.658 20.473 ( 1.332 -1.498 5.548) 5.899 20.673 ( 9.805 1.909 -10.302) 14.350 20.965 ( 6.469 -1.115 8.594) 10.815 21.385 ( 12.445 -0.656 -3.754) 13.015 22.627 ( -7.727 -1.729 -2.238) 8.229 22.656 ( -7.206 -1.193 4.215) 8.433 24.169 ( 1.048 0.570 -0.649) 1.358 24.225 ( 1.919 0.760 -0.290) 2.084 24.814 ( -8.733 -2.960 1.199) 9.298 25.158 ( -1.583 1.166 -6.488) 6.780 25.358 ( -1.159 1.396 -2.488) 3.080 25.678 ( 6.431 -3.855 -3.842) 8.425 25.989 ( -11.620 0.983 0.989) 11.703 26.847 ( 9.967 1.988 7.512) 12.638 47.904 ( -8.446 -0.336 17.313) 19.266 48.236 ( -9.791 0.175 17.089) 19.695 48.586 ( 8.864 0.128 -13.673) 16.295 48.879 ( 6.263 -0.086 -16.527) 17.674 98.685 ( -4.598 1.139 1.715) 5.038 98.937 ( 1.745 0.236 -0.067) 1.762 99.327 ( -5.838 -0.428 -5.303) 7.899 99.451 ( -2.436 -1.590 12.172) 12.515 100.702 ( -1.969 -0.042 5.383) 5.732 101.071 ( 6.903 -0.493 -6.987) 9.835 101.602 ( -8.234 1.469 11.289) 14.050 101.724 ( -3.141 0.435 -9.191) 9.722 ======================= Grid point 380 (191/230) ======================= q-point: (-0.56 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( 1.942 0.000 3.546) 4.043 1.805 ( 1.389 0.000 -1.547) 2.079 1.965 ( -8.798 -0.000 15.695) 17.993 2.372 ( 2.313 0.000 -1.882) 2.981 2.716 ( 2.516 0.000 1.223) 2.797 3.215 ( -6.683 -0.000 -5.893) 8.910 3.239 ( -2.765 -0.000 9.101) 9.512 3.268 ( 2.995 0.000 0.447) 3.028 3.476 ( -6.922 -0.000 -1.197) 7.024 3.717 ( -1.400 -0.000 6.504) 6.653 3.784 ( 2.338 0.000 -3.634) 4.321 3.895 ( -8.873 -0.000 3.006) 9.369 4.236 ( 5.598 0.000 2.336) 6.066 4.414 ( 3.236 0.000 -2.853) 4.314 4.458 ( 4.472 0.000 -10.226) 11.161 4.699 ( 1.569 0.000 2.062) 2.591 5.113 ( 4.478 0.000 3.461) 5.660 5.126 ( -1.733 -0.000 12.587) 12.706 5.188 ( -2.415 -0.000 9.410) 9.715 5.821 ( 9.008 0.000 -7.645) 11.815 5.822 ( -8.899 -0.000 -0.335) 8.906 5.937 ( -2.035 -0.000 -1.420) 2.481 6.325 ( -7.633 -0.000 4.260) 8.741 6.376 ( 4.837 0.000 -14.374) 15.166 6.574 ( -2.057 -0.000 10.980) 11.171 6.937 ( 5.635 0.000 -3.803) 6.799 8.512 ( 3.142 0.000 8.753) 9.300 9.027 ( 0.687 0.000 -7.999) 8.029 10.034 ( -3.714 -0.000 1.114) 3.877 10.081 ( -0.937 -0.000 1.331) 1.628 10.322 ( -5.260 -0.000 -5.671) 7.734 10.522 ( 1.740 0.000 -11.987) 12.112 10.817 ( -0.250 -0.000 1.612) 1.632 10.904 ( 8.567 0.000 4.017) 9.462 11.324 ( -0.373 -0.000 1.343) 1.394 11.787 ( 0.296 0.000 -5.132) 5.140 11.881 ( -0.555 -0.000 6.785) 6.808 12.303 ( -4.153 -0.000 -2.196) 4.698 13.245 ( 3.904 0.000 3.783) 5.436 13.693 ( -4.399 -0.000 -4.319) 6.165 16.466 ( 14.338 0.000 2.646) 14.581 17.928 ( -28.514 -0.000 -8.230) 29.678 18.779 ( 13.675 0.000 4.586) 14.423 19.192 ( -1.518 -0.000 0.753) 1.694 19.662 ( 7.938 0.000 3.881) 8.836 20.148 ( -2.719 -0.000 -3.861) 4.722 20.306 ( -5.793 -0.000 6.760) 8.903 20.624 ( 0.269 0.000 -8.281) 8.286 20.988 ( -13.142 -0.000 6.542) 14.680 21.185 ( 1.267 0.000 -8.828) 8.919 22.459 ( 3.202 0.000 6.733) 7.455 22.963 ( 2.940 0.000 -6.878) 7.480 24.211 ( -2.137 -0.000 -3.027) 3.705 24.257 ( 0.097 0.000 -2.805) 2.807 24.853 ( 7.584 0.000 1.664) 7.764 24.910 ( 0.654 0.000 8.361) 8.387 25.343 ( 2.365 0.000 0.043) 2.365 25.784 ( 2.779 0.000 -10.881) 11.230 26.185 ( 10.329 0.000 2.448) 10.615 26.784 ( -15.566 -0.000 -0.715) 15.583 47.959 ( -10.312 -0.000 15.635) 18.729 48.211 ( -6.972 -0.000 18.870) 20.117 48.567 ( 7.070 0.000 -16.689) 18.125 48.886 ( 8.764 0.000 -14.163) 16.655 98.800 ( 2.664 0.000 -0.329) 2.684 98.811 ( 0.334 0.000 5.639) 5.649 99.205 ( -2.942 -0.000 5.726) 6.437 99.685 ( -0.385 -0.000 -4.720) 4.736 100.722 ( -5.259 -0.000 6.709) 8.524 100.956 ( 3.473 0.000 -6.088) 7.009 101.352 ( 0.729 0.000 15.295) 15.312 102.427 ( 8.184 0.000 -27.971) 29.143 ======================= Grid point 382 (192/230) ======================= q-point: (-0.44 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.666 ( 4.495 4.518 4.636) 7.881 1.856 ( 2.465 -12.934 -5.406) 14.233 2.021 ( 0.328 1.178 15.206) 15.255 2.451 ( 9.981 -0.648 -5.729) 11.527 2.722 ( -5.970 -1.094 6.926) 9.209 2.983 ( -10.936 0.087 -3.061) 11.357 3.225 ( -6.858 0.953 6.445) 9.459 3.356 ( 4.128 1.562 1.053) 4.537 3.479 ( 1.909 -3.124 8.043) 8.837 3.689 ( -7.359 1.207 0.752) 7.495 3.745 ( -5.867 2.978 1.654) 6.784 3.832 ( 5.021 0.674 -2.047) 5.464 4.322 ( -0.903 -0.993 6.010) 6.158 4.373 ( -3.666 -1.732 -6.909) 8.011 4.458 ( 6.102 1.590 -3.639) 7.280 4.843 ( 11.974 -0.709 -9.149) 15.086 5.083 ( -5.997 1.850 3.563) 7.217 5.226 ( 6.091 1.935 0.753) 6.435 5.292 ( 0.517 -2.051 14.362) 14.517 5.704 ( -5.015 0.893 3.530) 6.197 5.872 ( -2.904 -0.379 -3.088) 4.256 5.904 ( 6.456 -1.555 -7.157) 9.763 6.208 ( -7.016 2.226 1.228) 7.463 6.396 ( 7.801 -1.535 -8.941) 11.965 6.642 ( -0.969 0.462 10.494) 10.549 6.987 ( 5.497 0.444 -6.312) 8.381 8.644 ( 3.211 -0.163 8.282) 8.884 8.949 ( -1.181 1.125 -8.116) 8.279 10.020 ( 0.082 -0.696 2.080) 2.195 10.093 ( 0.457 -0.871 1.185) 1.540 10.213 ( -2.995 -0.487 -2.576) 3.980 10.435 ( 0.147 1.155 -10.256) 10.322 10.816 ( -2.719 -2.265 2.271) 4.204 10.988 ( 1.931 0.978 -3.242) 3.898 11.407 ( 4.010 -1.398 7.106) 8.278 11.704 ( -3.932 0.016 -6.869) 7.914 11.956 ( 0.573 -0.786 9.149) 9.200 12.188 ( -6.352 -0.047 -2.290) 6.752 13.367 ( 6.900 0.027 3.254) 7.629 13.577 ( -3.297 0.460 -6.301) 7.127 16.908 ( 30.158 -0.421 8.537) 31.346 17.280 ( -33.924 0.010 -10.713) 35.575 19.078 ( 15.387 -0.463 0.975) 15.425 19.133 ( -4.890 -0.427 -2.322) 5.430 19.825 ( 5.646 0.348 6.108) 8.325 20.020 ( -8.221 0.315 -3.271) 8.853 20.294 ( -1.254 0.454 5.818) 5.969 20.593 ( 5.337 0.157 -9.655) 11.033 20.869 ( -8.501 -0.493 7.708) 11.486 21.180 ( 5.591 -0.338 -7.565) 9.413 22.558 ( 0.630 -0.342 8.535) 8.565 22.903 ( -2.120 -0.348 -8.075) 8.356 24.173 ( -0.396 0.299 -0.631) 0.803 24.234 ( 0.144 -0.037 -3.074) 3.077 24.931 ( -3.307 0.274 4.515) 5.603 24.998 ( 6.298 -2.328 0.677) 6.749 25.417 ( 4.712 -0.074 2.180) 5.193 25.698 ( -0.909 1.185 -11.541) 11.638 26.400 ( 11.747 0.490 3.946) 12.401 26.504 ( -16.307 0.131 -0.499) 16.315 47.923 ( -9.812 -0.150 15.968) 18.743 48.243 ( -8.018 0.039 18.303) 19.982 48.555 ( 7.761 0.020 -15.733) 17.543 48.905 ( 7.928 0.006 -14.841) 16.826 98.822 ( -2.648 0.187 2.317) 3.524 98.849 ( 2.607 -0.213 0.586) 2.680 99.248 ( -0.082 0.115 9.858) 9.859 99.599 ( -4.053 -1.010 -6.709) 7.904 100.698 ( -4.134 -0.161 6.296) 7.534 100.973 ( 4.907 0.116 -6.392) 8.059 101.495 ( -0.731 -0.373 16.674) 16.695 102.247 ( -0.834 2.199 -25.178) 25.288 ======================= Grid point 383 (193/230) ======================= q-point: (-0.33 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.782 ( 5.259 -3.264 4.443) 7.619 1.968 ( 5.371 -13.622 -8.215) 16.790 2.190 ( 7.130 0.934 8.516) 11.146 2.539 ( 5.554 -0.500 -11.508) 12.788 2.703 ( -5.625 1.519 10.672) 12.158 2.849 ( -4.668 -5.491 4.267) 8.376 3.135 ( -7.588 2.778 4.882) 9.441 3.416 ( 1.631 0.876 3.261) 3.750 3.500 ( -7.643 -1.104 -2.838) 8.227 3.618 ( -2.422 -0.920 10.344) 10.663 3.687 ( -0.640 2.273 2.541) 3.469 3.886 ( 3.174 1.085 -0.445) 3.384 4.272 ( -4.973 -0.970 -0.869) 5.141 4.314 ( -2.722 3.777 -1.456) 4.878 4.564 ( 11.920 1.007 -1.643) 12.075 4.783 ( -4.052 -2.070 -14.985) 15.661 5.104 ( 2.064 -0.556 5.559) 5.956 5.303 ( 5.293 7.280 -0.377) 9.009 5.461 ( 5.307 -1.702 9.527) 11.037 5.660 ( -4.108 -1.322 1.922) 4.724 5.807 ( -2.998 -3.526 -3.320) 5.696 5.945 ( 4.184 -0.857 -5.672) 7.101 6.101 ( -3.545 1.489 -1.128) 4.007 6.489 ( 9.459 1.111 -5.265) 10.882 6.703 ( -0.133 1.180 7.041) 7.140 7.007 ( 5.369 1.597 -9.156) 10.733 8.744 ( 1.172 1.394 5.757) 6.038 8.843 ( -1.800 0.677 -7.516) 7.758 10.074 ( 2.652 -0.137 2.695) 3.783 10.109 ( 1.629 -1.619 -2.003) 3.048 10.213 ( -0.092 -3.343 4.755) 5.813 10.351 ( 0.033 0.525 -7.757) 7.775 10.797 ( -4.335 -2.401 3.235) 5.918 10.954 ( -0.585 1.274 -3.578) 3.843 11.527 ( -0.864 -0.389 3.196) 3.333 11.563 ( -3.421 -1.811 -3.535) 5.242 12.045 ( -1.290 0.196 8.574) 8.673 12.077 ( -4.568 -1.406 0.689) 4.829 13.478 ( -0.825 0.987 -7.394) 7.505 13.528 ( 8.924 -0.169 2.281) 9.212 16.678 ( -26.106 -0.222 -7.937) 27.287 17.567 ( 35.237 -0.823 9.807) 36.585 19.006 ( -5.259 -0.706 -6.351) 8.276 19.280 ( 8.218 -0.368 -2.337) 8.552 19.820 ( -11.051 0.612 -3.686) 11.665 19.941 ( 2.501 0.237 5.414) 5.968 20.363 ( 3.334 0.123 5.581) 6.502 20.629 ( 8.937 0.953 -10.051) 13.483 20.840 ( -3.010 -1.156 8.107) 8.724 21.242 ( 8.239 -0.463 -5.924) 10.158 22.625 ( -2.615 -0.681 9.743) 10.111 22.774 ( -5.285 -1.097 -7.884) 9.555 24.174 ( 0.572 0.652 0.466) 0.985 24.216 ( 0.851 -0.088 -2.498) 2.641 24.876 ( -6.499 -1.567 1.913) 6.954 25.118 ( 5.785 -1.625 -0.945) 6.083 25.505 ( 1.121 1.564 -1.080) 2.207 25.563 ( -0.459 -0.602 -7.794) 7.831 26.232 ( -14.911 0.702 0.342) 14.931 26.638 ( 11.785 0.914 5.508) 13.041 47.902 ( -9.195 -0.252 16.604) 18.982 48.251 ( -8.994 0.099 17.681) 19.838 48.562 ( 8.405 0.059 -14.725) 16.955 48.902 ( 7.031 -0.019 -15.629) 17.138 98.771 ( -4.151 0.610 1.036) 4.321 98.901 ( 2.570 0.178 0.929) 2.738 99.344 ( -0.273 -0.601 11.591) 11.610 99.462 ( -5.890 -1.159 -6.746) 9.030 100.692 ( -2.897 -0.153 5.975) 6.642 101.011 ( 6.201 -0.036 -6.835) 9.228 101.598 ( -4.389 -0.125 16.590) 17.162 101.976 ( -5.711 2.494 -19.039) 20.033 ======================= Grid point 384 (194/230) ======================= q-point: (-0.22 0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.944 ( 4.228 -11.029 -1.345) 11.888 2.069 ( 4.161 -7.092 -5.832) 10.081 2.316 ( 0.944 -3.589 0.027) 3.711 2.517 ( 1.443 -2.039 -7.830) 8.219 2.628 ( -4.508 -0.759 0.041) 4.572 2.889 ( -8.996 -0.724 9.596) 13.173 3.090 ( 2.872 0.051 6.406) 7.020 3.395 ( -2.638 -3.706 1.168) 4.696 3.492 ( 1.937 0.898 3.539) 4.133 3.573 ( -3.898 4.059 1.546) 5.836 3.733 ( -2.382 0.559 9.903) 10.201 3.936 ( 1.727 0.971 0.345) 2.011 4.144 ( -5.570 6.130 -1.230) 8.374 4.228 ( -1.076 0.343 -2.611) 2.845 4.620 ( -4.808 -5.624 -10.314) 12.693 4.812 ( 15.624 1.000 0.994) 15.687 5.159 ( 4.330 3.902 -3.949) 7.041 5.288 ( -2.797 6.640 8.674) 11.276 5.578 ( -0.238 -4.146 -5.570) 6.948 5.644 ( 3.351 0.483 -0.768) 3.472 5.757 ( -4.056 -5.545 -1.003) 6.943 5.971 ( 1.167 -0.994 -2.693) 3.098 6.062 ( 1.620 0.899 0.205) 1.865 6.591 ( 9.066 4.798 -3.564) 10.859 6.738 ( 0.470 1.389 2.615) 2.998 6.989 ( 4.703 2.495 -11.625) 12.786 8.689 ( -3.680 3.396 -4.729) 6.888 8.832 ( 1.174 -1.369 1.647) 2.442 10.112 ( 2.106 -0.281 -0.294) 2.145 10.202 ( 5.097 -1.094 4.358) 6.795 10.294 ( 0.650 -4.643 2.778) 5.450 10.302 ( 0.603 -1.350 -3.647) 3.936 10.758 ( -4.714 -1.495 2.774) 5.670 10.897 ( -2.663 0.730 -2.227) 3.547 11.409 ( -4.288 -1.797 -4.297) 6.331 11.614 ( -0.479 -1.290 5.283) 5.459 12.003 ( -3.365 -2.588 0.797) 4.319 12.113 ( -2.317 1.652 9.709) 10.117 13.401 ( 0.422 1.453 -8.294) 8.431 13.697 ( 8.483 -0.318 1.356) 8.597 16.309 ( -12.017 -0.468 -1.548) 12.125 18.147 ( 18.816 -0.637 4.212) 19.292 18.931 ( 7.623 -0.731 -7.449) 10.683 19.330 ( 1.117 0.067 -3.259) 3.446 19.585 ( -11.561 0.790 -3.742) 12.177 19.999 ( 0.052 -0.167 2.756) 2.762 20.454 ( 0.201 -1.000 5.578) 5.670 20.699 ( 10.271 1.616 -10.318) 14.648 20.948 ( 6.780 -1.186 8.635) 11.043 21.375 ( 12.300 -0.573 -3.552) 12.816 22.605 ( -7.726 -1.288 -4.491) 9.029 22.637 ( -7.257 -1.247 6.692) 9.950 24.182 ( 1.162 1.179 -0.089) 1.658 24.230 ( 1.861 -0.137 -0.363) 1.901 24.776 ( -7.840 -2.158 0.380) 8.141 25.169 ( 1.063 0.325 -6.097) 6.198 25.379 ( -2.493 1.451 -5.078) 5.840 25.627 ( 4.269 -2.919 -0.887) 5.247 26.003 ( -11.955 0.888 1.116) 12.040 26.873 ( 10.410 1.411 6.806) 12.517 47.899 ( -8.504 -0.306 17.475) 19.436 48.239 ( -9.735 0.169 17.044) 19.629 48.587 ( 8.943 0.102 -13.802) 16.447 48.877 ( 6.213 -0.070 -16.501) 17.632 98.702 ( -4.230 1.079 1.303) 4.556 98.941 ( 1.655 0.262 -0.412) 1.725 99.322 ( -4.984 -0.276 -4.004) 6.399 99.429 ( -2.394 -1.400 11.296) 11.632 100.701 ( -1.974 -0.041 5.720) 6.051 101.064 ( 6.660 -0.482 -7.416) 9.979 101.621 ( -8.600 0.947 14.402) 16.801 101.731 ( -4.902 0.490 -12.031) 13.000 ======================= Grid point 385 (195/230) ======================= q-point: (-0.11 -0.56 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.922 ( -10.033 -3.947 -9.798) 14.568 2.119 ( 0.653 -8.615 -2.823) 9.089 2.361 ( 2.732 -7.202 -3.459) 8.444 2.496 ( 3.119 -4.139 -7.769) 9.339 2.594 ( -1.229 -4.045 -3.595) 5.550 2.782 ( -11.717 -1.170 11.720) 16.614 3.245 ( 5.185 -1.591 5.362) 7.627 3.440 ( -8.503 3.783 2.858) 9.736 3.467 ( 7.371 0.030 1.807) 7.589 3.561 ( -0.545 0.385 4.128) 4.182 3.794 ( -0.648 -1.986 9.656) 9.879 3.801 ( -3.809 8.217 -6.985) 11.438 4.146 ( 0.972 -0.538 6.254) 6.352 4.210 ( 0.443 0.807 -0.235) 0.950 4.533 ( -1.680 -5.862 -6.238) 8.724 4.908 ( -0.185 10.508 -1.534) 10.621 5.194 ( 1.718 4.357 3.588) 5.900 5.350 ( 6.896 -1.753 3.681) 8.011 5.506 ( -0.676 -3.356 -12.005) 12.483 5.626 ( 1.041 -3.669 -11.859) 12.457 5.759 ( -2.083 -1.821 3.280) 4.291 5.941 ( -2.629 -1.026 -0.660) 2.899 6.142 ( 4.373 2.552 6.134) 7.954 6.660 ( 7.677 7.283 -2.981) 10.993 6.742 ( 0.369 1.291 -1.249) 1.834 6.937 ( 4.055 2.393 -13.163) 13.980 8.555 ( -4.129 3.705 -4.085) 6.889 8.884 ( 1.697 -2.917 1.189) 3.578 10.155 ( 0.890 -1.704 1.444) 2.405 10.285 ( 1.565 0.315 -3.435) 3.788 10.305 ( 0.754 -0.697 3.986) 4.116 10.404 ( 5.445 -4.512 2.717) 7.576 10.727 ( -2.897 -2.622 2.208) 4.488 10.799 ( -5.367 1.179 -3.046) 6.283 11.376 ( -0.111 -2.986 0.623) 3.053 11.647 ( -1.001 -0.775 4.327) 4.509 12.000 ( -1.112 -3.192 1.760) 3.810 12.117 ( -4.028 2.708 8.132) 9.470 13.321 ( -0.105 1.796 -8.529) 8.717 13.832 ( 5.867 -0.249 0.649) 5.908 16.265 ( 3.559 -0.550 7.019) 7.889 18.149 ( -10.347 0.232 -11.397) 15.395 19.190 ( 15.818 0.539 -2.168) 15.975 19.292 ( -1.516 0.076 -2.828) 3.209 19.416 ( 0.775 0.213 -1.160) 1.411 19.988 ( -3.221 -0.586 0.324) 3.290 20.477 ( -3.949 -2.297 5.655) 7.270 20.761 ( 8.715 2.408 -10.275) 13.687 21.217 ( 14.050 -0.948 8.797) 16.604 21.620 ( 18.198 -0.761 -0.802) 18.232 22.413 ( -10.004 -1.535 -6.676) 12.125 22.537 ( -13.592 -1.110 7.296) 15.467 24.205 ( 2.510 1.270 0.504) 2.858 24.263 ( 1.751 0.454 0.674) 1.930 24.656 ( -7.751 -2.030 -0.385) 8.022 25.033 ( -4.826 1.632 -10.831) 11.969 25.365 ( 1.747 0.455 -0.004) 1.805 25.707 ( 4.030 -3.902 -2.918) 6.323 25.837 ( -7.894 0.417 0.995) 7.967 27.076 ( 7.681 1.898 7.131) 10.652 47.916 ( -7.772 -0.321 18.484) 20.054 48.210 ( -10.210 0.205 16.385) 19.307 48.627 ( 9.314 0.140 -13.062) 16.043 48.834 ( 5.665 -0.123 -17.389) 18.289 98.640 ( -3.656 1.389 2.208) 4.491 98.928 ( -0.951 -0.379 -4.353) 4.471 99.260 ( -0.393 1.462 2.172) 2.647 99.470 ( -4.796 -1.974 9.737) 11.032 100.720 ( -1.477 0.181 5.615) 5.809 101.101 ( 4.163 -0.971 -8.012) 9.081 101.532 ( -9.314 1.545 6.815) 11.644 101.641 ( 0.102 -2.315 -2.922) 3.729 ======================= Grid point 391 (196/230) ======================= q-point: ( 0.56 -0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.793 ( 3.718 0.000 -7.016) 7.940 1.830 ( 8.272 0.000 1.015) 8.334 2.198 ( 6.837 0.000 8.043) 10.556 2.534 ( 3.852 0.000 -10.472) 11.158 2.728 ( 0.438 0.000 14.726) 14.733 2.793 ( -10.529 -0.000 1.199) 10.597 3.156 ( -7.418 -0.000 5.588) 9.287 3.423 ( -0.104 -0.000 3.367) 3.369 3.489 ( -8.746 -0.000 -4.224) 9.712 3.607 ( 2.229 0.000 12.427) 12.626 3.706 ( -2.438 -0.000 -0.029) 2.438 3.897 ( 2.553 0.000 -1.042) 2.757 4.263 ( -3.844 -0.000 -2.217) 4.437 4.345 ( -1.512 -0.000 2.657) 3.058 4.575 ( 11.280 0.000 -2.374) 11.527 4.765 ( -5.428 -0.000 -16.297) 17.177 5.098 ( 2.255 0.000 6.176) 6.575 5.366 ( 9.212 0.000 -4.905) 10.437 5.440 ( 3.443 0.000 11.673) 12.170 5.651 ( -5.492 -0.000 5.270) 7.612 5.779 ( -3.645 -0.000 -4.507) 5.796 5.939 ( 4.711 0.000 -6.698) 8.189 6.112 ( -3.865 -0.000 -2.012) 4.357 6.497 ( 10.181 0.000 -3.951) 10.921 6.712 ( -0.390 -0.000 7.685) 7.695 7.019 ( 5.510 0.000 -9.012) 10.563 8.755 ( 1.916 0.000 6.820) 7.084 8.848 ( -2.634 -0.000 -8.471) 8.871 10.072 ( 3.525 0.000 3.103) 4.696 10.096 ( 1.226 0.000 -2.615) 2.888 10.188 ( -0.901 -0.000 4.440) 4.530 10.358 ( 0.490 0.000 -9.008) 9.022 10.778 ( -4.622 -0.000 5.119) 6.897 10.963 ( -0.621 -0.000 -4.329) 4.373 11.526 ( 2.217 0.000 7.518) 7.838 11.547 ( -6.458 -0.000 -7.684) 10.037 12.050 ( 0.359 0.000 10.657) 10.663 12.061 ( -6.034 -0.000 -1.383) 6.190 13.485 ( -0.751 -0.000 -7.551) 7.588 13.527 ( 8.804 0.000 2.458) 9.140 16.676 ( -26.134 -0.000 -8.056) 27.348 17.561 ( 35.149 0.000 10.113) 36.575 19.000 ( -5.145 -0.000 -6.513) 8.300 19.277 ( 8.538 0.000 -2.486) 8.893 19.825 ( -11.067 -0.000 -3.772) 11.692 19.943 ( 2.338 0.000 5.483) 5.961 20.364 ( 3.033 0.000 5.486) 6.268 20.637 ( 9.259 0.000 -10.152) 13.740 20.831 ( -3.214 -0.000 8.331) 8.929 21.239 ( 8.302 0.000 -5.933) 10.204 22.620 ( -2.539 -0.000 9.688) 10.015 22.766 ( -5.413 -0.000 -7.980) 9.643 24.179 ( 0.819 0.000 0.689) 1.070 24.215 ( 0.550 0.000 -2.523) 2.582 24.864 ( -6.407 -0.000 1.449) 6.569 25.105 ( 6.417 0.000 -0.924) 6.483 25.516 ( 4.061 0.000 2.738) 4.898 25.559 ( -4.127 -0.000 -11.334) 12.062 26.237 ( -14.878 -0.000 0.369) 14.883 26.645 ( 11.866 0.000 5.402) 13.038 47.900 ( -9.218 -0.000 16.673) 19.052 48.252 ( -8.974 -0.000 17.672) 19.820 48.563 ( 8.436 0.000 -14.772) 17.011 48.902 ( 7.014 0.000 -15.624) 17.126 98.776 ( -4.023 -0.000 1.045) 4.157 98.902 ( 2.600 0.000 1.115) 2.829 99.340 ( -0.351 -0.000 11.243) 11.249 99.453 ( -5.659 -0.000 -6.461) 8.589 100.690 ( -2.887 -0.000 6.063) 6.715 101.011 ( 6.114 0.000 -6.928) 9.240 101.597 ( -4.495 -0.000 17.358) 17.930 101.994 ( -5.972 -0.000 -20.198) 21.062 ======================= Grid point 393 (197/230) ======================= q-point: (-0.33 0.56 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.827 ( 6.434 -4.415 -7.851) 11.069 1.986 ( 7.750 -3.396 -3.275) 9.073 2.300 ( -2.115 0.301 1.356) 2.530 2.482 ( -1.058 -2.022 -3.914) 4.531 2.632 ( -7.028 0.594 -1.531) 7.217 2.865 ( -5.880 -1.538 13.951) 15.218 3.098 ( 0.263 0.635 2.279) 2.381 3.351 ( -2.205 -1.823 3.303) 4.369 3.499 ( 2.201 0.221 3.525) 4.162 3.642 ( -3.721 5.021 2.766) 6.834 3.709 ( -4.092 -3.414 7.480) 9.185 3.936 ( 2.891 -0.247 2.294) 3.699 4.199 ( -2.896 0.984 0.145) 3.062 4.283 ( -2.135 5.220 -3.578) 6.679 4.539 ( -5.956 -4.495 -13.434) 15.367 4.824 ( 18.537 0.473 -0.713) 18.556 5.180 ( 1.365 0.117 5.393) 5.565 5.399 ( 0.761 7.033 -3.160) 7.748 5.514 ( -1.966 -4.666 -3.106) 5.940 5.655 ( -0.013 1.124 -1.077) 1.557 5.689 ( -2.368 -3.487 2.044) 4.685 5.960 ( 2.045 -0.453 -3.763) 4.306 6.073 ( 2.525 0.458 -1.205) 2.835 6.641 ( 10.078 1.847 -2.641) 10.581 6.753 ( -0.190 0.589 3.360) 3.416 7.015 ( 4.905 0.954 -12.095) 13.087 8.723 ( -3.024 1.152 -7.925) 8.560 8.821 ( -0.041 -0.301 4.496) 4.506 10.110 ( 1.827 -0.014 -0.111) 1.830 10.178 ( 5.226 -1.249 1.481) 5.574 10.231 ( -0.208 -2.510 4.995) 5.594 10.317 ( 2.226 1.109 -3.603) 4.378 10.738 ( -5.908 -0.931 5.157) 7.897 10.904 ( -2.236 0.241 -3.617) 4.259 11.392 ( -4.346 -0.538 -5.257) 6.842 11.600 ( -0.402 -0.533 6.089) 6.125 11.975 ( -3.588 -1.069 0.030) 3.744 12.130 ( -1.847 0.595 10.524) 10.701 13.416 ( 0.659 0.581 -8.552) 8.597 13.694 ( 8.358 -0.143 1.576) 8.507 16.304 ( -11.997 -0.188 -1.701) 12.118 18.140 ( 18.977 -0.248 4.812) 19.579 18.924 ( 8.018 -0.282 -7.691) 11.114 19.330 ( 1.539 -0.001 -3.801) 4.101 19.594 ( -11.592 0.322 -3.727) 12.181 19.997 ( -0.293 -0.070 2.895) 2.911 20.445 ( -0.456 -0.334 5.672) 5.700 20.717 ( 10.415 0.664 -10.569) 14.853 20.934 ( 7.051 -0.545 8.866) 11.341 21.369 ( 12.232 -0.224 -3.504) 12.726 22.592 ( -7.643 -0.453 -6.660) 10.148 22.624 ( -7.368 -0.540 9.049) 11.682 24.201 ( 1.422 1.349 0.303) 1.983 24.221 ( 1.645 -0.975 -0.434) 1.961 24.754 ( -7.368 -0.765 -0.055) 7.408 25.170 ( 2.948 -0.037 -6.332) 6.985 25.396 ( -3.522 0.683 -6.813) 7.700 25.597 ( 2.947 -1.079 1.423) 3.446 26.012 ( -12.114 0.354 1.177) 12.176 26.886 ( 10.651 0.484 6.407) 12.439 47.896 ( -8.542 -0.124 17.578) 19.544 48.240 ( -9.702 0.070 17.013) 19.585 48.589 ( 8.998 0.038 -13.890) 16.550 48.877 ( 6.179 -0.026 -16.479) 17.599 98.714 ( -3.989 0.446 1.115) 4.166 98.944 ( 1.581 0.119 -0.751) 1.754 99.320 ( -4.421 -0.080 -3.142) 5.424 99.414 ( -2.426 -0.561 10.726) 11.011 100.701 ( -1.972 -0.017 5.934) 6.253 101.059 ( 6.475 -0.202 -7.644) 10.020 101.629 ( -8.835 0.286 16.615) 18.820 101.737 ( -5.970 0.223 -14.078) 15.293 ======================= Grid point 394 (198/230) ======================= q-point: (-0.22 -0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.884 ( -5.496 -1.403 -9.940) 11.445 1.980 ( 0.141 -8.670 -5.179) 10.100 2.280 ( 2.559 -3.128 -0.547) 4.079 2.466 ( 1.036 -1.423 -2.571) 3.116 2.543 ( -1.384 -2.463 -3.945) 4.853 2.767 ( -16.001 -0.953 12.697) 20.449 3.211 ( 5.860 -2.270 3.546) 7.215 3.452 ( 5.630 -0.859 2.793) 6.343 3.517 ( -7.577 5.445 4.418) 10.324 3.567 ( 0.563 0.431 4.856) 4.907 3.728 ( -2.373 -5.250 6.051) 8.355 3.919 ( -5.768 5.614 -1.990) 8.291 4.159 ( 0.914 2.247 1.416) 2.809 4.240 ( 2.371 3.453 0.959) 4.297 4.436 ( -0.671 -7.276 -6.614) 9.856 5.050 ( 6.347 8.719 -1.643) 10.909 5.264 ( 6.485 3.566 -4.173) 8.497 5.309 ( -2.405 -2.056 8.444) 9.018 5.455 ( -2.436 -3.849 -8.808) 9.916 5.554 ( -1.484 -4.747 -11.980) 12.971 5.756 ( 0.574 0.579 3.816) 3.902 5.927 ( -2.669 -0.835 -1.283) 3.077 6.180 ( 7.853 2.274 3.904) 9.060 6.743 ( 3.778 3.306 -0.802) 5.084 6.763 ( 4.520 1.966 -3.481) 6.034 6.966 ( 4.062 1.438 -14.668) 15.288 8.599 ( -2.669 2.049 -6.743) 7.536 8.851 ( -0.602 -1.503 3.355) 3.725 10.134 ( -2.013 -1.060 3.525) 4.196 10.245 ( 3.039 -2.520 -4.757) 6.182 10.306 ( 2.929 -2.864 2.284) 4.691 10.386 ( 5.365 2.781 6.496) 8.873 10.686 ( -4.395 -2.711 1.817) 5.474 10.815 ( -4.438 0.790 -3.558) 5.742 11.345 ( 0.184 -1.320 0.676) 1.494 11.634 ( -1.173 -0.799 4.557) 4.773 11.958 ( -0.679 -2.277 1.159) 2.643 12.151 ( -4.426 1.687 8.916) 10.096 13.344 ( 0.209 1.217 -8.969) 9.053 13.828 ( 5.940 -0.212 0.747) 5.990 16.258 ( 3.686 -0.366 6.839) 7.777 18.152 ( -9.522 0.180 -11.369) 14.831 19.197 ( 18.027 0.335 -1.948) 18.135 19.293 ( -1.384 -0.004 -3.718) 3.967 19.419 ( -0.873 0.189 -1.059) 1.385 19.981 ( -3.604 -0.408 0.552) 3.669 20.451 ( -4.656 -1.243 6.032) 7.721 20.788 ( 9.377 1.343 -10.748) 14.326 21.204 ( 14.048 -0.643 8.996) 16.694 21.610 ( 17.996 -0.498 -0.496) 18.010 22.394 ( -9.817 -0.891 -6.289) 11.693 22.523 ( -13.796 -0.778 7.569) 15.755 24.226 ( 2.457 1.594 0.791) 3.034 24.263 ( 2.048 -0.521 0.791) 2.256 24.631 ( -7.270 -1.220 -0.800) 7.415 25.052 ( -4.754 0.924 -12.078) 13.013 25.370 ( 2.630 0.152 -1.051) 2.836 25.661 ( 2.882 -2.255 -0.577) 3.705 25.844 ( -8.815 0.413 1.674) 8.982 27.098 ( 8.222 1.032 6.276) 10.395 47.912 ( -7.818 -0.218 18.603) 20.180 48.213 ( -10.178 0.143 16.332) 19.244 48.629 ( 9.383 0.083 -13.172) 16.173 48.832 ( 5.605 -0.075 -17.330) 18.215 98.659 ( -3.267 1.024 1.863) 3.898 98.923 ( -0.960 -0.305 -5.260) 5.355 99.280 ( 0.227 1.157 3.422) 3.619 99.444 ( -4.805 -1.460 9.033) 10.335 100.723 ( -1.449 0.124 5.962) 6.137 101.088 ( 4.130 -0.687 -8.470) 9.449 101.555 ( -7.353 1.483 3.159) 8.139 101.608 ( -4.719 -2.080 2.369) 5.675 ======================= Grid point 395 (199/230) ======================= q-point: (-0.11 -0.44 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.547 ( -18.880 -3.850 -7.283) 20.599 2.124 ( 8.227 -5.843 -3.951) 10.836 2.311 ( 2.753 -4.429 -8.205) 9.722 2.453 ( -4.772 0.754 -1.751) 5.139 2.551 ( 1.674 -2.046 0.688) 2.731 2.691 ( -6.118 -6.980 14.651) 17.344 3.313 ( -10.562 2.645 5.235) 12.081 3.340 ( 2.184 1.229 1.026) 2.708 3.561 ( -2.639 1.084 1.811) 3.379 3.604 ( 5.073 -1.636 -2.367) 5.832 3.740 ( -5.982 -0.066 0.729) 6.027 3.850 ( 3.333 -3.660 7.027) 8.596 4.169 ( -0.969 0.021 1.803) 2.047 4.271 ( 2.965 5.806 1.112) 6.614 4.508 ( 5.342 -4.066 1.890) 6.974 4.951 ( -1.778 10.982 -2.337) 11.368 5.160 ( -9.045 2.597 0.508) 9.424 5.326 ( -4.072 -1.091 -12.112) 12.825 5.479 ( 1.524 -7.167 1.366) 7.454 5.548 ( 6.802 -3.373 -6.573) 10.042 5.746 ( -2.232 1.574 0.327) 2.751 5.907 ( 0.689 -1.859 0.872) 2.166 6.317 ( 5.567 5.443 6.029) 9.847 6.718 ( -0.626 1.210 -4.086) 4.307 6.809 ( 6.700 5.802 -4.412) 9.900 6.898 ( 4.778 1.091 -15.896) 16.634 8.492 ( -1.994 3.556 -4.105) 5.786 8.891 ( 0.431 -3.870 1.855) 4.313 10.111 ( -5.849 -3.084 4.433) 7.961 10.272 ( 2.946 -2.393 -4.541) 5.919 10.400 ( 5.443 3.386 3.190) 7.160 10.508 ( 1.732 -2.367 5.318) 6.074 10.681 ( -4.857 0.449 -0.380) 4.892 10.694 ( 1.112 -1.708 -3.302) 3.881 11.400 ( 2.085 -0.884 3.652) 4.297 11.663 ( -0.098 -1.361 3.524) 3.779 11.988 ( 0.458 -2.045 1.312) 2.473 12.123 ( -4.704 1.376 7.002) 8.547 13.254 ( -0.986 1.570 -7.860) 8.075 13.906 ( 2.537 -0.032 0.267) 2.551 16.527 ( 15.981 -0.389 14.299) 21.447 17.769 ( -17.573 1.302 -19.425) 26.226 19.203 ( -2.795 1.445 -1.407) 3.447 19.241 ( -2.070 -0.256 -1.958) 2.861 19.683 ( 19.826 -0.137 -1.133) 19.859 19.891 ( -7.058 -0.826 -1.533) 7.270 20.425 ( -5.953 -2.274 6.556) 9.142 20.829 ( 7.533 2.558 -10.202) 12.938 21.538 ( 15.101 -0.876 8.689) 17.444 21.964 ( 21.533 -0.588 1.459) 21.590 22.158 ( -12.460 -0.544 -6.316) 13.980 22.296 ( -19.477 -1.253 5.037) 20.157 24.273 ( 3.281 1.079 0.621) 3.510 24.301 ( 1.037 0.804 1.560) 2.039 24.531 ( -4.509 -1.700 0.144) 4.820 24.860 ( -4.984 0.562 -10.671) 11.791 25.404 ( 2.466 1.090 -1.065) 2.899 25.717 ( 0.350 -1.420 0.443) 1.528 25.744 ( -1.859 -1.947 -1.356) 3.014 27.245 ( 4.513 1.676 4.720) 6.742 47.950 ( -7.090 -0.262 19.609) 20.853 48.173 ( -10.415 0.185 15.662) 18.810 48.679 ( 9.398 0.151 -12.671) 15.777 48.776 ( 5.599 -0.165 -18.052) 18.901 98.624 ( -1.976 1.605 2.977) 3.917 98.852 ( -1.210 -0.518 -6.173) 6.312 99.342 ( 1.982 2.221 6.191) 6.870 99.438 ( -4.209 -1.972 7.054) 8.447 100.750 ( -1.330 0.447 6.304) 6.459 101.059 ( 0.447 -1.137 -8.064) 8.156 101.443 ( -11.535 2.132 9.838) 15.310 101.642 ( 7.717 -5.608 -5.397) 10.960 ======================= Grid point 402 (200/230) ======================= q-point: (-0.33 -0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.878 ( 10.522 0.000 -8.890) 13.775 1.908 ( -14.396 -0.000 -7.920) 16.430 2.262 ( 1.963 0.000 1.895) 2.729 2.450 ( 0.728 0.000 -0.079) 0.732 2.527 ( -1.748 -0.000 -4.797) 5.106 2.759 ( -17.311 -0.000 12.981) 21.637 3.193 ( 6.446 0.000 2.483) 6.908 3.444 ( 6.728 0.000 3.337) 7.510 3.571 ( 0.833 0.000 4.913) 4.983 3.574 ( -12.697 -0.000 6.437) 14.236 3.673 ( 0.999 0.000 2.745) 2.921 3.957 ( -5.992 -0.000 2.436) 6.468 4.182 ( -0.567 -0.000 -0.150) 0.587 4.301 ( 4.199 0.000 0.869) 4.288 4.345 ( -0.806 -0.000 -8.615) 8.653 5.133 ( 16.263 0.000 -3.066) 16.550 5.242 ( 0.405 0.000 5.717) 5.732 5.351 ( -9.556 -0.000 -1.105) 9.620 5.401 ( 1.175 0.000 -7.842) 7.930 5.518 ( -2.316 -0.000 -11.736) 11.962 5.762 ( 1.266 0.000 4.334) 4.515 5.920 ( -2.724 -0.000 -1.704) 3.213 6.198 ( 9.369 0.000 3.036) 9.849 6.759 ( -0.330 -0.000 -1.128) 1.176 6.786 ( 8.731 0.000 -3.251) 9.317 6.977 ( 3.961 0.000 -15.191) 15.699 8.613 ( -1.828 -0.000 -8.011) 8.217 8.841 ( -1.781 -0.000 4.382) 4.730 10.126 ( -3.532 -0.000 4.916) 6.053 10.226 ( 3.573 0.000 -4.896) 6.061 10.279 ( 4.006 0.000 2.694) 4.828 10.415 ( 6.446 0.000 5.363) 8.385 10.662 ( -5.990 -0.000 2.371) 6.442 10.821 ( -4.010 -0.000 -3.819) 5.538 11.335 ( 0.342 0.000 0.708) 0.786 11.628 ( -1.298 -0.000 4.628) 4.806 11.941 ( -0.487 -0.000 0.942) 1.060 12.163 ( -4.582 -0.000 9.195) 10.273 13.353 ( 0.346 0.000 -9.140) 9.146 13.826 ( 5.967 0.000 0.788) 6.018 16.256 ( 3.735 0.000 6.770) 7.732 18.153 ( -9.189 -0.000 -11.359) 14.610 19.200 ( 18.948 0.000 -1.845) 19.038 19.292 ( -1.390 -0.000 -4.071) 4.302 19.421 ( -1.505 -0.000 -1.039) 1.829 19.977 ( -3.766 -0.000 0.658) 3.823 20.442 ( -4.932 -0.000 6.182) 7.909 20.798 ( 9.605 0.000 -10.946) 14.562 21.200 ( 14.059 0.000 9.080) 16.737 21.606 ( 17.933 0.000 -0.403) 17.938 22.388 ( -9.698 -0.000 -6.168) 11.493 22.517 ( -13.923 -0.000 7.735) 15.928 24.248 ( 2.068 0.000 0.638) 2.164 24.249 ( 2.560 0.000 1.105) 2.788 24.622 ( -7.134 -0.000 -0.970) 7.199 25.059 ( -4.637 -0.000 -12.642) 13.466 25.371 ( 2.959 0.000 -1.484) 3.311 25.644 ( 2.285 0.000 0.501) 2.340 25.847 ( -9.065 -0.000 1.858) 9.253 27.105 ( 8.426 0.000 5.958) 10.320 47.910 ( -7.837 -0.000 18.649) 20.229 48.214 ( -10.164 -0.000 16.311) 19.219 48.630 ( 9.410 0.000 -13.218) 16.225 48.832 ( 5.581 0.000 -17.304) 18.182 98.667 ( -3.111 -0.000 1.782) 3.586 98.921 ( -0.966 -0.000 -5.674) 5.756 99.289 ( 0.582 0.000 3.964) 4.006 99.432 ( -4.931 -0.000 8.724) 10.021 100.724 ( -1.434 -0.000 6.098) 6.265 101.083 ( 4.098 0.000 -8.633) 9.556 101.572 ( -0.798 -0.000 -9.227) 9.261 101.586 ( -12.385 -0.000 15.368) 19.737 ======================= Grid point 403 (201/230) ======================= q-point: (-0.22 -0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.514 ( -21.808 -0.934 -4.429) 22.273 2.030 ( 12.474 -4.445 -6.880) 14.923 2.296 ( 1.703 0.619 -4.325) 4.690 2.465 ( -2.559 0.519 -3.033) 4.002 2.531 ( 2.768 -0.501 2.299) 3.633 2.605 ( -10.698 -3.950 17.473) 20.865 3.316 ( 1.736 -0.454 4.482) 4.828 3.399 ( -7.953 4.656 3.473) 9.849 3.542 ( -3.688 -5.019 1.402) 6.384 3.568 ( 2.105 -0.021 -2.223) 3.062 3.763 ( -4.314 2.797 2.890) 5.897 3.808 ( -3.623 -2.787 4.000) 6.074 4.180 ( 2.078 0.895 -0.569) 2.333 4.352 ( 5.705 5.101 1.916) 7.889 4.441 ( 5.592 -4.779 3.615) 8.196 5.107 ( -4.957 9.065 -5.868) 11.881 5.191 ( -6.604 1.130 -3.543) 7.579 5.309 ( -3.076 -0.736 -10.864) 11.315 5.355 ( -0.928 -8.015 6.722) 10.502 5.517 ( 10.055 -1.084 -8.145) 12.986 5.774 ( -2.017 1.539 1.252) 2.829 5.881 ( -0.977 -1.288 1.671) 2.326 6.378 ( 7.295 2.417 4.343) 8.827 6.734 ( 1.766 0.824 -5.882) 6.196 6.862 ( 4.071 1.349 -6.663) 7.923 6.912 ( 6.176 0.826 -15.077) 16.314 8.530 ( -0.101 1.502 -6.395) 6.570 8.848 ( -1.855 -1.638 4.035) 4.733 10.080 ( -7.163 -1.122 6.444) 9.700 10.246 ( 3.082 -0.994 -4.242) 5.337 10.398 ( 5.068 -1.637 2.990) 6.108 10.546 ( 2.764 5.733 4.767) 7.952 10.632 ( 2.424 -4.969 0.944) 5.609 10.702 ( -5.487 0.537 -4.295) 6.989 11.396 ( 2.960 0.048 5.061) 5.863 11.645 ( -0.560 -0.817 3.057) 3.214 11.967 ( 1.545 -0.826 1.378) 2.229 12.137 ( -6.022 0.511 7.154) 9.365 13.271 ( -0.877 0.662 -8.346) 8.418 13.905 ( 2.742 -0.032 0.215) 2.750 16.523 ( 16.143 -0.156 14.171) 21.481 17.783 ( -16.679 0.537 -19.860) 25.940 19.221 ( -2.615 1.035 -1.392) 3.138 19.235 ( -1.994 -0.562 -2.543) 3.280 19.682 ( 19.958 -0.053 -1.038) 19.985 19.882 ( -7.371 -0.336 -1.241) 7.482 20.402 ( -6.302 -0.825 6.814) 9.318 20.854 ( 8.238 0.918 -10.693) 13.529 21.529 ( 14.846 -0.368 8.961) 17.345 21.958 ( 21.294 -0.264 1.479) 21.347 22.156 ( -11.393 0.025 -5.538) 12.668 22.281 ( -20.311 -0.652 5.345) 21.013 24.286 ( 2.632 0.558 0.003) 2.690 24.308 ( 1.615 0.245 2.303) 2.823 24.512 ( -4.477 -0.739 -0.180) 4.541 24.866 ( -5.092 0.205 -11.041) 12.160 25.416 ( 3.727 0.394 -2.248) 4.370 25.691 ( 3.068 -1.154 -0.668) 3.346 25.735 ( -6.287 -0.042 2.253) 6.679 27.262 ( 5.072 0.590 3.850) 6.395 47.947 ( -7.104 -0.108 19.692) 20.935 48.175 ( -10.396 0.079 15.619) 18.763 48.680 ( 9.474 0.054 -12.728) 15.867 48.774 ( 5.498 -0.062 -17.997) 18.818 98.642 ( -1.678 0.740 2.904) 3.434 98.846 ( -0.838 -0.289 -6.798) 6.855 99.375 ( 1.059 2.238 6.662) 7.107 99.408 ( -3.016 -2.113 6.710) 7.654 100.755 ( -1.260 0.185 6.576) 6.698 101.046 ( 0.473 -0.472 -8.318) 8.345 101.474 ( -12.818 1.825 11.947) 17.617 101.573 ( 6.009 -3.271 -5.467) 8.758 ======================= Grid point 404 (202/230) ======================= q-point: (-0.11 -0.33 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.211 ( -14.054 -3.155 6.258) 15.705 2.128 ( -5.745 -1.884 -1.359) 6.197 2.284 ( 1.956 0.411 -2.702) 3.361 2.394 ( 3.509 -2.989 1.893) 4.983 2.604 ( 3.144 0.311 -0.184) 3.165 2.757 ( 5.222 -4.593 12.630) 14.418 3.190 ( -11.685 5.550 6.113) 14.308 3.363 ( -6.190 2.024 3.053) 7.193 3.519 ( -3.974 -5.249 3.180) 7.311 3.584 ( -6.229 -1.405 0.553) 6.410 3.627 ( 3.535 -5.261 -3.805) 7.392 3.933 ( 4.450 -4.726 2.939) 7.126 4.224 ( 3.162 3.378 2.825) 5.421 4.391 ( 3.076 9.745 -0.751) 10.247 4.602 ( 3.673 -4.197 2.710) 6.200 4.939 ( -6.305 1.655 3.807) 7.549 5.014 ( -6.610 3.808 -4.286) 8.750 5.142 ( -2.600 1.169 -14.675) 14.950 5.474 ( 0.517 -4.499 8.414) 9.556 5.556 ( -0.449 -1.372 -3.017) 3.345 5.709 ( -4.124 1.899 0.082) 4.541 5.951 ( 5.420 -3.006 -0.205) 6.201 6.441 ( -1.440 2.257 3.245) 4.207 6.697 ( 2.967 5.319 -8.608) 10.545 6.827 ( 5.258 -1.432 -14.978) 15.939 6.919 ( 6.097 3.717 -7.971) 10.702 8.478 ( 1.145 3.687 -3.389) 5.137 8.876 ( -0.749 -4.253 2.372) 4.927 10.035 ( -5.898 -2.146 7.392) 9.697 10.270 ( 2.240 -1.684 -3.230) 4.277 10.463 ( -2.821 -3.973 0.940) 4.963 10.561 ( -6.205 0.110 -3.045) 6.913 10.592 ( 6.799 7.223 2.969) 10.355 10.775 ( 7.331 -2.538 0.645) 7.785 11.481 ( 2.470 2.644 3.902) 5.322 11.684 ( 1.285 -2.370 2.238) 3.504 12.008 ( 1.110 0.269 1.481) 1.870 12.098 ( -4.503 -1.367 5.527) 7.259 13.184 ( -1.307 0.869 -5.333) 5.559 13.921 ( -0.846 0.152 -0.196) 0.882 17.005 ( 23.149 -0.130 17.842) 29.228 17.283 ( -18.973 1.650 -22.495) 29.474 19.178 ( -0.893 0.808 -1.043) 1.593 19.203 ( -0.542 0.182 0.165) 0.595 19.712 ( -10.581 -0.811 -3.707) 11.241 19.948 ( 13.509 -0.056 -3.187) 13.880 20.362 ( -6.601 -1.775 7.357) 10.043 20.879 ( 6.371 2.378 -10.097) 12.174 21.833 ( 4.862 -0.869 5.909) 7.701 21.872 ( -9.512 -1.121 -4.777) 10.703 21.938 ( -21.018 0.408 3.860) 21.373 22.372 ( 21.150 -0.248 2.385) 21.285 24.295 ( -2.317 0.389 -0.933) 2.528 24.335 ( 2.841 -0.503 -0.835) 3.004 24.521 ( 2.012 -0.412 4.924) 5.335 24.718 ( -2.323 0.489 -7.020) 7.411 25.442 ( 2.517 1.728 -2.668) 4.054 25.674 ( -3.358 -1.221 1.565) 3.901 25.759 ( 4.618 -1.856 -1.296) 5.143 27.322 ( 0.262 1.278 0.593) 1.433 48.005 ( -6.457 -0.125 20.479) 21.473 48.128 ( -10.382 0.128 14.991) 18.236 48.701 ( 5.573 0.103 -16.407) 17.328 48.747 ( 9.576 -0.159 -14.471) 17.353 98.650 ( 0.135 1.659 4.150) 4.471 98.797 ( 1.123 -0.290 -5.485) 5.606 99.319 ( -7.276 -0.935 3.915) 8.315 99.553 ( 7.974 1.730 6.451) 10.401 100.788 ( -1.598 0.617 7.451) 7.646 100.987 ( -0.050 -0.913 -6.852) 6.913 101.342 ( -11.947 1.950 10.796) 16.220 101.713 ( 11.590 -7.262 -6.864) 15.303 ======================= Grid point 412 (203/230) ======================= q-point: (-0.22 -0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.190 ( -15.016 -0.000 8.516) 17.262 2.106 ( -2.276 -0.000 -2.910) 3.694 2.300 ( 1.526 0.000 -0.246) 1.545 2.366 ( -0.481 -0.000 3.776) 3.807 2.606 ( 3.074 0.000 -0.039) 3.074 2.720 ( 7.250 0.000 12.696) 14.620 3.249 ( -10.468 -0.000 8.081) 13.224 3.382 ( -10.273 -0.000 1.707) 10.414 3.449 ( -3.127 -0.000 4.597) 5.560 3.573 ( -7.777 -0.000 1.089) 7.853 3.597 ( 4.168 0.000 -5.633) 7.007 3.899 ( 4.906 0.000 2.059) 5.320 4.250 ( 3.442 0.000 2.981) 4.554 4.513 ( 6.547 0.000 -3.561) 7.452 4.521 ( 1.546 0.000 6.659) 6.836 4.949 ( -9.115 -0.000 2.120) 9.358 5.049 ( -7.974 -0.000 -6.169) 10.081 5.154 ( 0.588 0.000 -15.995) 16.006 5.430 ( 2.386 0.000 11.802) 12.041 5.548 ( -0.298 -0.000 -3.739) 3.751 5.728 ( -4.786 -0.000 -0.044) 4.786 5.926 ( 4.703 0.000 1.055) 4.820 6.454 ( -2.850 -0.000 1.649) 3.293 6.769 ( 8.719 0.000 -9.434) 12.847 6.789 ( 2.403 0.000 -15.429) 15.615 6.947 ( 5.855 0.000 -8.530) 10.346 8.509 ( 2.537 0.000 -5.201) 5.787 8.841 ( -2.227 -0.000 4.213) 4.766 10.020 ( -6.252 -0.000 8.380) 10.455 10.258 ( 2.091 0.000 -2.795) 3.490 10.431 ( -2.543 -0.000 2.316) 3.440 10.563 ( -6.153 -0.000 -4.636) 7.704 10.669 ( 9.211 0.000 -0.886) 9.254 10.731 ( 5.145 0.000 4.510) 6.842 11.507 ( 3.862 0.000 5.532) 6.747 11.660 ( 0.773 0.000 1.386) 1.587 12.010 ( 1.936 0.000 1.670) 2.557 12.087 ( -5.925 -0.000 5.496) 8.081 13.191 ( -1.353 -0.000 -5.691) 5.850 13.922 ( -0.749 -0.000 -0.271) 0.797 17.004 ( 23.262 0.000 17.803) 29.293 17.296 ( -18.533 -0.000 -22.984) 29.525 19.183 ( -1.577 -0.000 -1.529) 2.196 19.206 ( 0.438 0.000 0.293) 0.527 19.705 ( -10.783 -0.000 -3.483) 11.332 19.947 ( 13.470 0.000 -3.191) 13.842 20.349 ( -6.703 -0.000 7.473) 10.039 20.897 ( 6.847 0.000 -10.482) 12.520 21.826 ( 6.880 0.000 8.251) 10.743 21.862 ( -14.116 -0.000 -7.034) 15.771 21.942 ( -18.903 -0.000 4.477) 19.426 22.370 ( 21.350 0.000 2.668) 21.516 24.299 ( -3.515 -0.000 -0.943) 3.639 24.330 ( 3.193 0.000 -1.380) 3.479 24.518 ( 2.541 0.000 5.274) 5.855 24.722 ( -2.163 -0.000 -6.921) 7.251 25.455 ( 3.658 0.000 -3.762) 5.247 25.663 ( -4.561 -0.000 2.377) 5.143 25.746 ( 4.408 0.000 -0.335) 4.421 27.332 ( 0.601 0.000 -0.034) 0.602 48.004 ( -6.416 -0.000 20.519) 21.498 48.129 ( -10.387 -0.000 14.967) 18.218 48.702 ( 5.472 0.000 -16.521) 17.404 48.745 ( 9.641 0.000 -14.335) 17.276 98.664 ( 0.228 0.000 4.382) 4.388 98.794 ( 1.518 0.000 -6.095) 6.281 99.312 ( -7.599 -0.000 3.756) 8.477 99.566 ( 8.749 0.000 6.544) 10.925 100.793 ( -1.527 -0.000 7.584) 7.736 100.980 ( -0.031 -0.000 -6.864) 6.864 101.359 ( -12.474 -0.000 11.644) 17.064 101.654 ( 9.967 0.000 -6.082) 11.677 ======================= Grid point 413 (204/230) ======================= q-point: (-0.11 -0.22 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 406 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.203 ( -1.365 -0.069 24.969) 25.006 1.936 ( -15.241 -1.136 6.131) 16.467 2.347 ( 3.923 2.537 2.089) 5.118 2.523 ( 10.194 -2.894 2.303) 10.844 2.609 ( -1.121 -0.086 -2.451) 2.696 2.980 ( 5.634 -1.219 12.440) 13.710 3.116 ( -7.759 7.882 6.067) 12.615 3.261 ( -7.237 -1.469 4.854) 8.837 3.328 ( -9.104 -6.959 5.275) 12.615 3.609 ( 3.669 -0.235 -3.184) 4.864 3.628 ( 3.718 -2.942 -2.556) 5.386 3.993 ( 4.009 -2.400 0.878) 4.754 4.310 ( -0.344 2.077 0.969) 2.317 4.408 ( -6.174 4.522 -5.705) 9.546 4.577 ( -2.568 -0.627 3.101) 4.075 4.860 ( -9.236 -0.128 0.676) 9.261 4.985 ( 5.251 -0.570 8.730) 10.203 5.064 ( 4.263 1.243 -11.868) 12.672 5.463 ( -4.619 1.953 -4.658) 6.844 5.585 ( -0.057 -0.840 8.335) 8.377 5.636 ( -2.362 -0.734 2.239) 3.336 6.016 ( 4.241 -1.802 -0.796) 4.676 6.371 ( -6.111 -0.984 -0.832) 6.245 6.696 ( 3.379 2.988 -13.887) 14.601 6.801 ( 3.719 1.404 -10.816) 11.524 6.952 ( 4.267 0.956 -8.861) 9.881 8.520 ( 3.861 2.669 -2.912) 5.524 8.848 ( -1.775 -3.057 2.796) 4.507 10.021 ( -3.330 -0.731 10.249) 10.801 10.257 ( -0.473 -0.532 -2.555) 2.652 10.391 ( -3.207 -1.018 -0.282) 3.377 10.435 ( -4.547 -1.016 -2.805) 5.438 10.787 ( 6.044 6.620 1.855) 9.153 10.872 ( 7.971 -4.218 -1.193) 9.097 11.575 ( 2.231 5.286 0.816) 5.795 11.707 ( 2.295 -2.974 0.291) 3.768 12.044 ( -2.403 -0.023 3.083) 3.909 12.060 ( -0.250 -1.600 4.657) 4.931 13.144 ( -0.143 0.183 -1.520) 1.538 13.876 ( -3.965 0.051 -0.953) 4.079 16.803 ( -16.094 0.951 -19.828) 25.555 17.569 ( 24.563 0.027 16.836) 29.779 19.117 ( -8.566 -0.064 0.406) 8.575 19.229 ( 1.919 0.840 0.249) 2.110 19.492 ( -7.137 -0.588 -5.362) 8.946 20.094 ( 7.781 -0.115 -4.105) 8.798 20.303 ( -6.737 -0.933 7.849) 10.386 20.894 ( 3.291 1.519 -10.181) 10.807 21.531 ( -23.796 -0.435 3.886) 24.116 21.560 ( -13.526 -0.216 -7.390) 15.415 22.114 ( 9.509 -0.196 8.680) 12.876 22.706 ( 15.982 0.066 0.302) 15.985 24.225 ( -3.166 -0.657 -1.888) 3.744 24.359 ( 2.178 -0.198 -4.171) 4.709 24.632 ( 3.617 0.368 7.738) 8.550 24.708 ( 5.299 0.450 -0.275) 5.325 25.468 ( 2.370 1.991 -4.250) 5.257 25.622 ( -3.034 -2.111 1.638) 4.042 25.838 ( 6.366 -0.571 0.010) 6.391 27.273 ( -5.543 0.598 -3.703) 6.693 48.067 ( -8.654 0.244 18.366) 20.304 48.088 ( -7.529 -0.164 16.819) 18.428 48.645 ( 5.570 -0.021 -17.541) 18.404 48.797 ( 9.789 -0.044 -13.310) 16.522 98.722 ( 1.994 1.338 5.461) 5.965 98.792 ( 3.411 -0.233 -4.860) 5.942 99.213 ( -7.208 -0.771 2.544) 7.683 99.769 ( 10.931 1.949 1.121) 11.160 100.823 ( -3.151 0.501 8.192) 8.792 100.935 ( 0.912 -0.459 -5.715) 5.806 101.280 ( -7.083 1.452 11.800) 13.839 101.795 ( 10.578 -5.913 -7.054) 14.022 ======================= Grid point 422 (205/230) ======================= q-point: (-0.11 -0.11 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 230 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.507 ( 4.478 0.000 33.482) 33.780 1.752 ( -14.839 -0.000 14.143) 20.499 2.434 ( 2.445 0.000 -3.453) 4.231 2.581 ( 0.605 0.000 5.174) 5.210 2.712 ( 10.521 0.000 1.646) 10.649 2.949 ( -13.916 -0.000 12.880) 18.962 3.120 ( -4.299 -0.000 3.854) 5.774 3.174 ( -2.600 -0.000 -0.701) 2.693 3.436 ( 11.706 0.000 6.085) 13.193 3.611 ( 1.322 0.000 -3.366) 3.616 3.642 ( 0.031 0.000 -1.336) 1.336 4.043 ( 0.408 0.000 -6.262) 6.276 4.117 ( -7.693 -0.000 -4.318) 8.822 4.404 ( -2.153 -0.000 8.006) 8.291 4.529 ( -7.305 -0.000 6.244) 9.610 4.812 ( 2.145 0.000 1.624) 2.690 5.052 ( 2.510 0.000 -4.134) 4.837 5.195 ( 9.600 0.000 6.788) 11.758 5.331 ( -5.094 -0.000 -9.414) 10.704 5.480 ( -7.940 -0.000 -0.693) 7.970 5.770 ( 4.247 0.000 9.752) 10.637 6.030 ( -1.088 -0.000 -1.865) 2.159 6.271 ( -2.629 -0.000 -1.760) 3.163 6.642 ( 4.282 0.000 -15.881) 16.448 6.736 ( -4.046 -0.000 -4.904) 6.358 6.939 ( 3.271 0.000 -9.282) 9.842 8.585 ( 5.005 0.000 -2.348) 5.529 8.823 ( -2.391 -0.000 2.425) 3.405 10.080 ( -0.963 -0.000 11.674) 11.714 10.186 ( -4.322 -0.000 -3.452) 5.532 10.331 ( -2.415 -0.000 -1.859) 3.047 10.380 ( -0.316 -0.000 0.367) 0.485 10.855 ( 0.157 0.000 -0.129) 0.203 11.011 ( 10.417 0.000 -4.043) 11.174 11.609 ( 0.721 0.000 -4.267) 4.328 11.734 ( 2.714 0.000 -0.884) 2.854 12.015 ( -2.899 -0.000 4.318) 5.201 12.123 ( 1.712 0.000 4.880) 5.172 13.159 ( 1.747 0.000 1.546) 2.333 13.776 ( -6.071 -0.000 -2.053) 6.409 16.480 ( -5.257 -0.000 -9.918) 11.225 18.043 ( 13.004 0.000 9.357) 16.020 18.852 ( -16.377 -0.000 -1.648) 16.460 19.262 ( 0.978 0.000 0.068) 0.981 19.462 ( 5.319 0.000 0.041) 5.319 20.146 ( 2.462 0.000 -3.874) 4.590 20.255 ( -6.422 -0.000 7.857) 10.148 20.817 ( -3.063 -0.000 -9.755) 10.224 21.202 ( -18.926 -0.000 5.872) 19.816 21.328 ( -5.128 -0.000 -8.143) 9.623 22.322 ( 6.255 0.000 9.125) 11.063 22.906 ( 8.768 0.000 -2.444) 9.103 24.165 ( -1.759 -0.000 -1.588) 2.370 24.333 ( 0.237 0.000 -5.736) 5.741 24.762 ( 2.912 0.000 9.032) 9.490 24.891 ( 13.786 0.000 2.226) 13.965 25.472 ( 2.002 0.000 -5.943) 6.271 25.568 ( -3.972 -0.000 2.027) 4.459 25.964 ( 8.229 0.000 1.091) 8.301 27.082 ( -12.127 -0.000 -5.633) 13.371 48.026 ( -10.216 -0.000 14.583) 17.806 48.153 ( -5.876 -0.000 19.766) 20.620 48.597 ( 6.150 0.000 -17.104) 18.176 48.846 ( 9.405 0.000 -13.565) 16.507 98.815 ( 4.193 0.000 -4.880) 6.434 98.818 ( 2.134 0.000 5.983) 6.352 99.124 ( -5.426 -0.000 3.737) 6.589 99.922 ( 8.318 0.000 -7.636) 11.291 100.812 ( -6.021 -0.000 7.295) 9.459 100.914 ( 2.186 0.000 -5.175) 5.617 101.343 ( 0.924 0.000 12.610) 12.644 101.867 ( 7.596 0.000 -7.015) 10.339 ======================= Grid point 423 (206/230) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.150 ( -1.129 -0.000 -12.105) 12.157 2.150 ( 1.129 0.000 12.105) 12.157 2.635 ( 1.672 0.000 -18.558) 18.633 2.635 ( -1.672 -0.000 18.558) 18.633 2.869 ( 3.180 0.000 -3.684) 4.867 2.869 ( -3.180 -0.000 3.684) 4.867 3.091 ( 7.480 0.000 -3.053) 8.079 3.091 ( -7.480 -0.000 3.053) 8.079 3.514 ( -1.414 -0.000 -0.942) 1.700 3.514 ( 1.414 0.000 0.942) 1.700 3.724 ( -2.724 -0.000 0.624) 2.795 3.724 ( 2.724 0.000 -0.624) 2.795 4.489 ( -10.531 -0.000 -8.327) 13.426 4.489 ( 10.531 0.000 8.327) 13.426 4.644 ( 7.622 0.000 -15.190) 16.995 4.644 ( -7.622 -0.000 15.190) 16.995 4.967 ( -5.730 -0.000 -10.785) 12.212 4.967 ( 5.730 0.000 10.785) 12.212 5.547 ( 2.141 0.000 -7.583) 7.880 5.547 ( -2.141 -0.000 7.583) 7.880 6.009 ( -0.471 -0.000 -1.591) 1.659 6.009 ( 0.471 0.000 1.591) 1.659 6.195 ( 4.499 0.000 -9.285) 10.317 6.196 ( -4.499 -0.000 9.285) 10.317 6.741 ( 3.268 0.000 -7.505) 8.186 6.741 ( -3.268 -0.000 7.505) 8.186 8.731 ( -4.700 -0.000 -0.426) 4.719 8.731 ( 4.700 0.000 0.426) 4.719 10.104 ( 0.461 0.000 -5.183) 5.204 10.104 ( -0.461 -0.000 5.183) 5.204 10.418 ( -1.957 -0.000 -2.418) 3.111 10.418 ( 1.957 0.000 2.418) 3.111 10.880 ( -2.149 -0.000 -4.658) 5.130 10.880 ( 2.149 0.000 4.658) 5.130 11.643 ( -3.089 -0.000 -2.833) 4.191 11.643 ( 3.089 0.000 2.833) 4.191 12.137 ( -1.793 -0.000 -2.572) 3.135 12.137 ( 1.793 0.000 2.572) 3.135 13.426 ( -6.098 -0.000 -4.313) 7.469 13.426 ( 6.098 0.000 4.313) 7.469 17.107 ( -32.923 -0.000 -8.200) 33.929 17.107 ( 32.923 0.000 8.200) 33.929 19.154 ( -9.394 -0.000 -1.162) 9.466 19.154 ( 9.394 0.000 1.162) 9.466 19.905 ( -7.240 -0.000 -5.321) 8.986 19.905 ( 7.240 0.000 5.321) 8.986 20.395 ( 1.338 0.000 -8.782) 8.883 20.395 ( -1.338 -0.000 8.782) 8.883 21.065 ( 6.528 0.000 -8.607) 10.803 21.065 ( -6.528 -0.000 8.607) 10.803 22.791 ( -0.963 -0.000 -9.030) 9.081 22.791 ( 0.963 0.000 9.030) 9.081 24.158 ( -0.777 -0.000 -2.199) 2.333 24.158 ( 0.777 0.000 2.199) 2.333 25.160 ( 2.264 0.000 -10.136) 10.386 25.160 ( -2.264 -0.000 10.136) 10.386 25.426 ( -7.498 -0.000 0.416) 7.509 25.426 ( 7.498 0.000 -0.416) 7.509 26.417 ( -13.799 -0.000 -3.482) 14.231 26.417 ( 13.799 0.000 3.482) 14.231 48.245 ( 8.986 0.000 -16.000) 18.351 48.245 ( -8.986 -0.000 16.000) 18.351 48.589 ( 8.484 0.000 -17.379) 19.339 48.589 ( -8.484 -0.000 17.379) 19.339 98.831 ( 4.021 0.000 -1.456) 4.277 98.831 ( -4.021 -0.000 1.456) 4.277 99.507 ( -3.323 -0.000 -13.531) 13.933 99.507 ( 3.323 0.000 13.531) 13.933 100.837 ( 5.414 0.000 -6.210) 8.238 100.837 ( -5.414 -0.000 6.210) 8.238 101.740 ( 0.767 0.000 -7.584) 7.623 101.740 ( -0.767 -0.000 7.584) 7.623 ======================= Grid point 425 (207/230) ======================= q-point: ( 0.11 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.059 ( 4.472 0.136 -16.727) 17.315 2.291 ( 5.998 0.384 4.411) 7.455 2.423 ( -0.565 6.360 -24.695) 25.507 2.647 ( -6.504 9.366 13.665) 17.798 2.833 ( -2.688 4.653 -4.257) 6.856 2.930 ( 0.218 -2.958 4.454) 5.351 3.051 ( -0.296 -6.218 5.873) 8.558 3.174 ( 4.946 -4.684 -6.199) 9.210 3.531 ( 2.724 0.208 0.542) 2.786 3.584 ( 2.599 -0.008 0.763) 2.709 3.687 ( -2.598 -2.170 4.769) 5.848 3.723 ( -2.596 -2.952 -1.060) 4.072 4.265 ( -6.376 2.208 -5.825) 8.914 4.561 ( -10.728 3.076 12.153) 16.500 4.629 ( 2.774 0.013 -8.969) 9.388 4.784 ( 14.502 5.098 4.880) 16.128 4.821 ( -4.498 -3.450 -3.718) 6.779 5.172 ( 5.106 -4.819 9.729) 11.998 5.480 ( 2.287 0.007 -16.824) 16.979 5.537 ( -1.258 -0.311 -3.027) 3.293 5.982 ( -0.958 2.135 -1.751) 2.923 5.999 ( 0.302 -0.177 -2.088) 2.117 6.205 ( 0.848 1.481 1.863) 2.527 6.247 ( -0.919 -2.347 10.520) 10.818 6.741 ( 3.880 -0.295 -7.200) 8.184 6.758 ( -2.261 -0.762 6.605) 7.023 8.646 ( -5.048 -0.539 -0.528) 5.104 8.809 ( 4.012 -0.392 -0.037) 4.032 10.096 ( 2.642 0.492 -2.532) 3.692 10.166 ( 1.747 -0.590 6.241) 6.508 10.345 ( -1.051 2.081 -6.259) 6.679 10.444 ( 0.834 0.606 -1.582) 1.888 10.830 ( -1.014 -0.291 -0.130) 1.063 10.946 ( -1.175 0.296 6.265) 6.381 11.555 ( -3.866 1.822 -1.037) 4.398 11.696 ( 0.073 0.196 3.338) 3.345 12.086 ( -1.699 -0.329 -1.656) 2.395 12.175 ( -0.045 0.241 2.466) 2.478 13.308 ( -3.190 -0.332 -5.198) 6.108 13.580 ( 7.886 -0.172 3.152) 8.495 16.577 ( -21.366 0.262 -4.552) 21.847 17.759 ( 33.300 0.056 7.553) 34.145 18.947 ( -10.360 0.576 -4.977) 11.508 19.268 ( 4.257 0.319 -1.362) 4.481 19.706 ( -10.616 -0.323 -4.936) 11.712 20.030 ( 2.131 -0.168 5.029) 5.465 20.390 ( 6.385 -0.474 -9.473) 11.434 20.499 ( 4.694 0.186 7.793) 9.099 21.060 ( -2.587 0.451 9.288) 9.652 21.138 ( 10.377 0.075 -7.112) 12.580 22.668 ( -3.914 0.539 -9.277) 10.084 22.848 ( -2.838 0.370 8.079) 8.571 24.138 ( 0.130 -0.327 -1.054) 1.111 24.198 ( 1.159 -0.222 2.933) 3.162 25.057 ( -4.284 3.524 -6.407) 8.475 25.119 ( -8.849 -1.511 1.744) 9.145 25.357 ( -1.039 0.171 1.504) 1.836 25.550 ( 7.483 -0.598 -2.577) 7.937 26.175 ( -12.302 -0.452 -1.515) 12.403 26.694 ( 13.609 -0.508 5.619) 14.732 48.239 ( -8.328 0.038 17.024) 18.952 48.270 ( 9.566 0.036 -15.168) 17.933 48.573 ( 7.399 0.020 -18.084) 19.539 48.583 ( -9.330 -0.034 16.609) 19.051 98.778 ( -4.437 -0.017 2.688) 5.188 98.886 ( 3.256 -0.079 -0.746) 3.342 99.332 ( -4.142 0.128 -10.987) 11.743 99.651 ( -0.122 1.074 13.734) 13.776 100.811 ( -3.775 -0.140 5.925) 7.027 100.887 ( 6.843 0.232 -6.565) 9.486 101.660 ( -1.811 0.633 -8.523) 8.737 101.771 ( -4.227 -2.478 8.156) 9.514 ======================= Grid point 426 (208/230) ======================= q-point: ( 0.22 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.968 ( 1.138 6.422 -17.987) 19.133 2.140 ( -2.523 -1.820 -21.075) 21.303 2.393 ( 6.157 4.615 -4.455) 8.892 2.579 ( -4.661 7.275 7.709) 11.580 2.680 ( -3.083 5.466 -5.954) 8.651 2.987 ( -0.394 0.555 7.017) 7.050 3.188 ( 2.615 -4.738 3.604) 6.502 3.256 ( 7.180 -7.690 -4.703) 11.524 3.521 ( -4.930 1.491 -3.110) 6.017 3.597 ( 1.226 1.517 2.734) 3.358 3.613 ( -5.521 -5.589 -2.381) 8.209 3.867 ( 6.408 -3.002 10.244) 12.451 4.163 ( -0.959 -1.042 -2.718) 3.065 4.441 ( -8.212 7.249 8.432) 13.824 4.577 ( -1.158 1.075 -5.312) 5.542 4.764 ( -0.822 -4.483 -3.045) 5.481 5.053 ( 13.195 4.753 7.446) 15.878 5.310 ( -2.663 -5.664 2.463) 6.726 5.351 ( 1.636 0.477 -19.318) 19.393 5.504 ( 4.690 0.397 -5.240) 7.043 5.893 ( -3.606 2.959 -3.679) 5.941 6.015 ( -0.671 -0.832 2.173) 2.421 6.249 ( 1.658 1.090 6.732) 7.018 6.353 ( 1.610 -4.126 6.798) 8.114 6.744 ( 3.167 0.648 -6.887) 7.608 6.781 ( -2.493 -0.725 6.519) 7.017 8.559 ( -5.020 -0.519 -0.725) 5.099 8.871 ( 3.101 -0.608 -0.469) 3.195 10.139 ( 3.983 1.214 0.534) 4.198 10.250 ( -0.937 0.007 -1.656) 1.902 10.284 ( 5.145 0.466 -0.713) 5.215 10.422 ( -0.495 -0.133 -2.563) 2.613 10.831 ( -0.284 1.108 1.198) 1.656 10.911 ( -7.268 1.157 4.321) 8.535 11.490 ( -1.220 4.762 1.662) 5.189 11.709 ( -1.563 -0.824 3.169) 3.628 12.065 ( -0.015 0.013 -0.582) 0.582 12.172 ( -2.172 -0.768 1.272) 2.632 13.229 ( -1.449 -0.651 -5.297) 5.530 13.736 ( 7.232 -0.159 2.160) 7.550 16.345 ( -4.468 0.601 3.619) 5.781 18.166 ( 3.050 -0.061 -3.015) 4.289 18.857 ( 12.000 0.720 -2.889) 12.363 19.282 ( 0.184 0.638 -2.375) 2.465 19.497 ( -9.549 -0.748 -2.614) 9.928 20.068 ( -2.283 -0.117 4.063) 4.662 20.438 ( 7.700 -1.185 -9.641) 12.396 20.638 ( 2.882 1.129 7.576) 8.184 21.154 ( 5.727 0.599 9.205) 10.857 21.307 ( 15.879 -0.007 -4.766) 16.579 22.496 ( -6.631 0.818 -8.933) 11.155 22.817 ( -8.110 0.531 6.436) 10.366 24.153 ( 1.484 -0.809 0.359) 1.728 24.246 ( 1.022 -0.365 3.224) 3.402 24.868 ( -9.746 3.827 -1.664) 10.602 24.974 ( -5.942 -2.113 -8.006) 10.191 25.371 ( 0.243 1.031 2.755) 2.952 25.635 ( 5.264 -0.134 -3.253) 6.189 25.983 ( -9.984 -0.697 -0.196) 10.010 26.965 ( 11.191 -0.693 6.678) 13.051 48.253 ( -7.629 0.077 18.096) 19.639 48.309 ( 10.047 0.061 -14.632) 17.749 48.532 ( 6.461 0.038 -18.944) 20.015 48.558 ( -9.979 -0.083 15.945) 18.810 98.727 ( -4.509 0.114 3.474) 5.693 98.906 ( 0.210 0.466 -3.291) 3.330 99.218 ( -0.176 -1.037 -5.032) 5.140 99.709 ( -4.225 2.302 11.161) 12.153 100.810 ( -2.527 -0.403 5.832) 6.369 100.944 ( 6.759 0.812 -7.085) 9.825 101.540 ( -0.943 2.118 -10.101) 10.363 101.772 ( -8.052 -5.467 9.397) 13.529 ======================= Grid point 427 (209/230) ======================= q-point: ( 0.33 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.664 ( -6.384 4.121 -23.310) 24.517 2.078 ( 4.089 -1.138 -6.090) 7.423 2.343 ( -0.331 6.968 -5.503) 8.886 2.531 ( -4.042 2.927 2.214) 5.459 2.582 ( 0.481 2.932 -2.375) 3.804 2.998 ( -2.746 4.981 5.265) 7.750 3.239 ( -0.462 -6.192 -5.365) 8.206 3.389 ( 1.666 -1.103 -5.345) 5.706 3.438 ( 6.994 -1.727 -0.537) 7.224 3.579 ( -4.200 -5.919 2.885) 7.809 3.638 ( 0.031 -2.980 2.920) 4.172 4.036 ( 1.467 -0.923 7.206) 7.412 4.179 ( 1.053 -0.301 0.584) 1.241 4.339 ( -4.116 6.722 3.711) 8.712 4.524 ( 1.501 2.550 0.564) 3.013 4.800 ( 2.020 -2.662 2.437) 4.136 5.164 ( -1.891 -2.571 -10.610) 11.079 5.217 ( -4.837 -3.944 -10.564) 12.270 5.337 ( 12.975 4.980 -1.015) 13.935 5.586 ( 5.244 1.944 1.210) 5.723 5.776 ( -4.103 0.412 -4.214) 5.896 6.003 ( -4.015 -0.554 3.592) 5.416 6.352 ( 0.508 0.500 12.758) 12.778 6.478 ( 5.711 -6.143 -0.806) 8.426 6.709 ( 0.736 2.249 -6.567) 6.981 6.788 ( -3.186 0.500 5.478) 6.357 8.475 ( -4.021 0.017 -0.941) 4.130 8.915 ( 2.011 -0.688 -0.409) 2.164 10.193 ( 1.788 1.702 -4.707) 5.315 10.215 ( 2.929 -0.142 0.056) 2.933 10.369 ( 0.027 -0.685 1.980) 2.095 10.447 ( 5.685 -2.483 1.187) 6.316 10.747 ( -6.898 2.957 -2.442) 7.893 10.834 ( -4.493 1.963 3.963) 6.304 11.466 ( 0.418 4.906 2.268) 5.421 11.717 ( -1.211 -1.058 2.631) 3.084 12.054 ( 0.158 3.046 -1.055) 3.228 12.158 ( -1.995 -4.014 1.037) 4.601 13.174 ( -0.826 -0.706 -4.269) 4.405 13.854 ( 4.755 0.050 1.221) 4.909 16.469 ( 10.343 0.954 13.073) 16.697 17.883 ( -19.320 -0.039 -15.306) 24.648 19.143 ( 11.156 -0.524 -1.729) 11.301 19.244 ( -0.643 1.053 -2.595) 2.874 19.425 ( 5.384 -0.638 2.523) 5.980 20.025 ( -6.315 0.069 2.884) 6.942 20.493 ( 6.633 -1.618 -8.610) 10.989 20.690 ( -2.363 1.886 7.303) 7.904 21.399 ( 13.476 0.400 8.711) 16.052 21.598 ( 21.542 -0.045 -2.176) 21.651 22.280 ( -9.537 0.602 -8.418) 12.735 22.664 ( -14.852 0.698 4.051) 15.411 24.207 ( 2.877 -1.273 1.525) 3.497 24.290 ( 0.457 -0.707 3.153) 3.263 24.679 ( -7.662 2.499 -0.809) 8.099 24.817 ( -4.813 -0.762 -9.496) 10.674 25.388 ( 0.110 0.886 1.934) 2.130 25.681 ( 3.640 0.553 -2.937) 4.710 25.844 ( -7.339 -0.873 0.633) 7.418 27.180 ( 7.089 -0.483 5.490) 8.979 48.287 ( -6.944 0.114 19.035) 20.263 48.359 ( 10.402 0.065 -14.415) 17.776 48.472 ( 5.989 0.001 -19.714) 20.603 48.519 ( -10.434 -0.107 15.383) 18.588 98.686 ( -3.612 0.122 3.584) 5.090 98.835 ( -2.143 0.854 -5.740) 6.186 99.259 ( 4.750 -2.143 0.247) 5.217 99.668 ( -7.028 2.840 6.492) 9.980 100.830 ( -1.657 -0.723 6.134) 6.395 100.965 ( 3.797 1.322 -7.896) 8.861 101.462 ( 4.856 2.885 -9.927) 11.422 101.734 ( -11.100 -6.312 9.670) 16.018 ======================= Grid point 428 (210/230) ======================= q-point: ( 0.44 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.403 ( -3.390 0.762 -10.429) 10.993 2.139 ( 4.386 0.218 -0.252) 4.399 2.257 ( 0.180 3.796 -3.141) 4.931 2.426 ( -5.470 -0.227 -0.528) 5.500 2.581 ( 0.330 1.064 0.492) 1.218 2.939 ( -1.993 2.921 0.987) 3.672 3.212 ( -0.448 -2.825 -3.593) 4.593 3.420 ( 2.941 0.290 -0.848) 3.074 3.532 ( 2.300 -1.381 -0.144) 2.686 3.569 ( -2.452 -0.451 1.589) 2.956 3.722 ( 2.506 -5.491 1.022) 6.122 4.093 ( 1.359 0.508 3.135) 3.455 4.152 ( -2.798 0.244 -0.174) 2.814 4.238 ( -3.349 4.799 -0.583) 5.881 4.628 ( 4.930 0.207 5.216) 7.181 4.898 ( 3.122 -0.555 6.504) 7.236 5.037 ( -2.741 -1.229 -10.178) 10.612 5.075 ( -3.583 -1.432 -7.484) 8.420 5.493 ( 6.711 1.702 -0.577) 6.947 5.645 ( 2.956 4.342 1.857) 5.571 5.695 ( -3.172 -3.744 -2.672) 5.587 5.965 ( -2.901 -0.254 2.009) 3.538 6.456 ( -0.579 -0.569 10.393) 10.425 6.590 ( 4.410 -2.547 -7.239) 8.851 6.655 ( 1.411 -0.390 -1.925) 2.419 6.750 ( -4.078 2.433 3.126) 5.685 8.418 ( -1.569 0.140 -0.470) 1.644 8.940 ( 0.703 -0.325 -0.131) 0.785 10.174 ( 1.341 0.357 -3.315) 3.594 10.245 ( -0.560 -0.378 0.968) 1.180 10.430 ( 4.520 -0.780 3.814) 5.965 10.564 ( -2.789 1.731 -1.490) 3.605 10.610 ( 2.517 -3.261 -1.594) 4.418 10.750 ( -5.552 3.710 1.505) 6.845 11.465 ( 0.464 1.813 1.013) 2.128 11.725 ( -0.388 -0.341 1.105) 1.220 12.019 ( -0.405 1.619 -0.899) 1.895 12.172 ( -0.413 -2.004 0.654) 2.149 13.142 ( -0.280 -0.327 -1.688) 1.742 13.914 ( 1.627 0.083 0.379) 1.673 16.859 ( 18.941 1.027 18.883) 26.765 17.373 ( -21.940 -0.608 -19.525) 29.377 19.167 ( -0.943 -0.297 -0.536) 1.124 19.214 ( -0.408 0.301 -1.225) 1.326 19.677 ( 15.429 -0.336 0.826) 15.455 19.899 ( -10.736 0.259 1.478) 10.840 20.533 ( 3.143 -0.970 -4.224) 5.354 20.682 ( -2.139 1.109 3.787) 4.489 21.715 ( 14.617 0.226 8.371) 16.846 21.976 ( 23.156 -0.226 -0.768) 23.169 22.020 ( -12.524 0.088 -8.186) 14.962 22.378 ( -20.402 0.634 1.609) 20.475 24.274 ( 2.232 -0.296 0.790) 2.387 24.322 ( -0.317 -1.375 2.002) 2.449 24.584 ( -1.784 1.876 1.857) 3.186 24.675 ( -3.254 -0.474 -6.904) 7.647 25.395 ( 0.013 0.330 0.674) 0.751 25.711 ( 3.395 0.991 -2.127) 4.127 25.757 ( -4.812 -1.044 1.311) 5.095 27.296 ( 2.382 -0.154 2.120) 3.192 48.338 ( -6.224 0.130 19.290) 20.269 48.404 ( 5.811 -0.233 -19.022) 19.891 48.414 ( 10.650 0.237 -15.038) 18.429 48.469 ( -10.626 -0.109 14.855) 18.265 98.668 ( -1.455 -0.018 2.177) 2.619 98.760 ( -0.924 0.431 -3.188) 3.347 99.377 ( 5.682 -2.112 0.661) 6.098 99.560 ( -6.572 2.348 1.879) 7.228 100.870 ( -1.056 -1.113 6.955) 7.122 100.925 ( 1.223 1.402 -7.924) 8.140 101.485 ( 6.806 2.433 -6.199) 9.522 101.664 ( -8.517 -3.895 6.342) 11.310 ======================= Grid point 434 (211/230) ======================= q-point: ( 0.11 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.022 ( 6.231 0.000 -13.333) 14.717 2.118 ( -9.458 -0.000 -25.063) 26.788 2.432 ( 8.749 0.000 -7.334) 11.416 2.640 ( -8.297 -0.000 7.337) 11.076 2.708 ( -4.604 -0.000 -6.674) 8.107 3.054 ( 4.286 0.000 7.320) 8.482 3.110 ( 4.698 0.000 5.610) 7.318 3.180 ( 5.300 0.000 -6.980) 8.764 3.549 ( -4.862 -0.000 2.207) 5.340 3.555 ( -5.618 -0.000 -5.900) 8.147 3.613 ( 0.065 0.000 1.170) 1.172 3.840 ( 7.292 0.000 11.519) 13.633 4.156 ( -1.630 -0.000 -4.485) 4.772 4.508 ( -8.981 -0.000 12.888) 15.709 4.572 ( 0.231 0.000 -9.023) 9.026 4.729 ( 0.118 0.000 -1.921) 1.924 5.101 ( 11.531 0.000 5.647) 12.839 5.252 ( -2.644 -0.000 3.464) 4.358 5.360 ( 2.474 0.000 -18.164) 18.332 5.507 ( 4.784 0.000 -5.171) 7.045 5.919 ( -3.340 -0.000 -5.496) 6.431 6.004 ( -0.439 -0.000 1.775) 1.828 6.259 ( 5.410 0.000 -2.176) 5.831 6.319 ( -3.613 -0.000 16.828) 17.211 6.750 ( 3.041 0.000 -5.166) 5.995 6.775 ( -2.263 -0.000 6.689) 7.062 8.555 ( -5.463 -0.000 0.638) 5.501 8.867 ( 3.815 0.000 -1.802) 4.219 10.151 ( 4.519 0.000 -0.012) 4.519 10.239 ( -0.546 -0.000 4.338) 4.372 10.298 ( 3.786 0.000 -7.342) 8.261 10.419 ( -0.610 -0.000 -3.211) 3.269 10.840 ( 0.735 0.000 1.302) 1.496 10.920 ( -7.910 -0.000 4.998) 9.357 11.531 ( -0.820 -0.000 2.844) 2.959 11.700 ( -2.156 -0.000 2.577) 3.360 12.058 ( -0.276 -0.000 -0.112) 0.297 12.171 ( -1.961 -0.000 0.286) 1.982 13.225 ( -1.509 -0.000 -5.118) 5.336 13.735 ( 7.381 0.000 2.030) 7.655 16.350 ( -4.485 -0.000 3.766) 5.856 18.166 ( 3.232 0.000 -3.116) 4.489 18.862 ( 11.543 0.000 -2.925) 11.908 19.287 ( 0.109 0.000 -2.033) 2.036 19.491 ( -9.543 -0.000 -2.737) 9.928 20.067 ( -2.138 -0.000 3.948) 4.489 20.429 ( 7.793 0.000 -9.952) 12.640 20.646 ( 2.974 0.000 8.007) 8.542 21.158 ( 5.562 0.000 9.147) 10.705 21.307 ( 15.950 0.000 -4.999) 16.715 22.502 ( -6.629 -0.000 -9.196) 11.336 22.821 ( -8.066 -0.000 6.298) 10.233 24.147 ( 1.506 0.000 0.134) 1.512 24.243 ( 0.900 0.000 3.410) 3.527 24.909 ( -13.145 -0.000 0.413) 13.151 24.946 ( -3.188 -0.000 -9.639) 10.152 25.379 ( -0.306 -0.000 3.618) 3.631 25.635 ( 6.496 0.000 -4.888) 8.130 25.978 ( -9.921 -0.000 -0.208) 9.924 26.960 ( 11.109 0.000 7.071) 13.168 48.253 ( -7.607 -0.000 18.057) 19.594 48.310 ( 10.005 0.000 -14.562) 17.668 48.533 ( 6.514 0.000 -19.062) 20.145 48.557 ( -10.035 -0.000 16.050) 18.929 98.728 ( -4.673 -0.000 3.941) 6.112 98.909 ( 0.346 0.000 -2.998) 3.018 99.211 ( -0.439 -0.000 -5.543) 5.560 99.727 ( -4.540 -0.000 11.876) 12.714 100.807 ( -2.487 -0.000 5.642) 6.166 100.950 ( 6.820 0.000 -6.933) 9.725 101.560 ( -0.645 -0.000 -9.659) 9.680 101.726 ( -7.528 -0.000 7.507) 10.632 ======================= Grid point 435 (212/230) ======================= q-point: ( 0.22 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.718 ( -8.392 2.469 -25.878) 27.316 2.053 ( 5.632 -1.454 -5.906) 8.289 2.440 ( 1.366 5.630 -8.172) 10.017 2.532 ( -7.541 -2.278 0.648) 7.904 2.615 ( -0.481 1.223 -3.401) 3.646 3.072 ( -6.795 2.337 3.707) 8.086 3.205 ( 6.340 4.582 -2.965) 8.366 3.325 ( 7.105 -8.155 -0.814) 10.846 3.430 ( 4.453 0.513 -5.533) 7.121 3.507 ( -4.533 -3.071 4.311) 6.968 3.617 ( -1.605 -0.350 -0.217) 1.657 4.000 ( 0.119 -2.073 3.574) 4.134 4.181 ( 4.074 0.083 5.494) 6.840 4.453 ( -3.095 7.514 2.117) 8.398 4.529 ( -1.177 -2.289 2.781) 3.789 4.776 ( 2.793 -0.753 5.129) 5.889 5.139 ( -2.182 -0.293 -10.186) 10.421 5.161 ( -3.283 -3.103 -11.434) 12.294 5.390 ( 9.256 1.850 0.338) 9.445 5.607 ( 7.353 0.921 0.548) 7.431 5.791 ( -4.127 0.952 -7.901) 8.964 5.991 ( -3.600 -0.710 2.920) 4.689 6.360 ( 4.824 0.618 4.291) 6.486 6.406 ( -0.314 -3.113 9.839) 10.324 6.738 ( -0.157 1.294 -3.238) 3.491 6.790 ( -3.043 -0.081 6.859) 7.504 8.475 ( -5.030 -0.050 1.598) 5.278 8.908 ( 3.451 -0.274 -3.081) 4.634 10.205 ( 0.801 -0.023 -6.627) 6.675 10.224 ( 2.926 0.950 1.017) 3.240 10.367 ( 3.639 0.456 0.764) 3.746 10.410 ( 2.988 -2.114 -0.484) 3.692 10.782 ( -10.073 1.537 2.219) 10.429 10.849 ( -1.549 0.222 0.747) 1.734 11.540 ( -0.377 4.188 3.346) 5.374 11.690 ( -1.652 -2.169 1.901) 3.324 12.077 ( 1.571 0.014 0.469) 1.639 12.121 ( -2.756 -0.649 -1.379) 3.149 13.167 ( -0.832 -0.241 -3.762) 3.861 13.854 ( 4.846 -0.006 1.208) 4.994 16.479 ( 10.182 0.383 13.520) 16.930 17.882 ( -19.606 -0.014 -15.209) 24.814 19.138 ( 10.395 -0.196 -1.626) 10.524 19.255 ( -1.185 0.427 -1.983) 2.349 19.418 ( 6.269 -0.272 2.117) 6.622 20.025 ( -6.063 0.029 2.622) 6.606 20.477 ( 7.381 -0.617 -9.773) 12.262 20.709 ( -3.306 0.738 8.815) 9.443 21.403 ( 13.476 0.156 8.430) 15.896 21.596 ( 21.675 -0.080 -2.670) 21.839 22.287 ( -9.487 0.283 -8.996) 13.077 22.672 ( -14.747 0.287 3.834) 15.240 24.194 ( 3.127 -0.482 1.247) 3.400 24.282 ( 0.088 -0.313 3.264) 3.280 24.708 ( -8.729 1.246 -0.413) 8.827 24.806 ( -4.130 -0.599 -9.344) 10.234 25.396 ( -0.937 0.278 3.046) 3.199 25.689 ( 5.281 0.381 -5.270) 7.470 25.835 ( -7.192 -0.315 0.430) 7.212 27.174 ( 6.779 -0.266 6.476) 9.378 48.288 ( -6.918 0.044 18.995) 20.215 48.360 ( 10.301 0.017 -14.275) 17.603 48.472 ( 6.057 0.010 -19.887) 20.789 48.517 ( -10.459 -0.042 15.453) 18.660 98.689 ( -4.069 0.168 4.676) 6.201 98.843 ( -2.416 0.254 -5.870) 6.353 99.237 ( 4.874 -0.807 0.034) 4.941 99.698 ( -7.765 1.173 7.350) 10.757 100.822 ( -1.631 -0.289 5.818) 6.049 100.980 ( 3.759 0.527 -7.773) 8.650 101.503 ( 5.834 2.262 -10.473) 12.200 101.654 ( -9.646 -3.776 7.185) 12.607 ======================= Grid point 436 (213/230) ======================= q-point: ( 0.33 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.428 ( -1.165 2.255 -15.329) 15.538 2.100 ( -1.580 -3.415 0.744) 3.836 2.344 ( 2.882 5.863 -7.935) 10.278 2.419 ( -4.978 -0.714 -2.027) 5.423 2.597 ( -0.531 0.990 -0.178) 1.137 2.926 ( -7.574 -3.575 -3.297) 9.001 3.247 ( 5.404 6.715 -0.187) 8.621 3.417 ( 1.944 -1.157 0.801) 2.400 3.503 ( 1.351 -1.471 1.410) 2.445 3.569 ( -1.106 -0.720 0.165) 1.330 3.630 ( 9.803 -5.919 -2.753) 11.778 3.999 ( -2.211 -5.765 -2.757) 6.762 4.224 ( -4.317 2.751 4.643) 6.911 4.362 ( -0.922 10.978 1.392) 11.104 4.612 ( 2.666 -2.742 4.913) 6.226 4.897 ( 2.951 0.208 9.748) 10.187 5.019 ( -2.368 -1.115 -8.796) 9.177 5.048 ( -1.283 -1.931 -6.584) 6.980 5.499 ( 2.125 -0.461 0.748) 2.299 5.656 ( -2.923 -1.372 -8.325) 8.929 5.710 ( 6.042 3.809 0.395) 7.153 5.959 ( -1.978 -0.513 0.896) 2.231 6.455 ( -1.905 0.442 13.422) 13.564 6.529 ( 6.033 -4.377 -1.967) 7.708 6.673 ( -2.352 1.669 -2.351) 3.721 6.779 ( -4.536 1.331 6.143) 7.751 8.420 ( -3.180 0.075 2.492) 4.041 8.935 ( 2.733 -0.346 -3.524) 4.473 10.182 ( 3.130 0.427 -6.376) 7.116 10.237 ( -0.879 -0.345 0.252) 0.978 10.432 ( 4.132 1.038 2.896) 5.152 10.532 ( 6.418 -4.484 0.441) 7.842 10.611 ( -9.488 1.925 0.263) 9.685 10.790 ( -4.581 1.659 -0.794) 4.936 11.512 ( -1.016 4.182 0.651) 4.353 11.703 ( -0.567 -2.615 0.654) 2.754 12.039 ( -2.473 1.033 -1.633) 3.138 12.146 ( 2.769 -1.382 0.539) 3.141 13.140 ( -0.119 -0.037 -0.822) 0.831 13.915 ( 1.443 -0.002 0.490) 1.524 16.872 ( 18.456 0.694 19.527) 26.877 17.366 ( -22.543 -0.384 -19.131) 29.569 19.161 ( -1.299 -0.405 0.556) 1.470 19.221 ( -0.534 0.432 -1.377) 1.539 19.673 ( 15.680 -0.230 0.345) 15.686 19.902 ( -10.447 0.166 1.092) 10.505 20.520 ( 6.030 -0.757 -8.126) 10.147 20.696 ( -5.538 0.774 8.151) 9.885 21.717 ( 14.553 0.101 7.920) 16.569 21.961 ( 16.230 -1.121 -2.770) 16.503 22.035 ( -4.989 1.271 -7.545) 9.134 22.385 ( -20.754 0.314 1.204) 20.791 24.272 ( 3.487 -0.072 1.338) 3.736 24.303 ( -0.377 -1.091 2.074) 2.374 24.611 ( -2.391 1.702 1.599) 3.342 24.665 ( -3.685 -0.796 -7.013) 7.962 25.397 ( -1.247 -0.018 1.886) 2.261 25.726 ( 4.657 0.919 -4.420) 6.487 25.746 ( -4.186 -0.487 0.629) 4.261 27.293 ( 1.787 -0.271 3.574) 4.005 48.340 ( -6.296 0.098 19.478) 20.470 48.400 ( 6.329 -0.260 -18.320) 19.384 48.418 ( 10.201 0.236 -16.042) 19.012 48.468 ( -10.639 -0.060 14.920) 18.325 98.672 ( -2.154 0.510 4.446) 4.966 98.761 ( -1.349 -0.198 -4.380) 4.587 99.352 ( 6.703 -1.191 0.717) 6.845 99.589 ( -8.142 1.508 2.350) 8.607 100.856 ( -1.118 -0.728 6.612) 6.745 100.943 ( 1.118 0.905 -8.075) 8.203 101.515 ( -1.038 1.455 -0.188) 1.798 101.614 ( 3.174 -2.689 -3.428) 5.390 ======================= Grid point 437 (214/230) ======================= q-point: (-0.56 0.11 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.414 ( 6.047 2.269 4.743) 8.014 2.054 ( -8.453 -8.920 2.480) 12.537 2.278 ( 0.762 4.429 -4.837) 6.602 2.425 ( 3.711 -0.474 0.374) 3.760 2.568 ( -1.688 -0.585 -1.021) 2.058 2.868 ( 0.376 -5.481 -3.029) 6.274 3.295 ( 3.897 6.901 4.258) 8.997 3.417 ( -1.912 0.069 0.495) 1.976 3.517 ( -2.752 -2.419 -0.669) 3.725 3.604 ( 5.645 2.575 -0.159) 6.207 3.769 ( 4.651 0.932 -3.006) 5.616 3.972 ( -2.764 -7.473 -5.138) 9.481 4.185 ( 0.071 -2.871 1.428) 3.207 4.282 ( -0.168 10.365 1.039) 10.418 4.612 ( -4.884 -1.914 -6.241) 8.153 4.916 ( -3.082 1.823 -0.559) 3.625 5.052 ( 1.891 0.745 12.780) 12.940 5.084 ( 5.071 -0.202 6.678) 8.388 5.456 ( -9.401 -2.664 1.476) 9.882 5.583 ( -0.917 -4.008 -6.346) 7.562 5.764 ( 4.527 5.169 -0.793) 6.917 5.964 ( 3.177 -0.395 -2.977) 4.372 6.471 ( -1.530 1.450 -6.519) 6.852 6.583 ( -2.677 -2.037 10.134) 10.678 6.682 ( 0.680 0.417 1.953) 2.110 6.728 ( -2.181 0.891 2.486) 3.425 8.416 ( -0.261 -0.180 3.580) 3.594 8.944 ( 1.599 0.113 -3.456) 3.810 10.177 ( -0.496 0.783 0.373) 0.999 10.241 ( 2.291 -0.889 -3.184) 4.022 10.446 ( -6.629 0.821 -1.869) 6.937 10.539 ( 3.935 -0.823 3.349) 5.232 10.647 ( -1.487 0.689 -0.837) 1.840 10.696 ( 1.917 -2.693 -1.099) 3.484 11.462 ( -1.809 1.158 -1.932) 2.889 11.714 ( 0.506 -1.632 -1.384) 2.199 11.996 ( -1.781 -1.469 0.096) 2.311 12.200 ( 3.424 1.623 -0.813) 3.875 13.149 ( 0.405 0.540 2.635) 2.720 13.913 ( -1.845 -0.157 -0.248) 1.868 16.844 ( -19.467 -0.870 -18.209) 26.670 17.382 ( 21.228 0.556 20.018) 29.183 19.167 ( 0.387 -0.237 2.200) 2.247 19.214 ( 0.432 0.269 0.594) 0.782 19.682 ( -15.155 0.281 -1.370) 15.219 19.895 ( 11.071 -0.234 -1.910) 11.237 20.545 ( 1.603 0.584 -2.174) 2.763 20.667 ( -3.101 -0.824 3.124) 4.479 21.711 ( -14.514 -0.266 -8.935) 17.046 21.963 ( -14.716 -1.422 2.614) 15.013 22.038 ( 3.879 1.939 4.955) 6.584 22.367 ( 20.621 -0.740 -2.145) 20.745 24.279 ( -1.488 0.335 -0.212) 1.540 24.340 ( 1.238 0.985 -1.513) 2.189 24.560 ( 0.665 -1.378 -3.183) 3.532 24.679 ( 2.855 0.168 7.439) 7.969 25.388 ( -1.340 -0.608 0.619) 1.597 25.700 ( -1.959 -0.500 0.061) 2.023 25.774 ( 5.449 1.214 -2.513) 6.122 27.296 ( -3.056 -0.117 -0.486) 3.097 48.336 ( 6.295 -0.099 -19.502) 20.494 48.404 ( -7.013 -0.229 19.531) 20.753 48.414 ( -9.541 0.193 14.688) 17.515 48.471 ( 10.632 0.111 -14.856) 18.269 98.675 ( 0.734 1.020 -0.198) 1.272 98.747 ( 0.410 -1.318 2.413) 2.779 99.411 ( -3.967 2.563 -0.651) 4.768 99.524 ( 4.326 -2.549 -1.387) 5.209 100.885 ( 0.989 0.979 -7.302) 7.433 100.905 ( -1.344 -1.258 7.702) 7.919 101.450 ( -8.626 -2.267 7.609) 11.724 101.718 ( 14.554 3.156 -11.855) 19.034 ======================= Grid point 438 (215/230) ======================= q-point: (-0.44 0.11 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.618 ( 3.647 -1.736 19.819) 20.226 2.049 ( -1.364 -6.783 3.923) 7.954 2.263 ( -0.227 -2.374 2.210) 3.251 2.471 ( -0.472 -4.139 -1.822) 4.547 2.541 ( -1.504 -2.572 0.466) 3.016 2.952 ( 7.973 -1.982 -3.679) 9.002 3.310 ( -2.271 2.383 1.273) 3.529 3.420 ( 0.843 3.210 5.350) 6.296 3.457 ( -2.915 1.618 0.268) 3.345 3.656 ( 3.727 4.103 -2.420) 6.049 3.711 ( -1.338 7.338 -3.250) 8.137 3.971 ( 0.637 -8.600 -6.932) 11.064 4.213 ( 0.221 3.008 0.035) 3.017 4.279 ( 2.732 -1.749 -3.046) 4.450 4.474 ( -3.987 -3.667 -2.782) 6.090 4.857 ( -1.440 5.337 2.696) 6.150 5.188 ( -1.111 -1.051 17.221) 17.288 5.249 ( -2.053 0.319 -1.006) 2.308 5.285 ( -4.991 -0.622 9.268) 10.544 5.547 ( -2.396 -3.137 -3.374) 5.193 5.794 ( 3.870 2.821 -0.826) 4.860 6.001 ( 3.668 -0.887 -4.393) 5.791 6.344 ( -1.304 -0.673 -13.771) 13.849 6.568 ( -8.035 5.550 6.148) 11.539 6.683 ( -1.809 -0.938 10.408) 10.606 6.776 ( 3.779 -1.031 -3.250) 5.090 8.473 ( 2.492 -0.349 4.341) 5.017 8.927 ( 0.173 0.870 -3.128) 3.251 10.170 ( -2.103 -1.228 2.975) 3.844 10.219 ( -3.337 0.275 -1.187) 3.552 10.379 ( 1.631 0.293 -2.387) 2.905 10.478 ( -6.334 1.922 -4.260) 7.872 10.702 ( 4.878 -3.087 4.772) 7.490 10.796 ( 5.654 -2.937 -2.975) 7.032 11.413 ( -1.634 -2.241 -2.487) 3.725 11.720 ( 1.430 -0.449 -2.958) 3.316 12.001 ( -0.829 -3.835 1.370) 4.156 12.220 ( 3.004 4.085 -2.351) 5.589 13.187 ( 0.710 0.941 4.998) 5.135 13.852 ( -4.624 -0.158 -1.223) 4.786 16.454 ( -10.578 -1.057 -12.439) 16.362 17.883 ( 18.853 0.054 15.484) 24.397 19.152 ( -12.421 0.671 1.856) 12.576 19.227 ( 0.104 -1.205 3.418) 3.625 19.435 ( -4.199 0.665 -3.064) 5.240 20.024 ( 6.713 -0.071 -3.292) 7.477 20.521 ( -5.050 2.113 6.214) 8.281 20.658 ( 0.661 -2.372 -4.425) 5.064 21.392 ( -13.484 -0.470 -9.162) 16.308 21.597 ( -21.459 -0.200 1.644) 21.523 22.272 ( 9.463 -0.491 7.493) 12.080 22.653 ( 15.061 -0.740 -4.423) 15.715 24.229 ( -2.380 1.641 -1.747) 3.378 24.300 ( -1.221 0.551 -3.183) 3.454 24.642 ( 6.999 -2.451 0.933) 7.475 24.825 ( 4.895 0.302 10.174) 11.294 25.372 ( -1.335 -1.189 -0.538) 1.866 25.676 ( -1.382 -0.082 -0.153) 1.393 25.859 ( 7.526 1.140 -1.051) 7.684 27.185 ( -7.558 0.242 -4.023) 8.566 48.285 ( 7.004 -0.134 -19.148) 20.389 48.358 ( -10.548 -0.112 14.670) 18.069 48.473 ( -5.931 0.039 19.507) 20.389 48.520 ( 10.413 0.123 -15.329) 18.532 98.688 ( 2.952 0.469 -2.358) 3.807 98.818 ( 1.783 -1.425 5.946) 6.369 99.295 ( -4.703 2.716 -0.648) 5.470 99.622 ( 6.238 -3.181 -5.417) 8.853 100.842 ( 1.664 0.811 -6.610) 6.865 100.944 ( -3.788 -1.503 8.071) 9.041 101.425 ( -4.209 -2.225 9.867) 10.956 101.822 ( 13.824 5.514 -13.799) 20.296 ======================= Grid point 439 (216/230) ======================= q-point: (-0.33 0.11 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.853 ( -1.116 -8.803 20.684) 22.507 2.151 ( -0.255 -1.101 14.134) 14.179 2.297 ( -4.302 -9.345 0.772) 10.316 2.459 ( -0.545 -5.984 -5.731) 8.304 2.606 ( 4.631 -3.554 5.051) 7.720 3.028 ( 6.027 4.378 -7.184) 10.349 3.237 ( -3.651 1.200 -3.934) 5.499 3.343 ( -5.145 3.984 4.136) 7.710 3.523 ( 4.505 2.517 3.636) 6.313 3.578 ( -2.807 -1.170 -4.879) 5.749 3.714 ( 4.274 8.171 4.279) 10.166 3.903 ( -4.968 1.189 -7.003) 8.668 4.190 ( 0.783 2.752 -1.103) 3.067 4.326 ( 8.135 -7.960 -8.276) 14.072 4.533 ( 1.314 -4.536 6.138) 7.744 4.842 ( 1.308 5.056 2.730) 5.893 4.992 ( -15.734 -2.601 -3.923) 16.423 5.330 ( -0.556 -0.397 14.968) 14.983 5.414 ( 4.433 6.571 1.414) 8.052 5.489 ( -4.563 -1.971 6.316) 8.038 5.853 ( 3.752 -2.064 -0.116) 4.284 6.013 ( 0.428 -1.303 -3.207) 3.488 6.230 ( 0.679 -1.681 -12.558) 12.688 6.426 ( -6.907 5.647 1.522) 9.051 6.737 ( -3.300 -0.109 10.444) 10.953 6.794 ( 3.109 1.057 -5.681) 6.561 8.566 ( 3.954 0.314 3.962) 5.606 8.885 ( -1.341 1.270 -2.583) 3.176 10.124 ( -3.587 -0.693 -1.036) 3.797 10.215 ( -1.715 -3.466 6.603) 7.652 10.309 ( -4.437 2.479 -5.960) 7.833 10.415 ( 0.804 -1.261 -0.297) 1.525 10.812 ( 2.746 -1.428 -0.902) 3.224 10.888 ( 5.777 -1.980 -1.879) 6.389 11.418 ( 1.128 -4.567 -0.289) 4.713 11.716 ( 1.228 0.066 -3.964) 4.150 12.037 ( 0.090 -3.460 1.955) 3.975 12.206 ( 1.810 3.522 -3.464) 5.262 13.242 ( 1.247 0.995 5.751) 5.968 13.738 ( -6.850 0.168 -2.464) 7.282 16.334 ( 4.423 -0.916 -3.265) 5.573 18.167 ( -2.593 0.083 2.780) 3.803 18.843 ( -13.152 -1.058 2.782) 13.484 19.270 ( -0.401 -0.981 3.144) 3.318 19.511 ( 9.591 1.098 2.360) 9.938 20.070 ( 2.667 0.204 -4.366) 5.120 20.461 ( -7.468 1.975 8.825) 11.728 20.616 ( -2.602 -1.697 -6.491) 7.196 21.142 ( -6.097 -0.942 -9.408) 11.250 21.306 ( -15.792 -0.244 4.350) 16.382 22.481 ( 6.608 -1.193 8.268) 10.651 22.807 ( 8.208 -0.781 -6.792) 10.683 24.169 ( -1.474 1.417 -0.894) 2.232 24.251 ( -1.293 0.279 -2.788) 3.086 24.813 ( 8.622 -3.623 1.536) 9.478 24.994 ( 5.276 0.677 9.169) 10.601 25.353 ( -0.904 -1.272 -1.098) 1.908 25.640 ( -2.674 0.586 -0.245) 2.748 25.997 ( 10.107 1.089 0.152) 10.167 26.977 ( -11.383 0.773 -5.708) 12.758 48.251 ( 7.692 -0.125 -18.209) 19.767 48.308 ( -10.153 -0.108 14.820) 17.965 48.532 ( -6.403 -0.025 18.793) 19.854 48.559 ( 9.910 0.119 -15.829) 18.676 98.727 ( 4.095 0.121 -2.444) 4.770 98.896 ( 0.114 -0.866 4.100) 4.193 99.239 ( -0.468 1.676 3.765) 4.148 99.667 ( 3.615 -3.207 -9.650) 10.792 100.818 ( 2.586 0.558 -6.282) 6.816 100.929 ( -6.561 -1.151 7.436) 9.983 101.511 ( 1.317 -1.709 11.276) 11.481 101.861 ( 9.560 6.162 -13.830) 17.906 ======================= Grid point 440 (217/230) ======================= q-point: (-0.22 0.11 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.038 ( -2.389 -4.191 16.902) 17.577 2.244 ( -8.816 -7.438 7.693) 13.864 2.312 ( 0.323 -6.420 9.001) 11.061 2.450 ( 1.990 -13.362 -12.312) 18.278 2.781 ( 6.416 -2.188 2.867) 7.360 2.987 ( -0.753 3.932 -4.709) 6.180 3.129 ( 1.863 4.072 -6.762) 8.111 3.273 ( -5.790 6.940 6.753) 11.282 3.534 ( -0.559 0.610 0.042) 0.829 3.587 ( 1.447 0.664 -1.759) 2.373 3.745 ( 1.427 4.722 -1.914) 5.291 3.781 ( -0.544 4.435 3.175) 5.481 4.227 ( 4.877 -1.690 1.708) 5.437 4.485 ( 11.150 -7.450 -9.764) 16.588 4.607 ( -3.860 -3.563 6.962) 8.721 4.695 ( -12.245 -3.904 -9.022) 15.703 4.909 ( 3.909 7.212 9.065) 12.226 5.257 ( -5.588 5.249 -8.095) 11.149 5.482 ( -1.781 0.536 16.468) 16.573 5.548 ( 1.964 1.465 2.718) 3.659 5.934 ( 2.504 -4.253 0.184) 4.939 5.991 ( -1.593 -1.643 -0.471) 2.337 6.187 ( 2.774 -1.006 -7.219) 7.799 6.291 ( -4.597 3.549 -1.971) 6.133 6.752 ( -3.578 1.225 8.373) 9.188 6.778 ( 2.467 1.853 -6.300) 7.014 8.660 ( 4.191 1.144 2.714) 5.122 8.821 ( -2.795 1.208 -2.001) 3.644 10.085 ( -1.837 -0.800 1.754) 2.663 10.177 ( -3.341 0.464 -5.081) 6.099 10.297 ( 1.186 -3.845 5.657) 6.942 10.422 ( -1.231 -2.436 -0.840) 2.856 10.839 ( 2.275 0.785 -0.746) 2.520 10.937 ( 0.911 -0.889 -3.766) 3.976 11.511 ( 4.415 -3.771 2.548) 6.340 11.689 ( -0.606 -0.651 -4.248) 4.340 12.084 ( 1.076 -1.182 2.696) 3.134 12.177 ( 0.264 0.790 -3.897) 3.985 13.317 ( 2.970 0.819 5.450) 6.261 13.585 ( -7.583 0.415 -3.532) 8.376 16.570 ( 21.341 -0.667 4.760) 21.876 17.758 ( -33.368 -0.146 -8.026) 34.320 18.932 ( 10.345 -1.440 5.157) 11.648 19.259 ( -4.539 -0.852 1.677) 4.914 19.714 ( 10.564 0.817 4.794) 11.630 20.035 ( -1.908 0.451 -5.146) 5.507 20.403 ( -6.531 1.263 9.090) 11.264 20.494 ( -4.257 -0.404 -7.366) 8.518 21.048 ( 2.557 -1.132 -9.145) 9.563 21.135 ( -10.456 -0.343 6.769) 12.461 22.654 ( 3.980 -1.347 9.044) 9.972 22.839 ( 2.760 -0.932 -8.332) 8.827 24.147 ( -0.099 0.859 0.725) 1.129 24.203 ( -1.259 0.459 -2.589) 2.916 24.994 ( 6.824 -4.551 2.490) 8.572 25.125 ( 2.897 -0.993 2.587) 4.009 25.358 ( 2.113 0.452 0.789) 2.300 25.565 ( -5.177 1.360 -0.482) 5.375 26.187 ( 12.419 1.104 1.521) 12.561 26.706 ( -13.688 1.116 -5.223) 14.693 48.238 ( 8.378 -0.102 -17.120) 19.060 48.269 ( -9.633 -0.097 15.295) 18.076 48.573 ( -7.220 -0.030 17.775) 19.186 48.584 ( 9.143 0.078 -16.297) 18.687 98.779 ( 4.287 0.151 -2.064) 4.760 98.888 ( -3.053 0.181 0.924) 3.195 99.328 ( 3.677 -0.269 10.015) 10.672 99.624 ( -0.048 -2.504 -12.446) 12.695 100.815 ( 3.793 0.296 -6.298) 7.358 100.881 ( -6.664 -0.536 6.917) 9.620 101.651 ( 2.263 -0.386 10.800) 11.042 101.828 ( 4.429 4.661 -11.913) 13.538 ======================= Grid point 441 (218/230) ======================= q-point: (-0.11 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 207 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.150 ( -1.044 -0.527 -11.218) 11.279 2.150 ( 1.044 -0.527 11.218) 11.279 2.497 ( 3.648 -14.893 -17.301) 23.117 2.497 ( -3.648 -14.893 17.301) 23.117 2.884 ( -1.024 0.910 -3.478) 3.738 2.884 ( 1.024 0.910 3.478) 3.738 3.152 ( 7.172 6.295 -4.494) 10.548 3.152 ( -7.172 6.295 4.494) 10.548 3.533 ( -0.442 2.663 -2.541) 3.707 3.533 ( 0.442 2.663 2.541) 3.707 3.754 ( 1.987 3.573 -3.490) 5.375 3.754 ( -1.987 3.573 3.490) 5.375 4.438 ( -9.447 -6.637 -9.149) 14.731 4.438 ( 9.447 -6.637 9.149) 14.731 4.612 ( 8.874 -2.506 -14.437) 17.130 4.612 ( -8.874 -2.506 14.437) 17.130 5.030 ( -6.080 6.699 -10.040) 13.515 5.030 ( 6.080 6.699 10.040) 13.515 5.552 ( 2.191 0.729 -8.071) 8.394 5.552 ( -2.191 0.729 8.071) 8.394 5.989 ( -0.301 -2.713 -0.443) 2.765 5.989 ( 0.301 -2.713 0.443) 2.765 6.202 ( 4.657 0.900 -9.671) 10.772 6.202 ( -4.657 0.900 9.671) 10.772 6.752 ( 3.385 1.444 -7.937) 8.748 6.752 ( -3.385 1.444 7.937) 8.748 8.739 ( -2.637 1.010 -2.575) 3.821 8.739 ( 2.637 1.010 2.575) 3.821 10.103 ( 0.041 -0.146 -4.854) 4.856 10.103 ( -0.041 -0.146 4.854) 4.856 10.395 ( -2.097 -3.065 -3.278) 4.954 10.395 ( 2.097 -3.065 3.278) 4.954 10.885 ( -2.332 0.598 -3.526) 4.270 10.885 ( 2.332 0.598 3.526) 4.270 11.630 ( -3.271 -1.677 -3.578) 5.130 11.630 ( 3.271 -1.677 3.578) 5.130 12.136 ( -1.256 -0.217 -3.243) 3.484 12.136 ( 1.256 -0.217 3.243) 3.484 13.430 ( -5.938 0.463 -4.479) 7.452 13.430 ( 5.938 0.463 4.479) 7.452 17.104 ( -32.908 -0.374 -8.375) 33.959 17.104 ( 32.908 -0.374 8.375) 33.959 19.148 ( -9.519 -0.863 -1.170) 9.629 19.148 ( 9.519 -0.863 1.170) 9.629 19.909 ( -7.182 0.476 -5.309) 8.944 19.909 ( 7.182 0.476 5.309) 8.944 20.398 ( 1.564 0.383 -8.644) 8.793 20.398 ( -1.564 0.383 8.644) 8.793 21.061 ( 6.623 -0.568 -8.472) 10.769 21.061 ( -6.623 -0.568 8.472) 10.769 22.784 ( -1.019 -0.934 -9.078) 9.183 22.784 ( 1.019 -0.934 9.078) 9.183 24.161 ( -0.665 0.492 -2.178) 2.329 24.161 ( 0.665 0.492 2.178) 2.329 25.134 ( 1.422 -3.287 -8.320) 9.058 25.134 ( -1.422 -3.287 8.320) 9.058 25.441 ( -6.132 1.771 -1.502) 6.557 25.441 ( 6.132 1.771 1.502) 6.557 26.425 ( -13.838 0.947 -3.433) 14.289 26.425 ( 13.838 0.947 3.433) 14.289 48.245 ( 9.017 -0.072 -16.061) 18.420 48.245 ( -9.017 -0.072 16.061) 18.420 48.590 ( 8.464 0.013 -17.379) 19.330 48.590 ( -8.464 0.013 17.379) 19.330 98.833 ( -0.749 0.230 0.027) 0.784 98.833 ( 0.749 0.230 -0.027) 0.784 99.498 ( -3.224 -1.215 -12.935) 13.385 99.498 ( 3.224 -1.215 12.935) 13.385 100.837 ( 5.362 -0.024 -6.430) 8.373 100.837 ( -5.362 -0.024 6.430) 8.373 101.752 ( 0.450 1.636 -9.534) 9.684 101.752 ( -0.450 1.636 9.534) 9.684 ======================= Grid point 445 (219/230) ======================= q-point: ( 0.22 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.449 ( 0.046 0.000 -17.602) 17.602 2.070 ( -3.771 -0.000 0.717) 3.838 2.396 ( -2.571 -0.000 -0.355) 2.595 2.409 ( 1.999 0.000 -11.639) 11.810 2.605 ( -0.731 -0.000 -0.495) 0.883 2.891 ( -9.002 -0.000 -3.985) 9.845 3.338 ( 4.433 0.000 -0.496) 4.461 3.381 ( 1.710 0.000 4.912) 5.201 3.494 ( 3.421 0.000 0.987) 3.560 3.549 ( -2.234 -0.000 -5.151) 5.615 3.590 ( 13.070 0.000 -1.135) 13.119 3.956 ( -2.720 -0.000 -2.578) 3.747 4.243 ( -5.172 -0.000 5.115) 7.274 4.476 ( 1.418 0.000 -1.642) 2.170 4.565 ( -0.386 -0.000 8.117) 8.126 4.899 ( 2.920 0.000 10.900) 11.284 5.010 ( -2.001 -0.000 -9.232) 9.447 5.031 ( -0.014 -0.000 -5.326) 5.326 5.494 ( 0.691 0.000 0.946) 1.172 5.646 ( -3.355 -0.000 -10.010) 10.557 5.742 ( 7.095 0.000 -0.459) 7.110 5.954 ( -1.519 -0.000 0.384) 1.567 6.464 ( -3.885 -0.000 16.520) 16.971 6.488 ( 7.646 0.000 -2.277) 7.978 6.687 ( -3.600 -0.000 -2.035) 4.136 6.788 ( -4.437 -0.000 7.371) 8.603 8.421 ( -3.826 -0.000 3.722) 5.338 8.932 ( 3.547 0.000 -4.928) 6.072 10.184 ( 4.035 0.000 -7.069) 8.140 10.236 ( -1.465 -0.000 -0.279) 1.491 10.452 ( 4.362 0.000 -0.621) 4.406 10.484 ( 5.982 0.000 3.032) 6.707 10.627 ( -10.738 -0.000 2.879) 11.117 10.801 ( -3.656 -0.000 -2.607) 4.490 11.555 ( -2.424 -0.000 0.753) 2.538 11.672 ( -0.006 -0.000 0.309) 0.309 12.047 ( -3.402 -0.000 -1.942) 3.918 12.136 ( 4.230 0.000 0.513) 4.261 13.140 ( -0.047 -0.000 -0.473) 0.476 13.915 ( 1.372 0.000 0.533) 1.472 16.877 ( 18.258 0.000 19.796) 26.930 17.363 ( -22.775 -0.000 -18.984) 29.650 19.157 ( -1.408 -0.000 0.862) 1.651 19.224 ( -0.620 -0.000 -1.302) 1.442 19.671 ( 15.782 0.000 0.155) 15.783 19.903 ( -10.334 -0.000 0.938) 10.376 20.514 ( 6.921 0.000 -9.336) 11.622 20.702 ( -6.653 -0.000 9.544) 11.634 21.718 ( 14.487 0.000 7.754) 16.432 21.953 ( 14.194 0.000 -3.648) 14.655 22.045 ( -2.523 -0.000 -7.230) 7.658 22.387 ( -21.018 -0.000 1.050) 21.044 24.271 ( 4.599 0.000 1.637) 4.881 24.295 ( -1.066 -0.000 1.960) 2.231 24.626 ( -2.329 -0.000 3.161) 3.926 24.657 ( -4.098 -0.000 -8.658) 9.579 25.397 ( -1.731 -0.000 2.344) 2.914 25.733 ( 4.355 0.000 -5.209) 6.790 25.743 ( -3.159 -0.000 0.251) 3.169 27.290 ( 1.551 0.000 4.159) 4.439 48.341 ( -6.369 -0.000 19.679) 20.684 48.398 ( 6.509 0.000 -18.341) 19.462 48.420 ( 10.099 0.000 -16.291) 19.168 48.467 ( -10.652 -0.000 14.970) 18.373 98.677 ( -2.482 -0.000 5.775) 6.286 98.759 ( -1.476 -0.000 -5.277) 5.480 99.343 ( 7.041 0.000 0.747) 7.080 99.600 ( -8.729 -0.000 2.557) 9.096 100.850 ( -1.144 -0.000 6.472) 6.572 100.950 ( 1.078 0.000 -8.129) 8.200 101.525 ( -10.422 -0.000 7.026) 12.569 101.594 ( 14.127 0.000 -12.173) 18.648 ======================= Grid point 446 (220/230) ======================= q-point: ( 0.33 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.455 ( 9.655 2.367 -0.350) 9.947 1.939 ( -11.992 -5.209 2.427) 13.298 2.343 ( 1.910 3.615 -8.499) 9.431 2.411 ( 0.149 -1.316 1.359) 1.897 2.565 ( -2.764 0.019 -1.349) 3.076 2.804 ( 2.635 -2.690 -3.310) 5.014 3.381 ( -1.912 4.125 7.202) 8.517 3.424 ( 2.748 0.670 -1.306) 3.115 3.478 ( -0.809 -2.414 -2.815) 3.796 3.608 ( 7.984 -1.280 -3.245) 8.712 3.788 ( 9.170 2.276 -0.260) 9.452 3.898 ( -1.221 -3.367 -4.085) 5.433 4.157 ( -6.105 -0.945 1.971) 6.485 4.406 ( -3.154 5.650 -2.690) 7.008 4.578 ( -2.745 -2.268 -6.410) 7.332 4.944 ( -2.398 1.558 6.893) 7.463 5.059 ( 1.130 0.391 13.825) 13.877 5.073 ( 4.455 -1.014 5.030) 6.795 5.429 ( -9.308 -0.898 1.581) 9.484 5.536 ( 0.454 -2.008 -10.254) 10.459 5.827 ( 5.369 2.712 -2.673) 6.582 5.955 ( 2.736 -0.610 -3.387) 4.396 6.493 ( -2.846 1.266 -7.140) 7.790 6.554 ( -3.579 -1.550 15.607) 16.087 6.668 ( 3.527 -0.899 1.371) 3.890 6.756 ( -5.827 1.406 6.448) 8.803 8.414 ( -1.478 -0.092 5.448) 5.646 8.944 ( 3.125 0.007 -5.633) 6.441 10.193 ( -1.470 1.147 -0.333) 1.894 10.225 ( 4.995 -1.115 -5.610) 7.594 10.444 ( -6.471 -0.567 -1.642) 6.700 10.545 ( 1.802 1.048 3.298) 3.902 10.627 ( 5.777 -1.648 2.790) 6.624 10.686 ( -5.669 0.098 -3.920) 6.893 11.485 ( -3.411 1.305 -2.857) 4.637 11.689 ( 1.486 -1.309 -1.321) 2.380 11.980 ( -3.163 -0.591 -0.408) 3.244 12.216 ( 5.128 0.603 -0.921) 5.245 13.156 ( 0.442 0.275 3.227) 3.269 13.911 ( -1.988 -0.083 -0.160) 1.996 16.835 ( -19.796 -0.336 -17.801) 26.624 17.388 ( 20.746 0.226 20.366) 29.073 19.163 ( 0.043 -0.190 3.099) 3.105 19.219 ( 0.438 0.211 0.351) 0.600 19.685 ( -14.981 0.108 -1.726) 15.080 19.893 ( 11.294 -0.095 -2.189) 11.505 20.550 ( 5.653 0.134 -7.627) 9.494 20.659 ( -7.422 -0.260 8.901) 11.592 21.708 ( -14.351 -0.121 -9.330) 17.118 21.947 ( -11.062 -0.611 3.208) 11.534 22.061 ( -0.558 0.933 3.595) 3.756 22.359 ( 21.263 -0.356 -2.584) 21.422 24.283 ( -1.181 0.151 0.205) 1.208 24.350 ( 2.262 0.317 -0.954) 2.476 24.546 ( -0.336 -0.484 -4.427) 4.466 24.681 ( 2.601 0.028 7.876) 8.295 25.381 ( -2.058 -0.305 1.323) 2.466 25.695 ( -1.152 -0.128 -0.953) 1.501 25.788 ( 5.864 0.564 -3.484) 6.844 27.294 ( -3.496 -0.111 0.582) 3.546 48.335 ( 6.418 -0.036 -19.850) 20.862 48.401 ( -8.025 -0.134 19.256) 20.862 48.417 ( -8.671 0.111 15.303) 17.589 48.472 ( 10.640 0.047 -14.886) 18.297 98.696 ( 0.213 1.763 1.545) 2.354 98.724 ( 0.149 -1.863 1.448) 2.364 99.449 ( -1.700 2.606 -0.747) 3.200 99.487 ( 1.738 -2.547 -1.007) 3.244 100.892 ( -1.411 -0.490 7.516) 7.663 100.896 ( 0.932 0.372 -7.493) 7.559 101.425 ( -8.551 -0.927 7.592) 11.472 101.750 ( 17.177 1.181 -14.438) 22.469 ======================= Grid point 447 (221/230) ======================= q-point: (-0.56 0.22 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.627 ( 1.914 3.400 14.472) 14.988 1.894 ( -1.104 -12.476 2.899) 12.856 2.281 ( -1.571 3.769 0.125) 4.085 2.415 ( -1.531 -3.974 -0.870) 4.347 2.514 ( -1.309 -1.034 -0.858) 1.876 2.929 ( 10.841 -1.217 -2.067) 11.103 3.330 ( -2.909 1.332 -2.957) 4.356 3.415 ( -3.691 -2.604 1.249) 4.687 3.529 ( 5.929 6.316 1.713) 8.830 3.682 ( 1.297 -1.001 -4.279) 4.581 3.846 ( 0.886 10.099 2.336) 10.403 3.853 ( 1.744 -5.581 -6.156) 8.490 4.180 ( 1.854 -6.511 1.982) 7.054 4.308 ( -0.503 3.623 -3.686) 5.193 4.430 ( -5.729 -2.147 -7.803) 9.916 4.947 ( -2.810 6.150 7.974) 10.455 5.146 ( -7.585 -2.123 12.688) 14.934 5.257 ( 3.679 -3.463 13.863) 14.755 5.273 ( -6.189 1.322 2.731) 6.893 5.511 ( 3.384 -1.485 -8.253) 9.042 5.845 ( 3.580 3.555 -4.406) 6.698 5.981 ( 2.584 -1.566 -4.157) 5.139 6.332 ( -3.956 -0.797 -12.459) 13.096 6.618 ( -7.673 1.289 13.929) 15.955 6.694 ( -3.425 2.138 8.251) 9.186 6.760 ( 4.350 -0.992 -0.984) 4.569 8.466 ( 1.190 -0.475 6.723) 6.844 8.939 ( 2.059 0.688 -5.555) 5.965 10.159 ( -2.666 -0.364 2.194) 3.472 10.222 ( -3.100 0.094 -3.116) 4.396 10.372 ( 2.072 -1.096 -4.433) 5.014 10.507 ( -6.085 2.109 -5.626) 8.551 10.661 ( 4.582 -2.450 4.304) 6.747 10.760 ( 5.055 -1.806 1.371) 5.540 11.396 ( -2.788 -0.404 -3.514) 4.504 11.710 ( 2.172 -0.719 -3.105) 3.857 11.952 ( -1.713 -2.540 1.370) 3.356 12.268 ( 3.868 2.359 -3.043) 5.458 13.199 ( 0.502 0.678 5.604) 5.667 13.850 ( -4.510 -0.155 -1.211) 4.672 16.441 ( -10.775 -0.675 -11.926) 16.087 17.884 ( 18.414 0.042 15.669) 24.179 19.161 ( -13.960 0.540 1.889) 14.098 19.211 ( 0.178 -0.861 4.093) 4.186 19.443 ( -3.254 0.413 -3.480) 4.782 20.023 ( 7.077 -0.043 -3.651) 7.964 20.553 ( -2.246 2.166 2.062) 3.740 20.623 ( -2.090 -2.321 0.115) 3.125 21.386 ( -13.495 -0.316 -9.576) 16.551 21.593 ( -21.472 -0.261 1.363) 21.517 22.267 ( 9.235 -0.214 6.659) 11.388 22.644 ( 15.298 -0.450 -4.797) 16.038 24.251 ( -1.605 1.385 -1.486) 2.588 24.304 ( -2.340 0.006 -3.676) 4.357 24.612 ( 6.796 -1.505 0.986) 7.031 24.827 ( 4.630 0.007 10.775) 11.728 25.357 ( -1.955 -0.797 0.320) 2.136 25.677 ( 0.271 0.156 -2.301) 2.322 25.874 ( 7.645 0.843 -1.543) 7.844 27.187 ( -7.967 -0.007 -2.754) 8.429 48.283 ( 7.077 -0.090 -19.296) 20.553 48.356 ( -10.665 -0.093 14.934) 18.351 48.473 ( -5.918 0.047 19.375) 20.259 48.522 ( 10.408 0.081 -15.323) 18.524 98.699 ( 2.388 0.891 -1.975) 3.225 98.796 ( 1.531 -1.430 6.781) 7.098 99.332 ( -4.936 2.096 -1.099) 5.474 99.581 ( 5.963 -2.246 -4.612) 7.866 100.852 ( 1.645 0.527 -7.020) 7.229 100.925 ( -3.723 -0.990 8.206) 9.065 101.399 ( -3.536 -1.236 9.705) 10.403 101.886 ( 15.832 3.081 -16.953) 23.400 ======================= Grid point 448 (222/230) ======================= q-point: (-0.44 0.22 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.734 ( -3.710 -6.784 16.846) 18.536 2.039 ( 1.156 -12.936 0.907) 13.019 2.228 ( -7.517 1.193 9.448) 12.133 2.410 ( -1.530 -2.693 -1.241) 3.336 2.579 ( 8.211 -0.291 2.695) 8.647 3.084 ( 9.670 2.767 -5.891) 11.656 3.228 ( -4.130 -1.496 -6.384) 7.749 3.372 ( -3.251 0.278 3.331) 4.663 3.560 ( -3.771 -0.609 -4.096) 5.601 3.594 ( 2.734 5.933 -0.701) 6.570 3.832 ( 0.650 4.842 3.680) 6.117 3.900 ( -0.181 1.137 -1.226) 1.682 4.228 ( 4.589 -4.819 -6.470) 9.281 4.239 ( 1.796 3.457 -4.742) 6.138 4.452 ( 2.478 -6.459 5.913) 9.100 4.859 ( -10.043 -2.136 -2.460) 10.558 5.028 ( -6.023 6.921 7.028) 11.557 5.325 ( -1.152 -0.783 11.941) 12.022 5.440 ( -1.718 -4.086 12.884) 13.625 5.506 ( 5.769 5.419 -4.421) 9.066 5.841 ( 2.969 0.435 -4.963) 5.800 5.981 ( -1.244 -2.785 -2.609) 4.014 6.200 ( 0.864 -2.202 -13.130) 13.341 6.505 ( -9.618 4.755 5.280) 11.958 6.743 ( -3.178 0.770 13.049) 13.453 6.809 ( 3.734 0.800 -4.192) 5.670 8.566 ( 2.965 -0.315 6.991) 7.600 8.906 ( 0.462 1.612 -5.202) 5.466 10.119 ( -3.757 -0.105 -1.057) 3.904 10.167 ( -2.866 -2.894 4.656) 6.186 10.341 ( -5.441 1.743 -5.727) 8.090 10.389 ( 2.064 -2.017 -4.972) 5.749 10.795 ( 5.463 -0.766 0.061) 5.517 10.858 ( 4.040 -1.950 1.306) 4.672 11.364 ( 0.380 -2.713 0.009) 2.740 11.713 ( 1.459 -0.273 -4.650) 4.881 11.982 ( 0.304 -3.626 2.766) 4.571 12.257 ( 1.167 2.989 -4.798) 5.772 13.256 ( 0.938 0.861 6.284) 6.412 13.740 ( -6.398 0.087 -2.776) 6.975 16.321 ( 4.370 -0.802 -2.890) 5.300 18.168 ( -2.080 0.064 2.548) 3.290 18.829 ( -14.456 -0.890 2.633) 14.721 19.256 ( -0.677 -0.876 3.883) 4.038 19.526 ( 9.668 0.931 2.142) 9.946 20.073 ( 3.132 0.207 -4.727) 5.674 20.492 ( -7.348 2.152 7.923) 11.018 20.591 ( -2.069 -1.742 -5.304) 5.953 21.129 ( -6.476 -0.866 -9.720) 11.712 21.301 ( -15.809 -0.429 4.114) 16.341 22.464 ( 6.535 -0.992 7.515) 10.009 22.796 ( 8.297 -0.651 -7.212) 11.013 24.192 ( -1.599 1.702 -1.459) 2.753 24.251 ( -1.476 -0.328 -2.340) 2.786 24.767 ( 8.040 -2.533 1.304) 8.529 24.996 ( 3.672 -0.346 10.305) 10.945 25.338 ( -0.703 -0.724 0.202) 1.029 25.651 ( -0.451 0.756 -3.332) 3.446 26.012 ( 10.185 0.984 0.072) 10.233 26.986 ( -11.578 0.421 -4.628) 12.476 48.249 ( 7.773 -0.117 -18.362) 19.940 48.306 ( -10.275 -0.108 15.051) 18.224 48.532 ( -6.416 0.006 18.779) 19.845 48.561 ( 9.908 0.099 -15.855) 18.696 98.731 ( 3.623 0.460 -1.589) 3.983 98.882 ( 0.452 -0.985 5.215) 5.327 99.264 ( -1.187 1.620 2.338) 3.082 99.623 ( 3.205 -2.633 -8.313) 9.290 100.825 ( 2.598 0.452 -6.751) 7.248 100.913 ( -6.276 -0.955 7.790) 10.049 101.491 ( 1.720 -1.024 12.260) 12.423 101.939 ( 11.013 4.370 -17.940) 21.499 ======================= Grid point 449 (223/230) ======================= q-point: (-0.33 0.22 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.905 ( -2.231 -12.420 17.118) 21.266 2.098 ( -2.212 -14.818 -8.031) 16.999 2.219 ( -3.911 -1.087 13.932) 14.511 2.363 ( -3.126 -1.694 -3.581) 5.046 2.764 ( 8.070 -0.254 2.417) 8.428 3.030 ( -4.648 1.680 -7.297) 8.813 3.177 ( 5.259 2.906 -5.607) 8.218 3.350 ( -5.685 3.624 5.556) 8.736 3.527 ( 4.214 -2.175 -1.399) 4.944 3.619 ( 2.764 3.870 -0.044) 4.756 3.787 ( -3.149 1.071 -1.758) 3.762 3.851 ( -2.385 4.467 5.180) 7.244 4.237 ( 4.432 2.895 -2.856) 6.015 4.364 ( 8.971 -7.395 -7.511) 13.841 4.556 ( -4.668 -3.052 8.961) 10.555 4.659 ( -5.757 -2.190 -7.904) 10.021 5.013 ( 2.124 6.788 7.711) 10.491 5.302 ( -6.487 0.733 -3.415) 7.367 5.498 ( -1.603 1.482 14.909) 15.067 5.581 ( 3.659 3.033 0.520) 4.781 5.869 ( 2.819 -4.257 -2.990) 5.917 5.949 ( -2.684 -3.874 -1.364) 4.906 6.175 ( 5.327 -0.710 -8.821) 10.329 6.348 ( -8.642 4.075 2.802) 9.957 6.775 ( -3.625 1.863 10.612) 11.367 6.808 ( 3.123 2.144 -6.524) 7.544 8.675 ( 3.245 0.811 5.825) 6.717 8.844 ( -1.264 1.905 -4.714) 5.239 10.074 ( -1.578 -0.743 1.223) 2.130 10.166 ( -3.876 -2.201 -1.847) 4.825 10.255 ( 0.092 -1.363 2.660) 2.991 10.378 ( -0.826 -3.298 -4.412) 5.570 10.852 ( 3.274 0.982 -1.342) 3.672 10.921 ( 0.822 -1.312 -1.067) 1.881 11.457 ( 4.680 -3.445 4.452) 7.321 11.679 ( -0.947 -0.716 -5.544) 5.670 12.053 ( 1.645 -2.709 3.819) 4.963 12.196 ( -0.852 1.490 -5.298) 5.569 13.330 ( 2.624 0.892 5.878) 6.499 13.591 ( -7.095 0.444 -4.095) 8.204 16.559 ( 21.303 -0.767 5.072) 21.912 17.756 ( -33.479 -0.174 -8.748) 34.604 18.909 ( 10.295 -1.610 5.435) 11.753 19.245 ( -4.937 -1.037 2.094) 5.462 19.728 ( 10.488 0.929 4.606) 11.492 20.042 ( -1.560 0.560 -5.342) 5.593 20.424 ( -6.787 1.582 8.496) 10.989 20.488 ( -3.585 -0.389 -6.697) 7.606 21.029 ( 2.614 -1.322 -9.163) 9.620 21.128 ( -10.659 -0.607 6.551) 12.526 22.632 ( 4.071 -1.500 8.672) 9.697 22.824 ( 2.621 -1.050 -8.698) 9.144 24.162 ( -0.204 1.097 0.317) 1.160 24.209 ( -1.259 0.271 -2.165) 2.519 24.933 ( 7.306 -3.772 1.111) 8.297 25.096 ( -1.198 -2.519 4.342) 5.160 25.370 ( 3.324 1.081 3.244) 4.768 25.586 ( -2.813 1.434 -3.850) 4.979 26.205 ( 12.538 1.192 1.519) 12.686 26.722 ( -13.752 1.004 -4.618) 14.541 48.236 ( 8.461 -0.125 -17.281) 19.242 48.267 ( -9.740 -0.122 15.499) 18.306 48.573 ( -7.196 -0.005 17.784) 19.185 48.585 ( 9.106 0.084 -16.302) 18.673 98.782 ( 4.046 0.375 -1.247) 4.251 98.891 ( -2.709 0.147 1.384) 3.046 99.325 ( 2.960 -0.194 8.509) 9.012 99.585 ( -0.196 -2.555 -10.863) 11.161 100.819 ( 3.789 0.261 -6.782) 7.773 100.873 ( -6.407 -0.545 7.368) 9.780 101.649 ( 2.680 0.068 13.435) 13.700 101.894 ( 4.927 4.179 -16.418) 17.643 ======================= Grid point 450 (224/230) ======================= q-point: (-0.22 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 207 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.091 ( 0.528 -9.856 -11.366) 15.053 2.091 ( -0.528 -9.856 11.366) 15.053 2.311 ( 4.731 -7.148 -14.277) 16.653 2.311 ( -4.731 -7.148 14.277) 16.653 2.890 ( -2.201 -0.021 -5.059) 5.517 2.890 ( 2.201 -0.021 5.059) 5.517 3.233 ( 8.037 4.652 -4.015) 10.117 3.233 ( -8.037 4.652 4.015) 10.117 3.584 ( 0.007 3.933 -3.286) 5.125 3.584 ( -0.007 3.933 3.286) 5.125 3.800 ( 1.508 1.642 -2.560) 3.394 3.800 ( -1.508 1.642 2.560) 3.394 4.341 ( -5.444 -4.787 -6.022) 9.424 4.341 ( 5.444 -4.787 6.022) 9.424 4.588 ( 7.539 -1.019 -13.849) 15.801 4.588 ( -7.539 -1.019 13.849) 15.801 5.117 ( -6.378 4.605 -7.489) 10.862 5.117 ( 6.378 4.605 7.489) 10.862 5.569 ( 2.143 1.702 -9.489) 9.876 5.569 ( -2.143 1.702 9.489) 9.876 5.934 ( -0.340 -4.572 -1.116) 4.719 5.934 ( 0.340 -4.572 1.116) 4.719 6.221 ( 5.135 1.698 -8.969) 10.473 6.221 ( -5.135 1.698 8.969) 10.473 6.781 ( 3.553 2.365 -8.731) 9.718 6.781 ( -3.553 2.365 8.731) 9.718 8.759 ( -1.717 1.596 -5.046) 5.564 8.759 ( 1.717 1.596 5.046) 5.564 10.098 ( -0.787 -0.646 -4.022) 4.149 10.098 ( 0.787 -0.646 4.022) 4.149 10.340 ( -1.874 -4.009 -4.812) 6.537 10.340 ( 1.874 -4.009 4.812) 6.537 10.894 ( -2.108 0.472 -1.614) 2.697 10.894 ( 2.108 0.472 1.614) 2.697 11.600 ( -3.702 -2.188 -5.282) 6.811 11.600 ( 3.702 -2.188 5.282) 6.811 12.129 ( -1.426 -0.649 -4.497) 4.762 12.129 ( 1.426 -0.649 4.497) 4.762 13.439 ( -5.533 0.698 -4.909) 7.430 13.439 ( 5.533 0.698 4.909) 7.430 17.097 ( -32.878 -0.581 -8.810) 34.043 17.097 ( 32.878 -0.581 8.810) 34.043 19.131 ( -9.801 -1.347 -1.201) 9.966 19.131 ( 9.801 -1.347 1.201) 9.966 19.918 ( -7.059 0.750 -5.277) 8.845 19.918 ( 7.059 0.750 5.277) 8.845 20.406 ( 2.141 0.675 -8.303) 8.601 20.406 ( -2.141 0.675 8.303) 8.601 21.049 ( 6.897 -0.959 -8.240) 10.789 21.049 ( -6.897 -0.959 8.240) 10.789 22.766 ( -1.179 -1.420 -9.167) 9.351 22.766 ( 1.179 -1.420 9.167) 9.351 24.171 ( -0.409 0.696 -2.078) 2.229 24.171 ( 0.409 0.696 2.078) 2.229 25.077 ( 0.102 -4.153 -5.239) 6.686 25.077 ( -0.102 -4.153 5.239) 6.686 25.470 ( -4.547 2.045 -4.394) 6.646 25.470 ( 4.547 2.045 4.394) 6.646 26.442 ( -13.912 1.296 -3.281) 14.352 26.442 ( 13.912 1.296 3.281) 14.352 48.243 ( 9.098 -0.119 -16.221) 18.599 48.243 ( -9.098 -0.119 16.221) 18.599 48.590 ( 8.415 0.031 -17.373) 19.304 48.590 ( -8.415 0.031 17.373) 19.304 98.838 ( -2.557 0.433 0.291) 2.610 98.838 ( 2.557 0.433 -0.291) 2.610 99.476 ( -2.972 -1.702 -11.579) 12.075 99.476 ( 2.972 -1.702 11.579) 12.075 100.836 ( 5.246 -0.062 -6.895) 8.664 100.836 ( -5.246 -0.062 6.895) 8.664 101.782 ( 0.086 2.262 -13.342) 13.532 101.782 ( -0.086 2.262 13.342) 13.532 ======================= Grid point 456 (225/230) ======================= q-point: (-0.67 0.33 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.704 ( 9.700 0.000 10.418) 14.235 1.746 ( -10.150 -0.000 4.564) 11.129 2.348 ( 4.644 0.000 -8.321) 9.529 2.350 ( -8.169 -0.000 6.938) 10.717 2.508 ( -0.742 -0.000 -1.434) 1.615 2.919 ( 11.537 0.000 -1.468) 11.630 3.351 ( -0.567 -0.000 -11.603) 11.617 3.381 ( -5.266 -0.000 7.808) 9.418 3.604 ( 8.950 0.000 2.889) 9.405 3.641 ( 0.245 0.000 -3.540) 3.549 3.814 ( -1.772 -0.000 -8.901) 9.075 3.960 ( 6.293 0.000 2.551) 6.791 4.095 ( -1.280 -0.000 5.399) 5.549 4.339 ( -1.191 -0.000 -4.023) 4.196 4.413 ( -6.003 -0.000 -10.483) 12.080 4.998 ( -7.121 -0.000 11.074) 13.165 5.153 ( -0.779 -0.000 8.092) 8.130 5.198 ( -3.336 -0.000 16.787) 17.115 5.287 ( -4.088 -0.000 4.520) 6.095 5.502 ( 7.080 0.000 -10.486) 12.653 5.876 ( 3.566 0.000 -6.059) 7.031 5.966 ( 1.972 0.000 -3.467) 3.989 6.326 ( -5.492 -0.000 -11.452) 12.700 6.624 ( -6.670 -0.000 16.968) 18.232 6.715 ( -4.972 -0.000 7.178) 8.732 6.751 ( 4.941 0.000 -0.190) 4.945 8.462 ( 0.696 0.000 7.478) 7.510 8.944 ( 2.791 0.000 -6.306) 6.896 10.157 ( -2.991 -0.000 1.834) 3.508 10.222 ( -3.132 -0.000 -3.541) 4.727 10.361 ( 2.785 0.000 -6.267) 6.858 10.527 ( -7.066 -0.000 -5.683) 9.068 10.640 ( 5.545 0.000 3.939) 6.802 10.747 ( 4.524 0.000 3.567) 5.762 11.394 ( -3.331 -0.000 -4.054) 5.246 11.704 ( 2.606 0.000 -3.126) 4.070 11.933 ( -2.074 -0.000 1.344) 2.471 12.285 ( 4.176 0.000 -3.267) 5.302 13.204 ( 0.392 0.000 5.836) 5.849 13.849 ( -4.463 -0.000 -1.204) 4.622 16.436 ( -10.851 -0.000 -11.734) 15.982 17.885 ( 18.234 0.000 15.750) 24.094 19.166 ( -15.061 -0.000 1.823) 15.171 19.204 ( 0.722 0.000 4.409) 4.468 19.446 ( -2.898 -0.000 -3.631) 4.646 20.022 ( 7.225 0.000 -3.793) 8.160 20.577 ( 4.565 0.000 -7.414) 8.707 20.597 ( -8.844 -0.000 9.737) 13.154 21.384 ( -13.501 -0.000 -9.744) 16.650 21.591 ( -21.494 -0.000 1.294) 21.533 22.265 ( 9.101 0.000 6.330) 11.086 22.641 ( 15.405 0.000 -4.959) 16.184 24.263 ( -0.915 -0.000 -0.949) 1.318 24.303 ( -3.201 -0.000 -4.311) 5.369 24.601 ( 6.786 0.000 1.014) 6.861 24.827 ( 4.477 0.000 10.992) 11.869 25.351 ( -2.089 -0.000 0.573) 2.166 25.678 ( 0.842 0.000 -3.007) 3.123 25.881 ( 7.679 0.000 -1.774) 7.881 27.187 ( -8.127 -0.000 -2.254) 8.434 48.282 ( 7.111 0.000 -19.367) 20.632 48.355 ( -10.709 -0.000 15.047) 18.469 48.474 ( -5.923 -0.000 19.334) 20.221 48.523 ( 10.409 0.000 -15.330) 18.530 98.707 ( 2.161 0.000 -2.411) 3.238 98.784 ( 1.454 0.000 7.688) 7.824 99.349 ( -5.200 -0.000 -1.316) 5.364 99.564 ( 6.057 0.000 -4.303) 7.429 100.856 ( 1.632 0.000 -7.178) 7.361 100.918 ( -3.684 -0.000 8.253) 9.038 101.390 ( -3.239 -0.000 9.615) 10.146 101.909 ( 16.534 0.000 -18.091) 24.509 ======================= Grid point 458 (226/230) ======================= q-point: (-0.56 0.33 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.672 ( -4.579 -1.771 8.007) 9.393 1.882 ( -1.665 -6.643 6.254) 9.274 2.270 ( -7.381 3.330 10.453) 13.222 2.362 ( -1.054 -3.381 -1.228) 3.749 2.586 ( 10.430 0.665 1.096) 10.508 3.102 ( 10.738 0.118 -1.958) 10.916 3.218 ( -2.806 0.099 -13.237) 13.532 3.364 ( -2.745 -0.857 4.110) 5.016 3.554 ( -5.757 -0.171 -4.394) 7.244 3.687 ( 2.225 6.258 -2.337) 7.041 3.790 ( 2.509 -5.770 -0.072) 6.292 3.989 ( -1.778 5.534 0.372) 5.824 4.188 ( 3.666 -0.736 1.309) 3.961 4.280 ( 2.095 1.667 -4.280) 5.048 4.359 ( 3.375 -5.082 2.268) 6.508 4.830 ( -14.075 -1.203 -0.393) 14.131 5.139 ( -3.183 7.016 6.919) 10.355 5.285 ( -2.051 -4.621 9.064) 10.379 5.396 ( -0.417 -1.291 17.114) 17.168 5.565 ( 9.115 2.321 -7.405) 11.971 5.854 ( 2.042 0.756 -8.464) 8.739 5.945 ( -3.513 -1.571 -0.716) 3.914 6.174 ( 0.462 -1.147 -11.716) 11.781 6.555 ( -10.542 1.828 6.874) 12.718 6.754 ( -3.093 0.557 13.819) 14.172 6.816 ( 4.101 0.233 -2.917) 5.038 8.561 ( 2.530 -0.293 8.462) 8.837 8.926 ( 1.451 0.796 -6.281) 6.495 10.119 ( -4.816 0.004 -0.610) 4.855 10.136 ( -2.742 -1.140 3.166) 4.341 10.357 ( -3.468 0.554 -6.325) 7.235 10.366 ( 0.535 -0.905 -7.655) 7.727 10.790 ( 7.657 -0.019 1.127) 7.740 10.835 ( 2.378 -0.950 3.209) 4.106 11.339 ( -0.293 -0.871 -0.207) 0.942 11.710 ( 1.774 -0.138 -5.051) 5.356 11.943 ( 0.394 -1.479 3.168) 3.518 12.287 ( 0.767 1.095 -5.438) 5.600 13.265 ( 0.694 0.335 6.647) 6.692 13.741 ( -6.090 0.022 -2.968) 6.774 16.312 ( 4.333 -0.316 -2.659) 5.094 18.169 ( -1.750 0.023 2.417) 2.984 18.819 ( -15.304 -0.342 2.517) 15.513 19.246 ( -0.866 -0.351 4.300) 4.401 19.536 ( 9.727 0.361 2.030) 9.943 20.075 ( 3.451 0.089 -4.969) 6.050 20.520 ( -8.326 1.406 8.415) 11.921 20.568 ( -0.624 -1.206 -5.603) 5.765 21.119 ( -6.714 -0.355 -9.970) 12.025 21.295 ( -15.869 -0.218 4.069) 16.383 22.454 ( 6.461 -0.378 7.029) 9.555 22.789 ( 8.341 -0.248 -7.495) 11.216 24.216 ( -2.060 1.422 -1.906) 3.146 24.241 ( -1.219 -0.915 -1.972) 2.492 24.742 ( 7.767 -0.903 1.199) 7.911 24.990 ( 2.541 -0.289 10.794) 11.093 25.332 ( -0.266 -0.186 0.905) 0.962 25.659 ( 0.716 0.342 -4.982) 5.044 26.023 ( 10.198 0.397 -0.001) 10.206 26.989 ( -11.695 0.104 -3.924) 12.336 48.248 ( 7.833 -0.048 -18.476) 20.067 48.305 ( -10.355 -0.046 15.211) 18.401 48.532 ( -6.454 0.009 18.826) 19.901 48.562 ( 9.932 0.038 -15.926) 18.769 98.738 ( 3.313 0.305 -1.313) 3.576 98.871 ( 0.660 -0.480 6.164) 6.218 99.282 ( -1.679 0.699 1.390) 2.289 99.596 ( 3.096 -1.026 -7.580) 8.252 100.830 ( 2.584 0.172 -7.042) 7.503 100.903 ( -6.062 -0.368 8.003) 10.047 101.481 ( 1.991 -0.345 12.776) 12.935 101.983 ( 11.818 1.537 -20.231) 23.480 ======================= Grid point 459 (227/230) ======================= q-point: (-0.44 0.33 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 405 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.742 ( -1.341 -8.652 10.133) 13.392 1.900 ( -3.422 -10.547 -3.115) 11.518 2.240 ( -4.794 2.681 12.329) 13.497 2.338 ( -2.939 -2.089 -1.133) 3.780 2.769 ( 7.398 0.692 2.622) 7.879 3.036 ( -5.380 -0.450 -11.322) 12.543 3.220 ( 7.473 2.865 -3.676) 8.808 3.383 ( -4.189 1.119 5.600) 7.082 3.481 ( 4.323 -3.325 -0.861) 5.521 3.683 ( 2.864 4.325 -0.885) 5.262 3.793 ( -3.391 -0.018 -2.336) 4.117 3.881 ( -5.955 -0.538 -0.035) 5.980 4.282 ( 4.692 1.325 -2.825) 5.635 4.320 ( 7.410 2.670 -0.894) 7.927 4.506 ( -0.910 -4.235 11.010) 11.831 4.630 ( -3.990 -1.443 -7.845) 8.919 5.102 ( -0.305 5.329 4.051) 6.701 5.288 ( -6.774 -2.158 1.867) 7.351 5.517 ( -2.000 0.914 16.386) 16.532 5.630 ( 5.963 3.206 -5.106) 8.480 5.819 ( 2.422 -2.432 -7.360) 8.121 5.889 ( -4.417 -3.940 0.726) 5.963 6.166 ( 6.860 -0.433 -7.983) 10.535 6.400 ( -10.681 2.806 4.287) 11.846 6.801 ( -3.600 1.427 11.894) 12.508 6.835 ( 3.503 1.387 -6.159) 7.220 8.682 ( 2.989 0.227 8.006) 8.549 8.871 ( -0.468 1.612 -6.368) 6.585 10.063 ( -2.017 -0.798 1.186) 2.473 10.129 ( -2.679 -2.174 0.238) 3.459 10.250 ( -2.253 0.170 0.523) 2.319 10.336 ( 0.387 -2.218 -7.505) 7.836 10.866 ( 2.680 0.945 -0.320) 2.860 10.901 ( 1.741 -1.295 -0.726) 2.288 11.417 ( 4.675 -1.961 5.966) 7.829 11.670 ( -0.994 -0.370 -6.584) 6.669 12.016 ( 2.458 -2.017 4.609) 5.600 12.214 ( -2.147 0.867 -6.188) 6.607 13.341 ( 2.311 0.559 6.300) 6.733 13.597 ( -6.644 0.279 -4.578) 8.074 16.549 ( 21.269 -0.505 5.338) 21.935 17.753 ( -33.582 -0.118 -9.378) 34.867 18.889 ( 10.229 -1.037 5.680) 11.746 19.232 ( -5.254 -0.713 2.400) 5.820 19.739 ( 10.422 0.607 4.467) 11.355 20.049 ( -1.248 0.393 -5.531) 5.684 20.445 ( -7.224 1.209 8.151) 10.958 20.483 ( -2.812 -0.305 -6.249) 6.859 21.013 ( 2.730 -0.905 -9.331) 9.764 21.120 ( -10.877 -0.501 6.553) 12.709 22.614 ( 4.142 -0.963 8.332) 9.354 22.810 ( 2.479 -0.679 -8.998) 9.358 24.177 ( -0.608 0.934 0.143) 1.124 24.210 ( -0.945 -0.125 -1.985) 2.202 24.889 ( 7.327 -2.091 0.530) 7.637 25.063 ( -3.086 -1.802 5.087) 6.217 25.384 ( 3.696 0.769 4.903) 6.188 25.604 ( -1.332 0.915 -6.153) 6.362 26.219 ( 12.587 0.746 1.505) 12.699 26.734 ( -13.761 0.520 -4.076) 14.362 48.234 ( 8.541 -0.087 -17.437) 19.416 48.266 ( -9.838 -0.085 15.690) 18.519 48.573 ( -7.284 0.010 17.993) 19.411 48.586 ( 9.182 0.054 -16.510) 18.892 98.788 ( 3.830 0.381 -0.713) 3.915 98.892 ( -2.377 0.039 2.038) 3.131 99.323 ( 2.317 -0.046 7.131) 7.498 99.554 ( -0.227 -1.551 -9.752) 9.877 100.822 ( 3.760 0.142 -7.143) 8.073 100.866 ( -6.188 -0.332 7.693) 9.878 101.651 ( 2.974 0.130 15.301) 15.588 101.942 ( 5.354 2.329 -19.613) 20.463 ======================= Grid point 460 (228/230) ======================= q-point: (-0.33 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 207 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.900 ( 0.822 -13.254 -11.110) 17.314 1.900 ( -0.822 -13.254 11.110) 17.314 2.278 ( 3.598 0.135 -12.553) 13.059 2.278 ( -3.598 0.135 12.553) 13.059 2.885 ( -2.325 -0.480 -6.601) 7.015 2.885 ( 2.325 -0.480 6.601) 7.015 3.291 ( 7.339 3.388 -3.546) 8.827 3.291 ( -7.339 3.388 3.546) 8.827 3.631 ( -2.118 1.839 -3.882) 4.789 3.631 ( 2.118 1.839 3.882) 4.789 3.790 ( -0.196 -2.147 -4.576) 5.058 3.790 ( 0.196 -2.147 4.576) 5.058 4.322 ( -0.826 1.580 -0.186) 1.793 4.322 ( 0.826 1.580 0.186) 1.793 4.576 ( 6.095 -0.732 -14.371) 15.627 4.576 ( -6.095 -0.732 14.371) 15.627 5.160 ( -4.344 1.493 -4.730) 6.593 5.160 ( 4.344 1.493 4.730) 6.593 5.599 ( 2.271 2.170 -12.165) 12.564 5.599 ( -2.271 2.170 12.165) 12.564 5.865 ( 1.297 -4.662 -2.384) 5.394 5.865 ( -1.297 -4.662 2.384) 5.394 6.248 ( 5.436 1.779 -6.395) 8.580 6.248 ( -5.436 1.779 6.395) 8.580 6.815 ( 3.592 2.206 -9.140) 10.065 6.815 ( -3.592 2.206 9.140) 10.065 8.782 ( -1.783 1.477 -6.777) 7.162 8.782 ( 1.783 1.477 6.777) 7.162 10.083 ( -1.118 -1.283 -3.148) 3.578 10.083 ( 1.118 -1.283 3.148) 3.578 10.290 ( -0.786 -2.648 -6.069) 6.667 10.290 ( 0.786 -2.648 6.069) 6.667 10.897 ( 0.986 0.033 -3.310) 3.454 10.897 ( -0.986 0.033 3.310) 3.454 11.572 ( -4.172 -1.564 -6.996) 8.294 11.572 ( 4.172 -1.564 6.996) 8.294 12.118 ( -2.654 -0.847 -5.521) 6.184 12.118 ( 2.654 -0.847 5.521) 6.184 13.448 ( -5.077 0.604 -5.422) 7.452 13.448 ( 5.077 0.604 5.422) 7.452 17.089 ( -32.859 -0.520 -9.291) 34.152 17.089 ( 32.859 -0.520 9.291) 34.152 19.112 ( -10.075 -1.207 -1.247) 10.224 19.112 ( 10.075 -1.207 1.247) 10.224 19.929 ( -6.962 0.680 -5.238) 8.739 19.929 ( 6.962 0.680 5.238) 8.739 20.416 ( 2.815 0.683 -7.932) 8.444 20.416 ( -2.815 0.683 7.932) 8.444 21.035 ( 7.260 -0.935 -8.168) 10.968 21.035 ( -7.260 -0.935 8.168) 10.968 22.746 ( -1.390 -1.238 -9.208) 9.395 22.746 ( 1.390 -1.238 9.208) 9.395 24.180 ( -0.156 0.550 -1.889) 1.974 24.180 ( 0.156 0.550 1.889) 1.974 25.023 ( -1.206 -3.134 -2.542) 4.212 25.023 ( 1.206 -3.134 2.542) 4.212 25.496 ( -3.616 1.484 -6.459) 7.549 25.496 ( 3.616 1.484 6.459) 7.549 26.459 ( -13.960 1.002 -3.064) 14.328 26.459 ( 13.960 1.002 3.064) 14.328 48.241 ( 9.194 -0.113 -16.409) 18.810 48.241 ( -9.194 -0.113 16.409) 18.810 48.590 ( 8.361 0.037 -17.359) 19.267 48.590 ( -8.361 0.037 17.359) 19.267 98.845 ( -2.952 0.464 0.223) 2.997 98.845 ( 2.952 0.464 -0.223) 2.997 99.452 ( -2.679 -1.365 -10.243) 10.676 99.452 ( 2.679 -1.365 10.243) 10.676 100.835 ( 5.123 -0.073 -7.311) 8.928 100.835 ( -5.123 -0.073 7.311) 8.928 101.813 ( -0.087 1.765 -16.713) 16.806 101.813 ( 0.087 1.765 16.713) 16.806 ======================= Grid point 468 (229/230) ======================= q-point: (-0.56 0.44 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.677 ( 0.039 0.000 4.892) 4.892 1.820 ( -5.352 -0.000 1.622) 5.592 2.271 ( -7.256 -0.000 15.307) 16.940 2.312 ( -0.123 -0.000 -4.160) 4.162 2.776 ( 6.524 0.000 3.128) 7.235 3.031 ( -4.556 -0.000 -13.340) 14.097 3.245 ( 8.204 0.000 -3.159) 8.791 3.388 ( -1.736 -0.000 5.992) 6.238 3.454 ( 1.390 0.000 -0.475) 1.469 3.722 ( 3.110 0.000 -2.452) 3.961 3.791 ( -1.719 -0.000 -2.510) 3.042 3.866 ( -8.365 -0.000 -2.016) 8.605 4.290 ( 5.815 0.000 -2.321) 6.262 4.369 ( 4.162 0.000 0.810) 4.240 4.454 ( 2.570 0.000 12.601) 12.860 4.620 ( -4.058 -0.000 -7.186) 8.252 5.149 ( -1.127 -0.000 0.062) 1.129 5.263 ( -7.022 -0.000 5.887) 9.163 5.523 ( -2.073 -0.000 18.166) 18.283 5.658 ( 7.715 0.000 -9.545) 12.273 5.802 ( 1.957 0.000 -9.561) 9.759 5.855 ( -5.896 -0.000 3.336) 6.775 6.163 ( 7.346 0.000 -7.201) 10.286 6.421 ( -11.256 -0.000 4.476) 12.113 6.812 ( -3.550 -0.000 12.182) 12.688 6.846 ( 3.589 0.000 -5.806) 6.825 8.683 ( 3.054 0.000 8.707) 9.227 8.884 ( -0.317 -0.000 -6.814) 6.821 10.055 ( -2.330 -0.000 1.366) 2.701 10.113 ( -2.343 -0.000 0.268) 2.358 10.252 ( -3.078 -0.000 0.368) 3.100 10.319 ( 1.143 0.000 -8.767) 8.841 10.876 ( -0.377 -0.000 4.166) 4.183 10.888 ( 4.819 0.000 -4.808) 6.807 11.402 ( 4.652 0.000 6.552) 8.035 11.668 ( -0.969 -0.000 -6.967) 7.034 12.001 ( 2.778 0.000 4.917) 5.647 12.220 ( -2.666 -0.000 -6.512) 7.037 13.345 ( 2.185 0.000 6.478) 6.837 13.599 ( -6.461 -0.000 -4.768) 8.030 16.545 ( 21.256 0.000 5.442) 21.942 17.752 ( -33.625 -0.000 -9.626) 34.975 18.881 ( 10.198 0.000 5.777) 11.720 19.226 ( -5.371 -0.000 2.506) 5.927 19.744 ( 10.396 0.000 4.419) 11.296 20.052 ( -1.124 -0.000 -5.612) 5.723 20.455 ( -7.779 -0.000 8.559) 11.566 20.480 ( -2.132 -0.000 -6.602) 6.937 21.006 ( 2.791 0.000 -9.431) 9.835 21.116 ( -10.970 -0.000 6.593) 12.799 22.607 ( 4.168 0.000 8.194) 9.193 22.805 ( 2.418 0.000 -9.112) 9.428 24.185 ( -1.056 -0.000 0.292) 1.095 24.208 ( -0.532 -0.000 -2.132) 2.198 24.874 ( 7.298 0.000 0.370) 7.308 25.049 ( -3.584 -0.000 5.280) 6.382 25.390 ( 3.732 0.000 5.485) 6.634 25.611 ( -0.842 -0.000 -6.961) 7.012 26.225 ( 12.594 0.000 1.496) 12.682 26.737 ( -13.755 -0.000 -3.858) 14.286 48.234 ( 8.574 0.000 -17.502) 19.489 48.265 ( -9.877 -0.000 15.768) 18.606 48.573 ( -7.334 -0.000 18.102) 19.531 48.586 ( 9.227 0.000 -16.619) 19.009 98.791 ( 3.746 0.000 -0.568) 3.789 98.893 ( -2.240 -0.000 2.382) 3.270 99.323 ( 2.056 0.000 6.561) 6.876 99.543 ( -0.216 -0.000 -9.365) 9.367 100.823 ( 3.744 0.000 -7.275) 8.182 100.864 ( -6.103 -0.000 7.808) 9.910 101.652 ( 3.078 0.000 15.965) 16.259 101.960 ( 5.515 0.000 -20.735) 21.455 ======================= Grid point 470 (230/230) ======================= q-point: (-0.44 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 1.15e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.98e-04 2.98e-04 4.63e-04 4.63e-04 Number of triplets: 207 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.758 ( -1.590 -5.346 -4.774) 7.341 1.758 ( 1.590 -5.346 4.774) 7.341 2.284 ( 4.408 0.323 -11.402) 12.229 2.284 ( -4.408 0.323 11.402) 12.229 2.879 ( -2.342 -0.290 -7.656) 8.012 2.879 ( 2.342 -0.290 7.656) 8.012 3.329 ( 6.491 1.630 -3.823) 7.707 3.329 ( -6.491 1.630 3.823) 7.707 3.631 ( -8.452 -0.983 -7.224) 11.162 3.631 ( 8.452 -0.983 7.224) 11.162 3.771 ( 4.469 -0.286 -3.658) 5.782 3.771 ( -4.469 -0.286 3.658) 5.782 4.354 ( 5.369 1.684 -3.824) 6.803 4.354 ( -5.369 1.684 3.824) 6.803 4.567 ( 5.185 -0.401 -15.477) 16.327 4.567 ( -5.185 -0.401 15.477) 16.327 5.170 ( 2.492 0.164 -3.605) 4.385 5.170 ( -2.492 0.164 3.605) 4.385 5.626 ( 2.934 1.209 -15.789) 16.104 5.626 ( -2.934 1.209 15.789) 16.104 5.811 ( 4.488 -2.233 -4.650) 6.838 5.811 ( -4.488 -2.233 4.650) 6.838 6.268 ( 6.618 0.770 -3.871) 7.705 6.268 ( -6.618 0.770 3.871) 7.705 6.839 ( 3.557 0.899 -9.109) 9.820 6.839 ( -3.557 0.899 9.109) 9.820 8.798 ( -2.112 0.609 -7.696) 8.004 8.798 ( 2.112 0.609 7.696) 8.004 10.066 ( -1.035 -0.752 -2.740) 3.024 10.066 ( 1.035 -0.752 2.740) 3.024 10.265 ( 0.419 -0.774 -6.776) 6.833 10.265 ( -0.419 -0.774 6.776) 6.833 10.896 ( 2.039 -0.081 -5.254) 5.636 10.896 ( -2.039 -0.081 5.254) 5.636 11.557 ( -4.496 -0.526 -8.018) 9.208 11.557 ( 4.496 -0.526 8.018) 9.208 12.108 ( -3.675 -0.400 -6.071) 7.108 12.108 ( 3.675 -0.400 6.071) 7.108 13.455 ( -4.785 0.236 -5.768) 7.498 13.455 ( 4.785 0.236 5.768) 7.498 17.083 ( -32.855 -0.207 -9.597) 34.229 17.083 ( 32.855 -0.207 9.597) 34.229 19.099 ( -10.234 -0.482 -1.280) 10.325 19.099 ( 10.234 -0.482 1.280) 10.325 19.936 ( -6.924 0.273 -5.213) 8.671 19.936 ( 6.924 0.273 5.213) 8.671 20.424 ( 3.274 0.294 -7.700) 8.372 20.424 ( -3.274 0.294 7.700) 8.372 21.025 ( 7.520 -0.394 -8.227) 11.154 21.025 ( -7.520 -0.394 8.227) 11.154 22.733 ( -1.544 -0.487 -9.204) 9.345 22.733 ( 1.544 -0.487 9.204) 9.345 24.186 ( 0.001 0.200 -1.726) 1.737 24.186 ( -0.001 0.200 1.726) 1.737 24.991 ( -4.016 -1.140 0.138) 4.177 24.991 ( 4.016 -1.140 -0.138) 4.177 25.511 ( -3.222 0.538 -7.495) 8.176 25.511 ( 3.222 0.538 7.495) 8.176 26.469 ( -13.976 0.363 -2.895) 14.278 26.469 ( 13.976 0.363 2.895) 14.278 48.240 ( 9.258 -0.047 -16.536) 18.951 48.240 ( -9.258 -0.047 16.536) 18.951 48.591 ( 8.328 0.017 -17.345) 19.240 48.591 ( -8.328 0.017 17.345) 19.240 98.850 ( -3.447 0.205 0.456) 3.483 98.850 ( 3.447 0.205 -0.456) 3.483 99.438 ( -2.482 -0.511 -9.449) 9.783 99.438 ( 2.482 -0.511 9.449) 9.783 100.834 ( 5.045 -0.033 -7.540) 9.072 100.834 ( -5.045 -0.033 7.540) 9.072 101.830 ( -0.139 0.643 -18.593) 18.605 101.830 ( 0.139 0.643 18.593) 18.605 =================== 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 3/58320 10.0 25.383 48.350 30.025 0.000 1.318 -0.000 3/58320 20.0 8.565 8.522 9.332 0.000 0.935 -0.000 3/58320 30.0 4.041 3.410 4.477 0.000 0.458 -0.000 3/58320 40.0 2.537 2.003 2.840 0.000 0.255 -0.000 3/58320 50.0 1.841 1.405 2.082 0.000 0.162 -0.000 3/58320 60.0 1.453 1.087 1.661 0.000 0.114 -0.000 3/58320 70.0 1.208 0.893 1.397 0.000 0.086 -0.000 3/58320 80.0 1.041 0.763 1.216 0.000 0.069 -0.000 3/58320 90.0 0.919 0.669 1.084 0.000 0.056 -0.000 3/58320 100.0 0.826 0.599 0.983 0.000 0.048 -0.000 3/58320 110.0 0.753 0.544 0.903 0.000 0.042 -0.000 3/58320 120.0 0.694 0.500 0.837 0.000 0.037 -0.000 3/58320 130.0 0.646 0.463 0.782 0.000 0.034 -0.000 3/58320 140.0 0.606 0.431 0.735 0.000 0.031 -0.000 3/58320 150.0 0.572 0.404 0.694 0.000 0.029 -0.000 3/58320 160.0 0.544 0.381 0.659 0.000 0.027 -0.000 3/58320 170.0 0.519 0.360 0.627 0.000 0.026 -0.000 3/58320 180.0 0.497 0.342 0.599 0.000 0.024 -0.000 3/58320 190.0 0.478 0.326 0.574 0.000 0.023 -0.000 3/58320 200.0 0.462 0.311 0.552 0.000 0.022 -0.000 3/58320 210.0 0.447 0.298 0.531 0.000 0.021 -0.000 3/58320 220.0 0.434 0.286 0.513 0.000 0.021 -0.000 3/58320 230.0 0.422 0.275 0.496 0.000 0.020 -0.000 3/58320 240.0 0.412 0.264 0.480 0.000 0.019 -0.000 3/58320 250.0 0.402 0.255 0.466 0.000 0.018 -0.000 3/58320 260.0 0.393 0.247 0.453 0.000 0.018 -0.000 3/58320 270.0 0.385 0.239 0.440 0.000 0.017 -0.000 3/58320 280.0 0.377 0.231 0.429 0.000 0.016 -0.000 3/58320 290.0 0.370 0.224 0.418 0.000 0.016 -0.000 3/58320 300.0 0.363 0.218 0.408 0.000 0.015 -0.000 3/58320 310.0 0.357 0.212 0.399 0.000 0.014 -0.000 3/58320 320.0 0.351 0.206 0.390 0.000 0.013 -0.000 3/58320 330.0 0.345 0.201 0.382 0.000 0.013 -0.000 3/58320 340.0 0.340 0.195 0.374 0.000 0.012 -0.000 3/58320 350.0 0.334 0.191 0.367 0.000 0.011 -0.000 3/58320 360.0 0.329 0.186 0.360 0.000 0.010 -0.000 3/58320 370.0 0.324 0.182 0.354 0.000 0.010 -0.000 3/58320 380.0 0.320 0.178 0.347 0.000 0.009 -0.000 3/58320 390.0 0.315 0.174 0.342 0.000 0.008 -0.000 3/58320 400.0 0.311 0.170 0.336 0.000 0.007 -0.000 3/58320 410.0 0.306 0.166 0.331 0.000 0.007 -0.000 3/58320 420.0 0.302 0.163 0.325 0.000 0.006 -0.000 3/58320 430.0 0.298 0.159 0.321 0.000 0.005 -0.000 3/58320 440.0 0.294 0.156 0.316 0.000 0.005 -0.000 3/58320 450.0 0.290 0.153 0.311 0.000 0.004 -0.000 3/58320 460.0 0.286 0.150 0.307 0.000 0.003 -0.000 3/58320 470.0 0.282 0.147 0.303 0.000 0.003 -0.000 3/58320 480.0 0.279 0.145 0.299 0.000 0.002 -0.000 3/58320 490.0 0.275 0.142 0.295 0.000 0.001 -0.000 3/58320 500.0 0.272 0.140 0.291 0.000 0.001 -0.000 3/58320 510.0 0.268 0.137 0.288 0.000 0.000 -0.000 3/58320 520.0 0.265 0.135 0.284 0.000 -0.000 -0.000 3/58320 530.0 0.262 0.132 0.281 0.000 -0.001 -0.000 3/58320 540.0 0.259 0.130 0.278 0.000 -0.002 -0.000 3/58320 550.0 0.256 0.128 0.275 0.000 -0.002 -0.000 3/58320 560.0 0.253 0.126 0.271 0.000 -0.003 -0.000 3/58320 570.0 0.250 0.124 0.268 0.000 -0.003 -0.000 3/58320 580.0 0.247 0.122 0.266 0.000 -0.004 -0.000 3/58320 590.0 0.244 0.120 0.263 0.000 -0.004 -0.000 3/58320 600.0 0.241 0.118 0.260 0.000 -0.004 -0.000 3/58320 610.0 0.238 0.117 0.257 0.000 -0.005 -0.000 3/58320 620.0 0.236 0.115 0.255 0.000 -0.005 -0.000 3/58320 630.0 0.233 0.113 0.252 0.000 -0.006 -0.000 3/58320 640.0 0.230 0.112 0.250 0.000 -0.006 -0.000 3/58320 650.0 0.228 0.110 0.247 0.000 -0.006 -0.000 3/58320 660.0 0.226 0.109 0.245 0.000 -0.007 -0.000 3/58320 670.0 0.223 0.107 0.242 0.000 -0.007 -0.000 3/58320 680.0 0.221 0.106 0.240 0.000 -0.007 -0.000 3/58320 690.0 0.218 0.104 0.238 0.000 -0.008 -0.000 3/58320 700.0 0.216 0.103 0.236 0.000 -0.008 -0.000 3/58320 710.0 0.214 0.102 0.234 0.000 -0.008 -0.000 3/58320 720.0 0.212 0.100 0.231 0.000 -0.009 -0.000 3/58320 730.0 0.210 0.099 0.229 0.000 -0.009 -0.000 3/58320 740.0 0.207 0.098 0.227 0.000 -0.009 -0.000 3/58320 750.0 0.205 0.097 0.225 0.000 -0.009 -0.000 3/58320 760.0 0.203 0.096 0.223 0.000 -0.010 -0.000 3/58320 770.0 0.201 0.094 0.221 0.000 -0.010 -0.000 3/58320 780.0 0.199 0.093 0.220 0.000 -0.010 -0.000 3/58320 790.0 0.198 0.092 0.218 0.000 -0.010 -0.000 3/58320 800.0 0.196 0.091 0.216 0.000 -0.010 -0.000 3/58320 810.0 0.194 0.090 0.214 0.000 -0.011 -0.000 3/58320 820.0 0.192 0.089 0.212 0.000 -0.011 -0.000 3/58320 830.0 0.190 0.088 0.211 0.000 -0.011 -0.000 3/58320 840.0 0.188 0.087 0.209 0.000 -0.011 -0.000 3/58320 850.0 0.187 0.086 0.207 0.000 -0.011 -0.000 3/58320 860.0 0.185 0.085 0.206 0.000 -0.011 -0.000 3/58320 870.0 0.183 0.084 0.204 0.000 -0.012 -0.000 3/58320 880.0 0.182 0.084 0.202 0.000 -0.012 -0.000 3/58320 890.0 0.180 0.083 0.201 0.000 -0.012 -0.000 3/58320 900.0 0.179 0.082 0.199 0.000 -0.012 -0.000 3/58320 910.0 0.177 0.081 0.198 0.000 -0.012 -0.000 3/58320 920.0 0.175 0.080 0.196 0.000 -0.012 -0.000 3/58320 930.0 0.174 0.079 0.195 0.000 -0.012 -0.000 3/58320 940.0 0.172 0.079 0.193 0.000 -0.012 -0.000 3/58320 950.0 0.171 0.078 0.192 0.000 -0.012 -0.000 3/58320 960.0 0.170 0.077 0.190 0.000 -0.012 -0.000 3/58320 970.0 0.168 0.076 0.189 0.000 -0.012 -0.000 3/58320 980.0 0.167 0.076 0.188 0.000 -0.013 -0.000 3/58320 990.0 0.165 0.075 0.186 0.000 -0.013 -0.000 3/58320 1000.0 0.164 0.074 0.185 0.000 -0.013 -0.000 3/58320 Thermal conductivity related properties were written into "kappa-m9910.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 06:05:36]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|