----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-09 00:29:03]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 1] Primitive matrix: [ 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 2.953813475033036 -5.108642370000001 0.000000000000000 b 2.953813475033036 5.108642370000001 0.000000000000000 c -1.871482562859798 0.000000000000000 11.052556608985372 Atomic positions (fractional): *1 Na 0.32205257586757 0.15094038780253 0.00224273309884 22.990 2 Na 0.15094038780253 0.32205257586757 0.50224273309884 22.990 *3 Na 0.50000000000000 0.00000000000000 0.50000000000000 22.990 *4 Na 0.91454115515764 0.08545884484236 0.75000000000000 22.990 5 Na 0.08545884484236 0.91454115515764 0.25000000000000 22.990 6 Na 0.84905961219747 0.67794742413243 0.49775726690116 22.990 7 Na 0.00000000000000 0.50000000000000 0.00000000000000 22.990 8 Na 0.67794742413243 0.84905961219747 0.99775726690116 22.990 *9 Bi 0.58070226994431 0.41929773005569 0.75000000000000 208.980 *10 Bi 0.24792465295229 0.75207534704771 0.75000000000000 208.980 11 Bi 0.41929773005569 0.58070226994431 0.25000000000000 208.980 12 Bi 0.75207534704771 0.24792465295229 0.25000000000000 208.980 *13 O 0.22204193775212 0.02186069286008 0.63749391807750 15.999 *14 O 0.57727156525437 0.09278567774068 0.85894373092579 15.999 15 O 0.02186069286008 0.22204193775212 0.13749391807750 15.999 *16 O 0.29770753076578 0.49759206545481 0.86345276724605 15.999 17 O 0.09278567774068 0.57727156525437 0.35894373092579 15.999 18 O 0.49759206545481 0.29770753076578 0.36345276724605 15.999 19 O 0.50240793454519 0.70229246923422 0.63654723275395 15.999 20 O 0.90721432225932 0.42272843474563 0.64105626907421 15.999 21 O 0.70229246923422 0.50240793454519 0.13654723275395 15.999 22 O 0.97813930713992 0.77795806224788 0.86250608192250 15.999 23 O 0.42272843474563 0.90721432225932 0.14105626907422 15.999 24 O 0.77795806224788 0.97813930713992 0.36250608192250 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.907626950066072 0.000000000000000 0.000000000000000 b 0.000000000000000 10.217284740000002 0.000000000000000 c -1.871482562859798 0.000000000000000 11.052556608985372 Atomic positions (fractional): *1 Na 0.23649648183505 0.91444390596748 0.00224273309884 22.990 > 1 2 Na 0.23649648183505 0.08555609403252 0.50224273309884 22.990 > 2 *3 Na 0.75000000000000 0.25000000000000 0.50000000000000 22.990 > 3 *4 Na 0.50000000000000 0.58545884484236 0.75000000000000 22.990 > 4 5 Na 0.50000000000000 0.41454115515764 0.25000000000000 22.990 > 5 6 Na 0.76350351816495 0.91444390596748 0.49775726690116 22.990 > 6 7 Na 0.75000000000000 0.75000000000000 0.00000000000000 22.990 > 7 8 Na 0.76350351816495 0.08555609403252 0.99775726690116 22.990 > 8 9 Na 0.73649648183505 0.41444390596748 0.00224273309884 22.990 > 1 10 Na 0.73649648183505 0.58555609403252 0.50224273309884 22.990 > 2 11 Na 0.25000000000000 0.75000000000000 0.50000000000000 22.990 > 3 12 Na 0.00000000000000 0.08545884484236 0.75000000000000 22.990 > 4 13 Na 0.00000000000000 0.91454115515764 0.25000000000000 22.990 > 5 14 Na 0.26350351816495 0.41444390596748 0.49775726690116 22.990 > 6 15 Na 0.25000000000000 0.25000000000000 0.00000000000000 22.990 > 7 16 Na 0.26350351816495 0.58555609403252 0.99775726690116 22.990 > 8 *17 Bi 0.50000000000000 0.91929773005569 0.75000000000000 208.980 > 9 *18 Bi 0.50000000000000 0.25207534704771 0.75000000000000 208.980 > 10 19 Bi 0.50000000000000 0.08070226994431 0.25000000000000 208.980 > 11 20 Bi 0.50000000000000 0.74792465295229 0.25000000000000 208.980 > 12 21 Bi 0.00000000000000 0.41929773005569 0.75000000000000 208.980 > 9 22 Bi 0.00000000000000 0.75207534704771 0.75000000000000 208.980 > 10 23 Bi 0.00000000000000 0.58070226994431 0.25000000000000 208.980 > 11 24 Bi 0.00000000000000 0.24792465295229 0.25000000000000 208.980 > 12 *25 O 0.12195131530610 0.89990937755398 0.63749391807750 15.999 > 13 *26 O 0.33502862149752 0.75775705624316 0.85894373092579 15.999 > 14 27 O 0.12195131530610 0.10009062244602 0.13749391807750 15.999 > 15 *28 O 0.39764979811029 0.09994226734452 0.86345276724605 15.999 > 16 29 O 0.33502862149752 0.24224294375684 0.35894373092579 15.999 > 17 30 O 0.39764979811029 0.90005773265549 0.36345276724605 15.999 > 18 31 O 0.60235020188971 0.09994226734452 0.63654723275395 15.999 > 19 32 O 0.66497137850248 0.75775705624316 0.64105626907421 15.999 > 20 33 O 0.60235020188971 0.90005773265549 0.13654723275395 15.999 > 21 34 O 0.87804868469390 0.89990937755398 0.86250608192250 15.999 > 22 35 O 0.66497137850248 0.24224294375684 0.14105626907422 15.999 > 23 36 O 0.87804868469390 0.10009062244602 0.36250608192250 15.999 > 24 37 O 0.62195131530610 0.39990937755398 0.63749391807750 15.999 > 13 38 O 0.83502862149752 0.25775705624315 0.85894373092579 15.999 > 14 39 O 0.62195131530610 0.60009062244602 0.13749391807750 15.999 > 15 40 O 0.89764979811029 0.59994226734451 0.86345276724605 15.999 > 16 41 O 0.83502862149752 0.74224294375684 0.35894373092579 15.999 > 17 42 O 0.89764979811029 0.40005773265548 0.36345276724605 15.999 > 18 43 O 0.10235020188971 0.59994226734451 0.63654723275395 15.999 > 19 44 O 0.16497137850248 0.25775705624315 0.64105626907421 15.999 > 20 45 O 0.10235020188971 0.40005773265548 0.13654723275395 15.999 > 21 46 O 0.37804868469390 0.39990937755398 0.86250608192250 15.999 > 22 47 O 0.16497137850248 0.74224294375684 0.14105626907422 15.999 > 23 48 O 0.37804868469390 0.60009062244602 0.36250608192250 15.999 > 24 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.815253900132143 0.000000000000000 0.000000000000000 b 0.000000000000000 10.217284740000002 0.000000000000000 c -1.871482562859798 0.000000000000000 11.052556608985372 Atomic positions (fractional): *1 Na 0.11824824091753 0.91444390596748 0.00224273309884 22.990 > 1 2 Na 0.61824824091752 0.91444390596748 0.00224273309884 22.990 > 1 3 Na 0.11824824091753 0.08555609403252 0.50224273309884 22.990 > 2 4 Na 0.61824824091752 0.08555609403252 0.50224273309884 22.990 > 2 *5 Na 0.37500000000000 0.25000000000000 0.50000000000000 22.990 > 3 6 Na 0.87500000000000 0.25000000000000 0.50000000000000 22.990 > 3 *7 Na 0.25000000000000 0.58545884484236 0.75000000000000 22.990 > 4 8 Na 0.75000000000000 0.58545884484236 0.75000000000000 22.990 > 4 9 Na 0.25000000000000 0.41454115515764 0.25000000000000 22.990 > 5 10 Na 0.75000000000000 0.41454115515764 0.25000000000000 22.990 > 5 11 Na 0.38175175908247 0.91444390596748 0.49775726690116 22.990 > 6 12 Na 0.88175175908248 0.91444390596748 0.49775726690116 22.990 > 6 13 Na 0.37500000000000 0.75000000000000 0.00000000000000 22.990 > 7 14 Na 0.87500000000000 0.75000000000000 0.00000000000000 22.990 > 7 15 Na 0.38175175908247 0.08555609403252 0.99775726690116 22.990 > 8 16 Na 0.88175175908248 0.08555609403252 0.99775726690116 22.990 > 8 17 Na 0.36824824091753 0.41444390596748 0.00224273309884 22.990 > 1 18 Na 0.86824824091752 0.41444390596748 0.00224273309884 22.990 > 1 19 Na 0.36824824091753 0.58555609403252 0.50224273309884 22.990 > 2 20 Na 0.86824824091752 0.58555609403252 0.50224273309884 22.990 > 2 21 Na 0.12500000000000 0.75000000000000 0.50000000000000 22.990 > 3 22 Na 0.62500000000000 0.75000000000000 0.50000000000000 22.990 > 3 23 Na 0.00000000000000 0.08545884484236 0.75000000000000 22.990 > 4 24 Na 0.50000000000000 0.08545884484236 0.75000000000000 22.990 > 4 25 Na 0.00000000000000 0.91454115515764 0.25000000000000 22.990 > 5 26 Na 0.50000000000000 0.91454115515764 0.25000000000000 22.990 > 5 27 Na 0.13175175908247 0.41444390596748 0.49775726690116 22.990 > 6 28 Na 0.63175175908248 0.41444390596748 0.49775726690116 22.990 > 6 29 Na 0.12500000000000 0.25000000000000 0.00000000000000 22.990 > 7 30 Na 0.62500000000000 0.25000000000000 0.00000000000000 22.990 > 7 31 Na 0.13175175908247 0.58555609403252 0.99775726690116 22.990 > 8 32 Na 0.63175175908248 0.58555609403252 0.99775726690116 22.990 > 8 *33 Bi 0.25000000000000 0.91929773005569 0.75000000000000 208.980 > 9 34 Bi 0.75000000000000 0.91929773005569 0.75000000000000 208.980 > 9 *35 Bi 0.25000000000000 0.25207534704771 0.75000000000000 208.980 > 10 36 Bi 0.75000000000000 0.25207534704771 0.75000000000000 208.980 > 10 37 Bi 0.25000000000000 0.08070226994431 0.25000000000000 208.980 > 11 38 Bi 0.75000000000000 0.08070226994431 0.25000000000000 208.980 > 11 39 Bi 0.25000000000000 0.74792465295229 0.25000000000000 208.980 > 12 40 Bi 0.75000000000000 0.74792465295229 0.25000000000000 208.980 > 12 41 Bi 0.00000000000000 0.41929773005569 0.75000000000000 208.980 > 9 42 Bi 0.50000000000000 0.41929773005569 0.75000000000000 208.980 > 9 43 Bi 0.00000000000000 0.75207534704771 0.75000000000000 208.980 > 10 44 Bi 0.50000000000000 0.75207534704771 0.75000000000000 208.980 > 10 45 Bi 0.00000000000000 0.58070226994431 0.25000000000000 208.980 > 11 46 Bi 0.50000000000000 0.58070226994431 0.25000000000000 208.980 > 11 47 Bi 0.00000000000000 0.24792465295229 0.25000000000000 208.980 > 12 48 Bi 0.50000000000000 0.24792465295229 0.25000000000000 208.980 > 12 *49 O 0.06097565765305 0.89990937755398 0.63749391807750 15.999 > 13 50 O 0.56097565765305 0.89990937755398 0.63749391807750 15.999 > 13 *51 O 0.16751431074876 0.75775705624316 0.85894373092579 15.999 > 14 52 O 0.66751431074876 0.75775705624316 0.85894373092579 15.999 > 14 53 O 0.06097565765305 0.10009062244602 0.13749391807750 15.999 > 15 54 O 0.56097565765305 0.10009062244602 0.13749391807750 15.999 > 15 *55 O 0.19882489905515 0.09994226734452 0.86345276724605 15.999 > 16 56 O 0.69882489905515 0.09994226734452 0.86345276724605 15.999 > 16 57 O 0.16751431074876 0.24224294375684 0.35894373092579 15.999 > 17 58 O 0.66751431074876 0.24224294375684 0.35894373092579 15.999 > 17 59 O 0.19882489905515 0.90005773265549 0.36345276724605 15.999 > 18 60 O 0.69882489905515 0.90005773265549 0.36345276724605 15.999 > 18 61 O 0.30117510094485 0.09994226734452 0.63654723275395 15.999 > 19 62 O 0.80117510094485 0.09994226734452 0.63654723275395 15.999 > 19 63 O 0.33248568925124 0.75775705624316 0.64105626907421 15.999 > 20 64 O 0.83248568925124 0.75775705624316 0.64105626907421 15.999 > 20 65 O 0.30117510094485 0.90005773265549 0.13654723275395 15.999 > 21 66 O 0.80117510094485 0.90005773265549 0.13654723275395 15.999 > 21 67 O 0.43902434234695 0.89990937755398 0.86250608192250 15.999 > 22 68 O 0.93902434234695 0.89990937755398 0.86250608192250 15.999 > 22 69 O 0.33248568925124 0.24224294375684 0.14105626907422 15.999 > 23 70 O 0.83248568925124 0.24224294375684 0.14105626907422 15.999 > 23 71 O 0.43902434234695 0.10009062244602 0.36250608192250 15.999 > 24 72 O 0.93902434234695 0.10009062244602 0.36250608192250 15.999 > 24 73 O 0.31097565765305 0.39990937755398 0.63749391807750 15.999 > 13 74 O 0.81097565765305 0.39990937755398 0.63749391807750 15.999 > 13 75 O 0.41751431074876 0.25775705624315 0.85894373092579 15.999 > 14 76 O 0.91751431074876 0.25775705624315 0.85894373092579 15.999 > 14 77 O 0.31097565765305 0.60009062244602 0.13749391807750 15.999 > 15 78 O 0.81097565765305 0.60009062244602 0.13749391807750 15.999 > 15 79 O 0.44882489905515 0.59994226734451 0.86345276724605 15.999 > 16 80 O 0.94882489905515 0.59994226734451 0.86345276724605 15.999 > 16 81 O 0.41751431074876 0.74224294375684 0.35894373092579 15.999 > 17 82 O 0.91751431074876 0.74224294375684 0.35894373092579 15.999 > 17 83 O 0.44882489905515 0.40005773265548 0.36345276724605 15.999 > 18 84 O 0.94882489905515 0.40005773265548 0.36345276724605 15.999 > 18 85 O 0.05117510094485 0.59994226734451 0.63654723275395 15.999 > 19 86 O 0.55117510094485 0.59994226734451 0.63654723275395 15.999 > 19 87 O 0.08248568925124 0.25775705624315 0.64105626907421 15.999 > 20 88 O 0.58248568925124 0.25775705624315 0.64105626907421 15.999 > 20 89 O 0.05117510094485 0.40005773265548 0.13654723275395 15.999 > 21 90 O 0.55117510094485 0.40005773265548 0.13654723275395 15.999 > 21 91 O 0.18902434234695 0.39990937755398 0.86250608192250 15.999 > 22 92 O 0.68902434234695 0.39990937755398 0.86250608192250 15.999 > 22 93 O 0.08248568925124 0.74224294375684 0.14105626907422 15.999 > 23 94 O 0.58248568925124 0.74224294375684 0.14105626907422 15.999 > 23 95 O 0.18902434234695 0.60009062244602 0.36250608192250 15.999 > 24 96 O 0.68902434234695 0.60009062244602 0.36250608192250 15.999 > 24 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.2052079 0.0000000 0.0294507 0.0000000 5.2456311 0.0000000 0.0294632 0.0000000 3.6315292 -------------------------- Born effective charges -------------------------- 1 Na 0.9252016 0.0509094 -0.0070256 0.0570897 1.1171983 -0.0217194 0.0020865 0.0202264 1.4742292 2 Na 0.9252016 -0.0509094 -0.0070256 -0.0570897 1.1171983 0.0217194 0.0020865 -0.0202264 1.4742292 3 Na 1.1976569 0.1173366 0.0326071 0.1086733 0.8347255 0.0311876 0.0023468 0.0429448 1.4708934 4 Na 1.2025068 -0.0000000 0.0075018 0.0000000 1.1908305 -0.0000000 0.0112654 0.0000000 0.5611708 5 Na 1.2025068 -0.0000000 0.0075018 0.0000000 1.1908305 -0.0000000 0.0112654 0.0000000 0.5611708 6 Na 0.9252016 -0.0509094 -0.0070256 -0.0570897 1.1171983 0.0217194 0.0020865 -0.0202264 1.4742292 7 Na 1.1976569 -0.1173366 0.0326071 -0.1086733 0.8347255 -0.0311876 0.0023468 -0.0429448 1.4708934 8 Na 0.9252016 0.0509094 -0.0070256 0.0570897 1.1171983 -0.0217194 0.0020865 0.0202264 1.4742292 9 Bi 5.2641368 -0.0000000 -0.0424085 0.0000000 5.3705709 -0.0000000 0.0121917 0.0000000 2.0426768 10 Bi 4.7552178 -0.0000000 0.0117662 0.0000000 4.8047719 -0.0000000 -0.0913412 0.0000000 2.5168402 11 Bi 5.2641368 -0.0000000 -0.0424085 0.0000000 5.3705709 -0.0000000 0.0121917 0.0000000 2.0426768 12 Bi 4.7552178 -0.0000000 0.0117662 0.0000000 4.8047719 -0.0000000 -0.0913412 0.0000000 2.5168402 13 O -2.9142468 -0.8189597 -0.1702075 -0.4664183 -1.8627080 0.2754951 -0.2365425 0.2729815 -1.6066032 14 O -2.6586404 -0.6133106 -0.1490553 -1.0436081 -2.1211846 0.2981334 -0.0846554 0.3481170 -1.5161513 15 O -2.9142468 0.8189597 -0.1702075 0.4664183 -1.8627080 -0.2754951 -0.2365425 -0.2729815 -1.6066032 16 O -1.5620735 0.3086441 0.3215550 -0.0293569 -3.2337551 0.0273415 0.3518800 -0.0604823 -1.6472653 17 O -2.6586404 0.6133106 -0.1490553 1.0436081 -2.1211846 -0.2981334 -0.0846554 -0.3481170 -1.5161513 18 O -1.5620735 -0.3086441 0.3215550 0.0293569 -3.2337551 -0.0273415 0.3518800 0.0604823 -1.6472653 19 O -1.5620735 -0.3086441 0.3215550 0.0293569 -3.2337551 -0.0273415 0.3518800 0.0604823 -1.6472653 20 O -2.6586404 0.6133106 -0.1490553 1.0436081 -2.1211846 -0.2981334 -0.0846554 -0.3481170 -1.5161513 21 O -1.5620735 0.3086441 0.3215550 -0.0293569 -3.2337551 0.0273415 0.3518800 -0.0604823 -1.6472653 22 O -2.9142468 0.8189597 -0.1702075 0.4664183 -1.8627080 -0.2754951 -0.2365425 -0.2729815 -1.6066032 23 O -2.6586404 -0.6133106 -0.1490553 -1.0436081 -2.1211846 0.2981334 -0.0846554 0.3481170 -1.5161513 24 O -2.9142468 -0.8189597 -0.1702075 -0.4664183 -1.8627080 0.2754951 -0.2365425 0.2729815 -1.6066032 ---------------------------------------------------------------------------- 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: 12456/12456 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2718 Number of blocks in projector: 2718 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: 596 Use submatrix version of eigh solver. (1) Block: 596 / 596 (2) Block: 250 / 596 (2) 235 eigenvectors found. (2) Block: 500 / 596 (2) 239 eigenvectors found. (2) Block: 596 / 596 (2) 87 eigenvectors found. (2) Complementary block size: 35 (2) Compute compressed projector. (2) Use standard solver. (2) 20 eigenvectors found. (1) 581 eigenvectors found. (1) Complementary block size: 14 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 240 eigenvectors found. (2) Block: 500 / 560 (2) 240 eigenvectors found. (2) Block: 560 / 560 (2) 52 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 550 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: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 240 eigenvectors found. (2) Block: 500 / 560 (2) 240 eigenvectors found. (2) Block: 560 / 560 (2) 52 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 550 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: 334 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 334 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 334 Use standard eigh solver. Tree of FC basis block matrices: - (2718, 2659), data: False |-- (334, 326), data: True |-- (334, 326), data: True |-- (334, 326), data: True |-- (560, 550), data: False |-- (560, 550), data: False |-- (560, 18), data: (560, 28) @ (28, 18) |-- (60, 52), data: True |-- (250, 240), data: True |-- (250, 240), data: True |-- (560, 550), data: False |-- (560, 550), data: False |-- (560, 18), data: (560, 28) @ (28, 18) |-- (60, 52), data: True |-- (250, 240), data: True |-- (250, 240), data: True |-- (596, 581), data: False |-- (596, 581), data: False |-- (596, 20), data: (596, 35) @ (35, 20) |-- (96, 87), data: True |-- (250, 239), data: True |-- (250, 235), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 720 - Time: 0.825 Solver_block: 200 / 720 - Time: 0.653 Solver_block: 300 / 720 - Time: 0.651 Solver_block: 400 / 720 - Time: 0.642 Solver_block: 500 / 720 - Time: 0.639 Solver_block: 600 / 720 - Time: 0.643 Solver_block: 700 / 720 - Time: 0.652 Solver_block: 720 / 720 - Time: 0.250 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 5.062 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (zz) 0.00000000 (zz) Permutation basis: 288/288 Permutation basis: 12456/12456 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2718 Number of blocks in projector: 2718 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: 596 Use submatrix version of eigh solver. (1) Block: 596 / 596 (2) Block: 250 / 596 (2) 235 eigenvectors found. (2) Block: 500 / 596 (2) 239 eigenvectors found. (2) Block: 596 / 596 (2) 87 eigenvectors found. (2) Complementary block size: 35 (2) Compute compressed projector. (2) Use standard solver. (2) 20 eigenvectors found. (1) 581 eigenvectors found. (1) Complementary block size: 14 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 240 eigenvectors found. (2) Block: 500 / 560 (2) 240 eigenvectors found. (2) Block: 560 / 560 (2) 52 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 550 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: 560 Use submatrix version of eigh solver. (1) Block: 560 / 560 (2) Block: 250 / 560 (2) 240 eigenvectors found. (2) Block: 500 / 560 (2) 240 eigenvectors found. (2) Block: 560 / 560 (2) 52 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 550 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: 334 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 334 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 334 Use standard eigh solver. Tree of FC basis block matrices: - (2718, 2659), data: False |-- (334, 326), data: True |-- (334, 326), data: True |-- (334, 326), data: True |-- (560, 550), data: False |-- (560, 550), data: False |-- (560, 18), data: (560, 28) @ (28, 18) |-- (60, 52), data: True |-- (250, 240), data: True |-- (250, 240), data: True |-- (560, 550), data: False |-- (560, 550), data: False |-- (560, 18), data: (560, 28) @ (28, 18) |-- (60, 52), data: True |-- (250, 240), data: True |-- (250, 240), data: True |-- (596, 581), data: False |-- (596, 581), data: False |-- (596, 20), data: (596, 35) @ (35, 20) |-- (96, 87), data: True |-- (250, 239), data: True |-- (250, 235), data: True Max drift after symmetrization by symfc projector: 0.00000000 (xx) 0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-09 00:29:35]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 00:29:35]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 1] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.953813475033036 -5.108642370000001 0.000000000000000 b 2.953813475033036 5.108642370000001 0.000000000000000 c -1.871482562859798 0.000000000000000 11.052556608985372 Atomic positions (fractional): 1 Na 0.32205257586757 0.15094038780253 0.00224273309884 22.990 2 Na 0.15094038780253 0.32205257586757 0.50224273309884 22.990 3 Na 0.50000000000000 0.00000000000000 0.50000000000000 22.990 4 Na 0.91454115515764 0.08545884484236 0.75000000000000 22.990 5 Na 0.08545884484236 0.91454115515764 0.25000000000000 22.990 6 Na 0.84905961219747 0.67794742413243 0.49775726690116 22.990 7 Na 0.00000000000000 0.50000000000000 0.00000000000000 22.990 8 Na 0.67794742413243 0.84905961219747 0.99775726690116 22.990 9 Bi 0.58070226994431 0.41929773005569 0.75000000000000 208.980 10 Bi 0.24792465295229 0.75207534704771 0.75000000000000 208.980 11 Bi 0.41929773005569 0.58070226994431 0.25000000000000 208.980 12 Bi 0.75207534704771 0.24792465295229 0.25000000000000 208.980 13 O 0.22204193775212 0.02186069286008 0.63749391807750 15.999 14 O 0.57727156525437 0.09278567774068 0.85894373092579 15.999 15 O 0.02186069286008 0.22204193775212 0.13749391807750 15.999 16 O 0.29770753076578 0.49759206545481 0.86345276724605 15.999 17 O 0.09278567774068 0.57727156525437 0.35894373092579 15.999 18 O 0.49759206545481 0.29770753076578 0.36345276724605 15.999 19 O 0.50240793454519 0.70229246923422 0.63654723275395 15.999 20 O 0.90721432225932 0.42272843474563 0.64105626907421 15.999 21 O 0.70229246923422 0.50240793454519 0.13654723275395 15.999 22 O 0.97813930713992 0.77795806224788 0.86250608192250 15.999 23 O 0.42272843474563 0.90721432225932 0.14105626907422 15.999 24 O 0.77795806224788 0.97813930713992 0.36250608192250 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.815253900132143 0.000000000000000 0.000000000000000 b 0.000000000000000 10.217284740000002 0.000000000000000 c -1.871482562859798 0.000000000000000 11.052556608985372 Atomic positions (fractional): 1 Na 0.11824824091753 0.91444390596748 0.00224273309884 22.990 > 1 2 Na 0.61824824091752 0.91444390596748 0.00224273309884 22.990 > 1 3 Na 0.11824824091753 0.08555609403252 0.50224273309884 22.990 > 3 4 Na 0.61824824091752 0.08555609403252 0.50224273309884 22.990 > 3 5 Na 0.37500000000000 0.25000000000000 0.50000000000000 22.990 > 5 6 Na 0.87500000000000 0.25000000000000 0.50000000000000 22.990 > 5 7 Na 0.25000000000000 0.58545884484236 0.75000000000000 22.990 > 7 8 Na 0.75000000000000 0.58545884484236 0.75000000000000 22.990 > 7 9 Na 0.25000000000000 0.41454115515764 0.25000000000000 22.990 > 9 10 Na 0.75000000000000 0.41454115515764 0.25000000000000 22.990 > 9 11 Na 0.38175175908247 0.91444390596748 0.49775726690116 22.990 > 11 12 Na 0.88175175908248 0.91444390596748 0.49775726690116 22.990 > 11 13 Na 0.37500000000000 0.75000000000000 0.00000000000000 22.990 > 13 14 Na 0.87500000000000 0.75000000000000 0.00000000000000 22.990 > 13 15 Na 0.38175175908247 0.08555609403252 0.99775726690116 22.990 > 15 16 Na 0.88175175908248 0.08555609403252 0.99775726690116 22.990 > 15 17 Na 0.36824824091753 0.41444390596748 0.00224273309884 22.990 > 1 18 Na 0.86824824091752 0.41444390596748 0.00224273309884 22.990 > 1 19 Na 0.36824824091753 0.58555609403252 0.50224273309884 22.990 > 3 20 Na 0.86824824091752 0.58555609403252 0.50224273309884 22.990 > 3 21 Na 0.12500000000000 0.75000000000000 0.50000000000000 22.990 > 5 22 Na 0.62500000000000 0.75000000000000 0.50000000000000 22.990 > 5 23 Na 0.00000000000000 0.08545884484236 0.75000000000000 22.990 > 7 24 Na 0.50000000000000 0.08545884484236 0.75000000000000 22.990 > 7 25 Na 0.00000000000000 0.91454115515764 0.25000000000000 22.990 > 9 26 Na 0.50000000000000 0.91454115515764 0.25000000000000 22.990 > 9 27 Na 0.13175175908247 0.41444390596748 0.49775726690116 22.990 > 11 28 Na 0.63175175908248 0.41444390596748 0.49775726690116 22.990 > 11 29 Na 0.12500000000000 0.25000000000000 0.00000000000000 22.990 > 13 30 Na 0.62500000000000 0.25000000000000 0.00000000000000 22.990 > 13 31 Na 0.13175175908247 0.58555609403252 0.99775726690116 22.990 > 15 32 Na 0.63175175908248 0.58555609403252 0.99775726690116 22.990 > 15 33 Bi 0.25000000000000 0.91929773005569 0.75000000000000 208.980 > 33 34 Bi 0.75000000000000 0.91929773005569 0.75000000000000 208.980 > 33 35 Bi 0.25000000000000 0.25207534704771 0.75000000000000 208.980 > 35 36 Bi 0.75000000000000 0.25207534704771 0.75000000000000 208.980 > 35 37 Bi 0.25000000000000 0.08070226994431 0.25000000000000 208.980 > 37 38 Bi 0.75000000000000 0.08070226994431 0.25000000000000 208.980 > 37 39 Bi 0.25000000000000 0.74792465295229 0.25000000000000 208.980 > 39 40 Bi 0.75000000000000 0.74792465295229 0.25000000000000 208.980 > 39 41 Bi 0.00000000000000 0.41929773005569 0.75000000000000 208.980 > 33 42 Bi 0.50000000000000 0.41929773005569 0.75000000000000 208.980 > 33 43 Bi 0.00000000000000 0.75207534704771 0.75000000000000 208.980 > 35 44 Bi 0.50000000000000 0.75207534704771 0.75000000000000 208.980 > 35 45 Bi 0.00000000000000 0.58070226994431 0.25000000000000 208.980 > 37 46 Bi 0.50000000000000 0.58070226994431 0.25000000000000 208.980 > 37 47 Bi 0.00000000000000 0.24792465295229 0.25000000000000 208.980 > 39 48 Bi 0.50000000000000 0.24792465295229 0.25000000000000 208.980 > 39 49 O 0.06097565765305 0.89990937755398 0.63749391807750 15.999 > 49 50 O 0.56097565765305 0.89990937755398 0.63749391807750 15.999 > 49 51 O 0.16751431074876 0.75775705624316 0.85894373092579 15.999 > 51 52 O 0.66751431074876 0.75775705624316 0.85894373092579 15.999 > 51 53 O 0.06097565765305 0.10009062244602 0.13749391807750 15.999 > 53 54 O 0.56097565765305 0.10009062244602 0.13749391807750 15.999 > 53 55 O 0.19882489905515 0.09994226734452 0.86345276724605 15.999 > 55 56 O 0.69882489905515 0.09994226734452 0.86345276724605 15.999 > 55 57 O 0.16751431074876 0.24224294375684 0.35894373092579 15.999 > 57 58 O 0.66751431074876 0.24224294375684 0.35894373092579 15.999 > 57 59 O 0.19882489905515 0.90005773265549 0.36345276724605 15.999 > 59 60 O 0.69882489905515 0.90005773265549 0.36345276724605 15.999 > 59 61 O 0.30117510094485 0.09994226734452 0.63654723275395 15.999 > 61 62 O 0.80117510094485 0.09994226734452 0.63654723275395 15.999 > 61 63 O 0.33248568925124 0.75775705624316 0.64105626907421 15.999 > 63 64 O 0.83248568925124 0.75775705624316 0.64105626907421 15.999 > 63 65 O 0.30117510094485 0.90005773265549 0.13654723275395 15.999 > 65 66 O 0.80117510094485 0.90005773265549 0.13654723275395 15.999 > 65 67 O 0.43902434234695 0.89990937755398 0.86250608192250 15.999 > 67 68 O 0.93902434234695 0.89990937755398 0.86250608192250 15.999 > 67 69 O 0.33248568925124 0.24224294375684 0.14105626907422 15.999 > 69 70 O 0.83248568925124 0.24224294375684 0.14105626907422 15.999 > 69 71 O 0.43902434234695 0.10009062244602 0.36250608192250 15.999 > 71 72 O 0.93902434234695 0.10009062244602 0.36250608192250 15.999 > 71 73 O 0.31097565765305 0.39990937755398 0.63749391807750 15.999 > 49 74 O 0.81097565765305 0.39990937755398 0.63749391807750 15.999 > 49 75 O 0.41751431074876 0.25775705624315 0.85894373092579 15.999 > 51 76 O 0.91751431074876 0.25775705624315 0.85894373092579 15.999 > 51 77 O 0.31097565765305 0.60009062244602 0.13749391807750 15.999 > 53 78 O 0.81097565765305 0.60009062244602 0.13749391807750 15.999 > 53 79 O 0.44882489905515 0.59994226734451 0.86345276724605 15.999 > 55 80 O 0.94882489905515 0.59994226734451 0.86345276724605 15.999 > 55 81 O 0.41751431074876 0.74224294375684 0.35894373092579 15.999 > 57 82 O 0.91751431074876 0.74224294375684 0.35894373092579 15.999 > 57 83 O 0.44882489905515 0.40005773265548 0.36345276724605 15.999 > 59 84 O 0.94882489905515 0.40005773265548 0.36345276724605 15.999 > 59 85 O 0.05117510094485 0.59994226734451 0.63654723275395 15.999 > 61 86 O 0.55117510094485 0.59994226734451 0.63654723275395 15.999 > 61 87 O 0.08248568925124 0.25775705624315 0.64105626907421 15.999 > 63 88 O 0.58248568925124 0.25775705624315 0.64105626907421 15.999 > 63 89 O 0.05117510094485 0.40005773265548 0.13654723275395 15.999 > 65 90 O 0.55117510094485 0.40005773265548 0.13654723275395 15.999 > 65 91 O 0.18902434234695 0.39990937755398 0.86250608192250 15.999 > 67 92 O 0.68902434234695 0.39990937755398 0.86250608192250 15.999 > 67 93 O 0.08248568925124 0.74224294375684 0.14105626907422 15.999 > 69 94 O 0.58248568925124 0.74224294375684 0.14105626907422 15.999 > 69 95 O 0.18902434234695 0.60009062244602 0.36250608192250 15.999 > 71 96 O 0.68902434234695 0.60009062244602 0.36250608192250 15.999 > 71 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.2052079 0.0000000 0.0294507 0.0000000 5.2456311 0.0000000 0.0294632 0.0000000 3.6315292 -------------------------- Born effective charges -------------------------- 1 Na 0.9252016 0.0509094 -0.0070256 0.0570897 1.1171983 -0.0217194 0.0020865 0.0202264 1.4742292 2 Na 0.9252016 -0.0509094 -0.0070256 -0.0570897 1.1171983 0.0217194 0.0020865 -0.0202264 1.4742292 3 Na 1.1976569 0.1173366 0.0326071 0.1086733 0.8347255 0.0311876 0.0023468 0.0429448 1.4708934 4 Na 1.2025068 -0.0000000 0.0075018 0.0000000 1.1908305 -0.0000000 0.0112654 0.0000000 0.5611708 5 Na 1.2025068 -0.0000000 0.0075018 0.0000000 1.1908305 -0.0000000 0.0112654 0.0000000 0.5611708 6 Na 0.9252016 -0.0509094 -0.0070256 -0.0570897 1.1171983 0.0217194 0.0020865 -0.0202264 1.4742292 7 Na 1.1976569 -0.1173366 0.0326071 -0.1086733 0.8347255 -0.0311876 0.0023468 -0.0429448 1.4708934 8 Na 0.9252016 0.0509094 -0.0070256 0.0570897 1.1171983 -0.0217194 0.0020865 0.0202264 1.4742292 9 Bi 5.2641368 -0.0000000 -0.0424085 0.0000000 5.3705709 -0.0000000 0.0121917 0.0000000 2.0426768 10 Bi 4.7552178 -0.0000000 0.0117662 0.0000000 4.8047719 -0.0000000 -0.0913412 0.0000000 2.5168402 11 Bi 5.2641368 -0.0000000 -0.0424085 0.0000000 5.3705709 -0.0000000 0.0121917 0.0000000 2.0426768 12 Bi 4.7552178 -0.0000000 0.0117662 0.0000000 4.8047719 -0.0000000 -0.0913412 0.0000000 2.5168402 13 O -2.9142468 -0.8189597 -0.1702075 -0.4664183 -1.8627080 0.2754951 -0.2365425 0.2729815 -1.6066032 14 O -2.6586404 -0.6133106 -0.1490553 -1.0436081 -2.1211846 0.2981334 -0.0846554 0.3481170 -1.5161513 15 O -2.9142468 0.8189597 -0.1702075 0.4664183 -1.8627080 -0.2754951 -0.2365425 -0.2729815 -1.6066032 16 O -1.5620735 0.3086441 0.3215550 -0.0293569 -3.2337551 0.0273415 0.3518800 -0.0604823 -1.6472653 17 O -2.6586404 0.6133106 -0.1490553 1.0436081 -2.1211846 -0.2981334 -0.0846554 -0.3481170 -1.5161513 18 O -1.5620735 -0.3086441 0.3215550 0.0293569 -3.2337551 -0.0273415 0.3518800 0.0604823 -1.6472653 19 O -1.5620735 -0.3086441 0.3215550 0.0293569 -3.2337551 -0.0273415 0.3518800 0.0604823 -1.6472653 20 O -2.6586404 0.6133106 -0.1490553 1.0436081 -2.1211846 -0.2981334 -0.0846554 -0.3481170 -1.5161513 21 O -1.5620735 0.3086441 0.3215550 -0.0293569 -3.2337551 0.0273415 0.3518800 -0.0604823 -1.6472653 22 O -2.9142468 0.8189597 -0.1702075 0.4664183 -1.8627080 -0.2754951 -0.2365425 -0.2729815 -1.6066032 23 O -2.6586404 -0.6133106 -0.1490553 -1.0436081 -2.1211846 0.2981334 -0.0846554 0.3481170 -1.5161513 24 O -2.9142468 -0.8189597 -0.1702075 -0.4664183 -1.8627080 0.2754951 -0.2365425 0.2729815 -1.6066032 ---------------------------------------------------------------------------- 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] [-0.0017 0.0000 0.0099] [ 0.0017 0.0000 -0.0099] Computing fc3[ 5, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0017 0.0000 0.0099] [ 0.0017 0.0000 -0.0099] Computing fc3[ 7, 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] [-0.0017 0.0000 0.0099] [ 0.0017 0.0000 -0.0099] 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] [-0.0017 0.0000 0.0099] [ 0.0017 0.0000 -0.0099] 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] [-0.0017 0.0000 0.0099] [ 0.0017 0.0000 -0.0099] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0017 0.0000 0.0099] [ 0.0017 0.0000 -0.0099] Computing fc3[ 51, 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] [-0.0017 0.0000 0.0099] [ 0.0017 0.0000 -0.0099] Computing fc3[ 55, 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] [-0.0017 0.0000 0.0099] [ 0.0017 0.0000 -0.0099] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000001 (yyy) -0.00000001 (yyy) -0.00000001 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000001 (zx) -0.00000001 (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 2026-01-09 00:30:01]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 00:30:01]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 1] Primitive matrix: [ 0.5 0.5 -0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.953813475033036 -5.108642370000001 0.000000000000000 b 2.953813475033036 5.108642370000001 0.000000000000000 c -1.871482562859798 0.000000000000000 11.052556608985372 Atomic positions (fractional): 1 Na 0.32205257586757 0.15094038780253 0.00224273309884 22.990 2 Na 0.15094038780253 0.32205257586757 0.50224273309884 22.990 3 Na 0.50000000000000 0.00000000000000 0.50000000000000 22.990 4 Na 0.91454115515764 0.08545884484236 0.75000000000000 22.990 5 Na 0.08545884484236 0.91454115515764 0.25000000000000 22.990 6 Na 0.84905961219747 0.67794742413243 0.49775726690116 22.990 7 Na 0.00000000000000 0.50000000000000 0.00000000000000 22.990 8 Na 0.67794742413243 0.84905961219747 0.99775726690116 22.990 9 Bi 0.58070226994431 0.41929773005569 0.75000000000000 208.980 10 Bi 0.24792465295229 0.75207534704771 0.75000000000000 208.980 11 Bi 0.41929773005569 0.58070226994431 0.25000000000000 208.980 12 Bi 0.75207534704771 0.24792465295229 0.25000000000000 208.980 13 O 0.22204193775212 0.02186069286008 0.63749391807750 15.999 14 O 0.57727156525437 0.09278567774068 0.85894373092579 15.999 15 O 0.02186069286008 0.22204193775212 0.13749391807750 15.999 16 O 0.29770753076578 0.49759206545481 0.86345276724605 15.999 17 O 0.09278567774068 0.57727156525437 0.35894373092579 15.999 18 O 0.49759206545481 0.29770753076578 0.36345276724605 15.999 19 O 0.50240793454519 0.70229246923422 0.63654723275395 15.999 20 O 0.90721432225932 0.42272843474563 0.64105626907421 15.999 21 O 0.70229246923422 0.50240793454519 0.13654723275395 15.999 22 O 0.97813930713992 0.77795806224788 0.86250608192250 15.999 23 O 0.42272843474563 0.90721432225932 0.14105626907422 15.999 24 O 0.77795806224788 0.97813930713992 0.36250608192250 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.815253900132143 0.000000000000000 0.000000000000000 b 0.000000000000000 10.217284740000002 0.000000000000000 c -1.871482562859798 0.000000000000000 11.052556608985372 Atomic positions (fractional): 1 Na 0.11824824091753 0.91444390596748 0.00224273309884 22.990 > 1 2 Na 0.61824824091752 0.91444390596748 0.00224273309884 22.990 > 1 3 Na 0.11824824091753 0.08555609403252 0.50224273309884 22.990 > 3 4 Na 0.61824824091752 0.08555609403252 0.50224273309884 22.990 > 3 5 Na 0.37500000000000 0.25000000000000 0.50000000000000 22.990 > 5 6 Na 0.87500000000000 0.25000000000000 0.50000000000000 22.990 > 5 7 Na 0.25000000000000 0.58545884484236 0.75000000000000 22.990 > 7 8 Na 0.75000000000000 0.58545884484236 0.75000000000000 22.990 > 7 9 Na 0.25000000000000 0.41454115515764 0.25000000000000 22.990 > 9 10 Na 0.75000000000000 0.41454115515764 0.25000000000000 22.990 > 9 11 Na 0.38175175908247 0.91444390596748 0.49775726690116 22.990 > 11 12 Na 0.88175175908248 0.91444390596748 0.49775726690116 22.990 > 11 13 Na 0.37500000000000 0.75000000000000 0.00000000000000 22.990 > 13 14 Na 0.87500000000000 0.75000000000000 0.00000000000000 22.990 > 13 15 Na 0.38175175908247 0.08555609403252 0.99775726690116 22.990 > 15 16 Na 0.88175175908248 0.08555609403252 0.99775726690116 22.990 > 15 17 Na 0.36824824091753 0.41444390596748 0.00224273309884 22.990 > 1 18 Na 0.86824824091752 0.41444390596748 0.00224273309884 22.990 > 1 19 Na 0.36824824091753 0.58555609403252 0.50224273309884 22.990 > 3 20 Na 0.86824824091752 0.58555609403252 0.50224273309884 22.990 > 3 21 Na 0.12500000000000 0.75000000000000 0.50000000000000 22.990 > 5 22 Na 0.62500000000000 0.75000000000000 0.50000000000000 22.990 > 5 23 Na 0.00000000000000 0.08545884484236 0.75000000000000 22.990 > 7 24 Na 0.50000000000000 0.08545884484236 0.75000000000000 22.990 > 7 25 Na 0.00000000000000 0.91454115515764 0.25000000000000 22.990 > 9 26 Na 0.50000000000000 0.91454115515764 0.25000000000000 22.990 > 9 27 Na 0.13175175908247 0.41444390596748 0.49775726690116 22.990 > 11 28 Na 0.63175175908248 0.41444390596748 0.49775726690116 22.990 > 11 29 Na 0.12500000000000 0.25000000000000 0.00000000000000 22.990 > 13 30 Na 0.62500000000000 0.25000000000000 0.00000000000000 22.990 > 13 31 Na 0.13175175908247 0.58555609403252 0.99775726690116 22.990 > 15 32 Na 0.63175175908248 0.58555609403252 0.99775726690116 22.990 > 15 33 Bi 0.25000000000000 0.91929773005569 0.75000000000000 208.980 > 33 34 Bi 0.75000000000000 0.91929773005569 0.75000000000000 208.980 > 33 35 Bi 0.25000000000000 0.25207534704771 0.75000000000000 208.980 > 35 36 Bi 0.75000000000000 0.25207534704771 0.75000000000000 208.980 > 35 37 Bi 0.25000000000000 0.08070226994431 0.25000000000000 208.980 > 37 38 Bi 0.75000000000000 0.08070226994431 0.25000000000000 208.980 > 37 39 Bi 0.25000000000000 0.74792465295229 0.25000000000000 208.980 > 39 40 Bi 0.75000000000000 0.74792465295229 0.25000000000000 208.980 > 39 41 Bi 0.00000000000000 0.41929773005569 0.75000000000000 208.980 > 33 42 Bi 0.50000000000000 0.41929773005569 0.75000000000000 208.980 > 33 43 Bi 0.00000000000000 0.75207534704771 0.75000000000000 208.980 > 35 44 Bi 0.50000000000000 0.75207534704771 0.75000000000000 208.980 > 35 45 Bi 0.00000000000000 0.58070226994431 0.25000000000000 208.980 > 37 46 Bi 0.50000000000000 0.58070226994431 0.25000000000000 208.980 > 37 47 Bi 0.00000000000000 0.24792465295229 0.25000000000000 208.980 > 39 48 Bi 0.50000000000000 0.24792465295229 0.25000000000000 208.980 > 39 49 O 0.06097565765305 0.89990937755398 0.63749391807750 15.999 > 49 50 O 0.56097565765305 0.89990937755398 0.63749391807750 15.999 > 49 51 O 0.16751431074876 0.75775705624316 0.85894373092579 15.999 > 51 52 O 0.66751431074876 0.75775705624316 0.85894373092579 15.999 > 51 53 O 0.06097565765305 0.10009062244602 0.13749391807750 15.999 > 53 54 O 0.56097565765305 0.10009062244602 0.13749391807750 15.999 > 53 55 O 0.19882489905515 0.09994226734452 0.86345276724605 15.999 > 55 56 O 0.69882489905515 0.09994226734452 0.86345276724605 15.999 > 55 57 O 0.16751431074876 0.24224294375684 0.35894373092579 15.999 > 57 58 O 0.66751431074876 0.24224294375684 0.35894373092579 15.999 > 57 59 O 0.19882489905515 0.90005773265549 0.36345276724605 15.999 > 59 60 O 0.69882489905515 0.90005773265549 0.36345276724605 15.999 > 59 61 O 0.30117510094485 0.09994226734452 0.63654723275395 15.999 > 61 62 O 0.80117510094485 0.09994226734452 0.63654723275395 15.999 > 61 63 O 0.33248568925124 0.75775705624316 0.64105626907421 15.999 > 63 64 O 0.83248568925124 0.75775705624316 0.64105626907421 15.999 > 63 65 O 0.30117510094485 0.90005773265549 0.13654723275395 15.999 > 65 66 O 0.80117510094485 0.90005773265549 0.13654723275395 15.999 > 65 67 O 0.43902434234695 0.89990937755398 0.86250608192250 15.999 > 67 68 O 0.93902434234695 0.89990937755398 0.86250608192250 15.999 > 67 69 O 0.33248568925124 0.24224294375684 0.14105626907422 15.999 > 69 70 O 0.83248568925124 0.24224294375684 0.14105626907422 15.999 > 69 71 O 0.43902434234695 0.10009062244602 0.36250608192250 15.999 > 71 72 O 0.93902434234695 0.10009062244602 0.36250608192250 15.999 > 71 73 O 0.31097565765305 0.39990937755398 0.63749391807750 15.999 > 49 74 O 0.81097565765305 0.39990937755398 0.63749391807750 15.999 > 49 75 O 0.41751431074876 0.25775705624315 0.85894373092579 15.999 > 51 76 O 0.91751431074876 0.25775705624315 0.85894373092579 15.999 > 51 77 O 0.31097565765305 0.60009062244602 0.13749391807750 15.999 > 53 78 O 0.81097565765305 0.60009062244602 0.13749391807750 15.999 > 53 79 O 0.44882489905515 0.59994226734451 0.86345276724605 15.999 > 55 80 O 0.94882489905515 0.59994226734451 0.86345276724605 15.999 > 55 81 O 0.41751431074876 0.74224294375684 0.35894373092579 15.999 > 57 82 O 0.91751431074876 0.74224294375684 0.35894373092579 15.999 > 57 83 O 0.44882489905515 0.40005773265548 0.36345276724605 15.999 > 59 84 O 0.94882489905515 0.40005773265548 0.36345276724605 15.999 > 59 85 O 0.05117510094485 0.59994226734451 0.63654723275395 15.999 > 61 86 O 0.55117510094485 0.59994226734451 0.63654723275395 15.999 > 61 87 O 0.08248568925124 0.25775705624315 0.64105626907421 15.999 > 63 88 O 0.58248568925124 0.25775705624315 0.64105626907421 15.999 > 63 89 O 0.05117510094485 0.40005773265548 0.13654723275395 15.999 > 65 90 O 0.55117510094485 0.40005773265548 0.13654723275395 15.999 > 65 91 O 0.18902434234695 0.39990937755398 0.86250608192250 15.999 > 67 92 O 0.68902434234695 0.39990937755398 0.86250608192250 15.999 > 67 93 O 0.08248568925124 0.74224294375684 0.14105626907422 15.999 > 69 94 O 0.58248568925124 0.74224294375684 0.14105626907422 15.999 > 69 95 O 0.18902434234695 0.60009062244602 0.36250608192250 15.999 > 71 96 O 0.68902434234695 0.60009062244602 0.36250608192250 15.999 > 71 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 5.2052079 0.0000000 0.0294507 0.0000000 5.2456311 0.0000000 0.0294632 0.0000000 3.6315292 -------------------------- Born effective charges -------------------------- 1 Na 0.9252016 0.0509094 -0.0070256 0.0570897 1.1171983 -0.0217194 0.0020865 0.0202264 1.4742292 2 Na 0.9252016 -0.0509094 -0.0070256 -0.0570897 1.1171983 0.0217194 0.0020865 -0.0202264 1.4742292 3 Na 1.1976569 0.1173366 0.0326071 0.1086733 0.8347255 0.0311876 0.0023468 0.0429448 1.4708934 4 Na 1.2025068 -0.0000000 0.0075018 0.0000000 1.1908305 -0.0000000 0.0112654 0.0000000 0.5611708 5 Na 1.2025068 -0.0000000 0.0075018 0.0000000 1.1908305 -0.0000000 0.0112654 0.0000000 0.5611708 6 Na 0.9252016 -0.0509094 -0.0070256 -0.0570897 1.1171983 0.0217194 0.0020865 -0.0202264 1.4742292 7 Na 1.1976569 -0.1173366 0.0326071 -0.1086733 0.8347255 -0.0311876 0.0023468 -0.0429448 1.4708934 8 Na 0.9252016 0.0509094 -0.0070256 0.0570897 1.1171983 -0.0217194 0.0020865 0.0202264 1.4742292 9 Bi 5.2641368 -0.0000000 -0.0424085 0.0000000 5.3705709 -0.0000000 0.0121917 0.0000000 2.0426768 10 Bi 4.7552178 -0.0000000 0.0117662 0.0000000 4.8047719 -0.0000000 -0.0913412 0.0000000 2.5168402 11 Bi 5.2641368 -0.0000000 -0.0424085 0.0000000 5.3705709 -0.0000000 0.0121917 0.0000000 2.0426768 12 Bi 4.7552178 -0.0000000 0.0117662 0.0000000 4.8047719 -0.0000000 -0.0913412 0.0000000 2.5168402 13 O -2.9142468 -0.8189597 -0.1702075 -0.4664183 -1.8627080 0.2754951 -0.2365425 0.2729815 -1.6066032 14 O -2.6586404 -0.6133106 -0.1490553 -1.0436081 -2.1211846 0.2981334 -0.0846554 0.3481170 -1.5161513 15 O -2.9142468 0.8189597 -0.1702075 0.4664183 -1.8627080 -0.2754951 -0.2365425 -0.2729815 -1.6066032 16 O -1.5620735 0.3086441 0.3215550 -0.0293569 -3.2337551 0.0273415 0.3518800 -0.0604823 -1.6472653 17 O -2.6586404 0.6133106 -0.1490553 1.0436081 -2.1211846 -0.2981334 -0.0846554 -0.3481170 -1.5161513 18 O -1.5620735 -0.3086441 0.3215550 0.0293569 -3.2337551 -0.0273415 0.3518800 0.0604823 -1.6472653 19 O -1.5620735 -0.3086441 0.3215550 0.0293569 -3.2337551 -0.0273415 0.3518800 0.0604823 -1.6472653 20 O -2.6586404 0.6133106 -0.1490553 1.0436081 -2.1211846 -0.2981334 -0.0846554 -0.3481170 -1.5161513 21 O -1.5620735 0.3086441 0.3215550 -0.0293569 -3.2337551 0.0273415 0.3518800 -0.0604823 -1.6472653 22 O -2.9142468 0.8189597 -0.1702075 0.4664183 -1.8627080 -0.2754951 -0.2365425 -0.2729815 -1.6066032 23 O -2.6586404 -0.6133106 -0.1490553 -1.0436081 -2.1211846 0.2981334 -0.0846554 0.3481170 -1.5161513 24 O -2.9142468 -0.8189597 -0.1702075 -0.4664183 -1.8627080 0.2754951 -0.2365425 0.2729815 -1.6066032 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000001 (yyy) -0.00000001 (yyy) -0.00000001 (yyy) Max drift of fc2: 0.00000000 (xx) 0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 10 10 5 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.60, Number of G-points: 313, Lambda: 0.14 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/141) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 141 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 1.305 ( 0.000 0.000 0.000) 0.000 1.416 ( 0.000 0.000 0.000) 0.000 2.297 ( 0.000 0.000 0.000) 0.000 2.337 ( 0.000 0.000 0.000) 0.000 2.555 ( 0.000 0.000 0.000) 0.000 2.724 ( 0.000 0.000 0.000) 0.000 2.930 ( 0.000 0.000 0.000) 0.000 3.401 ( 0.000 0.000 0.000) 0.000 3.617 ( 0.000 0.000 0.000) 0.000 3.898 ( 0.000 0.000 0.000) 0.000 4.143 ( 0.000 0.000 0.000) 0.000 4.145 ( 0.000 0.000 0.000) 0.000 4.209 ( 0.000 0.000 0.000) 0.000 4.422 ( 0.000 0.000 0.000) 0.000 4.668 ( 0.000 0.000 0.000) 0.000 4.806 ( 0.000 0.000 0.000) 0.000 4.834 ( 0.000 0.000 0.000) 0.000 4.950 ( 0.000 0.000 0.000) 0.000 4.987 ( 0.000 0.000 0.000) 0.000 5.327 ( 0.000 0.000 0.000) 0.000 5.399 ( 0.000 0.000 0.000) 0.000 5.580 ( 0.000 0.000 0.000) 0.000 5.635 ( 0.000 0.000 0.000) 0.000 5.939 ( 0.000 0.000 0.000) 0.000 6.036 ( 0.000 0.000 0.000) 0.000 6.129 ( 0.000 0.000 0.000) 0.000 6.145 ( 0.000 0.000 0.000) 0.000 6.217 ( 0.000 0.000 0.000) 0.000 6.506 ( 0.000 0.000 0.000) 0.000 6.590 ( 0.000 0.000 0.000) 0.000 6.606 ( 0.000 0.000 0.000) 0.000 6.662 ( 0.000 0.000 0.000) 0.000 6.672 ( 0.000 0.000 0.000) 0.000 6.958 ( 0.000 0.000 0.000) 0.000 6.994 ( 0.000 0.000 0.000) 0.000 6.998 ( 0.000 0.000 0.000) 0.000 7.050 ( 0.000 0.000 0.000) 0.000 7.142 ( 0.000 0.000 0.000) 0.000 7.678 ( 0.000 0.000 0.000) 0.000 7.698 ( 0.000 0.000 0.000) 0.000 7.762 ( 0.000 0.000 0.000) 0.000 7.802 ( 0.000 0.000 0.000) 0.000 8.160 ( 0.000 0.000 0.000) 0.000 8.886 ( 0.000 0.000 0.000) 0.000 9.095 ( 0.000 0.000 0.000) 0.000 9.134 ( 0.000 0.000 0.000) 0.000 9.160 ( 0.000 0.000 0.000) 0.000 9.446 ( 0.000 0.000 0.000) 0.000 9.778 ( 0.000 0.000 0.000) 0.000 10.591 ( 0.000 0.000 0.000) 0.000 10.836 ( 0.000 0.000 0.000) 0.000 10.931 ( 0.000 0.000 0.000) 0.000 10.961 ( 0.000 0.000 0.000) 0.000 10.965 ( 0.000 0.000 0.000) 0.000 11.470 ( 0.000 0.000 0.000) 0.000 12.218 ( 0.000 0.000 0.000) 0.000 12.256 ( 0.000 0.000 0.000) 0.000 12.289 ( 0.000 0.000 0.000) 0.000 12.410 ( 0.000 0.000 0.000) 0.000 12.449 ( 0.000 0.000 0.000) 0.000 12.776 ( 0.000 0.000 0.000) 0.000 12.920 ( 0.000 0.000 0.000) 0.000 13.088 ( 0.000 0.000 0.000) 0.000 13.111 ( 0.000 0.000 0.000) 0.000 13.341 ( 0.000 0.000 0.000) 0.000 13.424 ( 0.000 0.000 0.000) 0.000 14.833 ( 0.000 0.000 0.000) 0.000 15.061 ( 0.000 0.000 0.000) 0.000 15.136 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/141) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.427 ( 21.213 -4.670 8.051) 23.165 0.546 ( 22.464 -14.986 1.914) 27.072 0.941 ( 40.168 -21.852 6.849) 46.237 1.397 ( 4.913 -6.704 -1.072) 8.380 1.603 ( 17.009 -7.845 -1.242) 18.772 2.247 ( -5.224 3.593 -3.292) 7.144 2.377 ( 1.202 1.798 6.679) 7.020 2.509 ( -4.223 -0.037 -5.707) 7.099 2.812 ( 8.735 2.517 2.417) 9.406 2.983 ( 4.611 0.229 -0.847) 4.693 3.444 ( 1.719 -2.467 0.708) 3.089 3.629 ( -0.033 -2.948 -2.223) 3.692 3.914 ( -0.345 0.931 1.544) 1.836 4.086 ( -3.056 3.873 3.170) 5.864 4.190 ( -2.163 0.096 -0.757) 2.294 4.288 ( 1.914 10.646 -0.306) 10.821 4.493 ( -8.968 -1.384 1.193) 9.152 4.637 ( -5.963 2.769 4.304) 7.858 4.755 ( -3.316 2.357 -0.337) 4.082 4.767 ( -2.436 0.867 -4.275) 4.996 4.930 ( -3.075 2.819 -3.282) 5.308 5.032 ( -2.583 -8.091 0.333) 8.500 5.257 ( -1.946 8.733 1.646) 9.097 5.481 ( -2.462 -9.147 1.386) 9.574 5.628 ( 4.512 2.196 1.059) 5.129 5.708 ( 3.683 -5.342 -1.642) 6.693 5.917 ( 1.004 5.345 0.508) 5.462 6.087 ( 1.753 -4.714 -0.354) 5.041 6.118 ( -1.643 -0.212 -0.352) 1.693 6.121 ( -0.938 1.508 1.015) 2.045 6.269 ( -2.495 -5.178 2.549) 6.288 6.482 ( -1.946 -0.252 -3.090) 3.661 6.560 ( -0.780 -0.471 -5.682) 5.755 6.631 ( 2.201 -0.662 0.934) 2.481 6.726 ( 2.891 -0.050 6.722) 7.318 6.771 ( 2.306 -2.012 3.302) 4.502 6.884 ( -3.878 -1.944 0.916) 4.434 7.005 ( 1.194 0.586 -0.531) 1.432 7.061 ( -0.282 -3.053 -3.170) 4.410 7.156 ( 1.223 -1.779 -7.894) 8.184 7.321 ( 13.597 5.061 -1.416) 14.578 7.685 ( -4.612 -2.761 -0.447) 5.394 7.749 ( -1.482 -4.201 -0.263) 4.463 7.942 ( 16.197 -4.670 -0.067) 16.857 8.046 ( -6.178 -6.054 8.596) 12.195 8.737 ( -8.932 10.356 0.164) 13.677 8.843 ( -12.689 10.002 0.041) 16.157 9.099 ( -1.762 -1.438 -1.797) 2.899 9.321 ( -5.622 5.755 1.742) 8.232 9.358 ( 4.530 -2.063 -3.664) 6.181 9.842 ( 4.871 0.030 1.933) 5.240 10.322 ( -12.201 14.486 0.311) 18.942 10.534 ( -21.183 9.518 -3.570) 23.496 10.811 ( 0.994 1.640 -15.863) 15.978 11.010 ( 3.244 -1.590 -6.045) 7.042 11.101 ( 1.616 -10.260 0.764) 10.414 11.536 ( 5.819 7.063 10.204) 13.706 11.670 ( 6.972 -5.523 9.151) 12.761 12.226 ( -1.355 0.638 0.121) 1.503 12.268 ( 0.883 -3.585 -1.586) 4.019 12.374 ( 5.766 -2.495 2.659) 6.823 12.417 ( 0.632 0.498 -14.439) 14.461 12.556 ( 6.570 -5.489 2.157) 8.829 12.791 ( 1.267 2.526 0.017) 2.827 12.911 ( -4.834 -2.367 -1.014) 5.477 13.143 ( -3.068 -13.899 -3.847) 14.744 13.153 ( -0.430 -4.826 0.246) 4.851 13.484 ( 11.379 -2.395 4.556) 12.489 14.787 ( -4.154 2.174 -0.826) 4.760 15.056 ( -0.240 0.343 -0.587) 0.721 15.139 ( 0.052 -0.897 -0.615) 1.089 15.550 ( 3.526 7.903 -6.571) 10.866 ======================= Grid point 2 (3/141) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.852 ( 20.121 -5.761 6.881) 22.032 1.051 ( 20.477 -12.669 0.703) 24.089 1.548 ( 6.533 -3.791 -0.938) 7.611 1.802 ( 33.275 -20.640 5.640) 39.561 2.035 ( 17.715 -13.996 -1.648) 22.637 2.131 ( -1.203 3.832 -4.681) 6.168 2.391 ( -0.561 -0.058 1.154) 1.285 2.437 ( -1.225 -1.290 -1.194) 2.143 2.922 ( 8.609 5.281 -0.412) 10.108 3.086 ( 6.178 -0.192 -0.193) 6.184 3.490 ( -0.036 -1.845 1.082) 2.139 3.661 ( -0.131 -4.171 -2.343) 4.786 3.857 ( -4.456 2.222 0.870) 5.055 4.069 ( 1.946 0.284 3.680) 4.172 4.126 ( -4.942 1.258 1.342) 5.273 4.178 ( -4.564 4.807 -2.981) 7.269 4.324 ( -10.528 -0.698 -1.230) 10.622 4.460 ( -9.245 5.163 3.985) 11.314 4.620 ( -7.130 4.250 0.133) 8.302 4.776 ( 1.926 -3.010 -5.546) 6.598 4.801 ( -6.765 5.038 -1.626) 8.590 5.007 ( -8.489 -5.343 -0.221) 10.033 5.138 ( -1.347 8.628 1.616) 8.881 5.523 ( -2.180 -8.220 -0.320) 8.510 5.680 ( 3.608 5.630 2.943) 7.306 5.829 ( 1.836 -0.546 -0.706) 2.041 5.926 ( 7.751 -0.101 -0.567) 7.772 6.094 ( -2.299 -1.844 1.530) 3.321 6.101 ( -0.728 -0.950 -1.340) 1.797 6.169 ( 3.509 -2.287 0.411) 4.208 6.271 ( -1.355 -1.175 4.776) 5.101 6.430 ( -4.192 -2.146 -5.867) 7.523 6.574 ( 2.368 -2.282 -5.889) 6.745 6.652 ( -0.983 1.484 3.117) 3.590 6.761 ( -0.806 -2.562 2.032) 3.367 6.847 ( 2.670 -2.062 6.111) 6.980 6.942 ( 6.367 -2.905 -2.805) 7.540 7.032 ( 0.390 -3.461 1.832) 3.935 7.065 ( -3.236 -5.341 -3.377) 7.099 7.189 ( 3.857 1.344 -2.434) 4.755 7.377 ( -1.454 2.541 -2.244) 3.689 7.629 ( -6.190 -5.606 -1.612) 8.505 7.736 ( -4.258 -3.258 -1.366) 5.532 7.949 ( -7.548 -0.644 9.779) 12.370 8.332 ( 7.965 2.587 1.965) 8.602 8.490 ( -5.668 15.962 -0.121) 16.939 8.602 ( 5.595 1.718 -1.248) 5.985 9.014 ( -7.183 5.077 -1.344) 8.899 9.095 ( -11.725 1.880 0.234) 11.877 9.418 ( 1.540 2.901 -2.556) 4.161 9.879 ( -1.351 11.491 1.241) 11.636 10.022 ( 0.113 9.987 1.602) 10.116 10.166 ( -12.817 2.704 -1.673) 13.205 10.784 ( 0.006 -1.759 -10.280) 10.430 11.040 ( 1.644 0.200 -3.971) 4.303 11.192 ( -0.835 -7.236 -1.519) 7.441 11.589 ( 6.697 9.114 7.218) 13.417 11.802 ( 3.095 -1.244 2.708) 4.296 12.177 ( -2.702 1.486 -0.040) 3.084 12.292 ( -3.123 -1.779 -2.743) 4.522 12.416 ( 2.365 -2.590 -4.075) 5.377 12.490 ( 4.290 1.792 1.030) 4.762 12.718 ( 1.172 -3.301 1.737) 3.909 12.782 ( 4.276 -6.900 0.815) 8.158 12.946 ( 1.379 -6.270 2.185) 6.782 13.218 ( 2.083 -4.500 2.970) 5.780 13.242 ( 3.084 -7.033 -2.508) 8.079 13.736 ( 12.411 -3.733 3.585) 13.447 14.645 ( -8.293 4.799 0.417) 9.591 15.041 ( -0.765 0.549 -1.514) 1.783 15.161 ( 1.238 -2.158 -1.135) 2.734 15.499 ( -0.509 4.319 -4.456) 6.226 ======================= Grid point 3 (4/141) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.240 ( 15.921 -6.005 5.419) 17.858 1.481 ( 17.604 -9.199 -1.246) 19.902 1.638 ( 1.896 -0.259 -1.152) 2.234 2.104 ( 2.274 -0.373 -0.542) 2.367 2.276 ( 0.846 -4.110 -5.312) 6.770 2.446 ( 2.473 -0.529 2.481) 3.542 2.475 ( 21.388 -14.730 2.485) 26.088 2.572 ( 12.971 -10.646 1.553) 16.852 3.020 ( 8.406 3.809 -0.769) 9.261 3.145 ( 2.133 1.536 -1.171) 2.878 3.469 ( -2.492 1.788 -0.677) 3.141 3.679 ( -1.767 -3.542 -1.505) 4.235 3.765 ( -3.818 2.718 2.712) 5.415 3.982 ( -9.592 3.125 1.094) 10.148 4.003 ( -6.435 3.941 2.502) 7.949 4.122 ( -1.473 -2.540 -0.456) 2.971 4.230 ( -3.206 -0.203 -2.241) 3.917 4.296 ( -4.103 3.972 0.952) 5.789 4.487 ( -3.743 1.466 -0.884) 4.116 4.628 ( -6.558 2.190 1.212) 7.019 4.819 ( -3.170 -1.190 -2.375) 4.136 4.902 ( -2.886 -4.656 -3.481) 6.491 5.056 ( -1.166 5.757 1.042) 5.965 5.514 ( -4.544 1.718 0.383) 4.873 5.672 ( 0.608 0.126 0.128) 0.634 5.847 ( 2.316 1.200 1.050) 2.812 6.043 ( -1.695 -1.130 1.817) 2.730 6.064 ( 0.919 1.097 -0.355) 1.475 6.124 ( -0.150 -4.124 1.864) 4.528 6.259 ( 4.890 -0.820 -1.149) 5.090 6.303 ( 1.203 -4.162 2.330) 4.919 6.344 ( -6.765 -2.985 -4.995) 8.924 6.606 ( -0.631 1.042 -0.848) 1.485 6.630 ( 1.727 -1.129 0.053) 2.064 6.769 ( -1.932 -2.785 -0.703) 3.462 6.916 ( 1.198 -0.707 5.413) 5.588 7.027 ( -3.210 -1.925 -2.323) 4.405 7.072 ( 4.261 -1.285 -2.573) 5.141 7.129 ( 6.222 -5.882 -0.007) 8.562 7.187 ( -8.148 -3.579 1.366) 9.003 7.281 ( -3.440 0.804 -1.529) 3.849 7.584 ( -3.931 -3.172 -1.915) 5.402 7.666 ( -5.674 -2.918 1.900) 6.657 7.880 ( -4.485 -2.621 5.953) 7.901 8.179 ( -8.737 6.877 -3.200) 11.571 8.309 ( 3.897 13.084 -0.825) 13.677 8.808 ( -7.732 5.146 2.197) 9.544 8.868 ( 10.248 11.835 1.112) 15.695 8.912 ( -3.334 -4.042 -1.351) 5.411 9.353 ( -1.099 7.771 -3.203) 8.477 9.678 ( -4.568 7.356 -0.495) 8.673 9.920 ( -1.481 15.591 0.944) 15.690 10.190 ( 7.830 -8.005 1.378) 11.282 10.768 ( -1.334 -1.362 -6.358) 6.638 11.046 ( 0.962 1.161 -2.716) 3.106 11.220 ( -1.612 -4.033 -0.400) 4.361 11.629 ( 6.449 8.504 4.925) 11.754 11.830 ( -0.264 1.076 0.241) 1.134 12.108 ( -2.992 1.841 0.266) 3.523 12.211 ( -6.859 -0.356 -0.940) 6.932 12.431 ( -0.118 -0.596 -0.907) 1.092 12.544 ( 5.884 3.302 -1.245) 6.861 12.803 ( 2.418 -6.877 -0.499) 7.306 12.929 ( 2.169 -6.220 -1.618) 6.783 13.063 ( 2.135 -9.968 7.083) 12.414 13.303 ( 0.695 -4.730 4.998) 6.916 13.374 ( 7.468 -2.431 -2.548) 8.257 13.956 ( 7.179 -4.065 -4.412) 9.356 14.447 ( -7.617 6.336 7.189) 12.241 15.003 ( -2.274 1.058 -3.131) 4.012 15.215 ( 2.490 -2.781 -1.696) 4.100 15.432 ( -1.732 2.879 -2.132) 3.980 ======================= Grid point 4 (5/141) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.500 ( 7.263 -3.435 2.809) 8.511 1.637 ( -0.329 0.607 -1.185) 1.371 1.823 ( 14.113 -6.021 -1.883) 15.458 2.177 ( 4.272 -0.633 1.692) 4.639 2.298 ( -1.035 -2.790 -1.067) 3.161 2.485 ( 2.020 -0.554 -0.201) 2.104 2.806 ( 6.301 -3.866 -1.215) 7.492 2.819 ( 3.161 -5.087 1.002) 6.072 3.068 ( 4.390 2.869 2.298) 5.726 3.221 ( 2.201 -5.364 -2.238) 6.215 3.393 ( -1.697 4.419 -1.116) 4.863 3.632 ( -0.411 2.490 -0.629) 2.601 3.732 ( -0.812 -0.703 4.035) 4.176 3.831 ( -6.876 -1.597 0.224) 7.062 3.896 ( -3.233 1.522 2.043) 4.116 4.048 ( -6.180 3.671 -3.510) 7.999 4.203 ( -0.042 -1.396 3.437) 3.710 4.244 ( 2.104 2.231 -1.092) 3.256 4.383 ( -5.673 1.377 -1.516) 6.032 4.664 ( 3.556 -5.946 -0.792) 6.973 4.680 ( -6.161 1.539 0.467) 6.367 4.969 ( -2.856 2.869 3.200) 5.160 5.009 ( 4.649 -6.043 -7.246) 10.518 5.366 ( -5.792 8.590 2.726) 10.713 5.704 ( 1.016 -2.736 -0.362) 2.941 5.876 ( 1.280 0.229 0.676) 1.465 5.951 ( -6.708 0.125 -1.708) 6.923 6.070 ( -0.139 0.468 -1.278) 1.368 6.139 ( -2.540 -1.474 3.205) 4.347 6.264 ( -2.869 -2.222 -0.737) 3.703 6.312 ( 1.030 0.639 -1.400) 1.852 6.393 ( 2.579 -3.702 1.164) 4.660 6.622 ( 2.308 -2.184 0.618) 3.237 6.673 ( 1.379 -0.945 0.894) 1.895 6.743 ( -2.539 -1.099 -1.533) 3.163 6.901 ( -4.295 3.743 -0.244) 5.703 6.976 ( -0.123 1.473 2.085) 2.556 7.061 ( -6.329 -4.786 -1.126) 8.015 7.105 ( -2.578 1.398 -0.677) 3.010 7.249 ( -0.455 -2.358 2.228) 3.275 7.315 ( 8.456 -3.831 -4.382) 10.265 7.526 ( -2.769 2.053 3.922) 5.221 7.688 ( -1.161 -10.598 -0.304) 10.666 7.859 ( -2.449 -0.671 2.319) 3.439 8.034 ( -1.516 3.848 -1.572) 4.425 8.286 ( 5.152 8.496 -1.696) 10.080 8.660 ( -4.939 2.819 2.627) 6.265 8.736 ( -5.272 0.781 -4.024) 6.677 9.016 ( 5.237 7.082 1.551) 8.943 9.255 ( 0.183 6.569 -2.172) 6.921 9.603 ( -2.031 -2.764 -1.186) 3.629 9.764 ( -0.066 13.751 1.942) 13.888 10.411 ( 8.362 -5.161 3.707) 10.503 10.720 ( -2.823 0.784 -5.254) 6.016 11.035 ( -0.305 0.737 -1.377) 1.591 11.225 ( -1.048 -1.945 0.114) 2.212 11.678 ( 6.115 6.497 6.094) 10.805 11.788 ( -1.984 0.797 -4.726) 5.188 12.045 ( -1.730 4.085 -2.486) 5.085 12.097 ( -6.845 -3.074 3.232) 8.171 12.450 ( 1.433 -0.313 0.078) 1.469 12.605 ( 4.278 2.070 -0.744) 4.811 12.882 ( 1.072 -4.287 -3.035) 5.360 12.977 ( -1.618 -3.906 1.394) 4.452 13.242 ( 3.727 -10.233 7.376) 13.153 13.360 ( 1.746 -0.190 4.840) 5.148 13.488 ( 3.863 -1.508 -5.973) 7.271 13.956 ( -4.894 1.237 -8.596) 9.969 14.407 ( 3.396 1.093 11.086) 11.646 14.924 ( -3.763 1.788 -4.095) 5.842 15.276 ( 2.275 -2.018 -1.974) 3.625 15.382 ( -1.356 1.458 0.444) 2.040 ======================= Grid point 5 (6/141) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.578 ( 0.000 -0.000 0.000) 0.000 1.627 ( -0.000 -0.000 0.000) 0.000 2.000 ( 0.000 -0.000 0.000) 0.000 2.225 ( 0.000 -0.000 0.000) 0.000 2.288 ( 0.000 0.000 0.000) 0.000 2.512 ( 0.000 -0.000 0.000) 0.000 2.825 ( -0.000 0.000 -0.000) 0.000 2.862 ( 0.000 -0.000 0.000) 0.000 3.155 ( 0.000 -0.000 0.000) 0.000 3.225 ( -0.000 -0.000 0.000) 0.000 3.333 ( 0.000 0.000 0.000) 0.000 3.668 ( 0.000 -0.000 0.000) 0.000 3.729 ( -0.000 -0.000 -0.000) 0.000 3.780 ( 0.000 -0.000 0.000) 0.000 3.876 ( 0.000 -0.000 0.000) 0.000 3.935 ( -0.000 -0.000 -0.000) 0.000 4.212 ( 0.000 -0.000 -0.000) 0.000 4.272 ( 0.000 -0.000 0.000) 0.000 4.329 ( 0.000 -0.000 0.000) 0.000 4.583 ( 0.000 -0.000 -0.000) 0.000 4.790 ( 0.000 -0.000 0.000) 0.000 4.890 ( 0.000 -0.000 0.000) 0.000 5.123 ( -0.000 0.000 0.000) 0.000 5.230 ( 0.000 -0.000 -0.000) 0.000 5.737 ( 0.000 -0.000 0.000) 0.000 5.870 ( 0.000 -0.000 -0.000) 0.000 5.887 ( 0.000 0.000 0.000) 0.000 6.061 ( 0.000 -0.000 0.000) 0.000 6.123 ( 0.000 -0.000 0.000) 0.000 6.262 ( 0.000 -0.000 0.000) 0.000 6.302 ( 0.000 -0.000 -0.000) 0.000 6.439 ( 0.000 -0.000 0.000) 0.000 6.677 ( 0.000 -0.000 -0.000) 0.000 6.708 ( -0.000 0.000 -0.000) 0.000 6.714 ( 0.000 -0.000 0.000) 0.000 6.800 ( 0.000 -0.000 0.000) 0.000 6.988 ( 0.000 -0.000 -0.000) 0.000 7.034 ( 0.000 -0.000 0.000) 0.000 7.049 ( 0.000 -0.000 0.000) 0.000 7.268 ( 0.000 -0.000 0.000) 0.000 7.425 ( 0.000 -0.000 -0.000) 0.000 7.485 ( 0.000 0.000 0.000) 0.000 7.780 ( -0.000 0.000 -0.000) 0.000 7.804 ( 0.000 -0.000 0.000) 0.000 8.006 ( 0.000 -0.000 -0.000) 0.000 8.287 ( 0.000 -0.000 0.000) 0.000 8.619 ( 0.000 0.000 0.000) 0.000 8.673 ( 0.000 0.000 0.000) 0.000 9.008 ( 0.000 -0.000 0.000) 0.000 9.226 ( -0.000 -0.000 0.000) 0.000 9.617 ( 0.000 -0.000 0.000) 0.000 9.683 ( 0.000 0.000 0.000) 0.000 10.548 ( -0.000 0.000 -0.000) 0.000 10.652 ( 0.000 -0.000 0.000) 0.000 11.024 ( 0.000 -0.000 0.000) 0.000 11.226 ( 0.000 -0.000 0.000) 0.000 11.730 ( 0.000 0.000 0.000) 0.000 11.742 ( -0.000 -0.000 -0.000) 0.000 11.986 ( 0.000 0.000 0.000) 0.000 12.068 ( -0.000 -0.000 0.000) 0.000 12.467 ( 0.000 -0.000 0.000) 0.000 12.631 ( 0.000 0.000 0.000) 0.000 12.914 ( -0.000 -0.000 0.000) 0.000 12.976 ( 0.000 -0.000 -0.000) 0.000 13.352 ( 0.000 0.000 0.000) 0.000 13.410 ( 0.000 -0.000 0.000) 0.000 13.487 ( 0.000 -0.000 -0.000) 0.000 13.873 ( 0.000 -0.000 0.000) 0.000 14.472 ( 0.000 -0.000 0.000) 0.000 14.862 ( 0.000 -0.000 0.000) 0.000 15.307 ( -0.000 0.000 0.000) 0.000 15.362 ( 0.000 -0.000 -0.000) 0.000 ======================= Grid point 12 (7/141) ======================= q-point: ( 0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.811 ( 22.344 -0.000 7.565) 23.590 0.901 ( 24.053 -0.000 6.407) 24.891 1.501 ( 12.592 -0.000 -3.088) 12.966 1.592 ( 38.703 -0.000 3.147) 38.830 1.877 ( 15.773 -0.000 2.228) 15.929 2.170 ( 0.295 -0.000 -8.438) 8.443 2.412 ( -4.391 0.000 -5.854) 7.318 2.414 ( 0.124 -0.000 7.149) 7.150 3.002 ( 9.978 -0.000 0.989) 10.027 3.068 ( 6.023 -0.000 -1.564) 6.223 3.471 ( 1.744 -0.000 2.240) 2.839 3.607 ( -0.025 0.000 -3.177) 3.177 3.893 ( -3.286 0.000 -0.044) 3.286 4.078 ( -0.093 0.000 3.899) 3.900 4.103 ( -6.474 0.000 -1.224) 6.589 4.269 ( -7.502 0.000 2.236) 7.828 4.306 ( -10.923 0.000 -2.816) 11.280 4.515 ( -10.438 0.000 4.532) 11.380 4.661 ( -8.161 0.000 0.215) 8.164 4.744 ( 1.005 -0.000 -4.795) 4.900 4.887 ( -6.951 0.000 -2.110) 7.264 4.897 ( -5.981 0.000 -1.216) 6.104 5.287 ( -2.258 0.000 3.659) 4.300 5.380 ( -1.287 0.000 -0.744) 1.486 5.743 ( 3.850 -0.000 5.821) 6.979 5.798 ( 9.062 -0.000 -4.555) 10.143 5.961 ( 1.270 -0.000 -1.909) 2.293 6.050 ( -2.465 0.000 0.135) 2.469 6.098 ( -0.584 0.000 -1.622) 1.724 6.151 ( 2.669 -0.000 2.333) 3.545 6.245 ( 0.120 -0.000 4.715) 4.716 6.412 ( -4.400 0.000 -5.239) 6.842 6.515 ( -1.422 0.000 -3.442) 3.724 6.659 ( 1.619 -0.000 -2.070) 2.628 6.746 ( -2.930 0.000 5.779) 6.479 6.815 ( 3.174 -0.000 3.978) 5.089 6.907 ( 6.649 -0.000 -1.032) 6.729 6.981 ( -2.391 0.000 2.620) 3.547 7.035 ( 0.651 -0.000 -3.970) 4.023 7.222 ( 5.496 -0.000 -5.660) 7.889 7.402 ( -7.291 0.000 -0.483) 7.308 7.541 ( -8.568 0.000 -0.642) 8.592 7.683 ( 1.591 -0.000 -4.367) 4.648 7.943 ( -7.210 0.000 11.533) 13.601 8.390 ( 30.246 -0.000 2.711) 30.367 8.607 ( -16.617 0.000 -2.324) 16.779 8.665 ( -6.527 0.000 -0.516) 6.547 9.085 ( -0.740 0.000 1.857) 1.999 9.101 ( -15.874 0.000 0.340) 15.878 9.441 ( 2.429 -0.000 -1.859) 3.059 10.001 ( 10.274 -0.000 3.186) 10.757 10.153 ( -22.141 0.000 -1.834) 22.217 10.242 ( -5.084 0.000 1.037) 5.189 10.773 ( 0.298 -0.000 -31.209) 31.210 11.037 ( 0.136 -0.000 4.221) 4.223 11.063 ( 5.085 -0.000 -8.142) 9.599 11.720 ( 0.908 -0.000 27.355) 27.370 11.766 ( 6.532 -0.000 -4.615) 7.998 12.209 ( -4.645 0.000 6.512) 7.999 12.283 ( 3.305 -0.000 -2.848) 4.363 12.375 ( 1.301 -0.000 -12.314) 12.383 12.499 ( 7.719 -0.000 1.498) 7.863 12.660 ( 6.759 -0.000 4.614) 8.184 12.740 ( -7.815 0.000 0.624) 7.840 12.892 ( 3.477 -0.000 -1.058) 3.635 13.070 ( 1.761 -0.000 4.325) 4.670 13.231 ( 8.638 -0.000 -2.505) 8.994 13.698 ( 12.483 -0.000 4.009) 13.111 14.690 ( -8.230 0.000 0.197) 8.232 15.048 ( -0.722 0.000 -1.047) 1.271 15.137 ( 0.906 -0.000 -1.017) 1.362 15.548 ( -2.686 0.000 -6.621) 7.145 ======================= Grid point 13 (8/141) ======================= q-point: ( 0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.196 ( 20.205 0.473 6.831) 21.334 1.330 ( 20.696 -5.314 4.109) 21.758 1.669 ( 8.999 2.707 -3.807) 10.139 1.983 ( -2.236 -7.487 -2.045) 8.077 2.236 ( 28.750 -7.138 2.190) 29.704 2.276 ( 4.835 1.337 -7.451) 8.983 2.435 ( 12.615 -3.202 0.446) 13.022 2.439 ( 0.843 -0.302 5.400) 5.473 3.110 ( 6.657 4.372 -1.203) 8.054 3.166 ( 3.082 -0.072 -0.982) 3.236 3.491 ( -0.081 0.714 1.878) 2.011 3.599 ( -2.064 -3.467 -3.223) 5.164 3.817 ( -3.139 2.749 1.175) 4.335 4.005 ( -6.610 -2.823 0.434) 7.201 4.042 ( -9.765 1.972 2.085) 10.178 4.122 ( -6.567 1.785 0.799) 6.852 4.190 ( 1.078 -1.931 -2.893) 3.641 4.359 ( -7.103 1.894 2.942) 7.918 4.517 ( -6.606 0.817 -0.707) 6.694 4.697 ( -9.798 4.142 0.428) 10.646 4.766 ( -2.589 -2.648 -0.400) 3.725 4.807 ( -4.110 -4.338 -5.924) 8.414 5.217 ( -0.401 8.538 2.231) 8.834 5.417 ( -0.914 -7.482 0.765) 7.576 5.773 ( -0.356 5.763 2.751) 6.396 5.859 ( 0.508 -0.645 1.115) 1.384 6.015 ( -1.463 -0.938 -0.775) 1.903 6.037 ( 4.647 -2.714 -2.523) 5.944 6.081 ( -0.747 -0.279 -3.069) 3.171 6.223 ( 3.034 -1.814 3.767) 5.166 6.250 ( -0.796 -1.195 2.885) 3.222 6.314 ( -5.233 -0.355 -1.869) 5.568 6.534 ( 0.334 -6.891 -2.532) 7.349 6.645 ( -1.596 1.666 -1.984) 3.043 6.706 ( -2.627 -1.450 -0.401) 3.028 6.885 ( 1.191 -1.293 4.310) 4.655 6.938 ( -3.385 -2.397 2.223) 4.706 7.049 ( 7.035 -0.853 -2.464) 7.502 7.064 ( 3.805 -1.829 -1.039) 4.348 7.210 ( -6.503 3.452 -0.170) 7.364 7.277 ( -3.929 -1.303 -1.151) 4.296 7.440 ( -2.977 -5.200 -4.777) 7.663 7.711 ( 1.129 1.850 -1.354) 2.555 7.834 ( -9.009 -1.408 10.930) 14.234 8.307 ( -11.905 5.365 -2.367) 13.271 8.507 ( -3.242 4.855 -1.681) 6.076 8.748 ( -2.126 -3.121 0.883) 3.878 8.870 ( -11.243 -0.999 -1.499) 11.386 9.154 ( 15.922 11.147 4.919) 20.050 9.445 ( -1.182 -0.434 -0.143) 1.267 9.858 ( -8.815 2.723 -2.882) 9.666 10.101 ( 3.939 11.646 0.940) 12.330 10.220 ( 7.570 3.756 0.012) 8.451 10.703 ( -1.729 -4.356 -17.335) 17.958 11.084 ( 0.297 -1.771 2.491) 3.071 11.108 ( 2.307 -1.634 -4.705) 5.489 11.763 ( 1.842 4.680 10.769) 11.886 11.831 ( 0.409 -1.246 1.384) 1.907 12.123 ( -7.208 -0.676 7.137) 10.166 12.258 ( -1.745 5.059 -5.074) 7.375 12.402 ( 1.010 -2.166 -6.350) 6.785 12.610 ( 6.525 2.092 -1.710) 7.062 12.689 ( 1.217 -3.252 2.873) 4.507 12.806 ( 5.499 -5.405 -0.344) 7.718 12.938 ( 1.104 -2.158 5.340) 5.864 13.146 ( 0.619 -6.515 5.262) 8.398 13.402 ( 12.320 1.634 -1.926) 12.576 13.891 ( 7.640 -2.019 -2.571) 8.310 14.530 ( -9.165 2.106 6.022) 11.167 15.020 ( -2.053 0.544 -2.071) 2.966 15.171 ( 2.792 -1.322 -1.640) 3.497 15.471 ( -3.282 0.965 -4.787) 5.884 ======================= Grid point 14 (9/141) ======================= q-point: ( 0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.495 ( 13.652 2.414 5.879) 15.058 1.701 ( 2.564 5.584 -2.161) 6.514 1.710 ( 16.709 -5.008 0.800) 17.462 2.071 ( 2.549 -9.320 -3.495) 10.275 2.294 ( 2.886 1.295 -2.186) 3.845 2.470 ( 1.408 -0.893 3.451) 3.833 2.681 ( 13.636 -7.149 -1.552) 15.475 2.713 ( 10.087 -4.865 2.528) 11.481 3.135 ( -2.322 2.857 -0.771) 3.762 3.155 ( 0.543 -0.054 -0.656) 0.853 3.456 ( -2.593 2.173 -1.535) 3.715 3.590 ( -2.463 -3.775 -0.819) 4.581 3.750 ( -3.622 0.380 0.075) 3.643 3.866 ( -4.440 4.365 2.303) 6.639 3.912 ( -5.846 0.063 2.622) 6.407 4.053 ( -2.360 -2.448 -0.861) 3.508 4.201 ( -2.091 0.464 0.735) 2.264 4.285 ( 0.056 1.352 -0.363) 1.401 4.433 ( -4.792 3.336 -3.229) 6.672 4.573 ( 1.748 -2.676 0.339) 3.214 4.652 ( -9.954 -3.504 1.148) 10.615 4.875 ( 4.325 -4.155 -4.085) 7.257 5.133 ( 0.516 9.172 0.373) 9.194 5.457 ( -1.823 -1.921 2.726) 3.801 5.692 ( -1.230 3.836 0.420) 4.050 5.866 ( -2.398 -1.846 0.310) 3.042 5.968 ( -2.362 1.666 0.246) 2.901 6.061 ( -1.051 -1.163 -4.224) 4.505 6.086 ( -1.804 -3.189 0.002) 3.664 6.234 ( -1.708 -0.718 1.850) 2.618 6.308 ( 1.996 -2.266 3.676) 4.758 6.320 ( 3.672 -2.144 0.214) 4.257 6.582 ( -2.253 -4.105 1.153) 4.823 6.630 ( 1.635 -3.276 -3.485) 5.055 6.694 ( -1.497 -4.071 -2.242) 4.882 6.859 ( -5.694 -3.233 3.087) 7.239 6.926 ( -2.273 -1.540 -1.064) 2.944 7.055 ( -4.302 1.926 2.115) 5.166 7.127 ( -3.990 -1.468 -2.190) 4.782 7.172 ( 5.491 -1.638 0.046) 5.730 7.273 ( 6.484 -1.384 -2.546) 7.102 7.494 ( 2.177 -5.923 -4.665) 7.848 7.621 ( -6.595 4.624 9.236) 12.255 7.802 ( -1.268 -3.384 1.944) 4.104 8.113 ( -5.115 3.656 -1.373) 6.435 8.432 ( 0.112 5.267 -2.636) 5.891 8.602 ( -13.990 -4.260 0.740) 14.643 8.722 ( -7.013 -0.411 -1.467) 7.177 9.276 ( 8.964 10.969 2.967) 14.473 9.400 ( -1.459 4.075 -2.141) 4.829 9.713 ( -1.121 13.057 -3.294) 13.513 10.030 ( 2.199 11.528 1.567) 11.840 10.366 ( 10.889 1.583 2.489) 11.281 10.681 ( -2.751 -4.894 -8.837) 10.470 11.066 ( -0.740 2.519 -2.762) 3.810 11.163 ( 0.394 -4.107 3.131) 5.179 11.758 ( -1.182 1.157 -4.004) 4.332 11.817 ( -2.427 2.319 10.379) 10.908 12.037 ( -7.317 -2.904 3.679) 8.690 12.146 ( -1.588 5.716 -2.215) 6.333 12.407 ( -0.179 -1.882 -5.779) 6.080 12.691 ( 5.862 3.627 -0.862) 6.947 12.782 ( 3.128 -4.226 -0.148) 5.260 12.905 ( 2.839 -3.321 -2.416) 4.993 13.057 ( 3.735 -7.487 10.251) 13.232 13.243 ( 1.586 -7.772 4.115) 8.936 13.565 ( 10.501 5.635 -2.827) 12.248 13.941 ( -2.094 -2.271 -9.874) 10.346 14.436 ( -2.023 1.508 13.049) 13.291 14.950 ( -4.258 1.000 -3.811) 5.802 15.239 ( 3.810 -1.580 -2.200) 4.675 15.403 ( -2.517 0.572 -1.728) 3.106 ======================= Grid point 15 (10/141) ======================= q-point: ( 0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.633 ( 5.914 5.306 3.677) 8.755 1.676 ( 1.888 4.691 -1.159) 5.188 1.975 ( 7.163 -2.494 0.617) 7.610 2.180 ( 2.791 -4.836 -3.135) 6.403 2.310 ( 0.535 2.265 0.003) 2.327 2.512 ( 1.494 -0.065 1.076) 1.842 2.820 ( 0.777 -0.582 2.165) 2.373 2.845 ( 2.122 -2.076 -2.295) 3.752 3.121 ( -5.436 -5.024 -0.516) 7.420 3.145 ( 3.357 -3.270 1.290) 4.861 3.353 ( -6.109 0.818 -2.133) 6.523 3.554 ( -7.562 -5.060 0.359) 9.105 3.745 ( 2.870 -2.299 -0.372) 3.696 3.829 ( 3.133 5.092 4.017) 7.203 3.866 ( 0.127 -0.774 -0.885) 1.183 4.000 ( -3.403 3.078 -2.460) 5.206 4.201 ( 0.676 -0.828 3.826) 3.973 4.298 ( 0.884 2.417 -1.748) 3.111 4.335 ( 0.420 0.675 -1.320) 1.540 4.534 ( -6.417 -3.823 0.970) 7.532 4.722 ( 8.012 -3.816 -3.220) 9.440 4.955 ( 0.335 -0.931 1.377) 1.695 5.081 ( 4.332 5.036 -4.271) 7.897 5.384 ( -3.223 8.601 4.387) 10.179 5.702 ( 1.333 -2.974 0.633) 3.319 5.820 ( -2.964 -2.012 -1.225) 3.786 5.953 ( 2.548 3.335 3.399) 5.401 6.036 ( -1.916 -2.558 -5.283) 6.174 6.105 ( 1.701 -1.293 -0.363) 2.167 6.232 ( -1.126 -1.801 4.396) 4.882 6.328 ( 0.225 1.461 -0.372) 1.524 6.411 ( 3.070 -2.302 1.649) 4.176 6.620 ( 0.706 -4.383 -1.128) 4.581 6.673 ( 0.447 -4.980 -2.165) 5.449 6.704 ( 0.560 0.592 1.700) 1.885 6.820 ( -5.378 -2.057 2.143) 6.144 6.886 ( -2.192 -7.638 -6.129) 10.035 7.027 ( 1.496 1.764 2.543) 3.437 7.050 ( -4.183 -0.498 -0.633) 4.260 7.253 ( 2.255 -1.254 -2.059) 3.301 7.418 ( 5.711 -0.960 -0.729) 5.836 7.510 ( -5.613 -3.110 10.515) 12.318 7.582 ( 2.266 -4.330 -3.153) 5.816 7.821 ( -0.256 -1.610 -0.199) 1.642 8.034 ( -1.609 1.609 -1.385) 2.664 8.321 ( -7.759 1.759 -1.716) 8.139 8.493 ( -6.275 -7.416 0.108) 9.715 8.637 ( -2.635 -0.492 0.942) 2.842 9.283 ( 4.422 12.007 1.723) 12.911 9.318 ( -0.796 7.067 -3.436) 7.899 9.559 ( -2.697 6.526 -2.892) 7.631 9.940 ( 3.109 16.901 1.347) 17.237 10.533 ( 6.669 -1.160 5.588) 8.778 10.632 ( -4.574 -2.157 -6.544) 8.271 11.024 ( -1.011 0.281 -2.156) 2.397 11.214 ( 1.199 -1.384 4.355) 4.724 11.659 ( -9.238 -4.778 -8.914) 13.698 11.790 ( -2.385 2.393 11.839) 12.312 11.964 ( -2.449 -1.017 1.504) 3.048 12.119 ( 3.432 3.731 -1.145) 5.197 12.397 ( -2.509 -4.156 -6.154) 7.838 12.708 ( 0.876 4.639 1.690) 5.015 12.870 ( 3.017 -3.313 -1.094) 4.612 12.987 ( 5.605 0.942 -0.425) 5.699 13.202 ( 1.058 -7.845 5.118) 9.426 13.397 ( 5.858 -7.312 4.131) 10.239 13.584 ( 2.106 9.565 -5.422) 11.194 13.885 ( -1.262 0.521 -3.034) 3.327 14.463 ( -0.525 -0.873 6.805) 6.880 14.858 ( -3.468 -0.257 -3.025) 4.609 15.303 ( 2.843 -0.291 -1.690) 3.321 15.365 ( -1.438 0.122 0.125) 1.449 ======================= Grid point 16 (11/141) ======================= q-point: (-0.50 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.624 ( -0.178 8.561 1.404) 8.677 1.670 ( 2.440 3.739 0.309) 4.476 1.939 ( -8.904 5.355 2.471) 10.680 2.160 ( -6.452 -0.736 -5.187) 8.311 2.352 ( 5.807 1.421 1.301) 6.118 2.499 ( -2.655 1.196 0.634) 2.980 2.843 ( -1.406 0.807 0.075) 1.623 2.871 ( 3.670 0.104 2.565) 4.479 3.033 ( -8.181 -1.166 -5.239) 9.785 3.252 ( -0.921 -5.083 1.807) 5.472 3.309 ( 1.061 -2.475 2.991) 4.024 3.484 ( -4.816 -9.519 -2.870) 11.048 3.796 ( 0.821 2.101 2.084) 3.071 3.881 ( 1.448 1.988 -5.346) 5.885 3.886 ( 4.494 2.084 1.627) 5.214 3.968 ( 5.176 -3.020 1.072) 6.088 4.209 ( -0.208 0.559 0.269) 0.654 4.260 ( -2.248 2.640 -0.750) 3.548 4.369 ( 4.201 -0.197 -0.925) 4.306 4.568 ( 2.300 -7.401 2.613) 8.179 4.800 ( -0.879 5.359 -1.556) 5.649 4.944 ( 4.355 1.819 -1.176) 4.864 5.157 ( 2.763 1.366 -1.221) 3.315 5.258 ( -0.250 4.369 2.796) 5.193 5.725 ( -0.639 -0.752 0.309) 1.034 5.861 ( 3.137 -1.984 1.429) 3.977 5.961 ( -0.574 -0.063 1.403) 1.517 6.045 ( 1.854 -0.869 -1.351) 2.453 6.155 ( 3.619 0.597 -3.758) 5.251 6.260 ( 0.494 -2.274 4.698) 5.242 6.333 ( 3.588 1.987 -1.315) 4.307 6.441 ( -1.280 1.413 2.336) 3.015 6.634 ( -2.288 -2.710 -3.710) 5.133 6.698 ( -2.640 1.376 1.020) 3.147 6.740 ( 2.959 -1.345 0.433) 3.279 6.803 ( 3.827 -3.746 -0.985) 5.445 6.973 ( 1.113 -8.072 0.488) 8.163 6.987 ( -0.034 -0.242 -3.567) 3.576 7.087 ( 3.391 -2.024 1.997) 4.425 7.265 ( -0.253 -0.820 -4.260) 4.346 7.365 ( -7.398 1.865 7.250) 10.524 7.568 ( 4.031 3.257 3.392) 6.194 7.685 ( -1.182 -15.415 -2.021) 15.592 7.818 ( 1.015 1.210 -2.751) 3.172 7.999 ( -0.687 0.599 -0.721) 1.162 8.203 ( -4.541 -0.016 0.259) 4.548 8.460 ( -8.069 -11.974 -0.116) 14.439 8.662 ( 1.651 -3.217 3.049) 4.730 9.200 ( 5.317 19.490 -3.614) 20.523 9.237 ( -2.361 1.693 1.572) 3.303 9.513 ( -3.736 -8.508 -1.403) 9.397 9.831 ( 4.319 17.360 0.016) 17.889 10.512 ( -4.568 4.083 -3.488) 7.050 10.666 ( 2.835 -4.108 3.904) 6.337 11.021 ( 0.460 -0.969 -1.038) 1.492 11.250 ( 1.056 0.818 3.089) 3.366 11.528 ( -10.503 -8.732 -5.394) 14.685 11.772 ( -1.391 -0.799 7.466) 7.636 11.992 ( 2.821 -1.248 2.342) 3.873 12.159 ( 5.632 3.166 -2.138) 6.806 12.377 ( -3.198 -5.516 -5.189) 8.221 12.647 ( -3.233 3.976 1.690) 5.396 12.934 ( 2.882 0.932 0.351) 3.049 13.053 ( 4.588 4.095 -0.289) 6.156 13.277 ( -0.711 -5.489 -0.351) 5.546 13.417 ( -4.315 5.995 -5.776) 9.376 13.588 ( 5.158 5.386 5.139) 9.057 13.902 ( 3.938 -2.774 3.526) 5.970 14.403 ( -6.926 0.515 -4.847) 8.469 14.871 ( 2.541 -3.604 2.400) 5.020 15.311 ( -1.322 1.399 2.606) 3.240 15.360 ( 0.926 -0.514 -2.936) 3.122 ======================= Grid point 17 (12/141) ======================= q-point: (-0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.434 ( -10.153 13.079 -2.000) 16.677 1.670 ( -10.505 8.540 3.732) 14.043 1.684 ( 0.110 5.436 1.183) 5.564 2.049 ( -6.562 -3.543 -3.419) 8.204 2.388 ( 1.698 6.026 3.749) 7.298 2.449 ( -1.874 -0.262 -0.514) 1.961 2.734 ( -9.602 9.936 -1.033) 13.856 2.773 ( -8.326 7.535 -2.898) 11.597 2.972 ( -4.367 -1.588 -0.196) 4.651 3.137 ( -8.274 0.918 2.329) 8.644 3.409 ( 4.850 -4.579 1.424) 6.820 3.643 ( 8.158 -9.502 -1.403) 12.602 3.753 ( -0.842 3.392 -1.734) 3.901 3.914 ( 3.069 -3.372 -1.071) 4.683 3.957 ( 5.039 0.325 -0.108) 5.051 4.148 ( 8.594 -5.853 0.619) 10.417 4.186 ( -2.143 2.005 -0.791) 3.039 4.226 ( 1.627 -2.135 -0.653) 2.763 4.476 ( 5.972 -1.324 0.991) 6.197 4.637 ( -3.540 0.883 -1.806) 4.071 4.751 ( 4.934 -2.987 3.811) 6.913 5.004 ( 0.743 3.648 -4.181) 5.598 5.058 ( 0.593 6.247 5.359) 8.252 5.384 ( 5.717 -7.629 -0.798) 9.567 5.726 ( 0.614 1.130 1.504) 1.979 5.850 ( -3.202 2.288 1.013) 4.064 6.009 ( 0.039 -4.743 0.328) 4.754 6.056 ( 0.257 0.532 -3.175) 3.229 6.184 ( 3.569 1.927 -5.197) 6.592 6.263 ( -4.573 -0.656 2.673) 5.337 6.379 ( -1.918 3.599 -0.083) 4.079 6.412 ( 5.912 3.112 6.183) 9.103 6.597 ( -0.883 -0.895 -3.840) 4.041 6.647 ( -2.994 0.985 1.411) 3.453 6.796 ( 2.941 0.458 -0.415) 3.005 6.907 ( 1.443 -2.220 -0.809) 2.768 6.973 ( -0.029 -3.246 -0.732) 3.327 7.054 ( -2.164 -2.975 0.353) 3.696 7.210 ( 6.672 -2.676 -0.486) 7.205 7.243 ( -4.448 1.712 4.578) 6.609 7.278 ( 1.811 -0.558 -3.074) 3.611 7.572 ( 0.461 2.969 0.107) 3.006 7.758 ( -4.285 -9.339 2.210) 10.510 7.880 ( 7.222 0.418 -3.642) 8.099 8.034 ( 5.115 -2.960 -1.042) 6.001 8.167 ( 2.010 -0.280 1.132) 2.323 8.489 ( -6.717 -17.633 1.198) 18.908 8.734 ( 0.829 -5.872 0.054) 5.931 9.105 ( 5.102 14.813 -1.997) 15.794 9.241 ( 1.707 -3.559 3.240) 5.107 9.563 ( -4.445 -15.187 0.162) 15.825 9.768 ( 6.080 12.187 -2.120) 13.784 10.377 ( -2.737 8.744 -1.186) 9.239 10.751 ( 2.071 -2.796 2.899) 4.529 11.040 ( 1.348 -0.212 -0.497) 1.452 11.242 ( -2.103 -1.047 -2.656) 3.546 11.465 ( -6.161 -7.729 2.675) 10.240 11.797 ( 0.228 -2.099 2.926) 3.608 12.075 ( 4.176 -1.534 2.998) 5.364 12.234 ( 6.580 1.821 -1.916) 7.091 12.376 ( -1.672 -5.557 -3.073) 6.567 12.551 ( -3.720 3.415 1.374) 5.234 12.925 ( -1.454 4.999 0.480) 5.228 13.045 ( -0.206 5.643 0.797) 5.703 13.261 ( -1.298 6.332 -8.635) 10.787 13.290 ( -3.076 1.078 3.717) 4.944 13.532 ( -1.147 9.358 -1.813) 9.601 14.022 ( -1.995 1.293 9.238) 9.539 14.302 ( 0.993 -7.005 -10.084) 12.318 14.970 ( 3.011 -2.762 3.689) 5.505 15.266 ( -2.551 2.156 2.794) 4.354 15.376 ( 0.457 -2.124 -2.040) 2.980 ======================= Grid point 18 (13/141) ======================= q-point: (-0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.053 ( -16.434 14.192 -3.710) 22.029 1.330 ( -14.592 15.006 3.583) 21.236 1.657 ( 0.068 7.034 -1.734) 7.245 2.009 ( -3.775 -6.471 2.431) 7.876 2.256 ( -16.769 20.157 -2.250) 26.317 2.340 ( -10.548 10.708 -0.681) 15.046 2.443 ( 2.369 8.468 0.761) 8.826 2.507 ( -6.780 7.990 -0.083) 10.479 2.843 ( -7.826 -2.442 0.557) 8.217 3.077 ( -4.145 -0.575 -0.177) 4.188 3.520 ( 3.995 0.158 1.169) 4.165 3.717 ( 0.360 1.487 -0.765) 1.711 3.826 ( 5.589 -2.467 -0.069) 6.110 4.013 ( 1.573 -6.352 1.525) 6.719 4.047 ( 1.059 -3.105 -3.826) 5.040 4.139 ( 0.515 -0.366 -1.089) 1.259 4.328 ( 5.759 -5.862 1.321) 8.323 4.346 ( 8.455 -2.937 -0.119) 8.951 4.527 ( 2.886 -1.969 -1.513) 3.807 4.687 ( 4.725 -6.310 1.355) 7.999 4.863 ( -1.025 4.760 4.728) 6.787 4.938 ( 2.045 -7.378 -0.816) 7.699 5.119 ( 6.371 2.735 -0.388) 6.944 5.526 ( 1.358 -7.696 0.089) 7.815 5.690 ( -1.670 7.007 2.139) 7.514 5.801 ( -0.606 -2.191 -1.307) 2.622 5.953 ( -6.259 0.536 -2.842) 6.895 6.084 ( 1.506 -1.108 -2.418) 3.057 6.159 ( -5.681 1.726 5.166) 7.870 6.216 ( 3.433 2.608 -5.200) 6.755 6.307 ( -1.881 3.493 -0.341) 3.982 6.476 ( 2.358 1.507 5.397) 6.079 6.582 ( -4.406 -0.445 3.399) 5.583 6.613 ( 0.956 -1.803 -2.571) 3.283 6.799 ( -1.832 0.931 -3.124) 3.740 6.892 ( 0.336 2.348 -3.185) 3.971 6.969 ( -5.056 -0.913 3.600) 6.274 7.042 ( -0.777 -1.007 1.267) 1.796 7.186 ( -0.912 1.517 -0.380) 1.810 7.254 ( 0.771 7.675 0.468) 7.728 7.327 ( -0.110 -2.190 2.507) 3.330 7.572 ( -2.857 -9.025 -1.893) 9.654 7.769 ( -2.651 -3.982 0.376) 4.798 7.963 ( 6.016 0.754 -5.855) 8.428 8.228 ( 13.638 -5.223 0.048) 14.604 8.346 ( 14.056 0.936 1.048) 14.126 8.491 ( -11.562 -10.361 1.181) 15.570 8.844 ( 5.825 -10.335 -2.077) 12.044 9.097 ( 4.451 5.286 2.434) 7.326 9.379 ( 7.356 -4.266 2.985) 9.012 9.648 ( -2.691 -14.914 1.207) 15.203 9.793 ( 4.986 -0.787 -4.365) 6.673 10.270 ( 1.385 8.519 1.497) 8.760 10.802 ( 1.276 -0.120 2.469) 2.782 11.074 ( 3.995 2.522 -0.518) 4.753 11.197 ( -3.850 -5.098 -11.361) 13.033 11.462 ( -4.097 -3.764 11.935) 13.168 11.812 ( -0.715 -0.244 -0.527) 0.922 12.168 ( 4.213 -0.351 2.695) 5.013 12.313 ( 3.132 -0.102 1.118) 3.327 12.424 ( 2.453 -3.833 -1.491) 4.788 12.474 ( -1.719 3.306 1.273) 3.937 12.802 ( -5.260 5.305 -0.749) 7.508 12.942 ( -4.806 7.680 2.038) 9.286 13.120 ( -3.251 9.756 -6.663) 12.253 13.249 ( -0.392 3.311 3.821) 5.071 13.425 ( -0.079 7.694 -3.017) 8.264 13.836 ( -11.432 6.185 -1.905) 13.137 14.497 ( 7.977 -10.220 -0.647) 12.981 15.029 ( 1.061 -0.800 2.344) 2.695 15.208 ( -2.128 2.386 1.883) 3.710 15.405 ( -1.053 -4.671 0.252) 4.795 ======================= Grid point 19 (14/141) ======================= q-point: (-0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.619 ( -16.058 14.195 -4.202) 21.841 0.909 ( -15.260 20.123 2.920) 25.423 1.512 ( -8.191 20.518 -4.321) 22.511 1.635 ( -12.460 26.076 -4.247) 29.210 1.896 ( -12.658 18.076 7.028) 23.159 2.134 ( 0.594 -4.907 -2.170) 5.398 2.384 ( -1.748 1.731 -3.601) 4.361 2.521 ( 5.365 1.876 7.234) 9.200 2.755 ( -6.144 -2.045 -1.676) 6.689 2.986 ( -5.198 0.171 -0.540) 5.229 3.531 ( 0.876 5.445 -0.455) 5.534 3.703 ( -0.245 3.360 1.296) 3.610 3.890 ( 0.247 -0.902 -0.541) 1.081 4.021 ( 0.252 -2.849 -2.755) 3.971 4.105 ( -1.023 -7.596 1.403) 7.791 4.183 ( 0.066 -2.634 -0.518) 2.685 4.492 ( 7.790 -0.730 0.458) 7.837 4.522 ( 6.198 -8.179 -2.565) 10.578 4.655 ( 3.981 -7.988 -0.326) 8.931 4.783 ( -2.429 2.766 2.350) 4.368 4.826 ( 2.839 -7.155 3.368) 8.402 5.083 ( 2.635 -9.175 -0.184) 9.547 5.174 ( 3.405 5.732 -0.352) 6.676 5.547 ( -3.230 -5.051 -2.360) 6.443 5.645 ( 2.703 5.517 1.510) 6.327 5.797 ( -6.858 1.984 0.126) 7.141 5.829 ( 0.240 -0.158 -0.326) 0.434 6.098 ( 0.514 -1.471 -0.617) 1.675 6.118 ( 0.049 0.139 0.794) 0.808 6.197 ( 0.039 5.751 -0.674) 5.790 6.291 ( 2.347 -0.961 -2.943) 3.885 6.494 ( -0.836 0.190 1.829) 2.020 6.547 ( -2.037 -2.227 6.662) 7.314 6.624 ( -0.607 -0.639 -1.974) 2.162 6.736 ( -2.599 0.514 -5.235) 5.867 6.850 ( -1.199 5.585 -2.431) 6.208 6.920 ( 0.562 0.233 1.051) 1.215 7.017 ( -2.350 1.219 1.331) 2.963 7.124 ( -2.542 2.494 0.219) 3.568 7.236 ( -11.983 -2.055 3.461) 12.641 7.240 ( 5.210 6.814 2.339) 8.891 7.637 ( -0.322 -7.177 -0.360) 7.194 7.739 ( -5.585 -4.776 -2.353) 7.716 8.059 ( 5.749 -1.244 -4.264) 7.265 8.243 ( -7.076 15.536 -3.148) 17.359 8.550 ( 11.346 -11.473 2.977) 16.408 8.643 ( 16.200 -3.222 0.619) 16.529 9.082 ( 4.823 -11.946 2.173) 13.065 9.107 ( -3.302 -5.349 1.629) 6.494 9.466 ( 2.961 8.087 1.542) 8.749 9.786 ( 1.612 -7.861 -0.322) 8.031 9.961 ( 6.974 -17.130 -4.765) 19.099 10.319 ( 5.012 -8.622 3.352) 10.521 10.821 ( 1.670 1.912 2.198) 3.358 11.042 ( -6.320 1.292 -3.603) 7.389 11.210 ( 8.367 1.787 -18.416) 20.306 11.462 ( -4.478 -2.059 21.606) 22.161 11.769 ( -2.042 3.965 -2.135) 4.945 12.231 ( 3.416 0.528 -1.177) 3.651 12.328 ( -3.288 -0.469 6.278) 7.103 12.435 ( -0.692 4.112 0.925) 4.271 12.463 ( 2.787 5.644 -1.779) 6.541 12.712 ( -2.108 2.472 -0.999) 3.399 12.763 ( -4.539 5.728 1.563) 7.474 12.972 ( -2.288 5.791 -1.827) 6.489 13.237 ( 2.924 5.169 2.446) 6.423 13.363 ( 1.377 6.454 -0.530) 6.621 13.581 ( -8.519 6.881 -3.270) 11.429 14.694 ( 4.385 -7.549 0.643) 8.754 15.048 ( 0.194 -0.394 0.914) 1.014 15.167 ( -0.905 1.687 0.941) 2.133 15.414 ( -4.576 -5.494 1.232) 7.256 ======================= Grid point 20 (15/141) ======================= q-point: (-0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.281 ( 0.000 15.790 -0.000) 15.790 0.511 ( 0.000 25.506 -0.000) 25.506 0.942 ( 0.000 46.938 -0.000) 46.938 1.485 ( 0.000 6.603 -0.000) 6.603 1.556 ( 0.000 22.543 -0.000) 22.543 2.216 ( -0.000 -7.296 0.000) 7.296 2.347 ( 0.000 0.869 -0.000) 0.869 2.587 ( 0.000 3.009 -0.000) 3.009 2.685 ( -0.000 -3.097 0.000) 3.097 2.937 ( 0.000 0.179 -0.000) 0.179 3.468 ( 0.000 6.291 -0.000) 6.291 3.666 ( 0.000 3.314 -0.000) 3.314 3.885 ( -0.000 -1.132 0.000) 1.132 4.097 ( -0.000 -4.079 0.000) 4.079 4.115 ( -0.000 -3.550 0.000) 3.550 4.197 ( -0.000 -1.473 0.000) 1.473 4.577 ( -0.000 -0.839 0.000) 0.839 4.639 ( -0.000 -4.868 0.000) 4.868 4.756 ( -0.000 -5.181 0.000) 5.181 4.762 ( -0.000 -2.133 0.000) 2.133 4.944 ( -0.000 -7.520 0.000) 7.520 5.110 ( 0.000 8.486 -0.000) 8.486 5.188 ( -0.000 -8.373 0.000) 8.373 5.576 ( 0.000 11.000 -0.000) 11.000 5.582 ( -0.000 -5.112 0.000) 5.112 5.743 ( -0.000 -0.221 0.000) 0.221 5.852 ( -0.000 -4.417 0.000) 4.417 6.109 ( 0.000 2.219 -0.000) 2.219 6.131 ( -0.000 -1.303 0.000) 1.303 6.146 ( 0.000 3.332 -0.000) 3.332 6.342 ( -0.000 -2.254 0.000) 2.254 6.489 ( -0.000 -1.446 0.000) 1.446 6.578 ( -0.000 -3.221 0.000) 3.221 6.603 ( 0.000 1.819 -0.000) 1.819 6.687 ( 0.000 1.288 -0.000) 1.288 6.741 ( 0.000 6.971 -0.000) 6.971 6.977 ( 0.000 1.818 -0.000) 1.818 7.023 ( -0.000 -4.958 0.000) 4.958 7.036 ( 0.000 4.060 -0.000) 4.060 7.100 ( 0.000 0.962 -0.000) 0.962 7.267 ( 0.000 3.029 -0.000) 3.029 7.653 ( -0.000 -2.268 0.000) 2.268 7.722 ( -0.000 -4.590 0.000) 4.590 7.971 ( 0.000 22.511 -0.000) 22.511 8.131 ( -0.000 -2.665 0.000) 2.665 8.815 ( -0.000 -17.153 0.000) 17.153 8.869 ( -0.000 -1.731 0.000) 1.731 9.109 ( -0.000 -3.087 0.000) 3.087 9.250 ( -0.000 -11.814 0.000) 11.814 9.386 ( 0.000 8.845 -0.000) 8.845 9.793 ( 0.000 1.094 -0.000) 1.094 10.255 ( -0.000 -24.244 0.000) 24.244 10.576 ( -0.000 -23.411 0.000) 23.411 10.829 ( 0.000 1.703 -0.000) 1.703 10.900 ( 0.000 4.704 -0.000) 4.704 11.211 ( 0.000 10.751 -0.000) 10.751 11.497 ( -0.000 -3.833 0.000) 3.833 11.659 ( 0.000 10.524 -0.000) 10.524 12.255 ( 0.000 3.134 -0.000) 3.134 12.307 ( -0.000 -2.129 0.000) 2.129 12.344 ( 0.000 6.937 -0.000) 6.937 12.433 ( 0.000 4.051 -0.000) 4.051 12.582 ( 0.000 10.532 -0.000) 10.532 12.775 ( -0.000 -2.112 0.000) 2.112 12.938 ( -0.000 -1.709 0.000) 1.709 13.241 ( 0.000 9.168 -0.000) 9.168 13.313 ( -0.000 -1.539 0.000) 1.539 13.481 ( 0.000 4.361 -0.000) 4.361 14.791 ( -0.000 -4.557 0.000) 4.557 15.055 ( -0.000 -0.478 0.000) 0.478 15.147 ( 0.000 1.072 -0.000) 1.072 15.378 ( -0.000 -1.920 0.000) 1.920 ======================= Grid point 23 (16/141) ======================= q-point: ( 0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 141 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.547 ( 17.361 -0.000 5.625) 18.249 1.633 ( 16.157 -0.000 4.715) 16.831 1.860 ( 10.556 -0.000 -5.293) 11.808 1.873 ( -2.946 0.000 -2.879) 4.119 2.309 ( 3.316 -0.000 -4.019) 5.211 2.459 ( 1.186 -0.000 6.259) 6.370 2.600 ( 16.183 -0.000 -2.645) 16.398 2.663 ( 11.761 -0.000 2.273) 11.978 3.149 ( -3.879 0.000 -0.077) 3.880 3.186 ( -1.825 0.000 -1.692) 2.488 3.496 ( -6.066 0.000 -4.731) 7.693 3.522 ( 2.502 -0.000 1.607) 2.973 3.763 ( -7.745 0.000 2.078) 8.019 3.893 ( -4.431 0.000 -0.046) 4.431 3.940 ( 0.174 -0.000 0.171) 0.244 4.011 ( -6.205 0.000 2.707) 6.770 4.202 ( -1.410 0.000 -0.492) 1.493 4.298 ( -1.039 0.000 0.344) 1.094 4.471 ( 1.583 -0.000 -4.382) 4.659 4.559 ( -10.510 0.000 -0.471) 10.520 4.599 ( -5.161 0.000 2.929) 5.934 4.835 ( 4.881 -0.000 -4.047) 6.341 5.274 ( -0.375 0.000 1.739) 1.779 5.375 ( 1.374 -0.000 2.505) 2.857 5.781 ( -5.456 0.000 -0.790) 5.513 5.814 ( -1.396 0.000 1.456) 2.017 5.999 ( -0.841 0.000 3.251) 3.358 6.039 ( -1.079 0.000 -2.999) 3.187 6.049 ( -1.116 0.000 -5.660) 5.769 6.228 ( -1.853 0.000 0.369) 1.889 6.280 ( 2.870 -0.000 5.503) 6.206 6.287 ( 2.910 -0.000 2.226) 3.664 6.486 ( -1.241 0.000 1.155) 1.695 6.604 ( -2.475 0.000 -4.869) 5.462 6.671 ( -0.098 0.000 -2.449) 2.451 6.878 ( -3.286 0.000 3.174) 4.568 6.893 ( -1.281 0.000 1.452) 1.937 7.048 ( -4.314 0.000 -2.304) 4.890 7.081 ( -3.247 0.000 1.135) 3.440 7.225 ( 1.772 -0.000 -0.577) 1.863 7.231 ( 7.835 -0.000 -4.395) 8.983 7.439 ( 3.750 -0.000 -3.467) 5.108 7.681 ( -9.857 0.000 13.165) 16.446 7.758 ( 2.314 -0.000 -2.590) 3.473 8.154 ( -8.018 0.000 -0.191) 8.020 8.471 ( -1.873 0.000 -3.759) 4.200 8.571 ( -14.334 0.000 0.370) 14.339 8.718 ( -5.953 0.000 -1.032) 6.042 9.393 ( -3.000 0.000 1.269) 3.257 9.414 ( 1.557 -0.000 0.661) 1.691 9.867 ( 8.994 -0.000 2.654) 9.377 10.197 ( -0.978 0.000 -7.668) 7.731 10.403 ( 10.632 -0.000 3.955) 11.344 10.585 ( -2.522 0.000 -11.763) 12.031 11.099 ( 1.464 -0.000 8.699) 8.821 11.114 ( -0.941 0.000 -5.711) 5.788 11.763 ( -6.316 0.000 -7.427) 9.749 11.842 ( -0.350 0.000 14.592) 14.596 12.003 ( -6.818 0.000 4.138) 7.975 12.216 ( -4.137 0.000 -0.953) 4.245 12.395 ( 0.553 -0.000 -6.960) 6.982 12.670 ( 3.256 -0.000 -3.934) 5.107 12.812 ( 9.641 -0.000 5.130) 10.921 12.840 ( 3.242 -0.000 -7.182) 7.880 12.989 ( 3.730 -0.000 12.190) 12.748 13.147 ( 1.596 -0.000 4.078) 4.380 13.634 ( 13.685 -0.000 -1.725) 13.793 13.907 ( -2.279 0.000 -10.073) 10.328 14.453 ( -4.033 0.000 13.124) 13.730 14.961 ( -4.472 0.000 -3.294) 5.554 15.223 ( 4.587 -0.000 -2.656) 5.301 15.407 ( -3.026 0.000 -2.522) 3.939 ======================= Grid point 24 (17/141) ======================= q-point: ( 0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.758 ( 9.591 6.213 4.790) 12.391 1.792 ( 0.998 6.095 -2.525) 6.673 1.906 ( 9.911 -4.216 2.725) 11.110 2.055 ( 7.581 -6.549 -3.822) 10.723 2.356 ( 2.319 1.730 -1.568) 3.290 2.504 ( 1.835 -0.643 4.013) 4.459 2.782 ( 6.130 -2.566 -5.570) 8.671 2.809 ( 3.550 -0.755 4.013) 5.411 3.042 ( -7.027 -1.516 1.503) 7.344 3.115 ( -4.127 -0.744 -1.143) 4.347 3.356 ( -8.239 -0.145 -5.121) 9.702 3.505 ( -8.662 -0.704 2.314) 8.993 3.708 ( 3.729 -1.177 0.293) 3.921 3.849 ( -0.938 -0.604 -0.484) 1.216 3.914 ( -1.392 3.339 3.057) 4.736 4.008 ( 0.054 -1.410 -0.799) 1.622 4.187 ( 2.151 -0.446 3.542) 4.168 4.326 ( 4.128 0.308 -3.935) 5.711 4.379 ( -5.000 3.367 -0.699) 6.069 4.461 ( -5.708 -3.489 0.454) 6.705 4.666 ( 9.291 -1.556 -4.085) 10.268 4.916 ( 4.463 -1.224 -0.171) 4.631 5.231 ( 0.500 6.868 -0.094) 6.886 5.452 ( 2.833 -1.944 4.757) 5.868 5.678 ( -3.516 1.040 -0.718) 3.736 5.790 ( -2.329 -1.139 -0.819) 2.719 5.978 ( -2.847 -0.954 -0.817) 3.112 6.022 ( 2.744 2.372 -1.275) 3.844 6.073 ( 3.236 -2.170 -0.054) 3.897 6.195 ( -3.212 -1.664 4.614) 5.863 6.353 ( 3.130 0.718 4.367) 5.421 6.369 ( 4.221 -1.540 0.247) 4.500 6.494 ( -0.160 -5.643 -0.546) 5.671 6.572 ( -1.718 -3.895 -4.544) 6.226 6.687 ( 3.027 -0.264 -1.725) 3.494 6.807 ( -3.290 4.421 1.986) 5.857 6.857 ( -3.313 -0.989 -1.985) 3.987 6.976 ( -5.260 -5.909 -1.013) 7.975 7.044 ( -1.294 -0.017 0.836) 1.541 7.253 ( 0.765 1.246 -1.592) 2.162 7.352 ( 4.369 -2.995 -5.435) 7.589 7.466 ( -1.737 0.136 6.577) 6.804 7.616 ( 0.929 1.962 6.509) 6.862 7.791 ( 1.672 -0.912 -1.832) 2.643 8.047 ( -4.431 -0.082 -0.603) 4.472 8.321 ( -13.976 -0.813 -0.049) 14.000 8.433 ( -1.921 0.019 -3.514) 4.005 8.648 ( -2.068 0.773 1.063) 2.450 9.339 ( -3.750 -0.162 0.970) 3.876 9.358 ( -5.389 -0.365 -0.811) 5.462 9.930 ( 4.490 20.174 -3.970) 21.045 10.161 ( 3.979 1.177 -2.298) 4.743 10.519 ( 0.717 0.037 -0.969) 1.206 10.577 ( 1.951 -2.421 1.461) 3.436 11.047 ( -2.875 1.824 -3.491) 4.876 11.172 ( 2.188 -2.327 8.563) 9.139 11.569 ( -14.276 -3.298 -9.727) 17.587 11.823 ( -5.745 0.808 12.382) 13.674 11.961 ( 0.920 0.361 1.278) 1.616 12.174 ( 0.695 1.334 0.058) 1.505 12.357 ( -2.553 -0.043 -5.662) 6.211 12.710 ( 0.138 -2.796 -3.620) 4.576 12.873 ( 5.749 2.307 -5.750) 8.452 13.001 ( 9.557 0.290 3.101) 10.051 13.104 ( 3.981 -1.140 10.159) 10.971 13.240 ( 4.841 -6.980 2.500) 8.855 13.754 ( 0.503 7.078 -5.567) 9.019 13.868 ( 4.273 -2.627 -3.913) 6.362 14.445 ( -2.366 -0.666 11.003) 11.274 14.857 ( -5.625 0.109 -4.249) 7.050 15.298 ( 4.745 -0.153 -3.322) 5.794 15.363 ( -2.015 -0.205 0.496) 2.085 ======================= Grid point 25 (18/141) ======================= q-point: (-0.60 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.757 ( 1.788 4.805 -1.133) 5.251 1.810 ( 4.454 8.937 3.714) 10.654 2.003 ( -1.186 1.180 1.272) 2.102 2.170 ( -2.816 0.896 -3.424) 4.522 2.346 ( 2.650 -1.272 1.075) 3.130 2.526 ( -0.723 0.925 1.119) 1.622 2.847 ( 0.738 -0.384 1.011) 1.309 2.863 ( 4.226 -0.174 -0.106) 4.231 2.989 ( -3.565 -3.206 -2.300) 5.318 3.124 ( -0.370 -5.947 -0.968) 6.037 3.232 ( -3.327 -4.611 -2.012) 6.031 3.354 ( -10.658 -3.179 2.310) 11.359 3.807 ( 4.562 0.119 1.381) 4.768 3.877 ( 3.277 -1.805 -0.780) 3.822 3.911 ( 1.621 -0.202 1.554) 2.255 3.964 ( -2.613 1.335 -0.536) 2.983 4.256 ( 3.162 3.276 0.450) 4.575 4.301 ( -2.173 1.150 -0.111) 2.461 4.375 ( 2.963 0.689 -4.790) 5.675 4.447 ( 0.686 -4.201 3.583) 5.564 4.828 ( 8.563 -1.108 -6.498) 10.807 4.995 ( 3.408 1.236 2.317) 4.303 5.179 ( 1.926 4.794 -1.940) 5.518 5.438 ( -2.712 8.740 4.796) 10.332 5.682 ( 0.162 -3.752 1.087) 3.910 5.791 ( 1.297 -4.336 -0.596) 4.565 5.928 ( -3.255 -1.356 -3.058) 4.668 6.067 ( 3.113 1.798 2.257) 4.244 6.150 ( 1.102 -1.995 -0.865) 2.438 6.215 ( 3.648 -1.240 5.653) 6.841 6.370 ( 3.820 1.992 -1.738) 4.646 6.455 ( 1.753 0.016 3.024) 3.496 6.549 ( -2.031 -5.039 -3.372) 6.394 6.623 ( 2.221 -7.671 -3.017) 8.537 6.719 ( -3.148 2.013 2.413) 4.448 6.790 ( 7.475 -4.595 1.174) 8.853 6.825 ( 1.867 0.856 -4.415) 4.870 6.966 ( -2.492 -4.690 -0.836) 5.376 7.045 ( -0.059 -1.991 2.159) 2.938 7.205 ( -6.616 -4.339 0.798) 7.953 7.382 ( -3.451 -4.577 -1.591) 5.949 7.445 ( -2.010 0.834 2.943) 3.660 7.660 ( 3.857 2.763 3.302) 5.780 7.812 ( 0.177 -0.783 -2.574) 2.696 7.999 ( -1.468 -1.111 -1.471) 2.357 8.169 ( -5.025 -2.712 1.483) 5.900 8.364 ( -4.685 1.272 -2.776) 5.593 8.643 ( 1.188 0.354 2.935) 3.186 9.244 ( -6.494 -0.602 0.906) 6.584 9.306 ( -4.490 -5.189 -1.018) 6.937 9.715 ( -0.477 22.615 -5.664) 23.318 10.188 ( 6.522 15.227 0.400) 16.570 10.509 ( -1.970 -4.781 -5.125) 7.280 10.623 ( 1.015 0.768 7.581) 7.687 11.001 ( -0.293 -0.589 -2.539) 2.623 11.255 ( 2.352 -0.585 6.769) 7.190 11.343 ( -14.624 -9.164 -7.667) 18.884 11.760 ( -3.789 -0.385 7.616) 8.515 11.996 ( 3.303 1.424 2.657) 4.471 12.204 ( 3.755 0.839 -0.517) 3.882 12.299 ( -3.077 -1.613 -4.406) 5.611 12.692 ( -2.708 -0.051 -2.349) 3.585 12.947 ( 5.998 1.129 -5.521) 8.230 13.131 ( 6.331 3.388 3.738) 8.095 13.193 ( 2.803 -1.949 2.121) 4.019 13.406 ( 2.289 -6.612 -0.248) 7.001 13.677 ( 1.874 3.654 2.944) 5.053 13.916 ( 1.688 3.782 -2.349) 4.761 14.410 ( -6.076 -0.146 2.858) 6.716 14.799 ( -0.320 -3.147 -1.282) 3.413 15.329 ( -1.725 0.502 3.089) 3.574 15.359 ( 2.395 0.136 -4.310) 4.933 ======================= Grid point 26 (19/141) ======================= q-point: (-0.50 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.701 ( -4.768 11.203 0.412) 12.182 1.780 ( 3.736 7.354 1.166) 8.330 1.869 ( -7.542 9.537 4.932) 13.121 2.007 ( -8.372 -0.050 -4.996) 9.750 2.424 ( -1.070 -2.746 0.178) 2.953 2.499 ( 2.500 4.840 2.434) 5.967 2.837 ( -2.164 1.632 -1.655) 3.175 2.873 ( -6.972 3.086 -3.652) 8.454 2.949 ( 3.167 -0.168 0.683) 3.244 3.129 ( -7.017 -2.945 2.168) 7.912 3.284 ( 1.422 -7.269 2.282) 7.750 3.408 ( 8.623 -12.928 -2.416) 15.727 3.827 ( -1.655 3.764 2.280) 4.702 3.895 ( 1.802 0.741 -1.190) 2.283 3.960 ( 2.514 -0.922 -0.090) 2.680 4.027 ( 5.606 -5.438 -0.110) 7.811 4.227 ( -0.614 4.389 -1.186) 4.588 4.251 ( -1.535 2.002 -2.286) 3.405 4.429 ( 4.356 -2.643 -2.565) 5.704 4.538 ( 1.051 -6.014 4.487) 7.576 4.861 ( 0.035 8.162 -1.132) 8.240 5.033 ( 4.918 0.844 -3.600) 6.152 5.212 ( 0.159 3.716 1.034) 3.861 5.304 ( -0.360 3.737 3.265) 4.976 5.707 ( -0.246 -2.254 1.035) 2.492 5.840 ( -5.693 -7.189 -3.744) 9.905 5.932 ( 4.757 0.189 4.010) 6.224 6.068 ( -2.055 0.077 0.773) 2.197 6.195 ( 2.780 -1.184 -1.218) 3.258 6.246 ( -2.361 0.015 -1.443) 2.767 6.433 ( -2.384 1.392 4.294) 5.105 6.474 ( 6.494 3.650 1.576) 7.614 6.542 ( -1.876 -4.162 -5.252) 6.959 6.636 ( -3.899 -2.480 0.771) 4.684 6.750 ( 3.150 -7.065 1.364) 7.854 6.864 ( 3.540 0.778 -3.650) 5.144 6.938 ( -4.139 -2.055 0.640) 4.665 6.989 ( 3.677 -1.503 0.980) 4.091 7.095 ( 0.696 -7.001 -0.356) 7.044 7.220 ( 5.494 -4.510 -0.864) 7.160 7.303 ( -6.788 2.188 4.139) 8.246 7.442 ( -4.516 -12.482 -0.886) 13.304 7.677 ( 0.500 4.052 1.222) 4.262 7.850 ( 6.475 -3.515 -3.603) 8.201 8.034 ( 6.386 0.056 -1.505) 6.561 8.192 ( -0.649 -6.488 4.781) 8.085 8.253 ( -3.906 2.703 -2.462) 5.350 8.676 ( 1.123 -0.665 1.882) 2.290 9.180 ( -1.751 -2.078 1.814) 3.267 9.298 ( -4.603 -9.888 -1.520) 11.012 9.480 ( -0.611 19.597 -3.067) 19.845 10.099 ( 3.924 18.278 -0.811) 18.712 10.498 ( -0.447 3.313 -1.557) 3.688 10.678 ( 2.370 -4.104 3.138) 5.684 11.022 ( 1.881 -1.494 -2.215) 3.268 11.182 ( -7.883 -5.914 -7.801) 12.569 11.344 ( 0.033 -3.810 9.682) 10.405 11.755 ( -0.391 -1.961 4.356) 4.793 12.059 ( 4.126 0.211 3.303) 5.289 12.268 ( -1.185 -2.079 -2.879) 3.744 12.275 ( 4.709 -0.613 -0.921) 4.837 12.622 ( -2.567 3.094 -1.338) 4.237 12.988 ( 1.134 1.740 -4.252) 4.732 13.151 ( -0.867 4.756 4.336) 6.494 13.243 ( 1.226 -0.876 -2.726) 3.114 13.409 ( 0.866 3.508 -1.750) 4.015 13.703 ( -1.032 7.131 -0.906) 7.262 13.952 ( 4.672 -6.306 7.681) 10.982 14.258 ( -8.590 2.031 -5.238) 10.264 14.888 ( 3.960 -5.290 1.904) 6.877 15.292 ( -2.992 0.693 3.814) 4.897 15.364 ( 0.106 0.483 -4.459) 4.486 ======================= Grid point 27 (20/141) ======================= q-point: (-0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.371 ( -13.858 17.288 -0.873) 22.174 1.628 ( -8.810 15.280 4.080) 18.103 1.803 ( 4.972 7.174 -0.912) 8.776 1.900 ( -5.383 -3.984 -0.613) 6.725 2.387 ( -3.211 0.073 -1.268) 3.453 2.484 ( -1.074 5.701 3.534) 6.793 2.704 ( -3.130 9.209 -1.623) 9.861 2.747 ( -4.332 11.918 -1.993) 12.837 2.836 ( -10.628 2.802 0.977) 11.035 3.079 ( -0.790 0.865 -0.170) 1.184 3.456 ( 6.748 -6.927 1.335) 9.762 3.679 ( 6.858 -11.164 0.919) 13.134 3.762 ( -0.314 2.423 -1.953) 3.128 3.931 ( 1.537 -1.054 0.972) 2.102 4.000 ( 0.859 -1.107 -1.786) 2.270 4.133 ( -1.764 -2.993 -1.832) 3.927 4.215 ( 1.345 -2.636 -1.941) 3.539 4.241 ( 4.606 -4.470 1.536) 6.599 4.553 ( 5.220 -5.581 -0.322) 7.649 4.579 ( -1.403 0.327 0.517) 1.530 4.805 ( 1.239 -0.232 2.175) 2.514 5.026 ( -3.577 8.390 -0.975) 9.173 5.148 ( 4.083 0.794 0.655) 4.211 5.390 ( 2.238 -5.521 1.128) 6.063 5.726 ( -1.280 -2.953 0.284) 3.231 5.787 ( -4.185 -2.260 -1.155) 4.895 5.965 ( -1.829 2.941 1.637) 3.831 6.054 ( 0.930 -2.253 -1.893) 3.086 6.150 ( -7.505 -1.672 3.198) 8.328 6.247 ( 3.061 0.406 -5.277) 6.114 6.399 ( -0.388 3.770 1.901) 4.240 6.475 ( -1.924 -1.363 0.068) 2.359 6.559 ( -0.836 -1.425 -1.511) 2.239 6.593 ( -2.914 -0.583 2.718) 4.027 6.813 ( -4.958 0.946 -0.752) 5.103 6.876 ( -3.623 -4.788 2.007) 6.331 6.915 ( 1.941 -4.990 0.028) 5.354 7.033 ( 2.779 0.698 1.472) 3.222 7.150 ( -5.606 -8.676 1.687) 10.467 7.212 ( -1.217 -3.223 -4.788) 5.898 7.328 ( 2.399 -1.823 -2.157) 3.706 7.478 ( -4.352 -2.530 4.688) 6.879 7.659 ( 2.378 1.157 -1.784) 3.190 8.006 ( 5.154 1.211 -7.096) 8.854 8.192 ( 3.301 -3.804 4.486) 6.745 8.269 ( 8.754 -7.752 -1.024) 11.738 8.313 ( 12.782 -2.751 2.921) 13.397 8.704 ( 0.534 -3.466 -1.235) 3.718 9.235 ( -5.685 -1.002 2.715) 6.379 9.301 ( 5.798 -3.184 2.106) 6.942 9.385 ( 5.490 0.496 -3.742) 6.662 9.986 ( 2.079 14.273 -1.945) 14.554 10.406 ( -6.030 4.673 3.369) 8.340 10.783 ( 5.715 -1.552 -2.367) 6.378 11.072 ( 1.525 -3.872 -8.148) 9.150 11.124 ( -0.015 -0.590 -2.031) 2.114 11.397 ( -1.643 -3.131 11.574) 12.102 11.792 ( 1.076 -1.638 1.375) 2.394 12.148 ( 4.010 -1.442 3.755) 5.680 12.271 ( -1.271 -3.714 -0.660) 3.981 12.380 ( 7.088 -0.680 -1.088) 7.203 12.555 ( 0.110 4.898 -0.325) 4.910 12.903 ( -6.293 4.516 -0.141) 7.747 13.068 ( -3.404 5.084 2.352) 6.555 13.226 ( -1.036 2.477 -6.626) 7.149 13.402 ( 4.236 9.218 3.709) 10.801 13.546 ( -5.707 5.526 -5.319) 9.560 13.966 ( -8.902 6.470 2.593) 11.306 14.263 ( 6.236 -12.547 -1.157) 14.059 14.996 ( 2.533 -2.950 2.292) 4.513 15.241 ( -3.113 0.834 3.106) 4.476 15.340 ( -1.735 -1.561 -3.460) 4.173 ======================= Grid point 28 (21/141) ======================= q-point: (-0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.956 ( -12.208 19.482 -1.484) 23.039 1.303 ( -9.675 19.686 2.427) 22.069 1.732 ( -1.365 7.650 -4.086) 8.780 1.942 ( 3.085 -3.547 4.158) 6.276 2.273 ( -8.016 16.814 -2.278) 18.766 2.301 ( -4.922 22.082 1.349) 22.664 2.437 ( -7.393 4.651 -2.500) 9.085 2.613 ( 2.226 7.558 3.399) 8.580 2.762 ( 0.486 3.462 0.528) 3.535 3.001 ( -5.418 2.176 -2.124) 6.213 3.603 ( 4.716 -0.097 1.696) 5.012 3.718 ( -0.646 -1.149 -0.649) 1.469 3.870 ( 2.458 -3.755 0.558) 4.522 3.942 ( -2.910 -4.110 -1.909) 5.385 3.998 ( -1.118 -2.060 -0.122) 2.347 4.115 ( -0.691 -3.830 -0.928) 4.001 4.345 ( 4.701 -9.132 -0.849) 10.306 4.412 ( 5.178 -9.708 1.502) 11.105 4.552 ( 1.360 1.550 -1.286) 2.430 4.685 ( 2.705 -6.681 1.180) 7.304 4.845 ( -4.770 -1.594 -0.779) 5.089 4.929 ( 2.294 -0.935 3.145) 4.004 5.236 ( 5.295 0.545 -1.087) 5.433 5.433 ( -3.725 -5.544 0.418) 6.692 5.710 ( -1.841 -1.161 0.849) 2.337 5.756 ( -1.496 -0.963 -1.384) 2.254 5.920 ( 0.429 4.542 0.407) 4.580 6.056 ( -1.999 -2.336 -0.700) 3.153 6.100 ( -1.578 -2.539 1.529) 3.357 6.273 ( 1.778 -0.482 -3.393) 3.861 6.336 ( -0.706 7.769 0.937) 7.857 6.467 ( -1.383 -2.988 -3.359) 4.704 6.499 ( -5.086 -1.921 5.617) 7.817 6.616 ( 2.022 -0.850 -0.030) 2.194 6.725 ( -4.409 -1.474 -1.416) 4.860 6.861 ( -2.247 -3.966 0.177) 4.562 6.960 ( 0.669 1.749 0.105) 1.875 7.044 ( -1.497 1.875 2.719) 3.626 7.134 ( -1.891 -2.286 -1.351) 3.260 7.201 ( -5.236 -3.675 0.321) 6.406 7.401 ( -0.760 6.041 3.231) 6.893 7.430 ( 3.516 -9.197 -2.786) 10.233 7.662 ( -2.107 -0.183 -1.575) 2.637 8.033 ( 4.265 0.054 -8.110) 9.163 8.224 ( -7.316 -11.746 7.988) 15.978 8.527 ( 15.790 4.375 -2.422) 16.563 8.620 ( 13.982 -2.495 -0.277) 14.206 8.803 ( 2.484 -12.650 -0.356) 12.897 9.073 ( -10.610 0.010 4.792) 11.642 9.533 ( 10.921 -3.400 -2.089) 11.627 9.588 ( 13.778 -8.945 0.487) 16.435 9.871 ( -1.471 9.418 -1.971) 9.734 10.235 ( -11.809 -1.023 2.541) 12.122 10.863 ( 4.279 2.085 -1.004) 4.864 11.050 ( -2.727 -0.731 -5.763) 6.417 11.221 ( 10.468 -0.014 -10.364) 14.731 11.413 ( -4.784 -3.069 16.135) 17.107 11.818 ( 1.228 1.078 -0.438) 1.691 12.225 ( 2.184 -1.428 1.590) 3.056 12.278 ( -2.554 -3.250 2.075) 4.625 12.501 ( 5.095 -1.697 -2.657) 5.992 12.554 ( 6.120 6.059 1.831) 8.804 12.734 ( -6.993 4.780 -0.115) 8.471 12.949 ( -3.982 8.373 5.108) 10.586 13.120 ( -2.390 7.969 -6.432) 10.516 13.342 ( -2.144 5.509 -0.219) 5.915 13.469 ( 3.216 5.219 0.547) 6.155 13.731 ( -8.682 8.345 -1.987) 12.205 14.491 ( 4.323 -12.840 0.852) 13.575 15.040 ( 0.473 -0.562 1.151) 1.366 15.195 ( -1.898 0.982 1.547) 2.638 15.324 ( -2.509 -3.726 -1.391) 4.702 ======================= Grid point 29 (22/141) ======================= q-point: (-0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 141 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.633 ( 0.000 20.165 -0.000) 20.165 0.990 ( 0.000 23.290 -0.000) 23.290 1.641 ( 0.000 8.062 -0.000) 8.062 1.808 ( 0.000 40.354 -0.000) 40.354 2.046 ( 0.000 24.531 -0.000) 24.531 2.060 ( -0.000 -7.106 0.000) 7.106 2.363 ( 0.000 0.416 -0.000) 0.416 2.636 ( -0.000 -1.371 0.000) 1.371 2.695 ( 0.000 8.896 -0.000) 8.896 2.930 ( -0.000 -0.767 0.000) 0.767 3.605 ( 0.000 6.295 -0.000) 6.295 3.723 ( 0.000 0.875 -0.000) 0.875 3.863 ( -0.000 -0.925 0.000) 0.925 4.004 ( -0.000 -7.112 0.000) 7.112 4.014 ( -0.000 -3.581 0.000) 3.581 4.147 ( -0.000 -3.632 0.000) 3.632 4.482 ( -0.000 -9.669 0.000) 9.669 4.548 ( -0.000 -2.880 0.000) 2.880 4.598 ( -0.000 -9.291 0.000) 9.291 4.779 ( 0.000 2.304 -0.000) 2.304 4.782 ( -0.000 -7.786 0.000) 7.786 5.017 ( -0.000 -8.442 0.000) 8.442 5.251 ( 0.000 5.207 -0.000) 5.207 5.454 ( -0.000 -7.324 0.000) 7.324 5.724 ( -0.000 -2.135 0.000) 2.135 5.726 ( 0.000 2.652 -0.000) 2.652 5.861 ( 0.000 6.177 -0.000) 6.177 6.087 ( -0.000 -3.572 0.000) 3.572 6.107 ( -0.000 -1.552 0.000) 1.552 6.254 ( 0.000 6.988 -0.000) 6.988 6.299 ( -0.000 -1.727 0.000) 1.727 6.463 ( -0.000 -1.167 0.000) 1.167 6.497 ( -0.000 -4.375 0.000) 4.375 6.647 ( 0.000 2.255 -0.000) 2.255 6.686 ( -0.000 -2.196 0.000) 2.196 6.901 ( -0.000 -6.332 0.000) 6.332 6.902 ( 0.000 8.127 -0.000) 8.127 7.011 ( 0.000 1.421 -0.000) 1.421 7.124 ( 0.000 0.457 -0.000) 0.457 7.131 ( 0.000 4.036 -0.000) 4.036 7.361 ( 0.000 6.041 -0.000) 6.041 7.558 ( -0.000 -11.073 0.000) 11.073 7.621 ( -0.000 -0.494 0.000) 0.494 8.080 ( -0.000 -1.674 0.000) 1.674 8.263 ( -0.000 -4.863 0.000) 4.863 8.605 ( 0.000 5.389 -0.000) 5.389 8.811 ( -0.000 -4.593 0.000) 4.593 8.953 ( -0.000 -15.366 0.000) 15.366 9.007 ( -0.000 -6.427 0.000) 6.427 9.635 ( 0.000 13.627 -0.000) 13.627 9.793 ( 0.000 1.309 -0.000) 1.309 9.828 ( -0.000 -17.202 0.000) 17.202 10.184 ( -0.000 -15.438 0.000) 15.438 10.876 ( 0.000 2.773 -0.000) 2.773 10.990 ( 0.000 3.888 -0.000) 3.888 11.332 ( 0.000 1.957 -0.000) 1.957 11.406 ( -0.000 -4.930 0.000) 4.930 11.800 ( 0.000 4.450 -0.000) 4.450 12.265 ( -0.000 -1.641 0.000) 1.641 12.272 ( -0.000 -1.808 0.000) 1.808 12.501 ( 0.000 8.865 -0.000) 8.865 12.587 ( 0.000 9.382 -0.000) 9.382 12.650 ( -0.000 -7.581 0.000) 7.581 12.819 ( 0.000 11.380 -0.000) 11.380 13.008 ( 0.000 7.237 -0.000) 7.237 13.298 ( -0.000 -0.136 0.000) 0.136 13.444 ( 0.000 11.541 -0.000) 11.541 13.567 ( 0.000 4.174 -0.000) 4.174 14.645 ( -0.000 -10.452 0.000) 10.452 15.047 ( -0.000 -0.245 0.000) 0.245 15.170 ( 0.000 1.126 -0.000) 1.126 15.327 ( -0.000 -3.160 0.000) 3.160 ======================= Grid point 34 (23/141) ======================= q-point: ( 0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.816 ( -0.079 0.000 -2.156) 2.157 1.903 ( 2.740 -0.000 0.630) 2.812 2.033 ( 5.956 -0.000 4.990) 7.770 2.152 ( 6.340 -0.000 -0.230) 6.345 2.338 ( -5.881 0.000 -1.829) 6.158 2.530 ( 0.609 -0.000 2.735) 2.802 2.847 ( 0.030 -0.000 3.810) 3.810 2.853 ( 6.421 -0.000 -5.934) 8.743 2.958 ( -0.846 0.000 2.321) 2.470 3.054 ( -0.531 0.000 -2.918) 2.966 3.187 ( -8.891 0.000 -5.154) 10.276 3.327 ( -11.362 0.000 3.892) 12.010 3.809 ( 7.025 -0.000 -0.276) 7.031 3.855 ( 2.247 -0.000 -0.188) 2.254 3.904 ( -1.223 0.000 4.036) 4.217 3.977 ( -2.727 0.000 -0.284) 2.742 4.293 ( 6.415 -0.000 1.041) 6.499 4.309 ( -3.655 0.000 -0.659) 3.714 4.384 ( 3.621 -0.000 -7.489) 8.318 4.409 ( -0.383 0.000 4.550) 4.566 4.811 ( 10.145 -0.000 -7.924) 12.873 5.002 ( 5.560 -0.000 2.716) 6.188 5.254 ( -1.479 0.000 0.594) 1.594 5.527 ( 2.903 -0.000 5.470) 6.193 5.625 ( -2.447 0.000 0.754) 2.561 5.741 ( -2.345 0.000 -4.647) 5.205 5.922 ( -1.378 0.000 -0.699) 1.545 6.096 ( 3.986 -0.000 0.730) 4.052 6.103 ( -3.655 0.000 1.435) 3.926 6.208 ( 7.428 -0.000 7.178) 10.329 6.402 ( 1.796 -0.000 -0.961) 2.037 6.455 ( 1.783 -0.000 2.572) 3.130 6.475 ( 1.836 -0.000 -1.706) 2.506 6.532 ( 3.693 -0.000 -6.679) 7.632 6.760 ( 5.926 -0.000 -1.391) 6.087 6.816 ( -2.613 0.000 3.095) 4.051 6.818 ( -0.850 0.000 0.894) 1.233 6.833 ( -0.200 0.000 -3.696) 3.701 7.028 ( -0.926 0.000 1.171) 1.493 7.162 ( -9.736 0.000 3.377) 10.305 7.337 ( -2.437 0.000 -7.712) 8.088 7.471 ( -2.645 0.000 6.858) 7.350 7.689 ( 3.230 -0.000 4.303) 5.381 7.803 ( 0.197 -0.000 -3.185) 3.192 7.984 ( -1.349 0.000 -1.566) 2.067 8.145 ( -5.239 0.000 0.423) 5.256 8.390 ( -2.171 0.000 -2.854) 3.586 8.649 ( 0.732 -0.000 2.989) 3.077 9.235 ( -7.389 0.000 0.372) 7.398 9.248 ( -6.304 0.000 -0.062) 6.304 10.013 ( -6.602 0.000 -9.084) 11.230 10.285 ( 13.585 -0.000 -1.342) 13.651 10.472 ( -1.756 0.000 -0.430) 1.808 10.635 ( -0.652 0.000 8.624) 8.648 11.004 ( -1.280 0.000 -2.986) 3.249 11.203 ( -7.751 0.000 6.116) 9.873 11.270 ( -5.782 0.000 -7.541) 9.502 11.757 ( -4.596 0.000 7.329) 8.651 12.018 ( 3.449 -0.000 2.815) 4.452 12.205 ( 2.484 -0.000 -0.133) 2.488 12.293 ( -3.294 0.000 -2.572) 4.179 12.680 ( -0.586 0.000 -4.096) 4.138 12.959 ( 5.734 -0.000 -9.444) 11.048 13.169 ( 7.649 -0.000 0.942) 7.707 13.230 ( 5.723 -0.000 11.952) 13.251 13.266 ( 2.828 -0.000 -1.593) 3.246 13.715 ( -2.237 0.000 1.278) 2.577 13.970 ( 3.845 -0.000 -4.591) 5.989 14.403 ( -5.009 0.000 7.357) 8.900 14.766 ( -2.426 0.000 -3.470) 4.234 15.334 ( -2.047 0.000 2.986) 3.620 15.360 ( 3.376 -0.000 -4.523) 5.644 ======================= Grid point 35 (24/141) ======================= q-point: (-0.60 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.801 ( -0.195 1.770 -0.463) 1.840 1.916 ( 0.867 2.694 -0.471) 2.869 2.026 ( -7.378 4.087 4.513) 9.566 2.108 ( -3.387 11.422 -0.890) 11.947 2.322 ( -0.091 -8.038 0.368) 8.047 2.555 ( 2.281 0.791 2.379) 3.389 2.836 ( -2.785 -0.677 -2.054) 3.526 2.918 ( 0.259 2.082 -1.402) 2.523 2.971 ( 0.495 0.648 0.311) 0.873 3.057 ( 1.932 -0.521 -1.754) 2.661 3.165 ( 1.889 -7.537 -3.463) 8.507 3.201 ( -0.770 -4.499 4.198) 6.201 3.884 ( 0.407 2.234 4.436) 4.983 3.912 ( 3.118 0.026 -2.294) 3.871 3.928 ( 1.346 -1.535 2.119) 2.942 3.953 ( 2.555 -1.808 -0.227) 3.139 4.265 ( -1.944 0.008 -0.693) 2.064 4.324 ( 0.341 3.450 -3.305) 4.790 4.396 ( 0.941 -0.644 -6.823) 6.918 4.461 ( 1.599 -1.943 6.699) 7.156 4.943 ( 7.537 0.627 -8.254) 11.195 5.077 ( 1.793 2.497 3.662) 4.782 5.228 ( 1.118 1.204 0.268) 1.665 5.469 ( -5.308 8.297 4.217) 10.714 5.637 ( -1.222 -5.118 2.607) 5.872 5.687 ( -5.057 -5.472 -7.135) 10.316 5.950 ( 4.288 1.078 2.984) 5.334 6.039 ( -4.828 -2.258 3.442) 6.345 6.173 ( 4.062 -0.447 0.276) 4.096 6.261 ( -2.779 0.892 -0.225) 2.927 6.442 ( -2.818 -0.714 0.839) 3.025 6.459 ( -1.671 -1.610 -2.067) 3.108 6.537 ( 8.691 0.442 -0.026) 8.702 6.566 ( -0.216 -3.688 -2.473) 4.446 6.684 ( -4.319 3.427 1.611) 5.744 6.819 ( -3.207 -5.967 -0.163) 6.776 6.912 ( 5.787 -1.235 -3.659) 6.957 6.971 ( -5.424 -3.013 4.467) 7.646 7.013 ( 5.802 2.995 0.631) 6.560 7.121 ( 13.006 -4.581 1.533) 13.875 7.275 ( -1.912 -2.050 -5.806) 6.447 7.359 ( -11.971 -0.085 4.740) 12.875 7.735 ( 2.218 1.627 2.572) 3.766 7.799 ( 2.595 -1.336 -3.573) 4.613 8.019 ( 6.221 -0.485 -2.557) 6.743 8.111 ( -2.273 -1.449 2.062) 3.393 8.340 ( -1.228 3.111 -0.724) 3.422 8.679 ( 1.186 0.358 2.920) 3.171 9.150 ( -2.417 -1.043 0.605) 2.702 9.161 ( -4.669 -3.497 -0.697) 5.874 9.806 ( -6.879 10.617 -5.119) 13.647 10.406 ( 0.505 11.464 0.850) 11.507 10.508 ( 6.031 -1.322 -4.240) 7.490 10.605 ( -2.015 -3.540 6.222) 7.436 10.996 ( -0.289 -0.662 -3.909) 3.976 11.042 ( -4.527 -5.984 -6.171) 9.715 11.308 ( 1.355 -0.642 9.031) 9.154 11.727 ( -1.083 -0.793 4.366) 4.567 12.076 ( 2.892 0.885 3.495) 4.622 12.233 ( -0.739 0.672 -1.164) 1.534 12.272 ( 2.773 -1.765 -0.708) 3.362 12.664 ( 0.468 1.219 -2.422) 2.752 13.005 ( 2.223 0.082 -8.068) 8.369 13.216 ( -3.757 2.125 8.080) 9.160 13.267 ( 5.387 2.897 -9.031) 10.907 13.393 ( 4.747 -4.142 2.064) 6.630 13.749 ( 3.272 -0.811 8.617) 9.253 13.922 ( -4.557 2.055 -4.391) 6.654 14.308 ( -7.088 1.973 2.212) 7.683 14.794 ( 4.222 -3.263 -1.022) 5.433 15.302 ( -2.888 0.309 4.091) 5.017 15.374 ( -0.054 0.318 -4.911) 4.922 ======================= Grid point 36 (25/141) ======================= q-point: (-0.50 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.678 ( -10.304 12.394 1.358) 16.175 1.839 ( -4.100 0.200 2.096) 4.609 1.900 ( -3.122 6.656 -2.598) 7.798 1.960 ( 1.673 11.622 1.961) 11.904 2.351 ( -2.936 -4.004 -1.262) 5.123 2.568 ( -1.075 2.869 2.300) 3.831 2.783 ( -0.172 -0.205 -0.640) 0.694 2.844 ( -6.240 2.167 -0.787) 6.652 2.944 ( -0.860 3.890 0.769) 4.058 3.107 ( 4.246 2.370 -0.181) 4.866 3.295 ( 8.009 -7.429 0.744) 10.949 3.429 ( 8.753 -12.698 -1.195) 15.469 3.831 ( -2.930 3.882 2.646) 5.537 3.945 ( 2.144 0.960 1.406) 2.738 3.978 ( 1.683 -1.264 -1.485) 2.576 4.038 ( 1.422 -4.230 -0.940) 4.561 4.210 ( -3.922 0.455 -2.962) 4.936 4.251 ( -1.208 4.220 -2.838) 5.227 4.440 ( 2.597 -5.002 -2.879) 6.329 4.517 ( 0.246 -4.147 6.131) 7.406 4.927 ( -2.057 8.845 -1.387) 9.187 5.104 ( 4.717 -0.354 -5.074) 6.937 5.229 ( -3.984 5.468 3.024) 7.410 5.333 ( -0.447 1.168 3.377) 3.601 5.625 ( -6.107 -7.157 -4.562) 10.456 5.687 ( -1.221 -6.024 1.297) 6.282 5.989 ( -3.003 -3.509 1.144) 4.758 6.038 ( 2.981 2.565 5.506) 6.766 6.132 ( -8.715 0.389 -0.471) 8.737 6.240 ( 1.664 -0.903 -2.514) 3.147 6.404 ( -2.166 -1.819 2.254) 3.617 6.430 ( -1.978 -3.106 -5.981) 7.023 6.533 ( -4.298 -2.960 1.464) 5.420 6.589 ( -0.083 1.498 -0.798) 1.699 6.760 ( 4.256 -5.421 4.325) 8.137 6.793 ( -5.517 -4.877 1.276) 7.474 6.846 ( -6.081 -1.656 1.385) 6.453 6.961 ( -3.499 -1.886 -0.124) 3.977 7.077 ( -0.169 0.251 -1.200) 1.238 7.161 ( -6.531 -3.287 -2.483) 7.722 7.287 ( 1.793 -1.126 -2.500) 3.276 7.445 ( 11.332 -0.666 2.610) 11.648 7.759 ( 4.974 5.468 -0.621) 7.418 7.957 ( 7.755 -4.518 -4.026) 9.836 8.091 ( 0.892 -2.982 3.757) 4.879 8.215 ( 15.963 -1.763 -2.092) 16.195 8.307 ( 2.337 1.946 1.895) 3.583 8.678 ( -1.510 -0.084 0.486) 1.588 9.137 ( -3.672 -4.931 1.335) 6.291 9.217 ( 8.256 -1.185 -0.092) 8.341 9.592 ( -3.474 10.387 -2.903) 11.331 10.234 ( -6.850 8.941 -0.170) 11.265 10.465 ( -5.474 2.571 3.977) 7.238 10.755 ( 10.615 -1.146 -6.671) 12.590 10.990 ( -1.002 -4.293 -4.063) 5.995 11.102 ( 5.586 -1.563 -1.159) 5.915 11.346 ( -1.545 -1.872 9.490) 9.795 11.758 ( 1.840 -1.600 1.959) 3.127 12.125 ( 1.799 -0.836 3.978) 4.445 12.220 ( -0.098 -0.559 -0.442) 0.719 12.353 ( 3.928 -2.577 -1.651) 4.980 12.660 ( 3.547 5.330 0.087) 6.403 12.969 ( -3.686 2.226 -2.836) 5.156 13.132 ( -4.914 1.183 5.504) 7.473 13.279 ( 2.765 3.358 -10.090) 10.988 13.490 ( 3.874 -0.092 -0.838) 3.965 13.682 ( -6.837 7.644 -2.078) 10.464 13.969 ( 2.609 -8.196 11.004) 13.967 14.153 ( -5.895 3.731 -4.036) 8.060 14.919 ( 4.830 -4.280 0.433) 6.468 15.253 ( -3.500 0.617 3.481) 4.975 15.331 ( -2.858 -0.018 -4.221) 5.097 ======================= Grid point 37 (26/141) ======================= q-point: (-0.40 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.343 ( -9.174 18.823 0.257) 20.941 1.667 ( -6.483 16.866 1.431) 18.126 1.782 ( -4.203 -0.421 -0.514) 4.255 1.973 ( 5.981 5.181 -0.446) 7.926 2.327 ( -1.681 -1.786 -0.594) 2.523 2.506 ( -3.476 3.501 1.776) 5.244 2.684 ( -5.795 4.918 1.059) 7.674 2.807 ( 1.350 11.092 -2.848) 11.531 2.859 ( 1.523 6.296 3.232) 7.239 3.109 ( 0.797 8.002 -2.400) 8.392 3.506 ( 6.681 -7.385 1.222) 10.034 3.651 ( 1.508 -8.346 2.218) 8.767 3.772 ( 0.462 -1.449 -1.926) 2.454 3.934 ( -2.428 2.119 -2.661) 4.179 3.981 ( -0.262 -0.253 1.081) 1.141 4.044 ( -3.847 -3.415 -1.891) 5.481 4.195 ( 1.672 -5.643 -0.417) 5.900 4.258 ( 2.037 -3.862 0.621) 4.410 4.531 ( 1.691 -5.602 1.576) 6.060 4.604 ( 2.849 -5.144 0.209) 5.884 4.782 ( -5.366 4.651 -1.204) 7.203 5.065 ( -1.940 9.427 1.185) 9.697 5.209 ( 4.375 -2.694 -2.013) 5.518 5.354 ( -2.123 -2.499 2.551) 4.155 5.600 ( -4.113 -8.491 -2.443) 9.746 5.727 ( -0.302 -3.460 0.151) 3.476 5.958 ( -2.535 -1.170 -0.164) 2.797 6.016 ( -3.822 -5.006 2.411) 6.744 6.069 ( 0.050 3.966 1.711) 4.320 6.254 ( 0.023 -1.654 -1.725) 2.389 6.402 ( -0.483 -2.965 -6.772) 7.408 6.430 ( 0.031 -0.720 2.972) 3.058 6.482 ( -5.077 0.081 2.517) 5.667 6.575 ( -1.550 -2.575 0.076) 3.006 6.720 ( -3.062 1.103 0.741) 3.338 6.780 ( -3.387 -3.384 0.398) 4.804 6.902 ( 1.732 -6.580 2.815) 7.364 6.946 ( -3.440 -10.844 1.702) 11.503 7.072 ( -0.445 -1.246 0.072) 1.326 7.117 ( -3.393 -4.313 -4.510) 7.103 7.334 ( 3.962 0.867 -2.429) 4.727 7.523 ( 1.524 4.288 2.298) 5.098 7.770 ( 3.901 8.798 -1.486) 9.738 7.972 ( -3.716 -6.070 -2.499) 7.543 8.142 ( -0.639 3.405 3.650) 5.032 8.505 ( 12.649 -6.303 1.353) 14.197 8.539 ( 15.309 -3.936 -1.335) 15.863 8.670 ( 2.611 -0.915 -2.413) 3.671 9.069 ( -9.405 -0.473 3.666) 10.106 9.441 ( 13.489 -3.574 -0.075) 13.955 9.529 ( 5.328 1.121 -2.810) 6.127 10.037 ( -9.196 2.317 -0.337) 9.489 10.308 ( -7.231 9.821 2.998) 12.559 10.895 ( 6.896 0.961 -4.332) 8.201 11.010 ( 0.217 -3.041 -3.251) 4.457 11.217 ( 7.207 -0.385 -4.591) 8.554 11.350 ( -4.137 -3.073 10.690) 11.867 11.815 ( 2.543 -1.052 0.218) 2.761 12.178 ( 0.886 -2.817 4.106) 5.058 12.228 ( -0.544 -1.548 -0.590) 1.743 12.431 ( 2.198 -4.123 -2.905) 5.502 12.689 ( 6.086 7.055 1.426) 9.426 12.844 ( -4.815 5.319 0.718) 7.210 13.071 ( -1.719 3.992 6.368) 7.710 13.243 ( 1.257 4.534 -9.377) 10.491 13.427 ( -9.333 2.288 -5.857) 11.254 13.588 ( 5.951 7.131 4.472) 10.309 13.902 ( -7.880 8.511 0.925) 11.636 14.222 ( 3.548 -13.472 0.943) 13.964 15.013 ( 1.957 -2.362 0.736) 3.154 15.203 ( -2.480 0.136 1.656) 2.985 15.276 ( -2.633 -1.289 -2.322) 3.740 ======================= Grid point 38 (27/141) ======================= q-point: (-0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.053 ( 0.000 21.881 -0.000) 21.881 1.417 ( 0.000 20.177 -0.000) 20.177 1.738 ( 0.000 1.212 -0.000) 1.212 2.003 ( 0.000 1.802 -0.000) 1.802 2.352 ( 0.000 12.519 -0.000) 12.519 2.353 ( -0.000 -1.693 0.000) 1.693 2.552 ( 0.000 28.364 -0.000) 28.364 2.638 ( 0.000 1.443 -0.000) 1.443 2.911 ( -0.000 -1.219 0.000) 1.219 2.956 ( 0.000 16.442 -0.000) 16.442 3.651 ( -0.000 -7.517 0.000) 7.517 3.662 ( -0.000 -0.788 0.000) 0.788 3.862 ( -0.000 -7.617 0.000) 7.617 3.870 ( 0.000 2.171 -0.000) 2.171 3.980 ( -0.000 -0.000 0.000) 0.000 4.053 ( -0.000 -5.693 0.000) 5.693 4.295 ( -0.000 -8.782 0.000) 8.782 4.353 ( -0.000 -9.913 0.000) 9.913 4.589 ( 0.000 1.052 -0.000) 1.052 4.662 ( -0.000 -1.813 0.000) 1.813 4.733 ( -0.000 -8.627 0.000) 8.627 4.977 ( 0.000 6.092 -0.000) 6.092 5.311 ( 0.000 1.298 -0.000) 1.298 5.318 ( -0.000 -6.224 0.000) 6.224 5.640 ( -0.000 -6.869 0.000) 6.869 5.740 ( -0.000 -0.735 0.000) 0.735 5.990 ( -0.000 -5.672 0.000) 5.672 6.001 ( 0.000 6.743 -0.000) 6.743 6.043 ( -0.000 -4.738 0.000) 4.738 6.271 ( -0.000 -1.577 0.000) 1.577 6.397 ( 0.000 5.409 -0.000) 5.409 6.425 ( -0.000 -2.727 0.000) 2.727 6.441 ( -0.000 -0.754 0.000) 0.754 6.600 ( -0.000 -5.462 0.000) 5.462 6.683 ( 0.000 1.692 -0.000) 1.692 6.795 ( -0.000 -4.767 0.000) 4.767 6.972 ( -0.000 -1.440 0.000) 1.440 7.004 ( -0.000 -6.486 0.000) 6.486 7.093 ( -0.000 -3.877 0.000) 3.877 7.118 ( -0.000 -3.861 0.000) 3.861 7.374 ( -0.000 -3.099 0.000) 3.099 7.482 ( 0.000 5.895 -0.000) 5.895 7.707 ( 0.000 8.915 -0.000) 8.915 8.023 ( -0.000 -11.659 0.000) 11.659 8.096 ( 0.000 3.485 -0.000) 3.485 8.688 ( -0.000 -6.974 0.000) 6.974 8.692 ( -0.000 -10.502 0.000) 10.502 8.786 ( 0.000 6.828 -0.000) 6.828 8.920 ( -0.000 -1.794 0.000) 1.794 9.602 ( -0.000 -6.591 0.000) 6.591 9.679 ( -0.000 -3.386 0.000) 3.386 9.963 ( -0.000 -8.151 0.000) 8.151 10.067 ( 0.000 19.528 -0.000) 19.528 10.928 ( 0.000 2.403 -0.000) 2.403 11.028 ( -0.000 -0.491 0.000) 0.491 11.323 ( -0.000 -1.998 0.000) 1.998 11.325 ( -0.000 -3.005 0.000) 3.005 11.845 ( 0.000 0.373 -0.000) 0.373 12.224 ( -0.000 -2.231 0.000) 2.231 12.230 ( -0.000 -2.395 0.000) 2.395 12.504 ( -0.000 -6.663 0.000) 6.663 12.667 ( 0.000 7.651 -0.000) 7.651 12.752 ( 0.000 7.298 -0.000) 7.298 13.012 ( 0.000 7.973 -0.000) 7.973 13.178 ( 0.000 9.120 -0.000) 9.120 13.298 ( -0.000 -0.141 0.000) 0.141 13.642 ( 0.000 3.548 -0.000) 3.548 13.685 ( 0.000 12.600 -0.000) 12.600 14.395 ( -0.000 -14.270 0.000) 14.270 15.041 ( -0.000 -0.665 0.000) 0.665 15.183 ( 0.000 0.059 -0.000) 0.059 15.267 ( -0.000 -2.479 0.000) 2.479 ======================= Grid point 45 (28/141) ======================= q-point: (-0.60 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 141 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.794 ( -2.436 0.000 1.012) 2.638 1.854 ( -11.417 0.000 1.978) 11.587 1.953 ( 2.233 -0.000 -0.940) 2.422 2.179 ( -2.362 0.000 1.607) 2.857 2.237 ( -2.236 0.000 -1.925) 2.951 2.597 ( 0.708 -0.000 2.765) 2.854 2.760 ( -3.285 0.000 -0.955) 3.421 2.863 ( -6.366 0.000 -0.261) 6.371 2.974 ( 1.977 -0.000 2.344) 3.067 3.197 ( 6.344 -0.000 -4.014) 7.507 3.221 ( 8.461 -0.000 0.738) 8.493 3.230 ( 10.412 -0.000 0.100) 10.413 3.879 ( -3.256 0.000 5.312) 6.230 3.938 ( 1.425 -0.000 0.494) 1.509 3.983 ( 3.542 -0.000 -0.103) 3.544 3.988 ( 1.673 -0.000 -2.042) 2.640 4.217 ( -4.306 0.000 -3.308) 5.430 4.324 ( -0.856 0.000 -3.651) 3.750 4.364 ( -0.180 0.000 -5.258) 5.261 4.478 ( -1.159 0.000 8.313) 8.393 5.038 ( 5.440 -0.000 -9.053) 10.562 5.093 ( -2.212 0.000 3.770) 4.371 5.257 ( 1.102 -0.000 1.832) 2.137 5.407 ( -8.538 0.000 1.105) 8.609 5.538 ( -6.047 0.000 -5.354) 8.076 5.589 ( -0.807 0.000 3.456) 3.549 5.952 ( -4.312 0.000 2.828) 5.156 6.056 ( 5.186 -0.000 3.589) 6.307 6.146 ( -10.100 0.000 -1.362) 10.192 6.229 ( 1.964 -0.000 0.517) 2.031 6.382 ( -4.637 0.000 1.270) 4.808 6.391 ( -1.799 0.000 -4.070) 4.450 6.484 ( -3.020 0.000 -3.538) 4.652 6.635 ( -5.498 0.000 2.437) 6.014 6.698 ( 1.939 -0.000 1.149) 2.253 6.710 ( 2.094 -0.000 1.998) 2.895 6.816 ( -8.320 0.000 4.999) 9.706 7.002 ( 3.257 -0.000 -4.050) 5.197 7.082 ( 1.753 -0.000 -5.239) 5.524 7.097 ( -16.699 0.000 3.954) 17.161 7.282 ( 4.356 -0.000 -2.665) 5.106 7.439 ( 15.605 -0.000 2.182) 15.757 7.822 ( 6.470 -0.000 -0.151) 6.472 7.899 ( 8.448 -0.000 -2.275) 8.749 8.072 ( 1.770 -0.000 2.686) 3.216 8.188 ( 15.337 -0.000 -3.012) 15.630 8.336 ( -1.097 0.000 1.712) 2.034 8.680 ( -2.134 0.000 0.798) 2.278 9.091 ( -0.945 0.000 2.303) 2.490 9.210 ( 8.547 -0.000 -1.617) 8.699 9.703 ( -8.248 0.000 -2.684) 8.674 10.307 ( -17.124 0.000 1.965) 17.236 10.513 ( 2.018 -0.000 1.971) 2.821 10.742 ( 12.203 -0.000 -8.778) 15.032 10.934 ( -0.058 0.000 -2.240) 2.241 11.084 ( 6.495 -0.000 0.479) 6.513 11.327 ( -1.841 0.000 8.275) 8.477 11.740 ( 1.988 -0.000 1.813) 2.691 12.115 ( 0.329 -0.000 4.194) 4.206 12.236 ( -0.029 0.000 0.133) 0.137 12.306 ( 3.214 -0.000 -2.303) 3.954 12.723 ( 5.232 -0.000 1.144) 5.355 12.992 ( -1.028 0.000 -5.943) 6.031 13.133 ( -7.060 0.000 7.576) 10.356 13.330 ( 3.700 -0.000 -15.272) 15.714 13.466 ( 3.004 -0.000 0.106) 3.006 13.803 ( -6.234 0.000 -2.205) 6.612 13.835 ( 3.024 -0.000 12.615) 12.972 14.209 ( -6.811 0.000 -0.367) 6.821 14.868 ( 6.015 -0.000 -0.778) 6.065 15.261 ( -3.494 0.000 4.079) 5.371 15.330 ( -3.360 0.000 -4.704) 5.781 ======================= Grid point 47 (29/141) ======================= q-point: (-0.50 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.625 ( -7.921 7.967 1.394) 11.321 1.774 ( -2.869 0.926 0.978) 3.170 1.946 ( -1.360 8.108 -0.375) 8.230 2.078 ( 0.853 6.845 -0.995) 6.969 2.240 ( -2.502 -7.147 -1.027) 7.642 2.563 ( -3.348 2.094 1.534) 4.236 2.734 ( -2.346 1.483 0.698) 2.862 2.810 ( 0.467 -3.011 1.277) 3.304 3.013 ( 2.632 3.165 0.521) 4.149 3.241 ( 5.106 5.216 -2.024) 7.575 3.404 ( 9.462 -2.221 0.995) 9.770 3.467 ( 9.456 -7.745 -0.134) 12.224 3.793 ( -7.163 1.548 2.627) 7.785 3.957 ( -3.971 -0.689 -2.624) 4.809 3.976 ( 1.110 0.013 -0.101) 1.115 4.017 ( 0.025 0.646 -1.018) 1.206 4.124 ( -3.275 -1.639 -1.999) 4.172 4.276 ( 0.420 4.356 -1.728) 4.705 4.413 ( 1.630 -6.269 -1.725) 6.704 4.487 ( -1.352 -3.688 6.232) 7.367 4.964 ( -3.346 10.791 -2.666) 11.608 5.135 ( 1.996 -5.450 -2.952) 6.512 5.229 ( -1.967 5.566 1.317) 6.048 5.319 ( -1.335 -1.836 2.413) 3.313 5.445 ( -5.405 -4.124 -2.961) 7.415 5.626 ( 0.277 -5.459 1.811) 5.758 5.906 ( -3.077 -2.202 0.649) 3.839 5.971 ( -8.070 -0.322 0.331) 8.083 6.133 ( 3.261 1.192 2.002) 4.008 6.228 ( -1.912 0.205 0.404) 1.965 6.349 ( -0.977 -2.512 -1.776) 3.228 6.379 ( 0.016 -2.798 -0.714) 2.888 6.440 ( -3.036 -2.396 -0.819) 3.954 6.551 ( -3.796 0.135 0.708) 3.864 6.682 ( -1.587 -2.801 -1.493) 3.549 6.735 ( -4.140 -2.647 3.025) 5.770 6.827 ( 4.848 -2.654 4.921) 7.400 6.862 ( -6.998 3.704 1.214) 8.010 7.030 ( -2.621 -3.805 -4.364) 6.355 7.052 ( -1.988 -0.611 -2.977) 3.632 7.362 ( 5.356 0.980 -1.269) 5.591 7.583 ( 3.281 1.640 1.820) 4.095 7.892 ( -3.414 -0.870 0.791) 3.610 7.917 ( 4.526 3.541 -1.800) 6.022 8.213 ( 3.633 2.385 0.929) 4.444 8.414 ( 12.023 -2.314 1.143) 12.297 8.467 ( 10.279 -2.490 -0.773) 10.604 8.677 ( 7.334 0.474 -2.547) 7.778 9.070 ( -4.973 0.420 3.827) 6.289 9.402 ( 13.690 -0.890 -1.757) 13.831 9.569 ( -4.110 1.822 -1.443) 4.722 10.017 ( -17.450 -1.772 0.816) 17.559 10.504 ( 0.011 6.955 1.731) 7.167 10.888 ( 7.114 -1.574 -8.221) 10.986 10.960 ( 1.577 -1.186 0.267) 1.991 11.210 ( 6.713 -0.162 0.262) 6.720 11.302 ( -3.928 -1.576 6.788) 7.999 11.793 ( 2.883 -0.789 0.264) 3.000 12.136 ( 0.517 -1.176 4.412) 4.595 12.219 ( -1.320 0.331 -1.366) 1.928 12.360 ( 1.787 -2.556 -2.231) 3.834 12.799 ( 3.704 3.212 1.466) 5.117 12.933 ( -2.092 3.595 -1.369) 4.379 13.099 ( 0.354 -0.724 10.081) 10.113 13.307 ( 0.499 1.973 -14.261) 14.406 13.439 ( -5.133 -0.303 -5.952) 7.865 13.728 ( 1.624 6.292 3.748) 7.501 13.953 ( 0.849 -6.368 12.155) 13.748 14.078 ( -4.926 1.878 -6.322) 8.232 14.963 ( 3.568 -1.916 -0.212) 4.055 15.212 ( -2.712 0.658 2.146) 3.520 15.258 ( -3.402 -0.680 -2.649) 4.365 ======================= Grid point 48 (30/141) ======================= q-point: (-0.40 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 141 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.439 ( 0.000 15.687 -0.000) 15.687 1.719 ( 0.000 4.305 -0.000) 4.305 1.800 ( 0.000 12.546 -0.000) 12.546 2.063 ( 0.000 2.761 -0.000) 2.761 2.286 ( -0.000 -5.347 0.000) 5.347 2.494 ( 0.000 3.972 -0.000) 3.972 2.684 ( 0.000 3.156 -0.000) 3.156 2.865 ( -0.000 -3.880 0.000) 3.880 2.964 ( 0.000 12.069 -0.000) 12.069 3.226 ( 0.000 8.815 -0.000) 8.815 3.523 ( -0.000 -3.467 0.000) 3.467 3.625 ( -0.000 -1.690 0.000) 1.690 3.710 ( -0.000 -6.578 0.000) 6.578 3.914 ( -0.000 -0.645 0.000) 0.645 3.959 ( -0.000 -0.038 0.000) 0.038 4.003 ( 0.000 1.167 -0.000) 1.167 4.152 ( -0.000 -5.751 0.000) 5.751 4.256 ( 0.000 0.464 -0.000) 0.464 4.493 ( -0.000 -6.816 0.000) 6.816 4.551 ( -0.000 -8.371 0.000) 8.371 4.804 ( 0.000 11.402 -0.000) 11.402 5.143 ( 0.000 8.901 -0.000) 8.901 5.210 ( -0.000 -5.431 0.000) 5.431 5.320 ( 0.000 0.129 -0.000) 0.129 5.462 ( -0.000 -9.874 0.000) 9.874 5.688 ( -0.000 -4.893 0.000) 4.893 5.897 ( -0.000 -3.367 0.000) 3.367 5.934 ( -0.000 -4.306 0.000) 4.306 6.129 ( 0.000 5.440 -0.000) 5.440 6.222 ( -0.000 -3.190 0.000) 3.190 6.376 ( -0.000 -3.722 0.000) 3.722 6.393 ( -0.000 -0.687 0.000) 0.687 6.442 ( -0.000 -3.166 0.000) 3.166 6.524 ( -0.000 -1.763 0.000) 1.763 6.705 ( -0.000 -4.249 0.000) 4.249 6.730 ( 0.000 0.099 -0.000) 0.099 6.794 ( -0.000 -4.578 0.000) 4.578 6.937 ( -0.000 -2.566 0.000) 2.566 6.993 ( -0.000 -5.118 0.000) 5.118 7.058 ( -0.000 -2.229 0.000) 2.229 7.398 ( 0.000 2.212 -0.000) 2.212 7.579 ( 0.000 3.756 -0.000) 3.756 7.874 ( -0.000 -4.029 0.000) 4.029 7.898 ( 0.000 8.647 -0.000) 8.647 8.190 ( 0.000 4.871 -0.000) 4.871 8.540 ( -0.000 -4.994 0.000) 4.994 8.578 ( -0.000 -3.790 0.000) 3.790 8.868 ( 0.000 2.129 -0.000) 2.129 8.925 ( 0.000 1.667 -0.000) 1.667 9.536 ( -0.000 -0.984 0.000) 0.984 9.615 ( -0.000 -2.656 0.000) 2.656 9.833 ( -0.000 -5.347 0.000) 5.347 10.400 ( 0.000 13.315 -0.000) 13.315 10.960 ( -0.000 -0.962 0.000) 0.962 10.984 ( -0.000 -1.556 0.000) 1.556 11.279 ( -0.000 -1.954 0.000) 1.954 11.288 ( -0.000 -1.042 0.000) 1.042 11.832 ( -0.000 -1.127 0.000) 1.127 12.182 ( -0.000 -1.877 0.000) 1.877 12.190 ( -0.000 -1.383 0.000) 1.383 12.401 ( -0.000 -3.757 0.000) 3.757 12.787 ( 0.000 4.314 -0.000) 4.314 12.875 ( 0.000 5.257 -0.000) 5.257 13.132 ( 0.000 4.255 -0.000) 4.255 13.281 ( -0.000 -1.622 0.000) 1.622 13.328 ( 0.000 5.562 -0.000) 5.562 13.716 ( 0.000 4.330 -0.000) 4.330 13.907 ( 0.000 9.102 -0.000) 9.102 14.124 ( -0.000 -12.404 0.000) 12.404 15.012 ( -0.000 -2.056 0.000) 2.056 15.183 ( 0.000 0.405 -0.000) 0.405 15.234 ( -0.000 -1.249 0.000) 1.249 ======================= Grid point 58 (31/141) ======================= q-point: ( 0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 78 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.594 ( 0.000 0.000 -0.000) 0.000 1.760 ( 0.000 0.000 -0.000) 0.000 1.986 ( 0.000 0.000 -0.000) 0.000 2.105 ( -0.000 -0.000 0.000) 0.000 2.177 ( 0.000 0.000 -0.000) 0.000 2.532 ( 0.000 0.000 -0.000) 0.000 2.753 ( -0.000 -0.000 0.000) 0.000 2.782 ( 0.000 0.000 -0.000) 0.000 3.057 ( 0.000 0.000 -0.000) 0.000 3.302 ( 0.000 0.000 -0.000) 0.000 3.505 ( 0.000 0.000 -0.000) 0.000 3.610 ( 0.000 0.000 -0.000) 0.000 3.646 ( 0.000 0.000 -0.000) 0.000 3.885 ( 0.000 0.000 -0.000) 0.000 3.996 ( 0.000 0.000 -0.000) 0.000 4.015 ( -0.000 -0.000 0.000) 0.000 4.085 ( 0.000 0.000 -0.000) 0.000 4.316 ( 0.000 0.000 -0.000) 0.000 4.381 ( -0.000 -0.000 0.000) 0.000 4.457 ( 0.000 0.000 -0.000) 0.000 5.020 ( 0.000 0.000 -0.000) 0.000 5.069 ( 0.000 0.000 -0.000) 0.000 5.245 ( 0.000 0.000 -0.000) 0.000 5.332 ( 0.000 0.000 -0.000) 0.000 5.350 ( 0.000 0.000 -0.000) 0.000 5.606 ( 0.000 0.000 -0.000) 0.000 5.864 ( 0.000 0.000 -0.000) 0.000 5.896 ( 0.000 0.000 -0.000) 0.000 6.183 ( 0.000 0.000 -0.000) 0.000 6.194 ( 0.000 0.000 -0.000) 0.000 6.324 ( 0.000 0.000 -0.000) 0.000 6.379 ( 0.000 0.000 -0.000) 0.000 6.388 ( 0.000 0.000 -0.000) 0.000 6.515 ( 0.000 0.000 -0.000) 0.000 6.654 ( 0.000 0.000 -0.000) 0.000 6.686 ( 0.000 0.000 -0.000) 0.000 6.827 ( 0.000 0.000 -0.000) 0.000 6.899 ( 0.000 0.000 -0.000) 0.000 6.937 ( 0.000 0.000 -0.000) 0.000 7.035 ( 0.000 0.000 -0.000) 0.000 7.420 ( 0.000 0.000 -0.000) 0.000 7.618 ( 0.000 0.000 -0.000) 0.000 7.839 ( 0.000 0.000 -0.000) 0.000 7.991 ( 0.000 0.000 -0.000) 0.000 8.243 ( 0.000 0.000 -0.000) 0.000 8.492 ( 0.000 0.000 -0.000) 0.000 8.542 ( 0.000 0.000 -0.000) 0.000 8.887 ( 0.000 0.000 -0.000) 0.000 8.949 ( 0.000 0.000 -0.000) 0.000 9.533 ( 0.000 0.000 -0.000) 0.000 9.587 ( 0.000 0.000 -0.000) 0.000 9.772 ( 0.000 0.000 -0.000) 0.000 10.545 ( 0.000 0.000 -0.000) 0.000 10.914 ( 0.000 0.000 -0.000) 0.000 10.990 ( 0.000 0.000 -0.000) 0.000 11.259 ( 0.000 0.000 -0.000) 0.000 11.278 ( 0.000 0.000 -0.000) 0.000 11.819 ( 0.000 0.000 -0.000) 0.000 12.161 ( 0.000 0.000 -0.000) 0.000 12.178 ( 0.000 0.000 -0.000) 0.000 12.362 ( 0.000 0.000 -0.000) 0.000 12.829 ( 0.000 0.000 -0.000) 0.000 12.936 ( 0.000 0.000 -0.000) 0.000 13.175 ( 0.000 0.000 -0.000) 0.000 13.256 ( 0.000 0.000 -0.000) 0.000 13.383 ( 0.000 0.000 -0.000) 0.000 13.785 ( 0.000 0.000 -0.000) 0.000 13.972 ( 0.000 0.000 -0.000) 0.000 14.003 ( 0.000 0.000 -0.000) 0.000 14.986 ( 0.000 0.000 -0.000) 0.000 15.195 ( 0.000 0.000 -0.000) 0.000 15.215 ( 0.000 0.000 -0.000) 0.000 ======================= Grid point 105 (32/141) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 141 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.364 ( 5.567 -0.000 19.789) 20.557 0.412 ( 1.655 -0.000 22.238) 22.299 0.746 ( 1.686 -0.000 39.645) 39.681 1.230 ( -1.644 0.000 -7.735) 7.908 1.336 ( 0.945 -0.000 -8.613) 8.665 2.261 ( -2.423 0.000 -8.851) 9.177 2.409 ( 18.273 -0.000 -0.370) 18.276 2.529 ( -10.473 0.000 -4.146) 11.264 2.728 ( 6.617 -0.000 1.912) 6.888 2.916 ( -1.575 0.000 -1.704) 2.321 3.442 ( -1.434 0.000 2.372) 2.772 3.601 ( -1.924 0.000 -1.723) 2.583 4.112 ( 21.838 -0.000 0.124) 21.839 4.145 ( -11.238 0.000 3.296) 11.712 4.193 ( -2.463 0.000 -1.717) 3.003 4.203 ( 4.630 -0.000 3.752) 5.959 4.401 ( 4.046 -0.000 -2.301) 4.655 4.575 ( 2.458 -0.000 -8.835) 9.171 4.808 ( -0.273 0.000 0.230) 0.357 4.812 ( -1.229 0.000 -0.583) 1.360 4.999 ( -3.130 0.000 0.717) 3.211 5.020 ( -1.678 0.000 4.895) 5.175 5.278 ( 3.804 -0.000 -4.373) 5.796 5.379 ( 2.675 -0.000 -2.974) 4.000 5.619 ( -5.939 0.000 3.628) 6.960 5.651 ( 5.650 -0.000 1.618) 5.877 5.936 ( 0.623 -0.000 -0.033) 0.624 6.040 ( -0.925 0.000 -0.650) 1.130 6.141 ( 1.830 -0.000 -0.392) 1.871 6.166 ( 0.901 -0.000 2.089) 2.275 6.216 ( 0.645 -0.000 -0.658) 0.921 6.445 ( -2.502 0.000 -6.281) 6.762 6.554 ( -0.478 0.000 -0.504) 0.695 6.598 ( 1.431 -0.000 -0.714) 1.599 6.688 ( 1.524 -0.000 2.418) 2.858 6.745 ( 1.812 -0.000 4.373) 4.733 6.956 ( 8.885 -0.000 -1.514) 9.014 7.040 ( -2.809 0.000 -1.095) 3.015 7.045 ( -2.448 0.000 2.914) 3.806 7.237 ( -45.726 0.000 -2.699) 45.805 7.291 ( -4.063 0.000 14.982) 15.523 7.698 ( -2.466 0.000 0.002) 2.466 7.743 ( 1.947 -0.000 -1.283) 2.332 7.841 ( -7.970 0.000 3.475) 8.695 7.970 ( 58.351 -0.000 -1.742) 58.377 8.433 ( -14.043 0.000 -16.419) 21.605 8.904 ( 1.630 -0.000 2.009) 2.587 9.092 ( 3.183 -0.000 -3.115) 4.453 9.124 ( -2.024 0.000 3.113) 3.713 9.288 ( -6.933 0.000 8.752) 11.165 9.423 ( -0.967 0.000 -1.484) 1.771 9.750 ( 3.456 -0.000 -3.150) 4.676 10.813 ( 2.477 -0.000 -1.206) 2.755 10.880 ( 10.230 -0.000 -3.184) 10.714 10.970 ( -7.165 0.000 4.654) 8.544 11.016 ( -8.471 0.000 3.203) 9.056 11.295 ( 11.151 -0.000 -2.167) 11.360 11.416 ( -2.504 0.000 -5.285) 5.849 12.207 ( -1.407 0.000 -0.511) 1.497 12.237 ( 1.914 -0.000 -1.641) 2.521 12.352 ( 2.083 -0.000 5.565) 5.942 12.480 ( -2.428 0.000 2.469) 3.463 12.799 ( -0.292 0.000 2.562) 2.579 12.914 ( 0.949 -0.000 -0.583) 1.114 13.061 ( -1.888 0.000 -2.761) 3.345 13.069 ( 0.980 -0.000 -3.935) 4.055 13.343 ( -37.487 0.000 1.644) 37.523 13.352 ( 7.307 -0.000 0.979) 7.372 14.830 ( -1.171 0.000 -0.307) 1.211 14.840 ( 13.000 -0.000 -0.691) 13.018 15.076 ( 1.704 -0.000 1.457) 2.242 15.135 ( -0.712 0.000 -0.187) 0.736 ======================= Grid point 106 (33/141) ======================= q-point: ( 0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.680 ( 20.110 -4.672 11.922) 23.841 0.801 ( 11.756 -7.626 22.903) 26.850 1.179 ( 27.500 -14.896 15.191) 34.769 1.322 ( 7.371 -12.679 -2.744) 14.920 1.515 ( 19.415 -4.623 -8.427) 21.664 2.148 ( -6.342 0.214 -7.777) 10.037 2.361 ( -6.095 0.363 -9.934) 11.661 2.489 ( 2.140 3.929 4.562) 6.389 2.844 ( 7.110 3.553 1.442) 8.078 2.950 ( 5.037 -1.520 -2.598) 5.868 3.487 ( 2.211 -1.804 3.549) 4.554 3.581 ( -0.519 -2.716 -2.762) 3.908 3.974 ( -4.578 1.046 4.782) 6.702 4.116 ( -2.332 2.961 -1.233) 3.965 4.189 ( -2.873 -2.740 1.746) 4.338 4.272 ( 1.812 12.025 -1.631) 12.269 4.456 ( -7.305 -2.686 -4.443) 8.962 4.590 ( 1.790 -0.267 -9.979) 10.142 4.709 ( -6.556 4.913 2.437) 8.547 4.758 ( -4.506 2.449 -0.955) 5.217 4.928 ( -3.080 2.733 2.323) 4.728 5.064 ( -3.391 -7.881 2.580) 8.959 5.272 ( 0.516 8.952 -0.238) 8.970 5.458 ( 2.188 -9.220 -3.595) 10.135 5.588 ( 0.125 -2.054 -3.187) 3.794 5.746 ( 4.716 1.928 3.981) 6.466 5.935 ( 1.086 3.081 1.786) 3.723 6.074 ( 2.033 -3.099 -1.625) 4.047 6.115 ( -2.849 -0.694 0.259) 2.944 6.163 ( -0.294 1.153 3.375) 3.579 6.289 ( 1.995 -6.808 -1.134) 7.185 6.383 ( -3.371 -1.385 -6.674) 7.605 6.504 ( -1.759 4.640 0.047) 4.963 6.644 ( 1.302 -4.534 -0.395) 4.734 6.795 ( 4.847 0.524 0.075) 4.876 6.810 ( 4.354 -0.717 1.457) 4.647 6.968 ( -2.975 -0.736 3.338) 4.531 6.975 ( -3.552 -0.873 4.459) 5.767 7.038 ( 2.151 -1.567 -1.185) 2.913 7.096 ( 0.640 -6.330 0.361) 6.372 7.337 ( 8.014 9.200 2.814) 12.521 7.666 ( -6.521 -2.496 -1.783) 7.206 7.726 ( -4.705 -6.729 -1.485) 8.344 8.000 ( 20.052 -4.927 6.586) 21.673 8.137 ( -0.249 -6.193 2.016) 6.517 8.734 ( -5.402 13.607 -1.562) 14.724 8.870 ( -15.104 7.892 1.974) 17.155 9.075 ( -0.203 3.268 -0.471) 3.308 9.284 ( 9.063 -0.812 -8.742) 12.618 9.327 ( -7.914 1.636 -0.655) 8.108 9.798 ( 25.401 -26.775 -32.035) 48.871 9.864 ( 18.210 -4.329 -8.558) 20.581 10.482 ( -23.466 14.636 1.027) 27.675 10.544 ( -19.924 4.571 -6.132) 21.342 10.903 ( 2.660 1.480 -2.217) 3.765 11.105 ( 2.784 -6.261 1.716) 7.064 11.453 ( 15.482 9.319 -3.828) 18.472 11.736 ( 11.176 -9.195 -4.123) 15.048 12.210 ( -1.190 -2.877 -1.645) 3.521 12.271 ( 0.638 -2.101 1.258) 2.531 12.440 ( -1.966 -1.756 1.630) 3.099 12.468 ( 7.098 -2.672 5.253) 9.226 12.735 ( -5.181 11.138 10.458) 16.133 12.845 ( -5.412 4.177 4.664) 8.277 12.901 ( 1.567 -5.412 3.402) 6.581 13.087 ( 2.323 -2.725 -3.161) 4.776 13.176 ( -3.001 -14.345 1.419) 14.724 13.561 ( 12.523 -1.971 3.849) 13.249 14.778 ( -3.472 1.621 0.072) 3.832 15.019 ( 0.771 0.235 -4.720) 4.788 15.126 ( -0.335 -0.624 -0.854) 1.109 15.272 ( 11.893 -2.085 -12.331) 17.258 ======================= Grid point 107 (34/141) ======================= q-point: ( 0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.087 ( 16.555 -5.873 10.052) 20.238 1.142 ( 15.455 -5.810 14.683) 22.095 1.486 ( 6.957 -8.251 -5.348) 12.045 1.909 ( 19.277 -4.082 -9.057) 21.687 1.950 ( 27.084 -17.480 7.376) 33.068 2.065 ( -1.908 -8.656 -2.729) 9.274 2.300 ( 3.417 -2.695 -7.633) 8.787 2.501 ( 0.818 1.957 4.594) 5.060 2.915 ( 7.396 5.038 -0.324) 8.955 3.065 ( 5.943 -0.502 -1.861) 6.248 3.505 ( -0.897 0.843 0.100) 1.235 3.635 ( 0.711 -5.458 0.129) 5.506 3.894 ( -5.089 1.497 2.865) 6.029 4.078 ( 0.030 0.777 -2.097) 2.236 4.126 ( -5.585 1.483 -2.786) 6.415 4.181 ( -2.711 1.109 3.940) 4.910 4.285 ( -9.889 2.174 -2.785) 10.502 4.524 ( -8.075 4.370 1.878) 9.372 4.568 ( -3.106 3.293 -6.481) 7.906 4.649 ( -2.856 0.160 -2.951) 4.110 4.827 ( -6.511 3.087 2.380) 7.588 5.023 ( -9.674 -4.233 1.564) 10.674 5.184 ( -0.181 8.163 2.569) 8.560 5.516 ( -1.517 -6.270 -0.148) 6.452 5.698 ( 7.035 2.666 -2.848) 8.044 5.799 ( 3.637 -1.536 -0.551) 3.986 5.937 ( 1.922 1.324 2.059) 3.112 6.059 ( -1.148 -0.003 -2.353) 2.618 6.140 ( -2.530 -3.576 2.849) 5.225 6.202 ( 5.204 -1.328 2.466) 5.909 6.319 ( -4.252 -2.976 -5.066) 7.253 6.382 ( 0.807 -0.874 5.642) 5.766 6.456 ( 2.278 0.108 -5.958) 6.380 6.708 ( -0.036 -5.551 -0.163) 5.553 6.793 ( -3.514 2.969 3.809) 5.973 6.894 ( 4.075 -1.713 -2.699) 5.180 6.956 ( 0.435 -0.897 4.907) 5.008 6.994 ( 2.134 -2.817 -1.373) 3.792 7.103 ( -0.937 -5.110 3.407) 6.213 7.156 ( 3.338 -2.706 -0.903) 4.391 7.342 ( -0.251 4.397 -1.651) 4.703 7.576 ( -8.381 -6.734 -3.663) 11.358 7.712 ( -3.483 -5.402 -0.828) 6.481 8.059 ( -3.961 0.521 1.094) 4.143 8.374 ( -6.761 7.428 2.466) 10.343 8.493 ( -4.946 14.814 0.081) 15.618 8.690 ( 14.540 -0.537 11.945) 18.826 9.001 ( -3.604 5.851 -0.053) 6.872 9.101 ( -13.321 3.178 0.266) 13.697 9.341 ( 1.236 3.176 -6.658) 7.480 9.889 ( -0.651 11.816 -0.182) 11.836 10.030 ( -6.034 5.199 -0.937) 8.019 10.127 ( -4.901 2.175 -2.235) 5.809 10.432 ( 6.989 -12.835 -23.567) 27.731 10.944 ( 2.839 -0.595 -3.254) 4.359 11.215 ( 1.939 -6.075 2.719) 6.932 11.547 ( 8.309 9.433 -3.457) 13.038 11.881 ( 3.841 -0.320 -0.936) 3.966 12.159 ( -2.978 1.905 0.268) 3.545 12.349 ( 2.429 -3.331 -0.713) 4.184 12.421 ( -4.913 -0.419 8.022) 9.416 12.559 ( 0.839 3.502 5.674) 6.720 12.706 ( 1.900 -0.286 -1.484) 2.428 12.792 ( 2.311 -6.535 0.575) 6.956 13.027 ( 2.909 -6.098 3.813) 7.758 13.197 ( 8.616 -1.649 1.150) 8.848 13.282 ( -0.269 -10.511 1.411) 10.609 13.765 ( 7.215 -2.148 -0.817) 7.572 14.698 ( -3.478 3.606 5.873) 7.720 14.989 ( -1.463 1.381 -4.752) 5.160 15.138 ( 0.949 -1.679 -1.399) 2.382 15.355 ( 2.575 -0.505 -8.528) 8.922 ======================= Grid point 108 (35/141) ======================= q-point: ( 0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.418 ( 12.094 -4.487 11.821) 17.497 1.478 ( 14.891 -4.634 1.941) 15.715 1.612 ( 2.798 -2.609 -1.187) 4.006 2.019 ( 4.385 -3.975 -9.237) 10.970 2.188 ( 3.538 -5.979 -3.558) 7.805 2.493 ( 0.736 1.684 2.631) 3.209 2.528 ( 16.845 -13.297 2.712) 21.632 2.582 ( 15.885 -10.005 -0.572) 18.782 3.022 ( 9.365 1.802 1.020) 9.592 3.106 ( 1.091 2.482 -2.775) 3.879 3.458 ( -2.361 2.671 -0.435) 3.591 3.656 ( -2.978 -2.533 -0.334) 3.923 3.810 ( -4.195 0.176 1.024) 4.322 3.978 ( -5.010 3.964 -0.408) 6.402 4.056 ( -6.052 2.536 2.941) 7.190 4.094 ( -6.383 -0.893 -3.955) 7.561 4.198 ( 1.501 -1.276 0.155) 1.976 4.341 ( -6.721 5.900 2.925) 9.410 4.462 ( -4.846 0.461 -1.022) 4.974 4.654 ( -1.853 -1.661 0.364) 2.515 4.718 ( 0.871 -1.418 -5.926) 6.156 4.867 ( -10.295 -0.691 -0.037) 10.318 5.115 ( -1.816 5.374 3.901) 6.884 5.538 ( -1.908 -0.911 1.568) 2.632 5.676 ( 0.029 4.777 0.530) 4.806 5.870 ( 1.838 0.535 1.363) 2.350 6.002 ( -0.464 -2.716 -5.439) 6.098 6.043 ( -0.811 -1.538 -2.587) 3.117 6.133 ( 0.361 -3.632 1.641) 4.002 6.261 ( -4.293 -2.387 -0.949) 5.003 6.325 ( 4.941 -1.752 1.018) 5.340 6.362 ( -1.395 1.262 5.249) 5.576 6.544 ( 4.918 -2.954 -2.595) 6.297 6.702 ( -4.064 1.596 4.053) 5.958 6.750 ( -1.684 -5.699 -0.569) 5.970 6.938 ( -1.915 0.444 -2.720) 3.355 6.978 ( 3.770 0.738 -4.227) 5.712 7.065 ( -0.205 -4.130 3.878) 5.669 7.139 ( 0.538 -2.393 0.271) 2.468 7.231 ( -4.053 -2.480 2.522) 5.380 7.260 ( -0.964 -1.116 -0.620) 1.600 7.508 ( -6.154 -10.678 -4.874) 13.253 7.702 ( -2.135 -1.365 1.924) 3.182 7.970 ( -4.874 1.008 1.132) 5.105 8.131 ( -6.831 8.036 -0.584) 10.563 8.312 ( 0.971 11.389 1.273) 11.501 8.838 ( -11.451 5.081 -2.413) 12.758 8.858 ( -3.469 8.872 3.002) 9.987 8.990 ( 10.288 1.843 7.925) 13.116 9.269 ( -0.492 6.457 -5.828) 8.711 9.666 ( -5.730 6.319 -0.543) 8.547 9.923 ( -0.676 14.895 -0.737) 14.929 10.233 ( 10.379 -7.661 3.662) 13.409 10.564 ( 2.867 -6.023 -14.242) 15.727 10.979 ( 1.552 -0.500 -2.772) 3.216 11.295 ( 0.252 -3.652 5.934) 6.972 11.561 ( 5.543 7.638 -5.511) 10.928 11.899 ( 0.424 3.712 0.037) 3.736 12.093 ( -2.213 2.888 0.885) 3.744 12.307 ( -7.582 1.947 8.747) 11.739 12.393 ( -2.044 -4.049 -2.723) 5.290 12.572 ( 4.542 4.087 3.919) 7.259 12.748 ( 1.521 -4.559 -4.220) 6.396 12.940 ( 2.404 -8.966 1.802) 9.456 13.162 ( 6.278 -4.894 1.307) 8.067 13.354 ( 0.701 -6.951 -0.133) 6.988 13.374 ( 4.798 -2.046 4.584) 6.944 13.833 ( 0.994 -2.003 -7.855) 8.167 14.636 ( -1.904 4.925 12.333) 13.416 14.915 ( -3.191 1.949 -6.517) 7.513 15.180 ( 2.194 -2.079 -2.008) 3.629 15.370 ( 0.851 -1.182 -3.669) 3.947 ======================= Grid point 109 (36/141) ======================= q-point: ( 0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.598 ( 3.933 0.112 6.490) 7.590 1.643 ( 1.025 -0.906 2.580) 2.920 1.787 ( 13.750 -4.542 -1.533) 14.561 2.113 ( 2.728 -5.065 -8.265) 10.070 2.290 ( 2.438 -3.332 0.085) 4.129 2.488 ( 1.240 1.107 0.375) 1.704 2.782 ( 4.522 -4.473 -1.353) 6.503 2.837 ( 3.503 -1.753 1.029) 4.050 3.106 ( 5.717 -1.607 0.276) 5.945 3.171 ( 2.281 -1.554 -1.562) 3.171 3.387 ( -1.611 3.818 0.482) 4.172 3.632 ( 1.341 -0.197 0.803) 1.576 3.737 ( -4.881 -0.836 -3.054) 5.818 3.881 ( -4.879 1.599 3.737) 6.350 3.930 ( -3.351 1.913 0.967) 3.978 3.989 ( -5.900 1.302 -2.009) 6.367 4.229 ( -0.642 2.403 -0.418) 2.522 4.256 ( 2.754 0.776 1.624) 3.290 4.374 ( -5.307 -0.945 1.072) 5.496 4.642 ( -3.063 -0.551 -0.709) 3.192 4.711 ( -1.700 -1.916 2.269) 3.422 4.869 ( 6.616 -8.031 -7.241) 12.676 5.031 ( -4.231 3.213 3.405) 6.310 5.446 ( -4.603 7.878 4.972) 10.391 5.687 ( 2.031 -2.130 -1.403) 3.260 5.882 ( 0.021 1.287 0.591) 1.416 5.929 ( -4.978 0.264 -0.615) 5.022 6.002 ( -1.990 -1.447 -5.992) 6.478 6.187 ( -3.881 -1.605 3.944) 5.761 6.249 ( 3.474 -0.225 -2.004) 4.016 6.318 ( -1.976 -0.565 -0.105) 2.058 6.439 ( 3.113 -1.611 5.200) 6.271 6.639 ( 3.740 -2.544 -0.272) 4.531 6.661 ( -1.905 -1.673 -0.750) 2.644 6.757 ( -2.157 -1.404 2.641) 3.687 6.845 ( -5.494 0.703 -4.574) 7.183 6.986 ( 1.163 2.891 -3.358) 4.581 7.075 ( -6.617 -6.778 3.486) 10.093 7.105 ( -2.666 1.226 0.948) 3.084 7.192 ( 1.909 0.515 -4.796) 5.188 7.328 ( 3.541 -1.727 2.083) 4.456 7.557 ( 0.963 -3.823 -0.242) 3.949 7.705 ( -0.983 -6.714 2.064) 7.092 7.894 ( -3.562 2.335 0.548) 4.294 8.009 ( -1.068 4.013 -0.673) 4.206 8.295 ( 4.578 5.225 2.579) 7.410 8.638 ( -5.032 2.911 -3.355) 6.712 8.751 ( -3.282 3.106 3.969) 6.014 9.043 ( 1.135 6.678 0.858) 6.828 9.221 ( 1.842 3.362 -0.978) 3.956 9.582 ( -2.123 -1.898 -0.794) 2.956 9.776 ( -0.287 12.529 -0.692) 12.551 10.476 ( 8.924 -1.817 2.564) 9.461 10.584 ( -0.160 -3.165 -7.577) 8.214 10.993 ( 0.348 -0.817 -1.788) 1.997 11.331 ( -0.481 0.020 9.080) 9.093 11.563 ( 2.938 2.937 -9.383) 10.262 11.850 ( 0.805 5.766 1.877) 6.117 12.033 ( -1.741 3.249 1.884) 4.139 12.191 ( -7.157 -0.135 6.815) 9.883 12.391 ( -2.281 -5.732 -6.003) 8.608 12.633 ( 5.405 4.450 3.237) 7.714 12.809 ( 1.969 -3.956 -3.493) 5.633 13.028 ( -1.643 -5.882 2.752) 6.698 13.312 ( 6.243 0.404 -2.408) 6.703 13.362 ( -5.229 -5.951 -5.845) 9.845 13.486 ( 5.539 -1.549 9.333) 10.963 13.844 ( 0.614 -1.692 -3.884) 4.281 14.587 ( -3.056 4.847 7.174) 9.182 14.835 ( -1.330 0.559 -4.184) 4.426 15.230 ( 2.203 -1.403 -2.745) 3.789 15.387 ( 0.179 -1.196 0.199) 1.226 ======================= Grid point 110 (37/141) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.625 ( -0.831 3.181 4.830) 5.843 1.663 ( -0.152 -0.472 3.936) 3.967 1.966 ( 2.692 0.163 -3.512) 4.428 2.133 ( -1.769 -3.039 -8.802) 9.478 2.311 ( -0.033 0.616 2.559) 2.632 2.509 ( 0.135 -0.051 -1.226) 1.234 2.818 ( 1.167 1.068 -0.267) 1.604 2.888 ( 1.859 -0.947 2.076) 2.943 3.109 ( -6.375 0.093 -3.651) 7.347 3.232 ( 4.683 0.324 -0.041) 4.695 3.358 ( 0.862 -0.565 2.635) 2.829 3.652 ( -6.195 -4.888 -2.574) 8.300 3.717 ( 6.159 6.751 -0.088) 9.139 3.782 ( -2.101 1.562 0.061) 2.619 3.866 ( -3.166 -0.054 0.139) 3.169 3.976 ( 2.650 -4.405 2.211) 5.596 4.181 ( -1.533 2.897 -1.114) 3.462 4.301 ( 2.610 0.180 1.414) 2.974 4.342 ( -2.675 -1.402 1.307) 3.291 4.576 ( 1.782 1.068 -0.665) 2.181 4.787 ( -0.033 -3.159 -0.159) 3.163 4.912 ( -2.537 2.872 1.985) 4.316 5.061 ( 4.568 -6.804 -3.966) 9.104 5.316 ( -2.710 5.016 6.349) 8.533 5.724 ( 0.528 0.703 -1.304) 1.573 5.843 ( -1.556 -1.671 -2.032) 3.056 5.916 ( 4.143 2.933 2.776) 5.785 6.001 ( 0.868 -3.016 -6.079) 6.841 6.137 ( -2.446 1.110 2.322) 3.550 6.274 ( 0.614 0.698 0.740) 1.189 6.310 ( 0.325 -0.651 0.179) 0.749 6.475 ( -0.822 2.396 3.460) 4.288 6.639 ( -0.877 0.109 -3.247) 3.365 6.689 ( -1.756 -0.125 0.033) 1.761 6.742 ( 1.551 -1.246 0.498) 2.051 6.808 ( 1.298 -1.933 1.235) 2.636 6.953 ( -1.297 1.744 -3.507) 4.126 7.037 ( -1.422 -2.953 0.464) 3.311 7.099 ( 0.620 -0.439 4.641) 4.703 7.201 ( -0.594 -1.337 -5.805) 5.987 7.389 ( 4.880 3.831 -2.394) 6.650 7.554 ( -1.527 5.134 4.673) 7.109 7.767 ( -1.342 2.875 -0.905) 3.299 7.813 ( -1.725 -4.599 0.512) 4.938 7.995 ( 0.907 -1.607 -0.972) 2.086 8.332 ( -0.420 -2.059 4.026) 4.541 8.588 ( 0.654 1.723 -1.442) 2.340 8.724 ( 2.386 1.186 3.565) 4.451 9.005 ( -1.551 -1.824 -0.401) 2.428 9.230 ( 0.194 -2.039 0.343) 2.077 9.604 ( -0.107 -5.775 -1.229) 5.905 9.673 ( -0.525 5.796 -0.987) 5.903 10.478 ( -3.086 2.872 -5.389) 6.842 10.678 ( 4.289 -3.326 1.512) 5.634 11.007 ( 0.774 -1.338 -0.538) 1.637 11.334 ( -0.749 2.410 9.514) 9.843 11.534 ( -1.528 -0.902 -10.685) 10.831 11.868 ( 4.794 2.887 3.062) 6.379 12.001 ( 1.701 2.274 2.007) 3.477 12.112 ( -4.778 -1.059 4.438) 6.607 12.395 ( -2.107 -6.569 -6.205) 9.279 12.666 ( 1.652 3.318 2.568) 4.509 12.865 ( 2.554 -0.684 -2.676) 3.762 13.023 ( -2.543 -0.631 1.707) 3.127 13.265 ( -2.775 4.568 -7.131) 8.912 13.343 ( -1.199 0.633 -1.351) 1.914 13.637 ( 1.559 -2.393 9.316) 9.744 13.884 ( 5.377 -2.757 0.663) 6.078 14.448 ( -7.917 5.257 -2.363) 9.793 14.868 ( 3.990 -2.305 0.681) 4.658 15.264 ( 1.628 -0.915 -3.272) 3.768 15.391 ( -1.061 -0.195 1.912) 2.196 ======================= Grid point 111 (38/141) ======================= q-point: (-0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.516 ( -8.103 6.584 4.608) 11.413 1.672 ( -0.940 -0.406 2.327) 2.542 1.838 ( -10.660 7.216 -0.511) 12.883 2.086 ( -3.443 -3.005 -6.966) 8.331 2.336 ( 2.796 2.430 2.966) 4.746 2.465 ( -2.760 1.644 -2.877) 4.313 2.786 ( -5.057 5.753 -2.016) 7.920 2.837 ( -8.466 4.560 1.633) 9.753 3.040 ( -1.904 -4.873 -0.835) 5.298 3.239 ( -1.209 5.883 -0.141) 6.008 3.420 ( 1.635 -3.921 1.568) 4.528 3.617 ( -2.014 -8.771 -2.747) 9.409 3.688 ( 3.585 6.013 0.314) 7.008 3.826 ( 2.950 -1.614 -0.355) 3.381 3.880 ( 5.075 1.634 0.149) 5.334 4.109 ( 3.968 -3.802 3.120) 6.320 4.143 ( 2.180 0.709 -2.846) 3.654 4.272 ( -3.347 -1.899 1.603) 4.169 4.410 ( 7.058 -2.250 1.247) 7.512 4.659 ( -4.132 4.777 -0.048) 6.316 4.692 ( 5.177 1.132 0.194) 5.303 4.912 ( 0.519 0.547 -3.283) 3.368 5.097 ( -0.522 0.692 2.144) 2.312 5.385 ( 5.167 -7.077 4.845) 10.012 5.698 ( 0.176 3.632 -1.066) 3.789 5.848 ( 0.825 -0.042 -1.971) 2.137 5.987 ( 3.139 1.041 -0.001) 3.307 6.034 ( 1.272 -3.478 -3.391) 5.022 6.098 ( -1.465 1.879 0.960) 2.569 6.301 ( 2.563 2.406 -0.870) 3.621 6.334 ( 2.967 0.285 1.715) 3.438 6.400 ( -2.029 5.128 3.713) 6.648 6.606 ( -1.923 1.346 -1.832) 2.978 6.670 ( -0.648 -1.708 1.522) 2.378 6.785 ( 1.819 0.975 2.278) 3.074 6.842 ( 0.800 1.375 -4.748) 5.007 6.967 ( 3.816 -4.028 -0.240) 5.554 7.080 ( 4.561 2.174 0.093) 5.053 7.114 ( -2.570 -2.070 -0.597) 3.353 7.198 ( 3.345 0.862 -0.348) 3.472 7.403 ( -4.003 2.799 1.261) 5.045 7.435 ( 2.139 8.935 -2.690) 9.573 7.713 ( 1.346 5.958 2.320) 6.534 7.833 ( 0.421 0.422 -0.565) 0.821 8.051 ( 1.772 -5.588 0.152) 5.864 8.339 ( -5.368 -7.566 3.275) 9.838 8.616 ( 4.110 -3.019 -1.747) 5.390 8.814 ( 6.382 0.243 3.657) 7.359 8.995 ( -5.901 -6.184 -0.696) 8.576 9.285 ( 0.561 -7.762 0.874) 7.832 9.622 ( 0.193 0.177 0.937) 0.973 9.713 ( 1.733 -12.212 -3.246) 12.755 10.354 ( -6.330 3.834 -2.334) 7.760 10.747 ( 1.054 -1.994 -1.838) 2.910 11.041 ( 1.105 -1.703 0.380) 2.066 11.313 ( -2.826 0.481 5.587) 6.280 11.492 ( -0.248 0.150 -7.708) 7.713 11.911 ( 0.261 0.485 3.825) 3.865 12.063 ( 2.997 2.276 -0.061) 3.764 12.107 ( 4.721 -3.340 3.735) 6.885 12.418 ( -1.216 -6.371 -2.252) 6.866 12.636 ( -3.109 0.806 1.839) 3.701 12.877 ( 0.478 2.839 -1.152) 3.100 13.000 ( 1.868 4.284 -0.256) 4.680 13.129 ( -4.736 7.778 -2.490) 9.441 13.287 ( -0.939 5.208 -2.982) 6.074 13.578 ( -8.266 0.945 4.303) 9.367 14.120 ( 13.358 -6.232 4.485) 15.408 14.220 ( -11.293 5.347 -4.974) 13.448 14.973 ( 4.283 -1.991 1.352) 4.912 15.282 ( 0.184 0.091 -1.890) 1.901 15.376 ( -0.660 -0.922 0.095) 1.138 ======================= Grid point 112 (39/141) ======================= q-point: (-0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.258 ( -15.096 7.901 7.231) 18.509 1.511 ( -15.495 12.788 1.868) 20.177 1.638 ( -4.542 -0.143 -1.460) 4.773 2.063 ( -0.195 -1.636 -4.590) 4.877 2.342 ( 0.478 5.513 -1.670) 5.780 2.408 ( -3.959 1.235 1.180) 4.312 2.453 ( -21.731 12.949 0.403) 25.299 2.546 ( -12.863 8.599 -0.569) 15.483 3.040 ( -7.183 -4.380 0.948) 8.467 3.143 ( -3.617 -0.607 -1.295) 3.889 3.478 ( 1.873 0.008 0.113) 1.876 3.671 ( 2.005 -1.795 -1.260) 2.972 3.775 ( 5.683 -0.760 2.988) 6.465 3.932 ( 7.807 -3.156 -3.058) 8.958 3.963 ( 5.146 -0.870 -2.092) 5.623 4.149 ( 3.073 0.678 1.788) 3.619 4.228 ( 4.033 -3.268 -1.101) 5.306 4.327 ( 2.353 -0.149 2.957) 3.782 4.485 ( -0.361 -0.463 -0.704) 0.917 4.614 ( 9.002 -3.086 -0.780) 9.549 4.819 ( 5.426 3.265 -2.041) 6.653 4.906 ( 4.492 -0.125 -1.536) 4.749 5.114 ( -0.915 -3.346 4.980) 6.069 5.542 ( 5.027 -0.971 3.100) 5.985 5.659 ( -1.120 2.013 -1.218) 2.606 5.837 ( -1.817 0.094 0.208) 1.831 5.981 ( -2.175 -1.483 -3.979) 4.771 6.061 ( 0.002 -0.382 -3.012) 3.036 6.077 ( 1.642 0.911 0.741) 2.019 6.247 ( -1.485 3.802 -2.017) 4.553 6.322 ( -3.826 3.204 2.818) 5.731 6.459 ( 7.155 4.778 5.604) 10.268 6.577 ( 0.590 -1.677 -0.760) 1.934 6.688 ( -0.615 -1.291 3.088) 3.403 6.783 ( -0.902 2.304 1.348) 2.818 6.802 ( -1.373 2.006 -6.448) 6.891 7.037 ( -1.542 3.415 -2.692) 4.614 7.083 ( 3.726 -2.038 1.394) 4.470 7.180 ( -0.692 4.970 3.094) 5.895 7.186 ( 1.024 3.424 1.563) 3.901 7.320 ( 5.512 1.834 2.831) 6.462 7.496 ( 7.021 -2.954 -9.820) 12.428 7.671 ( 2.399 9.685 1.927) 10.162 7.836 ( 2.069 2.975 0.603) 3.674 8.215 ( 9.182 -9.474 0.550) 13.205 8.333 ( -5.959 -10.974 1.542) 12.582 8.786 ( 9.211 -7.711 -0.482) 12.023 8.860 ( -14.581 -9.522 1.388) 17.470 8.964 ( 8.408 4.703 2.998) 10.089 9.381 ( 1.891 -5.619 -0.280) 5.935 9.684 ( 1.352 -10.716 0.272) 10.804 9.895 ( 4.864 -13.896 -1.669) 14.817 10.176 ( -7.761 6.525 -0.158) 10.141 10.754 ( -1.090 -2.672 -7.845) 8.359 11.064 ( -1.137 -2.085 0.022) 2.375 11.251 ( -7.563 -4.170 -2.226) 8.918 11.482 ( 4.312 6.682 -1.132) 8.032 11.891 ( -2.509 0.253 1.417) 2.893 12.108 ( 4.454 0.668 0.973) 4.608 12.273 ( 7.682 -2.973 3.366) 8.898 12.465 ( -0.433 -5.608 4.068) 6.941 12.578 ( -3.981 -0.995 0.946) 4.211 12.810 ( -3.634 5.878 2.369) 7.306 12.939 ( -3.439 11.748 -4.134) 12.920 12.985 ( -0.578 4.388 1.175) 4.579 13.207 ( 0.789 7.815 -4.245) 8.929 13.439 ( -7.485 0.939 4.538) 8.804 13.941 ( -13.564 4.938 -6.255) 15.732 14.422 ( 12.819 -5.932 4.393) 14.792 15.039 ( 1.781 -0.383 1.016) 2.086 15.241 ( -2.382 2.829 1.117) 3.863 15.411 ( 1.684 -4.329 -4.731) 6.630 ======================= Grid point 113 (40/141) ======================= q-point: (-0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.936 ( -16.956 6.463 14.905) 23.483 1.085 ( -17.465 17.942 4.213) 25.390 1.512 ( -8.237 1.205 -4.763) 9.590 1.761 ( -35.033 17.728 1.362) 39.287 1.987 ( -10.575 14.452 -6.306) 18.985 2.206 ( -5.514 -2.971 2.585) 6.776 2.307 ( -1.668 0.986 -5.687) 6.008 2.508 ( 4.925 0.801 4.504) 6.722 2.921 ( -10.627 -3.824 -0.673) 11.314 3.071 ( -5.857 -0.721 -1.631) 6.122 3.478 ( 0.047 2.244 -0.180) 2.251 3.700 ( -0.087 2.048 1.613) 2.608 3.873 ( 5.171 -1.841 2.711) 6.122 3.994 ( -1.652 -0.149 -3.456) 3.833 4.091 ( 7.554 -1.937 -2.883) 8.314 4.230 ( 4.046 -1.947 2.111) 4.962 4.326 ( 6.552 -0.746 -0.686) 6.629 4.398 ( 7.771 -2.438 -2.390) 8.488 4.611 ( 7.063 -4.858 -0.772) 8.607 4.737 ( 2.652 0.276 -4.171) 4.950 4.897 ( 7.037 -3.624 3.122) 8.509 5.027 ( 8.041 3.604 1.431) 8.927 5.150 ( -1.115 -6.017 2.631) 6.661 5.520 ( -1.127 9.647 -0.769) 9.743 5.626 ( -2.543 -1.659 -2.684) 4.052 5.842 ( 0.410 -2.438 1.821) 3.071 5.924 ( -6.946 -3.023 -0.862) 7.624 6.088 ( 3.246 0.806 -1.906) 3.849 6.090 ( 0.767 -0.539 0.941) 1.329 6.178 ( -3.019 3.302 -0.372) 4.489 6.232 ( -0.965 3.470 0.697) 3.669 6.497 ( 1.623 2.427 1.155) 3.140 6.626 ( 2.694 0.488 -1.578) 3.160 6.681 ( -1.444 1.101 5.284) 5.587 6.698 ( -5.915 0.339 -2.517) 6.437 6.757 ( 0.176 2.899 -3.030) 4.197 6.974 ( -3.610 2.823 -0.739) 4.642 7.029 ( -2.573 5.099 3.282) 6.587 7.136 ( 2.747 3.717 3.218) 5.632 7.237 ( -1.543 -4.760 2.665) 5.669 7.428 ( 3.170 -0.184 3.328) 4.600 7.622 ( 5.237 -3.222 -8.880) 10.801 7.659 ( 6.886 6.978 -3.955) 10.571 7.855 ( 5.057 6.101 1.342) 8.037 8.339 ( -8.903 -4.725 3.045) 10.529 8.492 ( 5.384 -15.377 -0.257) 16.294 8.679 ( -3.893 -1.222 6.505) 7.679 9.043 ( 10.908 -4.960 1.553) 12.083 9.092 ( 7.843 0.392 0.017) 7.853 9.445 ( 1.201 -1.796 -0.078) 2.162 9.852 ( 0.708 -10.199 -1.342) 10.312 9.985 ( -5.503 -9.499 -2.151) 11.187 10.175 ( 15.437 -3.550 -0.707) 15.856 10.701 ( -6.727 -5.785 -24.070) 25.653 11.028 ( -4.801 -0.746 -3.590) 6.041 11.130 ( -9.441 -4.162 -1.695) 10.456 11.485 ( 6.105 12.469 3.155) 14.237 11.838 ( -3.842 1.183 0.629) 4.069 12.176 ( 2.830 -0.576 -0.264) 2.900 12.368 ( 0.393 4.207 1.581) 4.511 12.502 ( -3.959 -0.700 1.745) 4.383 12.568 ( 0.711 -4.580 9.448) 10.524 12.710 ( -1.694 1.897 2.946) 3.892 12.761 ( -1.988 8.059 0.562) 8.319 12.932 ( -1.214 3.344 -1.279) 3.781 13.149 ( 2.954 8.398 -2.204) 9.171 13.348 ( -2.785 3.240 8.253) 9.294 13.645 ( -13.429 4.076 -6.445) 15.443 14.669 ( 8.582 -4.344 2.848) 10.032 15.058 ( 0.385 -0.106 0.588) 0.710 15.181 ( -1.576 2.447 1.169) 3.137 15.443 ( -1.711 -4.129 -10.457) 11.372 ======================= Grid point 114 (41/141) ======================= q-point: (-0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.620 ( -14.790 22.449 8.999) 28.350 0.680 ( -14.187 4.949 24.161) 28.452 0.976 ( -36.569 14.003 12.559) 41.124 1.343 ( -6.551 2.259 -6.660) 9.611 1.562 ( -15.494 12.576 -5.592) 20.724 2.239 ( 1.127 -3.379 -3.071) 4.703 2.281 ( 1.255 0.412 -5.443) 5.601 2.603 ( 4.826 0.634 5.120) 7.065 2.748 ( -11.668 -1.866 -4.217) 12.546 2.979 ( -4.769 -0.652 -1.150) 4.949 3.455 ( -0.619 0.882 1.272) 1.667 3.652 ( -1.776 3.017 0.090) 3.502 3.921 ( -1.086 -0.423 2.046) 2.355 4.047 ( 5.920 -4.727 0.126) 7.577 4.199 ( 3.032 -1.218 0.214) 3.274 4.297 ( -0.312 -3.080 0.595) 3.153 4.419 ( 3.962 1.602 -5.316) 6.821 4.540 ( 6.609 0.328 -6.479) 9.261 4.744 ( 3.977 -3.730 -1.140) 5.570 4.778 ( 3.154 -1.595 -0.929) 3.654 5.029 ( 2.191 -0.351 5.071) 5.535 5.059 ( 0.385 5.234 2.808) 5.952 5.218 ( 1.342 -5.998 -2.401) 6.599 5.421 ( 0.730 7.159 -4.314) 8.390 5.590 ( -0.868 -1.077 -2.224) 2.619 5.763 ( -6.871 4.115 3.867) 8.894 5.913 ( -1.129 -5.495 0.100) 5.611 6.094 ( -2.639 3.464 0.041) 4.355 6.120 ( 0.631 -1.690 0.909) 2.019 6.129 ( 2.520 0.780 0.670) 2.722 6.224 ( 2.497 2.857 -2.198) 4.385 6.488 ( -0.312 1.208 -2.047) 2.397 6.584 ( -2.937 0.978 -4.772) 5.688 6.628 ( -1.904 1.019 -0.508) 2.219 6.699 ( 0.560 0.108 5.202) 5.233 6.721 ( 0.445 2.494 0.378) 2.561 6.882 ( -0.774 2.232 -0.740) 2.475 7.019 ( 1.617 -0.038 1.873) 2.475 7.107 ( -3.261 1.470 1.610) 3.923 7.316 ( 2.390 -7.758 6.450) 10.368 7.407 ( -7.077 -3.718 8.380) 11.582 7.659 ( -0.059 2.329 -10.166) 10.430 7.694 ( 1.708 -0.240 -1.689) 2.414 7.880 ( 5.896 11.860 -1.383) 13.317 8.038 ( -17.095 5.026 6.872) 19.098 8.738 ( 10.121 -8.476 0.045) 13.201 8.861 ( 10.146 -5.852 1.129) 11.766 9.139 ( 1.882 3.234 2.681) 4.603 9.265 ( 7.191 -4.633 -4.048) 9.463 9.414 ( -6.545 2.999 -1.853) 7.434 9.782 ( -3.674 1.492 -4.572) 6.052 10.009 ( -29.254 7.743 -40.665) 50.690 10.487 ( 7.625 -11.721 -14.022) 19.803 10.570 ( 17.864 -7.401 -5.688) 20.156 10.961 ( -2.882 -4.654 2.277) 5.929 11.042 ( -6.498 -4.401 1.693) 8.028 11.422 ( 0.254 16.238 2.430) 16.421 11.690 ( -9.859 8.110 -1.016) 12.806 12.216 ( 1.300 -1.082 -0.444) 1.749 12.265 ( -2.690 5.490 -1.430) 6.279 12.391 ( -6.988 1.063 2.204) 7.404 12.536 ( -1.716 7.325 3.369) 8.243 12.798 ( 1.240 -7.345 1.667) 7.633 12.821 ( 2.954 -5.170 9.209) 10.966 12.913 ( 3.799 -4.863 -1.237) 6.294 13.132 ( 4.557 9.091 -0.535) 10.183 13.353 ( 2.694 2.417 11.473) 12.030 13.406 ( -3.682 4.825 0.067) 6.070 14.805 ( 3.152 -2.006 1.211) 3.928 15.063 ( -0.183 -0.213 0.178) 0.332 15.150 ( -0.677 0.970 0.602) 1.327 15.283 ( -17.642 2.379 -24.795) 30.524 ======================= Grid point 116 (42/141) ======================= q-point: ( 0.10 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.050 ( 15.278 -0.000 14.690) 21.195 1.061 ( 21.150 -0.000 10.483) 23.605 1.389 ( 11.639 -0.000 -7.610) 13.906 1.742 ( 33.840 -0.000 12.492) 36.072 1.857 ( 23.377 -0.000 -5.953) 24.123 2.005 ( -6.670 0.000 -8.192) 10.564 2.279 ( 0.669 -0.000 -8.453) 8.479 2.525 ( -0.210 0.000 4.961) 4.965 3.014 ( 8.112 -0.000 0.550) 8.131 3.022 ( 6.309 -0.000 -3.366) 7.150 3.538 ( 2.107 -0.000 4.796) 5.238 3.552 ( -0.241 0.000 -2.799) 2.810 3.912 ( -4.321 0.000 1.874) 4.710 4.053 ( -5.930 0.000 -3.996) 7.151 4.133 ( -1.292 0.000 2.388) 2.715 4.265 ( -10.372 0.000 -1.344) 10.459 4.273 ( -5.959 0.000 -2.771) 6.572 4.557 ( -4.425 0.000 -3.842) 5.860 4.622 ( -4.717 0.000 -1.185) 4.864 4.646 ( -8.438 0.000 -1.744) 8.616 4.887 ( -6.568 0.000 1.924) 6.844 4.930 ( -7.886 0.000 2.973) 8.428 5.351 ( -0.205 0.000 -2.467) 2.476 5.371 ( -0.762 0.000 5.021) 5.078 5.677 ( 10.552 -0.000 -8.090) 13.296 5.847 ( 3.517 -0.000 5.660) 6.664 5.947 ( -2.119 0.000 0.351) 2.148 6.050 ( -3.247 0.000 -1.461) 3.560 6.090 ( 0.365 -0.000 1.515) 1.559 6.206 ( 3.741 -0.000 4.056) 5.518 6.285 ( -3.365 0.000 -4.201) 5.382 6.324 ( 4.644 -0.000 -1.144) 4.783 6.497 ( -3.084 0.000 1.622) 3.485 6.613 ( -0.266 0.000 -2.998) 3.010 6.854 ( -4.255 0.000 3.250) 5.354 6.870 ( 3.694 -0.000 1.883) 4.147 6.903 ( 2.543 -0.000 3.511) 4.335 6.982 ( 1.507 -0.000 -1.976) 2.485 7.055 ( -2.397 0.000 5.018) 5.561 7.129 ( 6.810 -0.000 -4.286) 8.046 7.397 ( -7.905 0.000 0.007) 7.905 7.515 ( -9.893 0.000 -2.056) 10.105 7.612 ( 2.724 -0.000 -3.356) 4.323 8.054 ( -4.259 0.000 0.377) 4.275 8.529 ( 28.120 -0.000 12.431) 30.745 8.598 ( -17.229 0.000 1.483) 17.292 8.664 ( -9.869 0.000 0.498) 9.882 9.093 ( -16.056 0.000 -1.384) 16.116 9.133 ( 3.403 -0.000 3.513) 4.890 9.400 ( 4.727 -0.000 -4.360) 6.431 10.034 ( 10.602 -0.000 0.373) 10.609 10.056 ( 16.214 -0.000 -28.271) 32.591 10.121 ( -22.262 0.000 -1.210) 22.295 10.314 ( -4.306 0.000 -6.077) 7.448 10.954 ( 3.133 -0.000 -3.960) 5.050 11.128 ( 3.330 -0.000 5.680) 6.584 11.665 ( 6.102 -0.000 -6.491) 8.909 11.868 ( 6.092 -0.000 -1.320) 6.234 12.213 ( 2.052 -0.000 -3.838) 4.352 12.267 ( 1.036 -0.000 0.261) 1.068 12.419 ( -2.075 0.000 5.461) 5.842 12.581 ( 4.969 -0.000 6.636) 8.291 12.729 ( -5.350 0.000 -2.039) 5.725 12.742 ( -3.003 0.000 6.264) 6.947 12.966 ( 4.292 -0.000 7.556) 8.690 13.126 ( 3.433 -0.000 1.357) 3.691 13.195 ( 9.908 -0.000 -0.831) 9.943 13.743 ( 7.656 -0.000 0.457) 7.670 14.731 ( -3.287 0.000 4.813) 5.828 15.005 ( -1.131 0.000 -4.466) 4.607 15.118 ( 0.419 -0.000 -1.034) 1.115 15.347 ( 2.871 -0.000 -11.316) 11.674 ======================= Grid point 117 (43/141) ======================= q-point: ( 0.20 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.362 ( 16.629 -1.089 8.638) 18.770 1.432 ( 17.700 -0.860 7.796) 19.360 1.578 ( 10.129 -1.026 -5.179) 11.423 1.907 ( -3.566 -4.905 -7.309) 9.497 2.124 ( 8.380 -1.039 -7.192) 11.092 2.306 ( 23.573 -6.984 5.079) 25.105 2.438 ( 17.280 -3.312 -0.535) 17.602 2.530 ( -0.030 0.740 4.031) 4.098 3.085 ( 6.376 3.842 -1.337) 7.563 3.134 ( 2.840 -0.319 -2.110) 3.553 3.510 ( -1.788 2.453 -0.572) 3.089 3.584 ( -1.626 -3.634 2.263) 4.579 3.834 ( -3.877 2.491 0.440) 4.629 3.970 ( -4.820 -5.634 -3.606) 8.245 4.051 ( -8.975 2.603 -1.096) 9.409 4.149 ( -4.206 2.243 2.114) 5.215 4.178 ( -0.628 -0.943 0.942) 1.474 4.421 ( -8.485 2.043 3.615) 9.446 4.491 ( -6.832 1.585 -1.939) 7.276 4.605 ( 1.680 -2.144 -9.026) 9.428 4.735 ( -7.242 2.639 1.478) 7.848 4.808 ( -10.253 -4.173 1.633) 11.190 5.275 ( -0.320 9.190 2.907) 9.645 5.440 ( -0.221 -7.267 1.863) 7.505 5.817 ( 0.092 6.773 -1.319) 6.901 5.848 ( 5.753 -1.246 -2.480) 6.387 5.934 ( -1.887 -3.827 -0.195) 4.271 6.008 ( -2.210 -1.847 -3.618) 4.624 6.084 ( -1.480 -1.057 3.708) 4.130 6.213 ( -2.988 -1.745 -2.858) 4.489 6.302 ( 5.012 -0.203 4.366) 6.650 6.414 ( -1.210 2.700 7.447) 8.014 6.468 ( 4.351 -4.423 -4.501) 7.665 6.607 ( -3.237 -5.782 -2.596) 7.117 6.741 ( -7.168 1.742 4.902) 8.857 6.931 ( 1.210 -1.890 0.473) 2.293 6.970 ( -1.474 2.193 -1.294) 2.942 7.012 ( 4.495 -1.265 -1.081) 4.793 7.059 ( 1.415 -5.217 1.845) 5.711 7.205 ( -0.949 1.391 -0.556) 1.773 7.259 ( -5.834 -1.420 -0.396) 6.018 7.350 ( -5.611 -3.497 -4.625) 8.069 7.678 ( 3.087 -0.979 -1.666) 3.642 7.966 ( -6.321 -0.461 1.713) 6.565 8.311 ( -10.499 8.099 3.468) 13.706 8.480 ( -6.403 3.219 -1.129) 7.255 8.789 ( -6.196 -3.346 3.164) 7.719 8.851 ( -11.775 -1.434 -0.555) 11.874 9.263 ( 14.312 12.149 6.684) 19.928 9.415 ( 0.783 4.267 -3.890) 5.827 9.831 ( -6.526 6.226 0.286) 9.024 10.073 ( 0.103 1.418 -3.627) 3.895 10.220 ( 11.541 5.512 0.218) 12.791 10.400 ( 7.417 -8.925 -12.958) 17.395 10.989 ( 2.724 1.100 -4.855) 5.674 11.216 ( 2.299 -3.068 7.835) 8.723 11.681 ( 1.031 3.614 -7.610) 8.487 11.927 ( 1.770 -0.338 0.953) 2.038 12.178 ( -0.367 5.609 -2.472) 6.141 12.309 ( -3.038 -4.846 0.281) 5.726 12.358 ( -5.563 2.279 8.792) 10.651 12.615 ( 0.473 -0.559 1.673) 1.826 12.707 ( 0.780 1.402 -1.675) 2.319 12.782 ( 4.704 -5.768 1.138) 7.530 13.081 ( 5.824 -2.425 6.480) 9.044 13.199 ( 0.509 -5.708 0.145) 5.733 13.388 ( 11.959 0.940 1.795) 12.130 13.801 ( 0.410 -0.982 -6.662) 6.747 14.701 ( -2.442 1.652 12.134) 12.487 14.947 ( -3.347 1.080 -6.470) 7.364 15.142 ( 2.035 -1.383 -1.490) 2.876 15.349 ( 0.867 -0.754 -6.821) 6.917 ======================= Grid point 118 (44/141) ======================= q-point: ( 0.30 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.630 ( 10.052 2.755 5.193) 11.645 1.665 ( 5.533 2.717 2.113) 6.516 1.730 ( 14.626 -1.046 1.030) 14.700 1.966 ( 3.030 -9.497 -8.337) 12.995 2.238 ( 6.217 -1.566 -2.843) 7.014 2.521 ( 0.169 1.742 1.605) 2.375 2.656 ( 8.588 -7.223 -1.348) 11.302 2.760 ( 11.804 -4.789 2.322) 12.948 3.108 ( -2.048 1.776 -1.870) 3.293 3.151 ( 2.346 -0.196 0.311) 2.375 3.435 ( -4.748 1.104 -0.386) 4.890 3.595 ( -0.032 -2.665 1.364) 2.994 3.735 ( -4.697 1.931 -1.845) 5.403 3.893 ( -6.338 -0.604 -0.014) 6.367 3.959 ( -3.156 -0.433 2.091) 3.811 4.037 ( -3.273 2.586 -0.556) 4.209 4.231 ( 2.714 -0.673 2.202) 3.559 4.296 ( -3.733 1.737 1.359) 4.336 4.382 ( -4.362 1.667 -1.595) 4.935 4.573 ( -4.208 -3.922 -0.584) 5.781 4.675 ( -7.047 -2.602 1.112) 7.594 4.769 ( 7.851 -2.464 -5.591) 9.948 5.172 ( -1.840 9.531 2.802) 10.103 5.505 ( 0.363 -3.550 1.877) 4.032 5.707 ( -2.824 4.942 0.853) 5.756 5.882 ( -5.076 -0.863 1.406) 5.338 5.927 ( 1.254 -0.156 -3.526) 3.746 5.981 ( -1.283 -1.027 -4.233) 4.541 6.119 ( 0.009 -3.806 4.357) 5.785 6.230 ( 3.102 -2.207 -1.738) 4.186 6.341 ( -1.722 2.329 -0.155) 2.901 6.405 ( 2.313 -0.794 6.294) 6.753 6.589 ( 2.966 -3.076 0.390) 4.290 6.630 ( -2.898 -9.326 2.159) 10.001 6.639 ( -2.794 -2.199 -2.374) 4.275 6.849 ( -6.268 1.712 -3.880) 7.567 6.945 ( -5.565 -3.863 2.500) 7.221 7.069 ( 0.921 3.472 -4.049) 5.413 7.093 ( -2.359 -0.302 1.792) 2.978 7.146 ( -2.884 -7.563 -2.456) 8.459 7.255 ( 5.581 -3.418 -0.129) 6.546 7.426 ( 5.910 -3.357 -2.054) 7.101 7.702 ( 0.363 1.917 1.155) 2.267 7.888 ( -4.687 -1.494 4.235) 6.491 8.115 ( -5.348 6.141 2.251) 8.448 8.387 ( -1.648 2.676 -1.672) 3.559 8.612 ( -12.935 -2.295 0.013) 13.137 8.716 ( -7.429 -2.115 1.115) 7.804 9.320 ( 4.545 10.822 -0.933) 11.775 9.356 ( 1.687 6.406 0.025) 6.624 9.680 ( -1.550 13.565 0.016) 13.653 10.026 ( 1.059 9.032 -1.780) 9.267 10.425 ( 11.257 -2.077 2.881) 11.804 10.526 ( 3.571 -2.883 -5.950) 7.514 10.989 ( 0.131 0.849 -3.695) 3.794 11.300 ( 1.354 -2.521 9.097) 9.536 11.607 ( -3.814 1.102 -9.110) 9.937 11.942 ( 1.070 2.646 1.237) 3.111 12.107 ( -1.452 4.317 0.067) 4.555 12.202 ( -9.681 0.696 10.698) 14.444 12.309 ( -2.044 -1.424 -4.815) 5.421 12.678 ( 3.255 -2.371 -0.034) 4.027 12.727 ( 2.291 -2.344 -4.402) 5.489 12.919 ( 4.207 -4.098 1.835) 6.153 13.219 ( 0.379 -4.601 4.307) 6.314 13.270 ( 5.327 -5.421 -0.369) 7.609 13.543 ( 7.937 5.080 2.131) 9.662 13.797 ( 0.827 -2.885 -5.771) 6.505 14.667 ( -3.573 3.146 11.211) 12.180 14.846 ( -4.298 0.583 -6.843) 8.102 15.198 ( 2.944 -1.742 -2.160) 4.045 15.363 ( 1.022 -1.181 -2.033) 2.564 ======================= Grid point 119 (45/141) ======================= q-point: ( 0.40 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.677 ( 2.916 2.981 1.829) 4.554 1.740 ( 3.864 6.512 7.231) 10.470 1.957 ( 7.745 -0.812 -2.557) 8.197 2.066 ( 2.963 -3.955 -8.837) 10.125 2.321 ( 2.309 0.054 1.517) 2.763 2.511 ( 0.403 0.912 -1.729) 1.996 2.785 ( 2.406 -4.478 -2.318) 5.587 2.884 ( 1.501 0.352 2.944) 3.323 3.091 ( -5.716 -2.071 -2.464) 6.560 3.154 ( 1.431 -5.129 -0.243) 5.331 3.347 ( -5.043 -1.930 1.648) 5.646 3.579 ( -7.546 -2.023 2.032) 8.072 3.723 ( 5.508 -1.085 -1.986) 5.954 3.837 ( -1.509 -1.126 -1.492) 2.402 3.909 ( 0.370 3.681 3.899) 5.375 3.967 ( -1.375 3.541 -1.626) 4.132 4.221 ( -2.467 1.462 -0.608) 2.932 4.316 ( -0.336 -0.220 -0.733) 0.836 4.319 ( 1.725 0.151 3.307) 3.733 4.539 ( -3.136 -4.042 -0.609) 5.152 4.692 ( 3.789 -4.786 0.290) 6.111 4.937 ( 7.846 -4.289 -2.652) 9.327 5.054 ( -0.926 9.783 1.060) 9.884 5.474 ( -2.825 7.996 4.761) 9.726 5.696 ( 2.147 -3.001 -1.337) 3.924 5.818 ( -1.890 -0.481 0.670) 2.062 5.921 ( -2.793 -4.324 -6.317) 8.149 5.992 ( 5.134 3.692 1.148) 6.427 6.149 ( -0.790 -0.449 5.189) 5.268 6.279 ( 0.723 1.230 -3.938) 4.189 6.293 ( -0.359 -1.297 1.183) 1.791 6.483 ( 2.675 -1.569 5.232) 6.082 6.593 ( -2.647 -3.287 -1.476) 4.471 6.675 ( 2.493 -6.169 2.272) 7.031 6.725 ( 1.624 -2.728 -0.342) 3.193 6.737 ( -3.792 0.161 -6.949) 7.918 6.887 ( -5.204 -7.626 3.116) 9.744 7.012 ( -2.367 2.442 -2.494) 4.217 7.093 ( 0.012 -1.413 2.813) 3.148 7.170 ( 0.618 -1.773 -5.506) 5.817 7.413 ( 5.655 -5.546 -1.266) 8.021 7.534 ( 2.491 -4.767 -0.602) 5.412 7.685 ( -0.262 2.315 6.037) 6.471 7.833 ( -4.563 0.354 2.178) 5.069 8.017 ( -2.072 2.289 -0.407) 3.114 8.307 ( -6.268 -0.355 0.479) 6.296 8.484 ( -7.323 -7.134 -1.027) 10.275 8.666 ( -1.354 -2.408 1.911) 3.359 9.246 ( 2.641 13.004 -3.131) 13.634 9.332 ( 1.321 7.109 2.654) 7.702 9.539 ( -3.088 5.007 0.809) 5.938 9.924 ( 2.622 16.235 -2.734) 16.671 10.506 ( -2.863 -1.826 -6.611) 7.432 10.631 ( 6.962 0.453 5.026) 8.598 10.977 ( -0.261 -1.385 -1.871) 2.343 11.349 ( -1.391 -1.027 6.830) 7.046 11.499 ( -5.718 -2.891 -6.481) 9.114 11.935 ( 1.194 3.962 2.244) 4.708 12.034 ( -3.881 0.252 5.377) 6.637 12.120 ( -0.707 2.154 2.910) 3.689 12.283 ( -1.809 -3.678 -6.180) 7.416 12.712 ( -0.360 0.336 -0.582) 0.762 12.806 ( 3.017 -4.892 -3.631) 6.799 13.005 ( 3.246 -1.084 -0.886) 3.535 13.241 ( -0.731 -2.279 -0.476) 2.440 13.407 ( 3.885 0.403 -1.155) 4.073 13.618 ( 6.225 2.111 7.464) 9.946 13.845 ( 2.616 -1.490 -1.331) 3.292 14.550 ( -7.678 5.021 0.966) 9.225 14.808 ( 0.182 -3.509 -0.829) 3.610 15.250 ( 2.433 -0.737 -3.271) 4.143 15.383 ( 0.142 -0.536 1.348) 1.457 ======================= Grid point 120 (46/141) ======================= q-point: (-0.50 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.686 ( -0.904 8.067 4.785) 9.423 1.711 ( 1.101 5.657 4.321) 7.204 1.949 ( -4.690 3.015 -2.782) 6.231 2.049 ( -4.110 1.146 -5.353) 6.846 2.379 ( 5.306 1.504 1.967) 5.855 2.482 ( -2.724 0.557 -2.772) 3.926 2.841 ( 0.612 -0.258 -0.789) 1.032 2.899 ( -2.693 1.960 -0.073) 3.332 2.960 ( -5.656 -3.104 -1.569) 6.639 3.261 ( 1.022 -5.773 -1.069) 5.960 3.359 ( 2.523 -4.797 2.666) 6.040 3.455 ( -8.951 -4.358 -0.482) 9.967 3.792 ( 2.963 0.218 -3.399) 4.515 3.823 ( 0.446 4.808 0.845) 4.902 3.926 ( 4.160 3.293 1.841) 5.616 3.992 ( 4.578 -5.220 1.292) 7.062 4.170 ( -0.952 1.030 -2.379) 2.762 4.272 ( -4.632 1.647 1.239) 5.070 4.367 ( 4.524 -2.449 0.173) 5.147 4.618 ( 4.661 -5.006 2.296) 7.215 4.764 ( -0.240 1.440 -1.786) 2.307 4.946 ( 0.333 5.064 0.907) 5.155 5.118 ( 7.032 -1.326 -1.547) 7.321 5.352 ( -1.908 6.242 5.711) 8.673 5.732 ( 0.375 -0.124 0.220) 0.452 5.858 ( 2.913 0.438 -2.185) 3.668 5.920 ( -0.214 -7.841 -3.474) 8.579 6.034 ( 2.386 3.817 -2.450) 5.125 6.141 ( 0.136 2.172 3.864) 4.435 6.306 ( 1.607 -2.111 0.950) 2.818 6.329 ( 4.743 0.384 -0.230) 4.765 6.492 ( -1.475 2.798 1.635) 3.561 6.598 ( -2.334 -3.288 1.407) 4.271 6.667 ( -0.564 2.129 -3.418) 4.067 6.763 ( 1.515 -2.825 1.391) 3.495 6.798 ( 3.316 -6.089 0.807) 6.980 6.933 ( -1.282 0.823 -2.491) 2.920 6.983 ( 3.390 -7.878 0.440) 8.588 7.103 ( -1.431 -0.746 -2.845) 3.271 7.188 ( 2.317 -1.428 -0.965) 2.888 7.456 ( -2.487 3.524 2.152) 4.821 7.625 ( 1.398 -1.429 0.298) 2.021 7.694 ( -2.174 -7.135 4.339) 8.629 7.772 ( 0.854 -0.219 -1.489) 1.731 7.982 ( -0.576 -0.086 -0.930) 1.097 8.223 ( -5.941 -2.309 1.529) 6.555 8.458 ( -5.773 -10.996 -0.127) 12.420 8.699 ( -1.050 -5.022 0.504) 5.156 9.155 ( 4.708 15.586 -0.527) 16.290 9.288 ( 0.107 4.013 3.310) 5.204 9.503 ( -2.884 -7.218 0.692) 7.803 9.798 ( 3.402 16.875 -3.373) 17.542 10.426 ( -3.242 2.187 -4.839) 6.221 10.713 ( 1.566 -0.830 0.667) 1.894 11.002 ( 0.932 -2.293 -0.039) 2.476 11.283 ( -8.105 -3.726 -3.255) 9.496 11.483 ( 0.763 -1.160 4.130) 4.357 11.908 ( -2.391 -0.392 4.122) 4.781 12.055 ( 2.075 -1.465 5.474) 6.034 12.124 ( 4.825 3.567 -1.461) 6.176 12.292 ( -0.600 -5.549 -3.939) 6.831 12.663 ( -3.942 1.259 0.884) 4.231 12.878 ( 2.063 -2.466 -3.480) 4.738 13.060 ( 4.037 1.124 -4.104) 5.866 13.226 ( -1.518 2.793 -0.488) 3.216 13.396 ( 0.493 5.438 1.019) 5.554 13.647 ( -3.028 5.213 2.072) 6.375 13.985 ( 9.868 -6.659 3.690) 12.463 14.337 ( -10.320 6.291 -1.357) 12.162 14.896 ( 3.727 -5.890 0.245) 6.974 15.275 ( 1.389 -0.320 -4.307) 4.536 15.377 ( -1.650 0.658 2.631) 3.175 ======================= Grid point 121 (47/141) ======================= q-point: (-0.40 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.477 ( -10.971 13.794 6.247) 18.700 1.689 ( -0.614 4.904 -0.562) 4.974 1.748 ( -10.159 10.925 3.511) 15.326 1.988 ( -1.974 -3.790 -2.371) 4.887 2.399 ( -3.694 0.389 -4.938) 6.179 2.454 ( 4.426 3.798 3.274) 6.689 2.691 ( -10.817 8.439 -2.645) 13.972 2.743 ( -9.805 9.053 -0.591) 13.358 2.970 ( -2.836 -2.639 -0.118) 3.876 3.156 ( -9.823 1.883 -0.337) 10.007 3.438 ( 4.231 -4.292 1.328) 6.171 3.579 ( 7.581 -8.666 -3.296) 11.976 3.786 ( 1.560 3.217 3.390) 4.927 3.863 ( 4.756 -2.853 -2.709) 6.172 3.968 ( 2.800 1.174 0.020) 3.036 4.143 ( 4.111 -5.432 -0.569) 6.836 4.168 ( 0.339 0.823 -0.645) 1.099 4.240 ( 3.018 -5.172 1.379) 6.145 4.497 ( 5.609 -2.964 1.182) 6.453 4.621 ( -4.320 5.133 -0.006) 6.709 4.800 ( 6.595 -4.524 1.141) 8.078 4.922 ( -0.011 3.434 -4.358) 5.549 5.138 ( 0.664 4.601 2.943) 5.502 5.423 ( 4.995 -6.163 4.674) 9.207 5.738 ( 1.097 1.582 -0.493) 1.987 5.849 ( -2.054 -1.114 -1.496) 2.774 5.976 ( -2.179 2.118 -2.949) 4.234 6.025 ( 1.553 -1.946 -0.329) 2.512 6.121 ( 0.743 2.650 -0.582) 2.813 6.296 ( -3.630 0.399 -1.388) 3.907 6.371 ( -0.001 2.365 0.743) 2.479 6.526 ( 6.081 0.283 3.324) 6.936 6.560 ( -3.184 0.396 2.363) 3.984 6.663 ( 0.680 -0.773 0.330) 1.081 6.793 ( -1.216 0.004 -0.015) 1.216 6.864 ( 1.175 3.042 -3.520) 4.798 6.974 ( 3.890 -7.316 1.303) 8.388 7.047 ( -2.045 -0.874 -2.259) 3.170 7.153 ( 4.607 -6.149 -3.988) 8.657 7.268 ( 3.757 -0.417 1.346) 4.013 7.341 ( -6.189 1.612 5.192) 8.238 7.572 ( 1.518 8.898 -0.129) 9.027 7.793 ( 0.956 -8.782 -2.670) 9.228 7.823 ( -0.713 -1.502 1.957) 2.568 8.023 ( 4.766 -3.851 -0.160) 6.130 8.185 ( 1.705 -3.556 0.399) 3.964 8.518 ( -2.862 -14.205 1.954) 14.622 8.703 ( -3.523 -6.139 -3.015) 7.693 9.121 ( 6.761 11.730 2.718) 13.809 9.310 ( 2.366 -2.953 4.159) 5.623 9.573 ( -3.018 -15.286 1.477) 15.651 9.714 ( 5.378 12.724 -3.855) 14.342 10.338 ( -0.285 7.441 -2.893) 7.989 10.712 ( -1.912 -1.752 -6.793) 7.272 11.031 ( -0.285 -1.440 0.869) 1.706 11.175 ( -7.423 -3.905 -4.211) 9.385 11.535 ( 2.641 -0.190 5.239) 5.870 11.887 ( -2.427 -0.960 2.828) 3.849 12.121 ( 4.028 0.271 2.250) 4.622 12.226 ( 7.872 -1.043 0.934) 7.995 12.343 ( 0.355 -6.146 -0.199) 6.159 12.583 ( -4.019 1.433 2.669) 5.033 12.890 ( -0.858 1.580 -1.838) 2.571 13.073 ( 0.262 3.521 -3.548) 5.005 13.128 ( -2.713 6.909 -1.909) 7.664 13.355 ( 1.338 7.661 2.717) 8.238 13.503 ( -5.444 5.457 -0.145) 7.710 14.053 ( -11.114 6.031 -7.561) 14.732 14.281 ( 9.987 -7.611 9.244) 15.592 15.007 ( 2.761 -3.634 0.444) 4.585 15.284 ( 0.373 0.019 -3.308) 3.329 15.337 ( -2.635 -0.915 0.188) 2.795 ======================= Grid point 122 (48/141) ======================= q-point: (-0.30 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.135 ( -15.003 13.545 11.492) 23.251 1.424 ( -13.340 15.836 6.270) 21.634 1.591 ( -3.662 6.721 -5.282) 9.300 2.028 ( 1.151 -5.310 -0.872) 5.503 2.216 ( -19.748 22.973 -1.172) 30.317 2.323 ( -5.613 3.816 -2.868) 7.369 2.407 ( -10.737 15.962 -2.571) 19.408 2.541 ( 4.914 3.278 3.367) 6.799 2.862 ( -9.289 -1.737 1.232) 9.530 3.049 ( -5.091 -1.223 -2.715) 5.898 3.531 ( 3.274 1.681 -0.317) 3.694 3.691 ( 2.524 -1.518 -0.729) 3.035 3.869 ( 4.543 -1.734 3.498) 5.990 3.973 ( 1.497 -3.164 -3.155) 4.712 4.014 ( 4.076 -3.646 -1.659) 5.715 4.157 ( -1.216 -2.788 2.614) 4.011 4.278 ( 6.379 -5.416 -2.915) 8.861 4.395 ( 5.223 -1.671 2.006) 5.839 4.496 ( 2.844 -1.975 -1.626) 3.825 4.695 ( 5.015 -5.289 -0.853) 7.338 4.865 ( -0.262 1.392 -2.661) 3.015 4.963 ( 4.507 -7.156 1.909) 8.669 5.145 ( 3.439 2.838 2.617) 5.170 5.547 ( -0.773 -5.599 1.769) 5.922 5.713 ( 0.153 6.862 -0.302) 6.871 5.802 ( -2.881 0.450 2.260) 3.689 5.890 ( -3.266 -0.869 -3.184) 4.643 6.047 ( 0.680 -1.516 -2.052) 2.640 6.142 ( 3.046 1.946 -1.597) 3.951 6.217 ( -4.360 0.464 -0.263) 4.393 6.313 ( -2.320 4.821 0.521) 5.375 6.513 ( -2.246 -1.349 0.181) 2.627 6.625 ( 2.652 -0.835 5.461) 6.128 6.659 ( -4.071 -1.524 1.223) 4.515 6.734 ( -1.411 3.307 -2.669) 4.478 6.834 ( 0.723 3.908 -3.072) 5.023 7.011 ( -3.818 -0.292 0.255) 3.838 7.065 ( 0.158 -1.078 2.107) 2.372 7.185 ( -2.939 -1.354 -0.398) 3.260 7.264 ( 2.174 6.357 0.611) 6.747 7.381 ( 2.575 -7.084 2.695) 8.005 7.535 ( -1.833 -1.204 -1.748) 2.804 7.746 ( -6.249 -0.341 -2.330) 6.678 7.880 ( 2.706 -4.710 -1.869) 5.745 8.244 ( 14.793 -5.458 0.809) 15.788 8.347 ( 10.814 2.792 -0.092) 11.169 8.563 ( -6.881 -10.095 5.687) 13.476 8.809 ( 7.040 -13.384 -2.074) 15.264 9.165 ( 7.374 6.997 4.785) 11.236 9.438 ( 5.216 -5.342 3.239) 8.138 9.664 ( -2.756 -11.364 0.490) 11.703 9.727 ( 3.572 -3.065 -2.321) 5.247 10.267 ( 3.788 9.346 -1.992) 10.280 10.646 ( -3.616 -1.762 -20.116) 20.515 11.018 ( -2.403 0.049 0.770) 2.524 11.085 ( -4.635 -0.764 -2.867) 5.504 11.593 ( 2.069 0.354 4.515) 4.979 11.864 ( -0.974 0.719 1.334) 1.801 12.183 ( 2.758 0.897 -0.698) 2.983 12.383 ( 7.011 -2.274 0.442) 7.384 12.426 ( 1.434 -6.887 6.286) 9.434 12.521 ( -2.798 1.729 3.251) 4.625 12.790 ( -5.612 5.593 0.655) 7.950 12.983 ( -3.489 8.723 2.007) 9.607 13.007 ( -2.309 5.835 -5.685) 8.468 13.297 ( 1.145 8.043 1.072) 8.194 13.420 ( 0.010 3.211 3.492) 4.744 13.765 ( -11.337 8.066 -5.336) 14.902 14.541 ( 7.769 -8.524 4.902) 12.532 15.053 ( 0.419 -0.778 0.411) 0.975 15.240 ( -2.233 3.243 1.595) 4.249 15.337 ( -1.874 -6.056 -7.771) 10.029 ======================= Grid point 123 (49/141) ======================= q-point: (-0.20 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.825 ( -11.443 10.684 21.457) 26.561 1.028 ( -15.982 18.401 9.602) 26.196 1.424 ( -4.237 11.816 -6.382) 14.082 1.582 ( -14.375 34.437 0.418) 37.319 1.932 ( -12.262 21.447 -4.062) 25.037 2.136 ( 0.345 -5.458 2.385) 5.966 2.296 ( 1.161 1.174 -5.712) 5.946 2.622 ( 5.007 0.935 2.812) 5.818 2.716 ( -9.586 0.072 -1.394) 9.687 2.963 ( -4.663 -1.070 -1.870) 5.136 3.522 ( 1.048 5.310 -0.519) 5.437 3.712 ( -1.150 1.792 -0.299) 2.150 3.904 ( -1.113 -0.647 1.857) 2.259 4.000 ( 3.590 -0.504 0.862) 3.726 4.135 ( 2.198 -7.084 1.009) 7.485 4.183 ( -2.730 -5.460 1.279) 6.237 4.424 ( 6.603 -2.788 -4.890) 8.677 4.505 ( 6.860 -2.294 -1.822) 7.459 4.640 ( 4.104 -7.857 -1.641) 9.015 4.728 ( -1.196 -1.528 -3.642) 4.127 4.941 ( 1.955 -7.140 4.774) 8.809 5.084 ( 1.153 -7.369 0.279) 7.464 5.189 ( 3.513 5.406 1.858) 6.709 5.495 ( -3.274 -0.560 -2.687) 4.272 5.659 ( 1.127 7.693 -0.880) 7.824 5.772 ( -4.905 -3.522 -1.666) 6.264 5.851 ( -0.369 0.913 2.802) 2.970 6.084 ( 1.906 -2.260 -0.609) 3.018 6.131 ( -1.513 0.306 -0.267) 1.567 6.180 ( 1.195 3.636 0.044) 3.827 6.258 ( 1.316 1.431 -2.162) 2.908 6.492 ( -2.204 -1.332 0.491) 2.621 6.575 ( -5.291 -1.214 -3.586) 6.506 6.684 ( -1.477 2.072 3.274) 4.146 6.689 ( 2.510 0.259 3.084) 3.984 6.791 ( 0.172 4.346 -2.762) 5.152 6.944 ( -1.361 2.564 0.370) 2.926 7.036 ( -2.509 1.730 1.112) 3.244 7.132 ( -3.138 0.173 0.549) 3.190 7.264 ( -0.769 0.612 1.124) 1.493 7.356 ( -6.823 1.626 8.291) 10.860 7.616 ( 2.438 -7.186 -8.478) 11.378 7.655 ( -3.950 -4.030 -0.154) 5.645 7.959 ( 2.225 -4.332 -4.412) 6.571 8.278 ( -2.379 16.045 5.865) 17.248 8.647 ( 17.225 -5.596 5.594) 18.956 8.664 ( 8.525 -7.184 2.637) 11.456 9.040 ( 2.257 -13.863 -4.277) 14.682 9.202 ( -2.295 0.219 6.565) 6.958 9.512 ( 1.843 6.977 2.799) 7.741 9.757 ( -0.962 -6.675 -2.743) 7.280 9.883 ( 8.823 -14.449 -4.502) 17.518 10.329 ( 2.121 -10.341 -3.778) 11.212 10.509 ( 4.139 8.816 -33.334) 34.727 10.957 ( -3.783 1.902 2.044) 4.701 11.017 ( -1.766 2.262 -3.987) 4.913 11.596 ( -2.574 2.296 2.950) 4.539 11.841 ( 0.311 4.729 0.108) 4.741 12.202 ( 1.596 -0.170 -0.424) 1.660 12.420 ( -0.679 7.182 -1.133) 7.303 12.453 ( -3.290 4.474 2.400) 6.050 12.554 ( 0.252 -7.529 9.669) 12.257 12.709 ( 0.247 -2.969 0.856) 3.100 12.800 ( -4.760 10.480 2.714) 11.826 12.933 ( -0.897 3.145 -3.185) 4.565 13.276 ( 4.061 5.845 3.394) 7.885 13.400 ( -3.614 4.158 1.779) 5.789 13.535 ( -1.928 6.831 -0.301) 7.104 14.721 ( 3.250 -6.669 2.368) 7.788 15.057 ( -0.461 -0.394 0.000) 0.606 15.181 ( -2.019 1.957 0.637) 2.883 15.292 ( -5.379 -1.821 -12.764) 13.970 ======================= Grid point 124 (50/141) ======================= q-point: (-0.10 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.624 ( -6.697 20.621 11.308) 24.453 0.710 ( -0.679 8.400 29.006) 30.206 1.074 ( 7.210 37.881 15.103) 41.413 1.380 ( 7.097 9.035 -10.089) 15.290 1.521 ( -7.241 21.317 -4.693) 22.997 2.203 ( -0.435 -5.232 -4.296) 6.783 2.342 ( 6.875 -0.743 0.305) 6.921 2.525 ( -10.359 -0.148 -5.994) 11.970 2.715 ( 5.206 -0.400 3.169) 6.108 2.921 ( -0.157 0.119 -1.865) 1.876 3.486 ( 1.108 5.104 1.875) 5.550 3.642 ( -2.178 3.347 -2.396) 4.658 3.947 ( 3.042 -3.642 5.808) 7.501 4.089 ( 4.360 -3.483 -0.142) 5.582 4.147 ( -6.357 -4.294 2.053) 7.942 4.214 ( 0.650 -1.152 2.488) 2.817 4.515 ( 3.611 -0.344 -5.830) 6.866 4.589 ( 1.596 -0.620 -6.612) 6.830 4.713 ( -1.397 -6.089 -1.845) 6.514 4.757 ( -0.545 -5.528 -0.282) 5.562 4.984 ( -5.926 -4.075 2.716) 7.687 5.137 ( 1.126 4.876 1.555) 5.241 5.182 ( 1.312 -4.691 0.668) 4.917 5.494 ( 2.250 5.299 -5.901) 8.244 5.616 ( 2.983 0.943 1.008) 3.286 5.711 ( -3.587 -0.397 -2.556) 4.422 5.879 ( 0.765 -2.738 2.918) 4.074 6.096 ( -0.599 2.230 -1.623) 2.823 6.139 ( 1.675 0.303 0.104) 1.706 6.158 ( -0.616 0.611 2.061) 2.236 6.299 ( 4.219 1.680 -4.452) 6.359 6.461 ( -2.330 0.245 -3.568) 4.268 6.507 ( -3.277 -2.582 -1.164) 4.331 6.653 ( 0.429 2.660 1.698) 3.185 6.730 ( 2.419 4.613 0.177) 5.212 6.746 ( 1.278 0.568 3.648) 3.907 6.966 ( 3.778 1.362 -0.921) 4.121 7.012 ( 2.717 -0.639 -0.550) 2.845 7.083 ( -3.083 2.413 2.287) 4.534 7.158 ( -7.678 -3.068 5.937) 10.179 7.275 ( -8.720 1.236 1.910) 9.012 7.635 ( 7.008 -2.144 -2.928) 7.892 7.732 ( -0.224 -5.369 2.097) 5.768 7.974 ( 0.340 9.564 -2.224) 9.825 8.126 ( 6.686 13.288 4.137) 15.440 8.865 ( -5.242 -7.322 2.408) 9.321 8.885 ( 0.559 -9.602 2.645) 9.976 9.088 ( -6.619 -3.458 -2.103) 7.758 9.222 ( 0.399 -10.223 -3.627) 10.855 9.416 ( -1.791 10.323 0.951) 10.520 9.679 ( 5.591 11.895 -18.321) 22.548 9.962 ( 6.987 27.097 -27.316) 39.105 10.442 ( 3.751 -22.477 -3.228) 23.015 10.706 ( 4.470 -19.168 -8.829) 21.572 10.880 ( 0.764 1.888 0.215) 2.048 10.949 ( 1.041 4.661 -4.042) 6.256 11.445 ( -8.045 10.181 2.859) 13.287 11.761 ( 1.295 11.532 -3.401) 12.092 12.250 ( 1.375 2.048 2.191) 3.299 12.336 ( 0.690 8.755 -1.177) 8.861 12.348 ( 1.439 3.279 3.102) 4.738 12.562 ( -6.411 2.651 2.041) 7.232 12.682 ( -4.269 -7.343 8.667) 12.134 12.810 ( 0.323 -5.408 3.994) 6.731 12.908 ( 1.579 0.867 -1.551) 2.377 13.209 ( -6.310 8.111 -3.453) 10.841 13.349 ( 5.075 1.679 3.484) 6.381 13.487 ( -5.043 5.642 0.135) 7.569 14.794 ( -1.071 -3.879 0.464) 4.050 15.030 ( -1.157 1.922 -5.644) 6.074 15.133 ( 0.828 2.554 -2.630) 3.758 15.179 ( 3.255 7.045 -7.318) 10.666 ======================= Grid point 127 (51/141) ======================= q-point: ( 0.20 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 141 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.658 ( 15.144 -0.000 6.059) 16.311 1.730 ( 14.629 -0.000 5.770) 15.726 1.749 ( 11.385 -0.000 -6.427) 13.074 1.805 ( -2.057 0.000 -4.919) 5.331 2.225 ( 6.981 -0.000 -4.492) 8.301 2.539 ( 1.295 -0.000 2.148) 2.508 2.572 ( 9.057 -0.000 -0.514) 9.072 2.706 ( 13.513 -0.000 2.010) 13.662 3.142 ( -1.977 0.000 -0.428) 2.022 3.147 ( -1.022 0.000 -1.919) 2.174 3.442 ( -6.811 0.000 -1.185) 6.913 3.560 ( 0.738 -0.000 2.722) 2.820 3.792 ( -6.760 0.000 0.663) 6.792 3.850 ( -2.860 0.000 -4.122) 5.017 3.955 ( -0.714 0.000 1.126) 1.334 4.064 ( -5.644 0.000 2.333) 6.107 4.223 ( 2.500 -0.000 2.672) 3.659 4.313 ( -5.570 0.000 1.244) 5.707 4.408 ( -1.802 0.000 -2.129) 2.789 4.522 ( -8.647 0.000 -3.528) 9.339 4.650 ( -4.964 0.000 2.719) 5.659 4.745 ( 7.110 -0.000 -4.450) 8.388 5.331 ( -3.450 0.000 3.290) 4.768 5.401 ( 3.486 -0.000 0.411) 3.510 5.773 ( -6.020 0.000 -1.222) 6.142 5.870 ( -4.010 0.000 4.372) 5.933 5.945 ( -2.507 0.000 -5.305) 5.867 5.946 ( 5.630 -0.000 -3.921) 6.860 6.081 ( 0.458 -0.000 5.093) 5.114 6.197 ( 2.982 -0.000 -2.453) 3.862 6.375 ( 2.139 -0.000 5.002) 5.440 6.394 ( -3.237 0.000 5.423) 6.316 6.511 ( -3.014 0.000 -5.159) 5.975 6.526 ( 3.510 -0.000 3.212) 4.758 6.644 ( -4.691 0.000 0.744) 4.749 6.882 ( -5.404 0.000 -3.269) 6.316 6.949 ( -4.302 0.000 4.168) 5.990 6.986 ( -3.613 0.000 -3.904) 5.319 7.068 ( 0.403 -0.000 -3.085) 3.111 7.174 ( 1.689 -0.000 -0.914) 1.920 7.193 ( 1.646 -0.000 -3.063) 3.478 7.404 ( 8.376 -0.000 0.187) 8.378 7.722 ( 2.379 -0.000 -1.598) 2.866 7.870 ( -5.570 0.000 6.029) 8.208 8.195 ( -9.533 0.000 5.605) 11.059 8.393 ( -3.138 0.000 -4.810) 5.743 8.598 ( -14.671 0.000 2.736) 14.924 8.695 ( -4.873 0.000 -1.565) 5.118 9.413 ( -2.122 0.000 0.473) 2.175 9.413 ( -1.619 0.000 -0.608) 1.729 9.949 ( 8.847 -0.000 6.443) 10.944 10.023 ( -2.591 0.000 -9.628) 9.971 10.425 ( 4.575 -0.000 -6.653) 8.075 10.486 ( 12.727 -0.000 5.606) 13.907 11.010 ( 0.421 -0.000 -5.159) 5.176 11.268 ( 2.295 -0.000 9.024) 9.311 11.611 ( -7.819 0.000 -9.157) 12.041 11.959 ( 1.898 -0.000 2.502) 3.141 12.177 ( -10.112 0.000 8.160) 12.994 12.186 ( -1.704 0.000 -2.448) 2.982 12.326 ( -1.793 0.000 1.309) 2.220 12.605 ( 1.003 -0.000 -2.777) 2.952 12.719 ( 1.601 -0.000 -5.742) 5.961 12.882 ( 7.259 -0.000 1.724) 7.461 13.184 ( 1.545 -0.000 -0.279) 1.570 13.196 ( 6.178 -0.000 9.062) 10.968 13.610 ( 12.246 -0.000 0.332) 12.251 13.756 ( -1.648 0.000 -6.232) 6.446 14.700 ( -3.636 0.000 13.815) 14.285 14.854 ( -5.509 0.000 -8.909) 10.474 15.177 ( 3.426 -0.000 -2.102) 4.020 15.349 ( 1.422 -0.000 -2.940) 3.266 ======================= Grid point 128 (52/141) ======================= q-point: ( 0.30 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( 2.106 4.175 -1.488) 4.907 1.839 ( 5.829 1.537 2.626) 6.575 1.945 ( 8.583 0.591 1.621) 8.755 1.989 ( 12.763 -3.223 -2.423) 13.384 2.317 ( 3.833 -0.193 -2.286) 4.467 2.541 ( -0.223 1.359 -0.385) 1.429 2.684 ( 4.095 -4.027 -4.402) 7.236 2.876 ( 4.460 -1.036 3.072) 5.514 3.058 ( -4.825 -0.108 -0.095) 4.827 3.088 ( -6.040 -2.073 -1.505) 6.561 3.308 ( -8.675 -1.283 0.243) 8.773 3.559 ( -6.628 -0.414 3.732) 7.618 3.713 ( 2.771 -0.090 -0.316) 2.791 3.816 ( -0.639 -0.655 -2.390) 2.559 3.968 ( 0.598 2.364 0.681) 2.531 4.009 ( -1.499 0.175 1.917) 2.440 4.246 ( -0.917 1.116 -0.727) 1.617 4.276 ( 1.340 -2.166 2.099) 3.300 4.360 ( -3.245 2.568 -1.172) 4.301 4.453 ( 0.146 -3.992 -1.162) 4.160 4.633 ( 2.333 -1.257 0.510) 2.699 4.891 ( 9.195 -0.902 -1.845) 9.422 5.243 ( -1.073 8.032 0.769) 8.139 5.510 ( 4.658 -4.140 1.308) 6.368 5.680 ( -3.244 1.737 0.669) 3.740 5.803 ( -5.016 -1.660 1.474) 5.485 5.884 ( -2.052 1.123 -4.995) 5.515 6.037 ( 6.472 0.487 -0.101) 6.491 6.128 ( 2.046 -0.763 6.415) 6.776 6.251 ( 1.346 -1.660 -0.134) 2.141 6.347 ( -0.618 4.105 -2.426) 4.808 6.450 ( 2.196 -0.057 4.945) 5.410 6.474 ( -1.031 -9.303 -0.962) 9.410 6.529 ( -4.633 -3.992 0.519) 6.138 6.669 ( 5.161 -1.224 0.260) 5.311 6.763 ( -3.901 1.514 -5.821) 7.169 6.861 ( -4.149 2.633 1.939) 5.283 6.965 ( -4.219 -6.104 -0.415) 7.432 7.050 ( -1.149 -2.012 -0.932) 2.498 7.184 ( 2.641 3.373 -4.476) 6.196 7.269 ( 1.978 -5.115 -3.719) 6.626 7.539 ( 6.003 0.993 3.213) 6.880 7.738 ( 1.050 2.035 0.288) 2.308 7.819 ( -3.607 -1.057 7.773) 8.634 8.053 ( -6.763 1.096 1.719) 7.064 8.307 ( -8.463 0.096 -2.902) 8.947 8.397 ( -7.060 -1.802 1.190) 7.383 8.654 ( -0.175 0.190 -0.534) 0.593 9.347 ( -4.097 1.203 -0.365) 4.286 9.362 ( -4.242 -0.652 1.276) 4.477 9.851 ( -0.216 17.059 -3.497) 17.415 10.126 ( 5.915 0.076 -0.922) 5.987 10.457 ( 0.221 -0.454 -3.538) 3.573 10.674 ( 7.660 2.025 6.762) 10.416 10.975 ( -1.597 1.235 -3.633) 4.157 11.306 ( -4.528 -2.472 -0.995) 5.254 11.433 ( -7.897 -2.769 0.514) 8.384 11.999 ( 2.181 1.731 2.441) 3.703 12.019 ( -9.862 -0.719 8.155) 12.817 12.162 ( 0.735 1.144 -1.408) 1.958 12.286 ( -1.011 2.878 -1.581) 3.436 12.638 ( -0.132 -5.333 -3.409) 6.331 12.754 ( 3.971 -0.691 -5.711) 6.990 12.972 ( 3.588 -1.644 -6.417) 7.533 13.242 ( 4.717 2.025 4.421) 6.775 13.346 ( 5.583 -4.107 7.440) 10.169 13.707 ( 3.610 4.762 0.834) 6.034 13.809 ( 6.055 -2.387 -2.305) 6.905 14.635 ( -6.804 3.175 7.625) 10.701 14.746 ( -4.002 -2.421 -6.057) 7.653 15.235 ( 3.529 -0.579 -3.179) 4.785 15.373 ( 1.159 -0.376 0.708) 1.409 ======================= Grid point 129 (53/141) ======================= q-point: (-0.60 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.765 ( 2.738 2.834 1.848) 4.352 1.870 ( 1.065 4.505 1.574) 4.889 2.004 ( 1.309 6.041 -0.368) 6.192 2.119 ( 0.748 3.876 -1.941) 4.399 2.364 ( 2.203 -3.069 0.688) 3.840 2.513 ( 0.071 2.275 -2.196) 3.162 2.798 ( 5.646 -3.607 -3.228) 7.436 2.905 ( -0.710 -0.784 1.986) 2.250 2.935 ( -7.864 0.686 -3.239) 8.533 3.113 ( 1.963 -7.956 -0.891) 8.243 3.214 ( -5.012 -6.152 1.246) 8.032 3.422 ( -9.853 -1.211 3.838) 10.643 3.802 ( 4.852 0.283 -1.547) 5.101 3.847 ( 3.705 -1.449 -1.039) 4.111 3.948 ( -0.335 0.931 -0.503) 1.110 4.000 ( 1.121 2.280 5.215) 5.801 4.209 ( -0.322 2.904 -4.399) 5.281 4.297 ( -3.467 0.282 -0.078) 3.479 4.318 ( 1.495 -2.064 -1.477) 2.946 4.534 ( 4.197 -3.019 4.786) 7.046 4.736 ( 6.132 -2.507 -2.931) 7.244 5.035 ( 5.919 1.156 2.252) 6.438 5.159 ( 1.840 7.389 -0.412) 7.625 5.523 ( -2.866 8.270 4.086) 9.659 5.699 ( 2.277 -4.602 -0.941) 5.220 5.755 ( -5.031 -6.335 -2.063) 8.349 5.864 ( 4.062 0.643 -2.030) 4.586 6.114 ( 1.622 3.209 -1.909) 4.070 6.174 ( 1.110 1.075 6.333) 6.519 6.271 ( -0.997 -0.640 0.026) 1.184 6.331 ( 7.863 0.149 -1.745) 8.056 6.483 ( -4.664 -4.485 -3.162) 7.201 6.519 ( 1.065 -3.727 2.930) 4.859 6.593 ( 0.401 -7.604 -0.277) 7.619 6.733 ( 2.966 0.005 -2.262) 3.730 6.774 ( 1.040 2.320 1.332) 2.871 6.816 ( 6.110 -4.372 1.321) 7.628 6.943 ( -3.381 -3.382 -1.702) 5.076 7.068 ( 0.207 -2.629 -0.915) 2.791 7.166 ( -1.298 -0.168 -2.633) 2.940 7.321 ( -2.915 -11.208 -3.075) 11.982 7.555 ( -3.592 3.617 5.872) 7.776 7.751 ( 1.906 0.640 1.472) 2.492 7.780 ( -2.886 2.073 3.888) 5.267 7.974 ( -2.319 -1.136 -1.433) 2.953 8.202 ( -2.152 -1.869 1.172) 3.082 8.321 ( -5.379 -0.820 -1.152) 5.561 8.665 ( 1.138 0.039 -0.692) 1.332 9.266 ( -4.856 -0.730 1.126) 5.038 9.300 ( -5.453 -3.691 0.602) 6.613 9.664 ( -0.211 18.534 0.353) 18.538 10.158 ( 6.668 15.027 -2.981) 16.708 10.423 ( -2.266 -1.107 -3.968) 4.701 10.735 ( 0.882 2.911 3.734) 4.816 10.957 ( 0.506 -1.910 -1.543) 2.507 11.159 ( -11.750 -8.534 -7.437) 16.316 11.453 ( 1.083 -1.626 9.104) 9.311 11.898 ( -6.264 -0.910 6.063) 8.765 12.049 ( 3.321 0.911 3.185) 4.691 12.185 ( 3.401 0.892 -1.677) 3.895 12.243 ( -0.157 1.946 -1.722) 2.603 12.654 ( -2.299 -2.758 -0.439) 3.617 12.822 ( 4.266 -1.835 -6.510) 7.996 13.030 ( 3.606 -3.255 -10.296) 11.384 13.290 ( 1.869 3.679 4.379) 6.017 13.448 ( 1.245 -0.410 4.378) 4.570 13.752 ( 2.993 4.740 2.086) 5.982 13.893 ( 4.759 -2.392 1.506) 5.535 14.461 ( -8.962 6.230 1.847) 11.070 14.762 ( 1.314 -7.119 -2.075) 7.530 15.274 ( 1.840 0.089 -4.445) 4.812 15.387 ( -0.482 0.287 3.002) 3.054 ======================= Grid point 130 (54/141) ======================= q-point: (-0.50 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.747 ( -4.911 10.507 4.154) 12.320 1.808 ( 0.806 7.135 0.693) 7.214 1.894 ( -3.894 4.391 -2.280) 6.296 2.003 ( -5.908 6.632 5.017) 10.201 2.385 ( -3.188 -2.153 -4.136) 5.649 2.528 ( 4.493 3.383 0.566) 5.653 2.778 ( -5.644 2.191 -2.585) 6.583 2.860 ( -1.152 3.035 0.032) 3.246 2.928 ( 0.859 -1.763 -2.121) 2.889 3.160 ( -6.406 -2.971 1.114) 7.149 3.311 ( 0.981 -8.786 -0.099) 8.841 3.375 ( 6.790 -9.470 -0.375) 11.659 3.856 ( 0.045 2.768 0.302) 2.785 3.861 ( 2.881 1.658 -1.349) 3.587 3.998 ( 1.663 0.257 2.927) 3.376 4.032 ( 3.764 -3.212 1.029) 5.054 4.166 ( 0.229 1.192 -4.016) 4.196 4.225 ( -3.008 1.391 -0.510) 3.353 4.401 ( 4.203 -5.637 -0.951) 7.095 4.632 ( 0.822 -2.991 5.296) 6.138 4.811 ( 3.141 2.856 -3.507) 5.507 5.007 ( -0.183 6.254 0.026) 6.257 5.223 ( 4.058 1.860 0.844) 4.543 5.397 ( -1.520 5.159 5.704) 7.840 5.725 ( -4.451 -5.869 -2.310) 7.720 5.750 ( -0.265 -4.072 -1.948) 4.522 5.986 ( 6.626 -1.040 2.301) 7.091 6.052 ( -1.241 3.157 -5.715) 6.646 6.173 ( -0.841 2.076 2.813) 3.595 6.267 ( -3.498 -2.283 1.844) 4.566 6.406 ( -1.395 -0.767 -5.205) 5.443 6.497 ( 0.176 -1.179 0.856) 1.468 6.552 ( 1.830 -1.952 4.022) 4.831 6.626 ( -2.033 -3.062 -0.979) 3.804 6.792 ( 3.658 -6.463 -0.017) 7.427 6.818 ( 4.370 1.073 2.052) 4.945 6.915 ( -1.726 -0.984 -3.034) 3.626 7.001 ( 4.254 -2.801 0.293) 5.102 7.058 ( -1.911 -1.662 -3.937) 4.682 7.215 ( 5.689 -4.322 1.241) 7.251 7.401 ( -7.686 0.209 1.509) 7.836 7.425 ( -3.992 -14.678 3.113) 15.526 7.710 ( -2.417 3.629 0.715) 4.418 7.807 ( 4.541 -1.607 0.294) 4.826 8.005 ( 6.087 -1.120 -1.786) 6.442 8.212 ( 0.976 4.853 -2.410) 5.506 8.277 ( -1.485 -8.584 4.881) 9.986 8.665 ( -0.310 0.446 -3.063) 3.111 9.223 ( -2.276 -3.236 2.032) 4.447 9.273 ( -2.764 -6.070 -0.639) 6.700 9.501 ( -0.814 14.021 5.545) 15.100 10.056 ( 4.260 19.279 -3.809) 20.108 10.426 ( 3.826 1.426 -5.107) 6.538 10.690 ( -4.618 -0.742 -2.674) 5.387 10.995 ( 0.722 -2.595 0.320) 2.712 11.082 ( -4.205 -5.410 -2.705) 7.367 11.509 ( 0.746 -1.917 7.131) 7.422 11.855 ( -2.744 -2.076 4.349) 5.545 12.116 ( 3.644 -0.371 3.558) 5.107 12.242 ( 5.371 2.160 -1.556) 5.995 12.249 ( 1.074 -3.064 -0.855) 3.358 12.620 ( -2.055 1.840 2.165) 3.506 12.881 ( 2.210 -1.650 -5.962) 6.569 13.086 ( 2.393 -2.077 -9.730) 10.233 13.241 ( -3.368 4.899 2.740) 6.546 13.466 ( 1.546 2.789 5.183) 6.086 13.646 ( -4.780 8.575 -4.052) 10.621 14.072 ( 6.057 -5.597 1.447) 8.373 14.248 ( -7.615 6.113 6.578) 11.774 14.885 ( 3.877 -8.144 -2.304) 9.309 15.270 ( -0.345 0.015 -5.265) 5.276 15.362 ( -2.567 1.495 3.559) 4.636 ======================= Grid point 131 (55/141) ======================= q-point: (-0.40 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.442 ( -12.777 17.015 7.891) 22.694 1.694 ( -6.926 10.949 0.740) 12.977 1.764 ( -3.383 10.884 -0.613) 11.414 1.935 ( -0.129 -3.114 3.441) 4.643 2.323 ( -2.854 0.056 -5.731) 6.403 2.530 ( -1.480 4.157 1.322) 4.606 2.686 ( -2.667 10.433 0.073) 10.769 2.715 ( -3.314 12.730 -1.372) 13.226 2.862 ( -7.925 1.969 1.713) 8.344 3.043 ( -3.805 1.097 -3.536) 5.309 3.479 ( 6.686 -7.050 0.951) 9.762 3.627 ( 8.531 -8.855 -4.025) 12.938 3.809 ( -2.391 0.666 5.057) 5.633 3.897 ( 1.969 -1.434 -3.818) 4.529 4.009 ( 1.006 0.801 1.757) 2.177 4.113 ( -1.744 -3.726 -0.223) 4.120 4.177 ( 2.259 -3.082 -1.639) 4.158 4.256 ( 4.629 -6.577 0.056) 8.043 4.549 ( 5.265 -6.744 -0.069) 8.556 4.607 ( -2.570 4.917 2.473) 6.075 4.823 ( 0.181 -3.061 -0.565) 3.118 4.958 ( 0.747 4.834 -4.522) 6.661 5.200 ( 0.586 3.334 3.218) 4.670 5.446 ( 1.377 -3.752 4.167) 5.774 5.704 ( -3.798 -6.012 -2.335) 7.484 5.781 ( -0.050 -2.462 1.162) 2.723 5.966 ( -2.640 3.720 -2.596) 5.249 6.053 ( -0.039 3.630 2.014) 4.152 6.166 ( 2.988 0.760 -2.815) 4.175 6.194 ( -6.153 -2.580 0.753) 6.715 6.374 ( -2.605 -0.680 -4.659) 5.381 6.471 ( -2.230 -1.354 2.808) 3.832 6.599 ( -2.076 -1.076 2.919) 3.740 6.624 ( -0.985 -3.298 0.743) 3.521 6.797 ( -1.573 2.704 -0.833) 3.238 6.875 ( -3.019 -0.974 -1.417) 3.474 6.946 ( 1.090 -4.755 1.937) 5.249 7.059 ( 4.942 -0.050 0.933) 5.029 7.094 ( 0.166 -8.477 -5.825) 10.287 7.222 ( -8.965 -4.638 5.051) 11.287 7.310 ( -1.037 -1.846 -0.380) 2.151 7.557 ( -3.726 -8.275 3.341) 9.671 7.634 ( 0.754 4.890 -0.318) 4.958 7.878 ( 2.677 2.547 -6.349) 7.346 8.214 ( 17.352 -0.916 -0.930) 17.401 8.312 ( 6.978 -7.920 4.364) 11.422 8.373 ( 5.574 -5.029 3.465) 8.268 8.655 ( 0.875 -2.425 -3.954) 4.720 9.281 ( 0.907 -7.751 0.461) 7.818 9.333 ( 4.880 -1.207 -1.342) 5.203 9.397 ( -2.323 1.736 9.529) 9.961 9.945 ( 3.548 14.663 -2.975) 15.376 10.431 ( -1.353 6.392 -0.541) 6.556 10.614 ( 0.230 -1.344 -13.943) 14.009 11.018 ( -0.362 -0.502 1.934) 2.030 11.078 ( 0.585 -0.243 -2.557) 2.634 11.558 ( -0.165 -3.059 5.871) 6.622 11.857 ( -0.401 -1.328 2.822) 3.144 12.187 ( 2.364 -0.911 1.205) 2.806 12.306 ( 0.966 -4.789 3.245) 5.865 12.334 ( 5.804 -1.830 -3.178) 6.866 12.583 ( 0.985 4.442 3.612) 5.809 12.872 ( -2.567 1.946 -2.847) 4.299 13.051 ( -3.125 2.499 -6.439) 7.580 13.158 ( -0.996 5.346 2.372) 5.932 13.447 ( -5.623 2.263 -4.106) 7.321 13.498 ( 3.650 9.230 5.064) 11.143 13.943 ( -9.090 9.467 -3.672) 13.629 14.355 ( 5.514 -9.715 9.246) 14.501 15.001 ( 2.087 -5.156 -2.114) 5.950 15.246 ( -1.616 -2.332 -6.075) 6.704 15.297 ( -3.495 2.341 2.659) 4.977 ======================= Grid point 132 (56/141) ======================= q-point: (-0.30 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.098 ( -10.507 16.801 15.100) 24.914 1.382 ( -12.261 17.647 6.316) 22.397 1.623 ( 0.190 9.508 -7.432) 12.069 2.000 ( 1.467 -4.073 0.681) 4.382 2.230 ( -4.438 17.200 -3.240) 18.056 2.354 ( -4.307 18.361 3.547) 19.190 2.364 ( -6.708 12.745 -2.607) 14.636 2.639 ( -2.079 1.473 -0.993) 2.735 2.791 ( 2.326 7.364 2.250) 8.043 2.946 ( -5.246 0.127 -3.291) 6.194 3.613 ( 4.274 1.670 -0.978) 4.692 3.699 ( -0.713 -1.470 -0.952) 1.891 3.877 ( 1.402 -5.197 0.091) 5.384 3.940 ( -0.341 -7.405 1.898) 7.652 4.018 ( -0.221 0.495 1.726) 1.809 4.101 ( -1.234 -3.817 -0.191) 4.016 4.305 ( 5.045 -7.805 -2.888) 9.732 4.419 ( 3.744 -10.314 -0.871) 11.007 4.544 ( 2.010 3.695 0.314) 4.219 4.687 ( 1.473 -5.285 -0.945) 5.567 4.828 ( -2.452 -3.764 -0.849) 4.572 4.951 ( 0.620 -3.694 -0.720) 3.815 5.240 ( 4.414 0.379 1.513) 4.681 5.454 ( -4.848 -2.841 1.417) 5.795 5.699 ( -1.907 -3.107 -1.326) 3.880 5.783 ( -1.294 0.689 4.021) 4.280 5.907 ( 1.148 5.827 -1.909) 6.238 6.031 ( 0.030 -2.510 -1.631) 2.994 6.115 ( -3.642 -2.148 -0.665) 4.280 6.227 ( 3.503 0.989 -0.352) 3.657 6.303 ( -2.407 1.497 -5.728) 6.391 6.458 ( -2.437 -0.582 4.380) 5.046 6.541 ( -4.593 -2.092 -1.005) 5.146 6.663 ( 1.355 -2.060 3.951) 4.657 6.741 ( -2.382 2.240 1.836) 3.750 6.836 ( -1.880 -1.526 -1.829) 3.034 6.963 ( -0.309 0.367 -0.135) 0.499 7.071 ( -3.915 -0.191 -1.581) 4.226 7.132 ( 0.801 0.598 2.214) 2.429 7.225 ( -4.818 -6.212 2.433) 8.229 7.372 ( 3.768 -12.390 -3.103) 13.317 7.471 ( -3.417 6.377 4.150) 8.341 7.624 ( -1.089 0.955 -2.390) 2.794 7.875 ( 1.776 -1.195 -7.673) 7.966 8.394 ( -4.226 -8.738 9.262) 13.416 8.514 ( 15.951 2.762 1.107) 16.226 8.631 ( 12.983 -3.013 0.841) 13.354 8.777 ( 4.323 -12.072 -2.403) 13.046 9.197 ( -12.929 -0.862 8.743) 15.631 9.509 ( 13.516 -5.558 -0.611) 14.627 9.569 ( 8.691 -8.898 -2.169) 12.627 9.868 ( 2.113 10.340 1.241) 10.626 10.235 ( -13.450 1.070 -2.244) 13.678 10.660 ( 11.005 5.445 -20.731) 24.094 11.000 ( -1.636 1.979 2.213) 3.390 11.077 ( 1.938 3.132 -5.172) 6.350 11.582 ( -2.831 -2.804 4.980) 6.378 11.882 ( 1.450 0.304 2.518) 2.921 12.202 ( -0.278 -0.302 -1.421) 1.479 12.372 ( -1.821 -6.472 5.587) 8.742 12.459 ( 5.714 -4.276 -1.199) 7.236 12.587 ( 4.120 6.357 1.445) 7.712 12.736 ( -6.979 5.784 0.517) 9.079 12.958 ( -4.290 2.955 -7.179) 8.869 13.059 ( -0.553 10.109 2.298) 10.382 13.355 ( -0.953 2.628 3.602) 4.559 13.522 ( 5.197 7.035 3.648) 9.477 13.685 ( -8.512 9.028 -2.948) 12.753 14.548 ( 2.516 -10.622 5.222) 12.101 15.041 ( -0.227 -1.721 -1.636) 2.385 15.209 ( -3.462 -0.233 -1.954) 3.982 15.246 ( -0.750 -0.984 -4.280) 4.455 ======================= Grid point 133 (57/141) ======================= q-point: (-0.20 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.901 ( -1.378 12.909 24.162) 27.428 1.046 ( -4.111 21.493 6.009) 22.692 1.563 ( 6.706 9.607 -7.731) 14.037 1.841 ( -1.144 32.951 2.377) 33.056 1.966 ( -3.970 17.969 -4.848) 19.030 2.147 ( 2.003 5.696 4.812) 7.721 2.346 ( 3.964 0.767 -1.990) 4.501 2.545 ( -6.251 2.809 -6.244) 9.271 2.748 ( 0.465 4.574 3.128) 5.561 2.916 ( 2.240 -0.256 -1.599) 2.764 3.599 ( 0.138 5.013 -0.328) 5.026 3.700 ( -0.181 1.315 -2.408) 2.750 3.903 ( 0.883 -1.389 4.106) 4.423 4.010 ( -1.803 -6.648 0.307) 6.895 4.036 ( -0.161 -4.002 2.119) 4.531 4.155 ( 1.916 -4.428 1.176) 4.966 4.442 ( 2.275 -7.634 -3.490) 8.697 4.530 ( -0.610 -5.927 -3.097) 6.715 4.593 ( 1.015 -6.382 -0.427) 6.476 4.681 ( -1.401 0.802 -5.260) 5.502 4.858 ( -2.454 -6.784 3.965) 8.232 5.014 ( -0.523 -8.688 -0.524) 8.720 5.277 ( 0.285 4.457 2.771) 5.256 5.446 ( 1.446 -5.482 -0.967) 5.751 5.686 ( -1.700 -0.552 -2.144) 2.791 5.755 ( 1.573 6.813 -0.545) 7.013 5.852 ( -1.139 0.699 1.234) 1.819 6.076 ( -0.802 -2.976 -0.943) 3.224 6.123 ( 1.982 -2.418 1.324) 3.395 6.215 ( -0.478 3.663 -2.264) 4.333 6.310 ( 4.819 0.069 -3.739) 6.100 6.433 ( -2.984 -1.610 4.507) 5.640 6.490 ( -2.575 -0.241 -3.682) 4.499 6.689 ( -1.473 1.702 3.523) 4.180 6.733 ( 3.060 -1.858 3.272) 4.850 6.839 ( 2.118 1.812 -2.953) 4.061 6.958 ( 0.470 -1.334 1.927) 2.390 7.003 ( -1.846 1.054 -0.998) 2.348 7.128 ( -0.346 1.547 1.771) 2.377 7.167 ( -2.885 2.732 3.119) 5.051 7.355 ( -4.839 5.489 -0.433) 7.330 7.552 ( 3.228 -11.199 -1.471) 11.747 7.621 ( 2.377 -0.185 0.771) 2.506 7.938 ( 5.356 -4.363 -10.212) 12.329 8.423 ( -3.090 -3.117 12.482) 13.231 8.678 ( 4.324 5.398 7.103) 9.914 8.819 ( -3.067 -4.189 0.807) 5.254 8.910 ( 2.170 -13.969 -4.006) 14.693 9.026 ( -10.116 -6.431 2.055) 12.162 9.631 ( -0.618 5.985 -3.377) 6.900 9.763 ( 0.093 9.542 -0.136) 9.543 9.866 ( 5.924 -16.121 3.521) 17.533 10.141 ( -1.274 -14.583 -4.468) 15.305 10.716 ( 11.113 9.670 -26.700) 30.494 10.948 ( -0.081 3.731 -1.023) 3.870 11.048 ( 1.373 4.868 -6.054) 7.889 11.532 ( -6.470 0.165 5.298) 8.364 11.879 ( -0.824 2.661 -0.248) 2.797 12.238 ( 3.209 -2.192 4.008) 5.583 12.385 ( -6.615 -5.335 6.685) 10.813 12.500 ( -0.077 8.441 0.050) 8.441 12.583 ( 0.887 8.041 -0.401) 8.100 12.659 ( 2.012 -7.351 0.097) 7.622 12.765 ( -6.932 6.359 -6.323) 11.335 13.030 ( 5.299 9.313 4.317) 11.552 13.331 ( -3.246 4.154 0.674) 5.315 13.452 ( -0.351 8.467 2.300) 8.781 13.583 ( 2.726 4.683 1.161) 5.542 14.667 ( -1.221 -9.085 2.685) 9.552 15.032 ( -1.223 -0.678 -2.942) 3.258 15.160 ( -0.909 1.001 -1.175) 1.791 15.247 ( 2.721 0.347 -6.132) 6.717 ======================= Grid point 134 (58/141) ======================= q-point: (-0.10 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.900 ( 10.269 13.060 12.516) 20.800 0.964 ( 9.955 12.546 17.442) 23.680 1.548 ( 2.101 14.350 -1.763) 14.610 1.692 ( 17.144 17.075 -5.541) 24.823 1.778 ( 14.219 26.944 3.147) 30.628 2.159 ( 0.657 3.641 -1.384) 3.950 2.365 ( -4.495 0.910 -9.351) 10.415 2.437 ( 2.940 0.163 2.884) 4.121 2.777 ( 3.700 -2.250 1.123) 4.474 2.977 ( 5.509 1.050 -1.627) 5.840 3.539 ( -1.790 2.943 0.333) 3.461 3.670 ( 1.458 5.221 -1.838) 5.724 3.932 ( -2.726 -3.046 3.933) 5.672 4.060 ( -0.503 -3.484 0.415) 3.545 4.096 ( 2.650 -6.052 0.190) 6.610 4.208 ( -1.034 -1.641 2.968) 3.546 4.436 ( -8.019 -3.023 -4.296) 9.586 4.562 ( -2.327 -7.804 -1.327) 8.251 4.605 ( -3.033 -1.335 -6.983) 7.730 4.669 ( -1.286 -4.443 -1.275) 4.798 4.870 ( -3.588 -3.683 3.570) 6.259 5.093 ( -1.322 -9.871 0.804) 9.991 5.201 ( -4.295 5.568 2.319) 7.404 5.559 ( 5.445 -4.290 -1.339) 7.060 5.615 ( -3.157 3.863 -1.919) 5.345 5.755 ( 6.212 6.108 -2.899) 9.181 5.875 ( 0.735 -3.205 4.082) 5.241 6.074 ( -1.118 -1.768 -1.956) 2.864 6.154 ( -0.391 -0.164 3.061) 3.090 6.189 ( 2.114 4.502 -0.887) 5.052 6.371 ( 2.253 1.810 1.414) 3.217 6.413 ( -1.033 0.609 -3.735) 3.923 6.431 ( -2.245 -1.627 -3.356) 4.353 6.697 ( 1.968 0.281 3.304) 3.856 6.807 ( 2.400 0.649 1.598) 2.956 6.839 ( 3.534 3.036 -1.871) 5.021 6.978 ( -3.054 -1.526 2.699) 4.352 6.991 ( -0.494 0.368 2.820) 2.887 7.119 ( 2.778 6.144 -0.664) 6.776 7.197 ( 8.883 -2.679 -0.964) 9.328 7.221 ( -3.392 5.494 0.297) 6.463 7.655 ( -0.756 -4.700 1.232) 4.917 7.733 ( 5.718 -4.316 -2.214) 7.498 8.040 ( 3.567 -3.175 -4.942) 6.872 8.405 ( 3.711 14.740 13.031) 20.021 8.562 ( -15.346 -7.920 2.820) 17.498 8.647 ( -16.870 -5.772 1.725) 17.913 9.015 ( 1.021 -4.460 -2.550) 5.238 9.086 ( 0.524 -12.392 -2.983) 12.756 9.460 ( -6.140 8.800 0.627) 10.748 9.766 ( 0.351 -9.279 -2.418) 9.595 10.057 ( -4.511 -13.397 5.387) 15.128 10.222 ( -3.568 -4.941 -7.110) 9.365 10.592 ( -1.503 12.658 -29.347) 31.996 10.947 ( 2.350 4.276 -9.574) 10.745 11.112 ( 13.472 -1.484 -2.333) 13.752 11.424 ( -3.919 2.154 7.569) 8.791 11.845 ( 1.440 2.505 -0.722) 2.978 12.256 ( -9.008 0.347 2.172) 9.272 12.326 ( 2.911 1.675 3.154) 4.607 12.456 ( -0.332 1.226 4.153) 4.343 12.529 ( -1.780 0.589 4.766) 5.121 12.666 ( 4.357 4.819 -4.779) 8.065 12.771 ( 3.067 -2.071 0.778) 3.782 13.046 ( 5.122 9.649 6.613) 12.769 13.174 ( -3.242 5.906 -4.063) 7.868 13.403 ( -2.014 7.907 2.294) 8.475 13.634 ( 10.061 5.193 2.312) 11.556 14.704 ( -3.712 -6.295 2.112) 7.607 15.008 ( -0.870 -0.789 -4.244) 4.403 15.145 ( 0.383 1.092 -1.433) 1.842 15.306 ( 6.098 0.720 -7.109) 9.393 ======================= Grid point 138 (59/141) ======================= q-point: ( 0.30 0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.795 ( 1.508 -0.000 -0.337) 1.546 1.897 ( 1.714 -0.000 -0.791) 1.888 2.124 ( 6.337 -0.000 4.675) 7.875 2.147 ( 7.341 -0.000 -1.269) 7.450 2.310 ( -4.100 0.000 -1.081) 4.240 2.537 ( 0.456 -0.000 -1.609) 1.672 2.751 ( 7.941 -0.000 -4.927) 9.346 2.898 ( -4.513 0.000 1.776) 4.850 2.983 ( -3.501 0.000 -4.065) 5.365 2.984 ( 0.955 -0.000 0.439) 1.051 3.156 ( -7.904 0.000 1.783) 8.103 3.408 ( -10.476 0.000 4.360) 11.347 3.802 ( 6.418 -0.000 -0.634) 6.449 3.828 ( 2.725 -0.000 -1.450) 3.087 3.965 ( -1.832 0.000 -1.180) 2.179 4.018 ( 0.565 -0.000 7.015) 7.038 4.249 ( 1.115 -0.000 -7.020) 7.108 4.291 ( -3.148 0.000 -1.269) 3.394 4.297 ( 1.098 -0.000 -0.146) 1.107 4.505 ( 4.267 -0.000 5.356) 6.848 4.708 ( 7.204 -0.000 -2.934) 7.779 5.041 ( 8.690 -0.000 2.001) 8.917 5.271 ( -1.187 0.000 0.811) 1.437 5.566 ( 2.308 -0.000 -2.751) 3.591 5.661 ( -0.723 0.000 2.665) 2.761 5.694 ( -6.104 0.000 0.998) 6.185 5.880 ( 2.929 -0.000 -2.585) 3.906 6.131 ( 0.541 -0.000 1.687) 1.771 6.185 ( 1.726 -0.000 7.229) 7.432 6.297 ( 6.474 -0.000 1.779) 6.714 6.350 ( -2.701 0.000 -9.960) 10.320 6.385 ( -1.067 0.000 -0.982) 1.450 6.450 ( 1.008 -0.000 -0.158) 1.021 6.530 ( 2.775 -0.000 2.654) 3.839 6.750 ( 4.391 -0.000 0.683) 4.444 6.760 ( 6.101 -0.000 -4.005) 7.298 6.842 ( -1.984 0.000 1.036) 2.238 6.858 ( -1.747 0.000 1.473) 2.285 7.032 ( 0.727 -0.000 -1.416) 1.592 7.174 ( -4.456 0.000 -1.675) 4.760 7.219 ( -3.886 0.000 -3.899) 5.505 7.592 ( -3.156 0.000 5.494) 6.336 7.752 ( -0.723 0.000 -2.518) 2.619 7.805 ( -1.012 0.000 8.093) 8.157 7.961 ( -2.939 0.000 -1.066) 3.126 8.175 ( -3.591 0.000 2.305) 4.268 8.335 ( -1.588 0.000 -2.586) 3.034 8.668 ( 1.524 -0.000 -1.020) 1.834 9.253 ( -6.683 0.000 1.355) 6.819 9.258 ( -7.059 0.000 1.031) 7.134 9.896 ( -3.211 0.000 -3.322) 4.620 10.248 ( 9.160 -0.000 -1.630) 9.304 10.456 ( 0.274 -0.000 -0.914) 0.954 10.786 ( -0.180 0.000 7.447) 7.449 10.958 ( 0.202 -0.000 -1.997) 2.007 11.017 ( -15.102 0.000 -12.223) 19.429 11.434 ( 1.402 -0.000 10.125) 10.222 11.884 ( -7.227 0.000 6.225) 9.538 12.067 ( 3.397 -0.000 1.928) 3.906 12.183 ( 1.943 -0.000 -2.270) 2.988 12.290 ( -0.801 0.000 2.227) 2.367 12.605 ( 1.124 -0.000 -2.960) 3.166 12.810 ( 4.653 -0.000 -6.210) 7.760 12.988 ( 3.369 -0.000 -13.259) 13.680 13.339 ( 1.360 -0.000 2.660) 2.987 13.425 ( 3.531 -0.000 9.319) 9.965 13.803 ( 5.597 -0.000 7.474) 9.337 13.875 ( 1.678 -0.000 -5.641) 5.885 14.551 ( -8.776 0.000 8.398) 12.147 14.661 ( 0.360 -0.000 -7.921) 7.929 15.275 ( 2.362 -0.000 -4.448) 5.036 15.389 ( -0.012 0.000 3.016) 3.016 ======================= Grid point 139 (60/141) ======================= q-point: (-0.60 0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.820 ( 1.198 0.534 2.114) 2.488 1.901 ( 0.695 2.428 -0.889) 2.677 2.082 ( -8.310 9.344 1.167) 12.559 2.137 ( -1.368 6.466 3.628) 7.539 2.302 ( -1.616 -6.385 -2.643) 7.097 2.568 ( 3.213 0.597 -0.684) 3.339 2.807 ( -4.396 0.383 -0.492) 4.440 2.886 ( 5.271 0.182 -2.097) 5.676 2.926 ( 2.340 2.447 -4.939) 5.988 3.063 ( -0.631 -4.997 2.394) 5.577 3.130 ( 4.354 -6.834 -0.200) 8.105 3.273 ( -5.682 -2.140 2.984) 6.765 3.879 ( 3.734 0.593 -1.254) 3.983 3.892 ( 2.514 0.446 -1.828) 3.140 3.949 ( 1.334 -1.468 0.280) 2.003 4.046 ( 0.097 0.632 8.129) 8.154 4.215 ( -1.853 2.124 -6.088) 6.709 4.252 ( -1.411 1.557 -2.103) 2.973 4.310 ( 0.911 -3.298 -2.798) 4.420 4.590 ( 2.333 -1.054 6.687) 7.160 4.826 ( 6.712 -0.258 -4.003) 7.819 5.144 ( 0.896 4.996 3.489) 6.159 5.242 ( 2.917 1.733 1.280) 3.626 5.548 ( -3.439 1.790 -1.675) 4.223 5.551 ( -7.994 -1.770 -1.443) 8.313 5.698 ( -0.265 -3.765 3.708) 5.291 5.980 ( 7.520 0.467 0.910) 7.590 6.087 ( -4.150 -0.090 0.166) 4.154 6.196 ( -1.355 1.488 -0.822) 2.174 6.251 ( -2.665 0.601 2.016) 3.395 6.325 ( -3.351 -4.806 -6.493) 8.746 6.461 ( -1.506 -4.273 -1.958) 4.936 6.518 ( 0.494 1.127 -0.012) 1.230 6.592 ( 10.170 -1.489 1.729) 10.422 6.725 ( -3.126 1.673 1.771) 3.963 6.812 ( -2.366 -4.907 -0.483) 5.469 6.865 ( 2.823 -0.727 -0.589) 2.974 7.012 ( 6.479 3.145 -0.172) 7.204 7.049 ( -4.658 -0.034 2.072) 5.098 7.124 ( 8.283 -3.743 -0.839) 9.128 7.176 ( 3.402 -6.679 -3.972) 8.483 7.452 ( -13.859 0.903 5.085) 14.790 7.740 ( 1.813 0.334 -2.017) 2.733 7.799 ( 0.253 0.359 3.287) 3.317 7.982 ( 5.333 -0.653 -1.478) 5.572 8.175 ( -2.024 -2.123 5.075) 5.861 8.313 ( 2.583 3.332 -2.627) 4.967 8.680 ( 0.136 0.580 -2.766) 2.829 9.163 ( -3.728 -1.569 0.827) 4.129 9.179 ( -3.616 -2.844 2.211) 5.104 9.768 ( -4.904 9.015 1.356) 10.351 10.388 ( 5.635 10.746 -3.632) 12.666 10.424 ( 2.916 1.970 -2.925) 4.576 10.638 ( -11.339 -5.761 -3.639) 13.229 10.935 ( 1.121 -2.192 1.333) 2.800 11.000 ( 2.799 -2.317 -0.599) 3.683 11.477 ( -0.145 -0.978 7.293) 7.360 11.817 ( -3.313 -1.389 4.738) 5.946 12.119 ( 2.705 0.548 0.910) 2.906 12.217 ( 2.286 -0.576 -2.283) 3.282 12.283 ( 0.445 1.324 3.504) 3.772 12.646 ( 3.306 0.761 1.410) 3.674 12.861 ( 3.393 -0.068 -7.002) 7.781 13.021 ( 3.515 -3.185 -14.652) 15.400 13.310 ( -3.794 1.888 2.833) 5.097 13.483 ( 0.336 -0.100 4.814) 4.827 13.798 ( -3.044 5.905 -3.892) 7.700 13.965 ( 6.026 -4.401 8.553) 11.351 14.381 ( -9.384 5.484 5.437) 12.153 14.733 ( 5.283 -5.889 -5.409) 9.584 15.278 ( -0.310 0.380 -5.136) 5.160 15.380 ( -2.245 0.377 4.097) 4.687 ======================= Grid point 140 (61/141) ======================= q-point: (-0.50 0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.750 ( -8.963 12.204 5.959) 16.272 1.845 ( -2.513 5.225 -1.722) 6.048 1.920 ( 0.511 1.789 4.289) 4.675 1.988 ( -5.909 10.778 1.381) 12.369 2.294 ( -2.795 -3.393 -4.956) 6.625 2.580 ( -0.203 1.867 -0.793) 2.039 2.786 ( 2.045 0.507 0.541) 2.176 2.835 ( -6.549 1.774 -0.121) 6.786 2.946 ( 1.923 5.290 -0.737) 5.677 3.088 ( 0.879 2.129 -1.199) 2.597 3.308 ( 8.340 -8.455 0.601) 11.891 3.402 ( 8.871 -11.385 -1.565) 14.518 3.869 ( -1.863 3.428 1.615) 4.223 3.914 ( 0.973 1.615 -3.595) 4.060 4.007 ( -0.017 -2.931 1.514) 3.299 4.044 ( -0.930 0.112 2.742) 2.897 4.148 ( -2.398 -0.719 -2.449) 3.502 4.210 ( 0.847 1.312 -1.609) 2.242 4.397 ( 3.529 -7.332 -1.857) 8.347 4.631 ( -0.741 -1.420 5.748) 5.967 4.870 ( 0.352 4.678 -3.791) 6.032 5.058 ( -0.448 5.862 -0.812) 5.935 5.276 ( -1.233 3.076 2.478) 4.138 5.428 ( -1.462 2.420 6.026) 6.656 5.525 ( -4.878 -10.279 -5.167) 12.496 5.736 ( -0.907 -3.335 3.507) 4.924 5.984 ( -3.557 0.227 -2.376) 4.284 6.120 ( 2.889 0.254 2.191) 3.634 6.141 ( -4.393 -1.391 0.770) 4.671 6.190 ( -2.320 1.203 -2.013) 3.299 6.299 ( -3.672 -3.658 -5.189) 7.334 6.443 ( -2.673 -3.791 0.672) 4.687 6.521 ( -1.412 -4.984 -1.488) 5.390 6.605 ( -2.351 1.851 1.797) 3.490 6.792 ( -4.449 -5.659 -0.731) 7.235 6.816 ( 3.683 -2.966 -1.081) 4.851 6.883 ( -1.378 0.485 3.515) 3.807 6.980 ( -2.267 -3.637 -1.334) 4.489 7.021 ( -0.952 -2.413 -0.113) 2.597 7.174 ( -12.776 -0.555 3.308) 13.209 7.257 ( 2.075 -1.710 -1.054) 2.888 7.465 ( 12.063 -1.560 -0.164) 12.165 7.756 ( 2.963 5.500 0.127) 6.249 7.896 ( 6.718 -0.882 -2.359) 7.175 8.156 ( 9.507 -3.170 1.131) 10.086 8.201 ( 8.747 -3.524 3.115) 9.931 8.346 ( 4.495 1.162 1.626) 4.919 8.645 ( -1.939 0.295 -3.851) 4.321 9.169 ( 0.095 -2.910 1.336) 3.204 9.220 ( 4.597 -3.787 0.625) 5.989 9.597 ( -4.521 9.478 3.881) 11.195 10.190 ( -7.097 8.720 -4.896) 12.263 10.513 ( -0.500 2.660 1.105) 2.923 10.594 ( 5.592 -0.887 -8.439) 10.162 10.990 ( 1.343 -2.055 2.936) 3.828 11.079 ( 5.174 0.470 -1.101) 5.311 11.495 ( -1.884 -2.939 5.855) 6.817 11.820 ( 0.026 -2.052 3.500) 4.058 12.159 ( 1.363 -1.295 0.017) 1.880 12.252 ( 1.033 -0.875 2.131) 2.524 12.307 ( 1.594 -1.458 -1.654) 2.721 12.687 ( 4.786 5.788 3.098) 8.124 12.882 ( 0.913 0.028 -6.811) 6.872 13.065 ( 1.278 -1.862 -10.910) 11.142 13.227 ( -2.632 2.389 4.740) 5.925 13.453 ( -4.650 -0.424 -2.555) 5.322 13.688 ( 0.308 8.502 1.719) 8.679 14.079 ( -2.824 0.986 -1.845) 3.515 14.223 ( -2.720 -0.505 13.305) 13.589 14.875 ( 5.090 -6.447 -5.331) 9.792 15.235 ( -2.119 0.443 -4.603) 5.086 15.329 ( -4.087 0.905 3.490) 5.450 ======================= Grid point 141 (62/141) ======================= q-point: (-0.40 0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.448 ( -9.124 17.677 10.300) 22.401 1.704 ( -7.470 14.831 2.797) 16.840 1.766 ( -3.666 4.639 -1.819) 6.186 1.979 ( 4.363 2.062 0.901) 4.909 2.277 ( 0.145 -1.746 -4.960) 5.260 2.529 ( -3.830 4.374 1.522) 6.010 2.677 ( -6.781 2.812 -2.856) 7.877 2.792 ( 1.256 11.007 0.308) 11.083 2.894 ( 1.170 5.451 1.492) 5.771 3.062 ( 2.623 10.315 -2.160) 10.860 3.523 ( 6.197 -7.314 0.666) 9.609 3.657 ( 7.603 -10.850 -3.308) 13.655 3.752 ( -7.128 2.689 2.341) 7.970 3.894 ( 0.474 -0.067 -1.973) 2.030 4.011 ( -2.303 -2.456 0.618) 3.423 4.042 ( -1.557 -1.172 2.704) 3.333 4.169 ( 2.140 -5.430 -2.145) 6.218 4.256 ( 1.988 -4.362 -0.719) 4.848 4.533 ( 2.516 -8.738 -0.475) 9.105 4.649 ( 0.854 -0.269 3.985) 4.084 4.752 ( -5.152 3.085 -2.350) 6.448 5.009 ( 0.252 6.331 -4.873) 7.993 5.240 ( 1.050 0.450 3.237) 3.432 5.411 ( -3.243 -1.160 2.129) 4.049 5.574 ( -1.225 -9.800 1.008) 9.927 5.755 ( -1.059 -2.702 2.884) 4.091 5.943 ( -0.630 -1.939 -1.622) 2.605 6.047 ( -6.141 -3.195 -0.465) 6.938 6.081 ( -2.461 4.945 -0.246) 5.529 6.234 ( 3.996 -0.242 0.123) 4.006 6.257 ( -2.932 -4.341 -7.264) 8.956 6.462 ( 0.030 -2.427 0.541) 2.487 6.506 ( -4.285 -1.594 0.140) 4.574 6.600 ( -0.161 -3.227 2.224) 3.923 6.758 ( -4.301 -4.838 0.390) 6.485 6.785 ( -2.627 2.634 2.637) 4.559 6.956 ( 1.246 -1.675 1.279) 2.448 6.986 ( -0.774 -9.074 -5.112) 10.444 7.007 ( -6.943 -8.108 3.370) 11.194 7.087 ( -0.222 -5.301 -0.005) 5.306 7.310 ( 4.480 3.032 -0.117) 5.410 7.545 ( 0.061 3.015 -0.034) 3.016 7.748 ( 3.952 8.699 -0.768) 9.585 7.899 ( -1.199 1.639 -3.881) 4.380 8.259 ( -2.189 -2.865 7.471) 8.295 8.513 ( 15.792 -3.679 -1.447) 16.279 8.546 ( 11.639 -5.527 2.860) 13.199 8.629 ( 2.938 -1.571 -2.360) 4.083 9.159 ( -7.708 -1.664 5.807) 9.793 9.409 ( 12.262 -4.889 -3.643) 13.694 9.516 ( 3.448 2.452 2.017) 4.687 9.995 ( -8.186 1.343 -4.338) 9.361 10.370 ( -7.555 10.813 4.036) 13.794 10.724 ( 11.175 1.383 -12.481) 16.810 11.020 ( -0.354 -0.084 3.285) 3.305 11.136 ( 3.922 3.096 -3.929) 6.357 11.508 ( -3.210 -4.386 6.398) 8.395 11.868 ( 1.974 -1.508 3.168) 4.026 12.177 ( -1.273 -2.098 -2.010) 3.172 12.275 ( -1.615 -3.140 4.462) 5.690 12.368 ( 3.930 -4.121 -3.401) 6.633 12.719 ( 4.905 6.722 1.519) 8.458 12.832 ( -3.406 3.197 -2.764) 5.428 13.005 ( -2.695 2.336 -10.849) 11.420 13.219 ( 1.502 5.493 4.583) 7.310 13.382 ( -0.999 0.172 2.168) 2.393 13.655 ( 3.297 6.623 2.477) 7.802 13.874 ( -9.100 9.031 -3.398) 13.263 14.337 ( 0.705 -9.804 10.353) 14.276 14.977 ( 2.180 -4.430 -5.267) 7.219 15.191 ( -1.117 -0.168 -3.009) 3.214 15.258 ( -3.523 0.751 1.189) 3.793 ======================= Grid point 142 (63/141) ======================= q-point: (-0.30 0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.210 ( -1.808 17.675 15.641) 23.671 1.445 ( -2.423 18.894 3.000) 19.283 1.706 ( 2.827 4.546 -3.477) 6.384 1.997 ( -1.367 2.382 -1.824) 3.297 2.300 ( 1.742 0.277 -3.183) 3.639 2.390 ( -0.148 9.978 2.545) 10.299 2.509 ( -3.307 15.450 -3.594) 16.203 2.676 ( 2.558 13.709 1.818) 14.063 2.860 ( -4.898 2.143 -1.910) 5.678 2.986 ( 5.293 11.776 0.745) 12.933 3.623 ( -3.826 -4.041 -1.306) 5.716 3.675 ( 2.170 -2.087 -0.692) 3.090 3.834 ( 0.082 -8.614 -0.210) 8.617 3.907 ( 2.958 0.709 2.105) 3.699 4.002 ( -1.897 -1.592 0.631) 2.555 4.064 ( 1.702 -3.745 2.323) 4.724 4.268 ( 1.114 -8.727 -2.636) 9.184 4.330 ( -1.426 -9.501 -2.622) 9.958 4.599 ( -1.442 -1.292 0.985) 2.173 4.660 ( 0.730 0.736 0.109) 1.042 4.745 ( 1.601 -7.434 0.968) 7.666 4.923 ( -1.851 3.502 -4.805) 6.227 5.308 ( 3.608 -1.343 0.943) 3.963 5.360 ( -3.844 -2.124 2.255) 4.937 5.649 ( 0.952 -4.892 1.325) 5.157 5.774 ( -0.314 -1.715 3.550) 3.955 5.948 ( -2.424 5.102 -5.284) 7.735 5.992 ( 0.190 -5.156 -0.077) 5.160 6.055 ( 0.891 -3.367 1.481) 3.785 6.245 ( 0.027 -1.885 -5.717) 6.020 6.300 ( 4.212 -0.202 -2.546) 4.926 6.450 ( -1.426 2.480 4.170) 5.057 6.475 ( -1.250 -1.566 -1.411) 2.451 6.655 ( 0.612 -5.278 4.257) 6.809 6.729 ( -1.960 2.125 3.931) 4.879 6.768 ( -0.140 -5.115 -1.639) 5.373 6.951 ( -1.586 -3.153 -2.380) 4.257 7.010 ( 0.027 -1.354 -1.034) 1.704 7.075 ( -0.969 -9.083 1.162) 9.208 7.162 ( 1.497 -4.353 2.830) 5.404 7.370 ( 3.748 -1.796 -0.256) 4.165 7.467 ( -2.853 5.631 -1.730) 6.545 7.708 ( 1.931 8.556 0.137) 8.772 7.885 ( 3.220 -1.070 -7.999) 8.689 8.257 ( -5.173 -5.773 10.485) 13.039 8.659 ( 1.682 -10.313 -3.033) 10.881 8.708 ( -3.492 -6.084 1.603) 7.196 8.817 ( 14.560 2.922 1.180) 14.897 8.967 ( -15.777 0.609 7.144) 17.330 9.604 ( -0.934 -4.001 -3.660) 5.502 9.649 ( 7.247 -6.165 0.372) 9.522 9.921 ( -0.374 -8.177 -4.304) 9.248 10.109 ( -4.034 19.339 4.697) 20.306 10.842 ( 8.809 3.450 -14.489) 17.304 11.002 ( -0.716 1.594 0.396) 1.792 11.131 ( 1.438 3.680 -5.402) 6.693 11.494 ( -5.576 -3.453 7.392) 9.882 11.900 ( -1.172 -0.396 0.968) 1.571 12.178 ( -0.212 -3.586 1.584) 3.926 12.288 ( -2.496 -3.691 3.531) 5.686 12.490 ( 3.957 -6.630 -1.768) 7.921 12.681 ( -2.994 7.384 1.420) 8.094 12.740 ( -0.247 6.256 -1.697) 6.487 12.872 ( -2.871 4.689 -11.932) 13.138 13.224 ( 6.981 9.410 5.385) 12.895 13.401 ( 1.174 2.994 7.366) 8.038 13.598 ( -7.988 5.172 -3.255) 10.057 13.705 ( 5.402 8.231 0.431) 9.855 14.456 ( -2.142 -11.578 6.675) 13.535 15.006 ( -0.482 -2.095 -4.916) 5.365 15.173 ( -0.857 0.446 -0.690) 1.187 15.238 ( 2.302 -0.578 -2.255) 3.274 ======================= Grid point 143 (64/141) ======================= q-point: (-0.20 0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.145 ( 6.893 14.144 16.824) 23.036 1.301 ( 6.460 18.770 2.825) 20.050 1.750 ( 7.323 6.404 -2.639) 10.080 1.864 ( -5.355 3.877 -4.797) 8.168 2.300 ( 5.368 13.600 0.267) 14.623 2.333 ( 2.898 9.608 3.644) 10.676 2.404 ( 9.819 10.673 -3.764) 14.983 2.567 ( -0.230 13.492 -1.766) 13.609 2.770 ( 0.303 1.512 1.295) 2.013 3.009 ( 4.451 3.111 -1.336) 5.592 3.569 ( -4.361 -1.043 -1.633) 4.772 3.719 ( 0.066 -1.526 -0.640) 1.657 3.862 ( -1.632 -4.077 0.247) 4.399 3.973 ( -1.253 -3.725 0.517) 3.964 4.029 ( 4.380 -1.722 2.840) 5.497 4.146 ( 1.781 -3.221 2.839) 4.648 4.317 ( -5.867 -8.521 -3.528) 10.931 4.375 ( -3.272 -10.465 -2.556) 11.259 4.586 ( -0.422 1.765 2.103) 2.778 4.645 ( -2.017 -1.907 -3.056) 4.129 4.840 ( 1.832 3.106 -1.598) 3.944 4.886 ( -2.348 -10.541 -0.210) 10.802 5.268 ( -4.979 1.615 2.131) 5.651 5.441 ( 3.566 -6.128 0.948) 7.153 5.684 ( 0.537 2.383 -1.425) 2.828 5.808 ( 0.503 -2.956 4.020) 5.015 5.888 ( 4.016 4.776 -3.129) 6.981 6.022 ( -0.097 -3.263 -2.567) 4.153 6.129 ( 0.980 -2.672 3.385) 4.422 6.259 ( 3.518 1.807 -3.495) 5.278 6.373 ( 2.869 -1.755 -3.994) 5.222 6.417 ( -0.480 3.487 5.325) 6.383 6.451 ( -0.659 0.752 -3.723) 3.855 6.685 ( -0.736 -1.284 4.871) 5.091 6.780 ( 3.876 -3.373 3.755) 6.364 6.829 ( 1.675 -4.863 -2.357) 5.658 6.953 ( -0.626 -0.979 -1.215) 1.681 7.007 ( 0.646 1.890 -1.298) 2.382 7.162 ( 3.167 -4.360 1.834) 5.692 7.215 ( 3.106 1.505 1.834) 3.909 7.342 ( -1.826 6.811 -3.171) 7.731 7.479 ( 0.621 -9.837 2.471) 10.162 7.680 ( 1.821 1.114 0.525) 2.198 7.977 ( 6.071 -2.377 -10.329) 12.215 8.286 ( -3.294 -11.032 10.636) 15.674 8.560 ( -16.105 0.173 0.611) 16.118 8.661 ( -18.520 -2.418 2.916) 18.904 8.805 ( -1.195 -10.402 0.324) 10.476 9.033 ( 12.495 2.014 1.585) 12.755 9.544 ( -8.038 -9.451 -2.792) 12.718 9.590 ( -15.956 1.231 2.814) 16.249 9.937 ( 2.030 4.377 4.777) 6.789 10.150 ( 10.534 -0.835 -6.322) 12.314 10.797 ( -2.945 7.227 -13.111) 15.258 11.019 ( 4.430 1.997 -14.540) 15.331 11.115 ( 4.204 1.545 1.471) 4.714 11.435 ( -6.372 -1.286 9.696) 11.673 11.861 ( -2.257 -0.506 -0.430) 2.352 12.207 ( -5.657 -4.369 3.142) 7.808 12.309 ( 2.469 -2.336 4.514) 5.650 12.517 ( -6.989 0.207 -1.369) 7.125 12.541 ( -3.420 3.287 0.738) 4.801 12.707 ( 5.545 2.534 -4.411) 7.525 12.859 ( 8.612 7.110 -3.335) 11.655 13.255 ( 5.106 10.138 8.305) 14.065 13.310 ( -4.901 8.377 -3.220) 10.225 13.509 ( 1.610 3.487 3.301) 5.064 13.747 ( 7.109 5.817 -0.737) 9.215 14.530 ( -4.013 -11.033 5.523) 12.974 14.988 ( -1.533 -1.382 -5.301) 5.689 15.162 ( 0.751 0.607 -1.815) 2.056 15.306 ( 4.748 -0.298 -2.179) 5.233 ======================= Grid point 144 (65/141) ======================= q-point: (-0.10 0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.243 ( 12.510 9.969 13.395) 20.864 1.316 ( 11.744 11.857 4.321) 17.239 1.660 ( -1.445 8.664 -1.153) 8.859 1.923 ( 9.377 -0.650 -7.717) 12.162 2.244 ( 2.535 9.139 -3.118) 9.983 2.393 ( 13.000 14.641 4.729) 20.143 2.438 ( 10.418 13.432 -0.520) 17.007 2.489 ( 4.326 5.729 -1.181) 7.275 2.848 ( 7.515 -1.620 0.979) 7.750 3.056 ( 3.028 -0.922 -2.318) 3.923 3.498 ( -3.891 -0.629 -1.029) 4.073 3.711 ( -1.137 0.938 -0.432) 1.535 3.857 ( -3.113 -2.167 1.674) 4.146 3.986 ( -2.238 -5.441 -0.902) 5.952 4.096 ( -1.916 -3.437 2.062) 4.443 4.186 ( 0.334 0.205 3.110) 3.134 4.235 ( -7.531 -2.544 -5.943) 9.924 4.385 ( -7.002 -8.872 1.438) 11.393 4.533 ( -3.194 1.120 -1.041) 3.541 4.653 ( 1.326 -0.702 -2.353) 2.791 4.784 ( -4.635 -0.703 -1.863) 5.044 4.952 ( -3.180 -7.517 0.584) 8.182 5.155 ( -5.643 2.689 2.916) 6.897 5.544 ( -0.732 -6.721 1.714) 6.975 5.646 ( 1.530 3.983 -2.303) 4.848 5.841 ( -0.243 -1.704 3.086) 3.533 5.967 ( 9.354 4.827 -2.032) 10.720 6.037 ( -0.423 -2.056 -4.371) 4.849 6.165 ( 0.488 -0.355 3.673) 3.722 6.282 ( 2.995 5.114 -0.475) 5.945 6.355 ( -3.409 -1.144 4.832) 6.023 6.376 ( -2.226 1.921 -3.934) 4.911 6.488 ( 6.057 2.267 -3.728) 7.465 6.715 ( -1.147 -2.329 5.708) 6.271 6.821 ( -1.183 2.871 -0.986) 3.258 6.898 ( 4.265 -1.658 -3.521) 5.774 6.942 ( -0.496 -1.351 1.190) 1.867 7.030 ( 3.026 -0.508 1.216) 3.301 7.211 ( -1.695 2.425 2.142) 3.653 7.241 ( 1.618 6.135 -1.094) 6.439 7.291 ( 2.771 0.018 -1.538) 3.169 7.605 ( 1.350 -6.895 1.602) 7.206 7.748 ( 1.075 -2.430 -1.345) 2.978 8.005 ( -2.673 -2.670 -1.834) 4.200 8.275 ( -11.822 -3.794 4.557) 13.226 8.301 ( -17.570 -1.907 -2.970) 17.921 8.529 ( 7.213 -13.943 4.449) 16.317 8.876 ( -4.309 -11.638 0.248) 12.412 9.104 ( -1.271 9.796 4.812) 10.988 9.337 ( -10.440 -1.651 -1.518) 10.678 9.616 ( 2.279 -13.977 -2.244) 14.338 9.873 ( -7.793 -1.702 3.985) 8.917 10.222 ( 3.278 6.371 -3.541) 7.992 10.634 ( 0.355 7.320 -17.003) 18.515 10.984 ( 0.711 2.802 -5.763) 6.447 11.275 ( 8.305 -1.652 -5.225) 9.950 11.400 ( -0.603 -3.674 9.884) 10.562 11.859 ( 0.191 -2.483 0.008) 2.490 12.130 ( -5.072 -1.597 0.601) 5.351 12.371 ( -2.692 -0.776 6.101) 6.714 12.445 ( 0.553 1.252 -0.695) 1.535 12.483 ( -2.052 -2.394 3.928) 5.037 12.758 ( 4.572 4.035 -5.153) 7.984 12.937 ( 7.434 7.003 0.921) 10.254 13.166 ( -0.722 6.590 -3.096) 7.316 13.275 ( 5.356 7.055 7.967) 11.914 13.470 ( -0.511 8.167 1.078) 8.254 13.819 ( 5.852 3.000 -3.904) 7.647 14.581 ( -3.138 -8.315 8.612) 12.375 14.957 ( -2.050 -1.816 -5.862) 6.470 15.170 ( 1.793 1.352 -2.258) 3.185 15.363 ( 2.522 0.418 -3.187) 4.085 ======================= Grid point 149 (66/141) ======================= q-point: (-0.60 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 141 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.840 ( -0.539 0.000 3.742) 3.781 1.941 ( -12.359 0.000 7.241) 14.324 1.942 ( 2.357 -0.000 -0.353) 2.383 2.164 ( -1.850 0.000 -3.494) 3.953 2.192 ( -4.971 0.000 -2.836) 5.723 2.604 ( 0.948 -0.000 -1.999) 2.212 2.767 ( -0.934 0.000 1.492) 1.760 2.853 ( -5.941 0.000 -1.033) 6.030 3.033 ( 0.764 -0.000 4.089) 4.159 3.085 ( 10.153 -0.000 -6.272) 11.934 3.233 ( 10.292 -0.000 0.227) 10.294 3.253 ( 5.909 -0.000 1.374) 6.066 3.921 ( 0.069 -0.000 -0.101) 0.122 3.923 ( 1.408 -0.000 -3.358) 3.641 3.959 ( 0.096 -0.000 -0.016) 0.097 4.059 ( -1.598 0.000 7.509) 7.677 4.142 ( -4.532 0.000 -3.996) 6.043 4.260 ( -0.485 0.000 -2.725) 2.767 4.290 ( 2.678 -0.000 -3.131) 4.120 4.615 ( -1.473 0.000 5.955) 6.135 4.916 ( 4.799 -0.000 -3.981) 6.235 5.158 ( -3.195 0.000 3.382) 4.652 5.301 ( 1.586 -0.000 3.013) 3.405 5.367 ( -7.057 0.000 -5.436) 8.908 5.507 ( -5.283 0.000 2.134) 5.697 5.670 ( -1.655 0.000 5.053) 5.317 5.997 ( -5.726 0.000 1.793) 6.000 6.101 ( 3.876 -0.000 1.363) 4.109 6.133 ( -8.138 0.000 -0.465) 8.151 6.181 ( 1.125 -0.000 -8.520) 8.594 6.300 ( 0.665 -0.000 -0.379) 0.765 6.366 ( -5.072 0.000 -2.670) 5.732 6.471 ( -3.564 0.000 0.694) 3.631 6.677 ( -3.451 0.000 -0.680) 3.517 6.679 ( -5.426 0.000 2.122) 5.826 6.769 ( 6.265 -0.000 -0.417) 6.279 6.912 ( 1.806 -0.000 -2.832) 3.359 6.934 ( -7.398 0.000 6.417) 9.794 7.006 ( -0.733 0.000 -3.609) 3.682 7.167 ( -18.028 0.000 3.962) 18.458 7.246 ( 8.369 -0.000 -1.229) 8.459 7.452 ( 16.125 -0.000 -0.517) 16.133 7.826 ( 2.866 -0.000 0.414) 2.896 7.869 ( 10.158 -0.000 -0.993) 10.206 8.140 ( 15.539 -0.000 -2.185) 15.692 8.147 ( 1.253 -0.000 5.919) 6.050 8.367 ( 1.432 -0.000 1.053) 1.778 8.649 ( -2.493 0.000 -3.760) 4.511 9.153 ( 1.062 -0.000 3.978) 4.117 9.179 ( 5.870 -0.000 -1.730) 6.120 9.700 ( -7.709 0.000 2.553) 8.121 10.267 ( -17.032 0.000 -6.105) 18.093 10.555 ( 2.738 -0.000 2.860) 3.960 10.574 ( 10.632 -0.000 -7.854) 13.218 10.964 ( 1.553 -0.000 4.364) 4.632 11.088 ( 7.620 -0.000 -0.334) 7.628 11.462 ( -3.023 0.000 5.383) 6.174 11.796 ( 0.286 -0.000 3.504) 3.516 12.147 ( 0.575 -0.000 -1.242) 1.369 12.253 ( 2.976 -0.000 -3.198) 4.368 12.283 ( -2.286 0.000 5.397) 5.861 12.760 ( 6.415 -0.000 2.406) 6.851 12.891 ( 2.031 -0.000 -4.462) 4.903 13.018 ( 4.008 -0.000 -16.352) 16.836 13.253 ( -4.053 0.000 4.719) 6.221 13.447 ( -4.462 0.000 -1.464) 4.696 13.786 ( -0.485 0.000 -0.363) 0.606 14.041 ( 1.647 -0.000 7.523) 7.702 14.264 ( -8.931 0.000 7.538) 11.687 14.800 ( 7.103 -0.000 -6.545) 9.659 15.242 ( -2.152 0.000 -4.657) 5.130 15.337 ( -4.373 0.000 4.057) 5.965 ======================= Grid point 151 (67/141) ======================= q-point: (-0.50 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.721 ( -8.844 8.071 8.438) 14.648 1.821 ( -4.325 1.610 3.707) 5.920 1.937 ( -1.709 7.269 -0.549) 7.487 2.054 ( 1.738 5.839 -1.383) 6.247 2.199 ( -0.812 -6.380 -3.556) 7.349 2.582 ( -2.195 1.541 0.949) 2.845 2.724 ( -4.982 2.308 -3.207) 6.359 2.788 ( -0.234 -3.573 -2.505) 4.370 3.051 ( 2.141 4.438 3.505) 6.047 3.196 ( 6.565 3.044 -2.534) 7.667 3.427 ( 10.450 -1.783 1.140) 10.662 3.463 ( 10.151 -6.837 -0.329) 12.243 3.821 ( -9.462 2.763 1.190) 9.929 3.890 ( -3.015 -0.431 -4.612) 5.527 3.973 ( 0.169 -0.923 0.225) 0.965 4.049 ( 0.139 0.927 2.128) 2.325 4.092 ( -1.485 -1.649 0.197) 2.228 4.252 ( 2.064 2.328 -0.604) 3.170 4.372 ( 2.593 -6.754 -2.269) 7.583 4.570 ( -5.777 -3.063 1.666) 6.747 4.924 ( 0.615 8.513 -0.583) 8.555 5.103 ( 0.406 2.443 -0.666) 2.565 5.269 ( -2.487 1.923 2.493) 4.013 5.360 ( -1.252 -9.501 -1.344) 9.677 5.422 ( -3.487 1.717 3.813) 5.445 5.674 ( -2.019 -4.579 3.181) 5.929 5.914 ( -3.728 -0.560 0.487) 3.801 5.997 ( -7.445 -1.117 1.620) 7.701 6.117 ( -0.645 -1.870 -5.296) 5.653 6.208 ( -0.294 0.509 -1.309) 1.435 6.258 ( 1.434 3.116 -4.232) 5.448 6.359 ( -0.575 -6.307 -3.307) 7.145 6.439 ( -2.249 -3.509 1.260) 4.354 6.586 ( -2.853 1.426 2.918) 4.323 6.669 ( -2.070 -3.762 0.082) 4.295 6.840 ( -2.851 1.064 2.359) 3.850 6.857 ( -0.547 -2.779 -1.581) 3.244 6.900 ( -4.016 -0.729 3.420) 5.325 6.936 ( -4.684 -1.442 -0.184) 4.904 7.013 ( -0.099 -2.329 -2.763) 3.615 7.362 ( 5.957 1.534 1.138) 6.255 7.594 ( 2.745 1.483 -0.642) 3.185 7.881 ( 5.563 3.885 -1.815) 7.024 7.909 ( -3.588 -0.189 0.923) 3.710 8.263 ( 2.453 1.437 4.245) 5.109 8.443 ( 12.387 -2.341 -1.819) 12.737 8.462 ( 11.125 -2.355 3.896) 12.021 8.631 ( 6.257 0.416 -2.688) 6.823 9.156 ( -4.074 0.741 5.505) 6.888 9.342 ( 12.693 -1.929 -4.694) 13.670 9.574 ( -4.634 2.308 2.109) 5.590 9.979 ( -15.391 -1.488 -4.807) 16.192 10.551 ( -1.269 5.886 3.527) 6.978 10.728 ( 9.988 -0.500 -8.415) 13.071 11.003 ( 0.684 -1.046 4.000) 4.191 11.198 ( 5.485 2.690 -1.636) 6.325 11.427 ( -4.312 -3.182 6.276) 8.253 11.838 ( 2.260 -1.108 3.110) 4.001 12.140 ( -1.375 -1.186 -3.252) 3.724 12.245 ( -2.662 -0.302 4.541) 5.272 12.307 ( 3.016 -1.908 -3.173) 4.775 12.816 ( 1.754 2.076 -1.500) 3.104 12.888 ( 0.985 3.247 -3.970) 5.222 13.029 ( -1.075 -0.321 -12.542) 12.593 13.272 ( 5.338 0.581 8.256) 9.849 13.381 ( -1.147 0.100 -0.041) 1.152 13.768 ( 0.233 4.063 0.702) 4.130 13.981 ( -8.415 1.226 -4.644) 9.689 14.214 ( -1.589 -2.107 15.426) 15.650 14.900 ( 4.644 -2.584 -6.749) 8.591 15.198 ( -0.887 0.439 -2.560) 2.745 15.265 ( -4.730 0.043 2.402) 5.305 ======================= Grid point 152 (68/141) ======================= q-point: (-0.40 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.537 ( -2.580 13.769 10.040) 17.236 1.735 ( -1.211 5.990 1.587) 6.314 1.808 ( 0.220 11.181 0.495) 11.194 2.061 ( 1.231 3.179 -0.841) 3.511 2.255 ( 2.033 -4.331 -2.014) 5.191 2.503 ( -3.648 3.358 -0.164) 4.961 2.649 ( 1.284 3.717 -3.014) 4.955 2.804 ( -0.920 -3.019 -5.487) 6.330 3.011 ( -0.412 9.826 4.470) 10.803 3.221 ( 2.059 8.086 -0.923) 8.395 3.528 ( -1.594 -2.646 0.636) 3.154 3.645 ( -7.434 -0.897 0.057) 7.488 3.677 ( 6.397 -6.249 -0.704) 8.970 3.901 ( 3.748 -2.789 -2.142) 5.140 3.974 ( 0.447 0.487 1.326) 1.481 4.041 ( 0.231 1.182 4.029) 4.205 4.129 ( 0.660 -5.294 -2.211) 5.775 4.250 ( -0.192 1.595 -1.046) 1.918 4.456 ( -1.062 -8.261 -1.809) 8.523 4.561 ( -2.012 -9.160 -0.344) 9.384 4.837 ( 2.539 11.944 3.216) 12.627 5.062 ( 0.087 7.312 -5.298) 9.030 5.263 ( 1.527 -2.188 2.452) 3.624 5.351 ( -3.583 0.356 1.611) 3.945 5.488 ( 2.463 -10.142 4.258) 11.272 5.706 ( -1.266 -5.684 1.763) 6.084 5.909 ( 0.762 -2.838 1.322) 3.222 5.936 ( -2.346 -2.843 -0.550) 3.726 6.086 ( -1.019 3.551 -3.451) 5.055 6.180 ( 0.851 -2.892 -6.170) 6.867 6.296 ( 3.097 -0.773 -1.891) 3.710 6.404 ( 0.050 -5.201 -2.996) 6.003 6.456 ( -0.624 -3.045 2.030) 3.712 6.571 ( -0.716 -2.188 4.523) 5.075 6.686 ( 0.657 -2.967 -1.555) 3.413 6.784 ( -1.867 3.012 3.528) 5.000 6.836 ( -2.509 -7.595 4.756) 9.306 6.865 ( -3.557 -4.228 -5.069) 7.498 7.018 ( 4.523 -1.197 -0.502) 4.706 7.043 ( 2.493 -5.110 -0.723) 5.731 7.415 ( 1.901 2.864 1.864) 3.910 7.564 ( -1.857 3.823 -1.698) 4.577 7.857 ( -1.138 0.216 -1.039) 1.556 7.896 ( 2.234 6.648 -0.649) 7.043 8.242 ( -2.021 2.522 5.119) 6.054 8.514 ( -0.129 -4.437 -2.550) 5.119 8.611 ( -1.775 -3.445 3.293) 5.086 8.849 ( 13.232 1.316 -2.526) 13.535 8.996 ( -14.388 1.402 7.941) 16.494 9.548 ( 0.660 -1.405 -1.787) 2.367 9.571 ( 6.067 -2.482 -1.710) 6.775 9.795 ( -2.283 -4.875 -3.865) 6.627 10.429 ( -2.884 12.444 3.205) 13.169 10.867 ( 8.364 -0.454 -9.247) 12.477 11.016 ( -1.313 0.087 3.259) 3.515 11.198 ( 0.076 3.349 -3.401) 4.773 11.411 ( -5.221 -4.678 7.867) 10.537 11.875 ( -1.331 -1.568 1.625) 2.621 12.115 ( -1.871 -2.572 -1.669) 3.592 12.241 ( -0.444 -1.240 3.025) 3.299 12.383 ( 3.262 -4.043 -2.034) 5.579 12.791 ( -0.640 3.231 -1.231) 3.516 12.845 ( -1.739 5.179 -4.674) 7.189 12.941 ( -0.861 1.817 -10.475) 10.666 13.372 ( 7.943 5.415 5.346) 11.000 13.438 ( 3.839 0.727 9.447) 10.223 13.686 ( -6.099 4.663 -3.252) 8.338 13.835 ( -1.028 2.950 -5.659) 6.464 14.268 ( -2.486 -6.133 12.794) 14.404 14.954 ( 0.912 -2.701 -6.594) 7.184 15.185 ( -1.015 0.859 0.345) 1.374 15.228 ( 1.726 -0.638 -0.573) 1.927 ======================= Grid point 153 (69/141) ======================= q-point: (-0.30 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.444 ( 5.146 15.150 10.519) 19.148 1.654 ( 4.230 16.187 0.256) 16.733 1.796 ( 5.074 1.534 0.536) 5.328 1.977 ( -5.305 5.934 -0.679) 7.989 2.335 ( 3.401 -1.896 1.096) 4.045 2.432 ( 0.994 4.147 -6.171) 7.501 2.681 ( 8.579 5.989 0.630) 10.482 2.772 ( -1.354 2.327 -4.656) 5.379 2.889 ( -1.458 12.150 4.528) 13.048 3.124 ( -1.746 7.601 -1.062) 7.871 3.486 ( -6.653 -6.174 -0.662) 9.100 3.621 ( -2.410 -7.549 -1.107) 8.001 3.775 ( 0.436 -3.564 -0.574) 3.636 3.955 ( 0.248 1.243 -0.494) 1.360 4.004 ( 1.994 -1.381 2.127) 3.226 4.098 ( 3.236 -2.747 3.974) 5.815 4.182 ( 0.801 -4.092 -1.729) 4.514 4.230 ( -1.129 -1.635 -2.458) 3.160 4.509 ( -1.045 -7.504 0.344) 7.584 4.612 ( -3.369 -7.367 0.221) 8.103 4.803 ( 2.605 6.809 1.037) 7.364 4.985 ( 3.790 9.642 -5.462) 11.711 5.285 ( -4.627 0.506 3.682) 5.935 5.339 ( 2.083 -4.244 1.046) 4.842 5.645 ( 4.155 -5.903 2.842) 7.758 5.747 ( -0.602 -5.205 2.128) 5.655 5.931 ( 0.493 -0.114 -3.804) 3.837 5.973 ( 2.669 -1.166 -1.415) 3.238 6.071 ( 2.263 -1.704 2.308) 3.654 6.240 ( 3.565 -2.971 -4.773) 6.657 6.356 ( 3.332 -1.439 -2.678) 4.511 6.431 ( -0.526 -1.417 -2.658) 3.058 6.488 ( 2.322 0.513 2.565) 3.498 6.623 ( 0.264 -4.150 4.716) 6.288 6.725 ( 1.366 -2.393 -2.291) 3.583 6.766 ( 2.224 0.177 2.088) 3.055 6.861 ( -1.403 -6.643 -2.066) 7.097 6.956 ( 3.268 -12.040 2.796) 12.785 7.045 ( 0.637 0.142 -2.460) 2.545 7.182 ( 4.848 -3.715 2.289) 6.523 7.390 ( -2.078 0.613 3.595) 4.197 7.468 ( -3.312 4.732 -3.679) 6.848 7.794 ( -2.539 8.342 1.006) 8.777 7.920 ( 5.962 -2.931 -6.028) 8.970 8.197 ( -3.119 1.038 7.466) 8.157 8.497 ( -14.116 -5.957 0.215) 15.323 8.548 ( -8.253 -5.031 -0.457) 9.677 8.713 ( -11.850 -1.093 1.348) 11.976 9.047 ( 9.758 -0.576 2.186) 10.017 9.416 ( -13.026 -2.880 -2.701) 13.611 9.604 ( -2.970 0.960 5.312) 6.161 9.992 ( 12.425 -1.570 -5.889) 13.839 10.280 ( 1.662 12.514 0.749) 12.646 10.899 ( -2.899 3.654 -5.418) 7.149 11.017 ( 3.015 -1.713 -5.205) 6.254 11.153 ( -0.818 1.759 -1.698) 2.578 11.381 ( -5.830 -3.866 9.653) 11.921 11.834 ( -4.441 -1.968 -0.932) 4.946 12.125 ( -1.851 -3.562 0.975) 4.131 12.262 ( 0.678 -1.918 3.552) 4.093 12.448 ( -1.830 -4.429 -1.095) 4.916 12.661 ( -6.199 6.737 -2.919) 9.609 12.785 ( 5.003 4.183 -5.760) 8.701 12.965 ( 6.739 3.393 -3.458) 8.300 13.406 ( -2.554 6.346 6.794) 9.641 13.500 ( 1.252 9.210 -0.865) 9.335 13.552 ( 4.220 1.222 4.189) 6.071 13.833 ( 3.453 1.692 -5.938) 7.075 14.319 ( -3.521 -8.588 10.613) 14.099 14.951 ( -1.771 -2.398 -6.442) 7.098 15.170 ( 0.634 0.311 -1.546) 1.699 15.302 ( 5.193 -0.074 0.601) 5.228 ======================= Grid point 154 (70/141) ======================= q-point: (-0.20 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.473 ( 10.780 12.887 8.979) 19.050 1.582 ( 5.563 14.742 0.125) 15.757 1.804 ( -5.341 5.715 -0.123) 7.824 1.920 ( 8.645 0.990 -0.049) 8.702 2.368 ( 1.793 3.609 -4.204) 5.823 2.428 ( 1.491 0.846 -0.585) 1.812 2.730 ( 6.382 9.784 1.016) 11.726 2.768 ( 6.817 13.792 -0.320) 15.388 2.840 ( 7.673 0.338 1.854) 7.901 3.048 ( -1.503 0.444 -3.335) 3.685 3.437 ( -6.366 -6.433 -0.651) 9.073 3.647 ( -3.791 -8.048 -1.315) 8.993 3.792 ( -1.485 -3.007 -0.397) 3.377 3.935 ( -1.046 0.565 2.106) 2.418 4.025 ( -2.764 -2.895 0.554) 4.041 4.168 ( 0.243 -3.517 1.412) 3.798 4.209 ( -3.073 -1.856 -1.210) 3.788 4.226 ( 0.518 -1.565 -1.289) 2.093 4.573 ( -4.488 -1.577 2.104) 5.201 4.583 ( -0.183 -6.287 0.824) 6.344 4.764 ( -1.260 3.203 -1.872) 3.918 4.971 ( 5.433 8.428 -4.852) 11.139 5.197 ( -5.711 1.663 3.919) 7.123 5.407 ( -1.073 -6.284 2.556) 6.868 5.709 ( 0.407 0.602 -1.524) 1.688 5.802 ( 1.804 -2.070 1.328) 3.050 5.946 ( 0.138 -3.413 -1.248) 3.637 6.044 ( 5.419 -0.725 -2.503) 6.013 6.151 ( 3.202 -0.565 2.977) 4.408 6.300 ( 0.891 -1.823 -1.641) 2.610 6.377 ( -1.999 -0.188 -0.141) 2.013 6.423 ( 1.955 3.714 -2.466) 4.868 6.531 ( 4.876 2.353 -0.986) 5.504 6.658 ( -0.961 -3.779 5.284) 6.567 6.821 ( 0.728 -4.351 -1.589) 4.689 6.827 ( 5.717 -3.115 -1.191) 6.619 6.924 ( 1.140 -3.118 0.126) 3.322 7.007 ( -1.677 0.937 -1.259) 2.297 7.156 ( 4.759 -9.016 2.205) 10.431 7.265 ( 0.180 -0.665 1.588) 1.731 7.349 ( -4.228 1.815 -2.669) 5.319 7.436 ( 4.097 -7.051 2.381) 8.496 7.691 ( -1.823 1.847 1.773) 3.143 8.023 ( 2.104 1.178 -7.122) 7.519 8.173 ( -8.154 -8.431 3.361) 12.201 8.294 ( -11.517 1.103 2.324) 11.801 8.306 ( -12.694 -6.548 2.285) 14.464 8.689 ( -1.916 -6.273 -3.012) 7.217 9.220 ( 0.190 -1.198 0.418) 1.283 9.294 ( 2.171 -7.245 1.540) 7.719 9.467 ( -7.139 8.334 5.893) 12.456 10.012 ( -2.793 11.302 0.136) 11.643 10.311 ( 8.311 3.092 -6.576) 11.039 10.740 ( -6.393 3.993 -6.981) 10.274 11.027 ( -0.205 1.088 -8.308) 8.381 11.203 ( 6.456 -3.827 1.020) 7.574 11.357 ( -3.879 -2.425 10.135) 11.120 11.795 ( -2.755 -3.703 -0.811) 4.686 12.094 ( -4.280 -1.757 -0.012) 4.626 12.338 ( 2.060 -3.548 6.312) 7.528 12.388 ( -5.699 -2.107 0.134) 6.078 12.551 ( -0.230 5.378 -1.691) 5.643 12.842 ( 6.685 4.212 -6.222) 10.058 13.042 ( 6.624 3.522 -0.794) 7.544 13.273 ( -4.193 4.984 -0.705) 6.551 13.435 ( 0.464 7.289 5.922) 9.402 13.614 ( 3.091 7.089 1.812) 7.943 13.862 ( 3.077 0.622 -6.945) 7.622 14.397 ( -1.084 -9.194 11.851) 15.038 14.915 ( -2.804 -2.583 -6.766) 7.766 15.187 ( 2.260 0.477 -2.650) 3.515 15.376 ( 3.169 0.893 0.700) 3.366 ======================= Grid point 155 (71/141) ======================= q-point: (-0.10 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.540 ( 5.007 8.246 8.449) 12.824 1.617 ( 13.385 8.824 -0.978) 16.061 1.684 ( -2.258 4.792 1.155) 5.422 2.061 ( 8.415 1.257 -3.125) 9.065 2.323 ( 0.968 6.815 -3.429) 7.690 2.450 ( 0.723 -2.154 0.971) 2.470 2.743 ( 5.733 7.440 -0.168) 9.394 2.799 ( 8.946 10.172 -0.715) 13.565 2.993 ( 5.832 -2.555 2.325) 6.778 3.080 ( 7.826 0.659 -3.460) 8.582 3.393 ( -4.802 -4.840 -0.343) 6.826 3.639 ( -4.492 -5.678 -0.372) 7.250 3.790 ( -2.184 -2.682 -0.802) 3.550 3.923 ( -1.304 -0.490 2.550) 2.906 3.979 ( -5.016 -1.198 0.610) 5.192 4.117 ( -7.318 -0.295 -1.766) 7.533 4.207 ( -1.478 -5.488 1.662) 5.921 4.230 ( 0.366 0.895 -1.460) 1.751 4.478 ( -5.951 0.858 1.585) 6.218 4.665 ( -0.909 -7.926 -1.037) 8.045 4.705 ( 0.574 5.263 1.594) 5.529 4.935 ( 1.479 8.582 -6.518) 10.877 5.094 ( -5.164 1.733 4.304) 6.943 5.437 ( -4.299 -7.454 4.242) 9.594 5.690 ( 0.858 2.601 -2.089) 3.444 5.847 ( 1.421 -0.913 1.237) 2.094 5.971 ( -1.449 -4.649 -3.758) 6.151 6.097 ( -1.675 2.114 0.158) 2.701 6.187 ( 3.266 1.054 -1.577) 3.777 6.272 ( -4.448 -0.875 -2.044) 4.973 6.369 ( -1.056 1.805 1.211) 2.417 6.386 ( 2.190 3.806 4.164) 6.051 6.596 ( 4.660 1.761 -2.289) 5.483 6.683 ( -0.779 -0.869 3.462) 3.653 6.809 ( -3.046 0.845 1.213) 3.386 6.904 ( -2.625 -2.606 -0.944) 3.818 6.939 ( 3.851 -2.199 -4.509) 6.325 7.071 ( 2.826 -4.217 1.601) 5.323 7.173 ( -3.455 1.518 -3.013) 4.829 7.228 ( -4.923 -1.462 2.196) 5.586 7.322 ( -0.128 0.437 1.027) 1.123 7.577 ( 0.388 -2.474 0.939) 2.674 7.751 ( 3.332 -4.093 1.218) 5.417 7.912 ( -5.842 1.073 -0.036) 5.940 8.026 ( -7.039 -2.941 -2.296) 7.967 8.179 ( -0.280 -1.609 2.241) 2.773 8.482 ( 6.963 -18.084 0.870) 19.397 8.702 ( -3.189 -7.540 -3.052) 8.737 9.183 ( -4.682 7.306 1.254) 8.768 9.218 ( -2.567 7.155 5.430) 9.341 9.554 ( 4.874 -11.620 -0.904) 12.633 9.785 ( -7.429 8.801 -0.467) 11.527 10.375 ( 6.976 5.597 -1.693) 9.103 10.634 ( -0.846 1.614 -8.646) 8.836 10.999 ( 0.416 1.092 -3.048) 3.264 11.322 ( -0.437 -1.228 3.127) 3.388 11.420 ( 7.297 -5.970 1.089) 9.491 11.803 ( -1.643 -5.348 0.331) 5.604 12.046 ( -3.351 -2.077 1.199) 4.121 12.288 ( -6.119 -0.258 3.933) 7.279 12.459 ( 0.733 -2.886 5.065) 5.875 12.505 ( 3.313 2.977 -3.463) 5.642 12.846 ( 1.420 4.906 -5.602) 7.581 13.090 ( 1.980 5.751 3.541) 7.038 13.221 ( 3.426 0.697 -4.061) 5.359 13.417 ( 2.635 4.806 8.140) 9.813 13.531 ( -3.046 8.245 -2.551) 9.152 13.866 ( 0.640 0.970 -6.685) 6.785 14.515 ( 0.593 -6.910 12.555) 14.343 14.872 ( -2.812 -2.520 -6.885) 7.852 15.213 ( 2.431 1.148 -2.866) 3.930 15.395 ( 0.701 1.465 0.193) 1.636 ======================= Grid point 161 (72/141) ======================= q-point: ( 0.50 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.674 ( -3.059 0.000 8.155) 8.709 1.790 ( -1.497 0.000 3.091) 3.434 1.971 ( 0.368 0.000 -1.691) 1.731 2.136 ( 0.086 -0.000 -4.279) 4.280 2.141 ( 3.785 0.000 3.992) 5.502 2.537 ( -3.053 0.000 -0.510) 3.095 2.709 ( 2.020 0.000 -6.495) 6.802 2.735 ( -1.840 0.000 -1.781) 2.561 3.087 ( -1.497 0.000 3.120) 3.461 3.288 ( 2.849 0.000 -1.671) 3.303 3.518 ( -2.952 0.000 1.265) 3.212 3.613 ( 8.005 0.000 -2.077) 8.270 3.643 ( -10.278 0.000 2.671) 10.620 3.866 ( 5.313 0.000 -2.238) 5.765 3.984 ( 0.079 0.000 -1.036) 1.039 4.053 ( 0.051 0.000 -1.305) 1.306 4.094 ( 1.806 -0.000 5.686) 5.966 4.304 ( 2.009 0.000 -0.818) 2.170 4.366 ( 1.740 -0.000 -1.526) 2.314 4.429 ( -6.215 0.000 -2.926) 6.869 5.055 ( 6.423 -0.000 2.708) 6.971 5.075 ( -2.766 0.000 0.653) 2.842 5.249 ( -2.161 -0.000 0.448) 2.207 5.329 ( 3.547 0.000 -1.933) 4.039 5.389 ( -1.556 0.000 6.156) 6.350 5.618 ( -2.326 0.000 1.241) 2.636 5.880 ( -0.341 0.000 1.665) 1.699 5.912 ( -1.073 0.000 1.490) 1.836 6.104 ( 2.189 0.000 -7.244) 7.568 6.177 ( -2.936 -0.000 -2.439) 3.817 6.283 ( 0.937 0.000 -3.642) 3.761 6.327 ( 2.531 0.000 -5.385) 5.950 6.407 ( -0.241 0.000 2.932) 2.942 6.557 ( -1.248 0.000 4.679) 4.842 6.658 ( 1.289 0.000 -0.154) 1.298 6.763 ( -3.521 0.000 6.349) 7.260 6.807 ( -3.212 0.000 -6.647) 7.383 6.845 ( -1.953 -0.000 2.038) 2.823 6.974 ( 6.113 0.000 0.703) 6.153 7.017 ( 1.947 0.000 -1.829) 2.672 7.443 ( 1.260 0.000 2.425) 2.732 7.603 ( -1.639 0.000 -1.658) 2.331 7.848 ( -2.164 0.000 1.133) 2.442 7.976 ( 2.879 0.000 -1.614) 3.301 8.277 ( -1.434 0.000 3.503) 3.785 8.474 ( -0.380 0.000 -1.885) 1.923 8.577 ( -1.772 0.000 3.811) 4.203 8.865 ( 13.650 0.000 -3.019) 13.980 9.011 ( -15.038 0.000 7.176) 16.663 9.535 ( 6.688 0.000 -5.734) 8.810 9.550 ( 0.907 0.000 1.879) 2.087 9.742 ( -3.211 0.000 -3.149) 4.498 10.561 ( -2.181 0.000 1.929) 2.912 10.852 ( 7.336 0.000 -6.431) 9.756 11.015 ( -0.183 0.000 3.365) 3.370 11.248 ( -1.344 0.000 -3.020) 3.305 11.344 ( -5.079 0.000 8.407) 9.823 11.857 ( -1.237 0.000 1.561) 1.992 12.087 ( -2.052 0.000 -2.586) 3.301 12.231 ( 0.256 0.000 3.171) 3.181 12.341 ( 2.579 0.000 -2.267) 3.433 12.819 ( 0.593 0.000 -4.041) 4.085 12.927 ( 2.323 -0.000 -0.860) 2.477 12.933 ( -5.325 0.000 -12.973) 14.024 13.434 ( 6.137 0.000 5.150) 8.012 13.434 ( 7.516 -0.000 9.584) 12.179 13.763 ( -2.985 0.000 -2.454) 3.865 13.822 ( -7.433 -0.000 -7.715) 10.713 14.222 ( -1.391 0.000 14.603) 14.669 14.923 ( 1.526 0.000 -6.825) 6.994 15.200 ( -2.886 0.000 0.424) 2.917 15.216 ( 3.256 0.000 0.026) 3.256 ======================= Grid point 163 (73/141) ======================= q-point: (-0.40 0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.676 ( 4.254 6.778 6.556) 10.345 1.793 ( 2.212 1.615 2.825) 3.934 1.949 ( 2.849 7.845 -0.096) 8.346 2.073 ( -2.725 4.998 -1.898) 6.000 2.268 ( 4.025 -4.707 3.091) 6.921 2.495 ( 0.769 2.027 -6.752) 7.091 2.718 ( 2.650 -0.681 -1.215) 2.994 2.763 ( 3.486 -0.890 -2.303) 4.271 3.029 ( -4.560 1.961 2.124) 5.399 3.256 ( -4.474 5.211 -0.545) 6.890 3.399 ( -9.586 -1.680 0.354) 9.739 3.468 ( -8.861 -6.564 -0.012) 11.028 3.744 ( 4.652 -0.270 -1.871) 5.022 3.965 ( -1.834 -0.569 -0.383) 1.958 3.986 ( 5.441 -0.110 -0.310) 5.451 4.045 ( -1.496 -1.322 0.494) 2.057 4.174 ( 5.718 1.924 3.434) 6.942 4.299 ( 1.961 6.211 0.452) 6.529 4.368 ( 0.307 -5.516 -4.017) 6.830 4.449 ( -0.313 -7.676 0.716) 7.716 4.987 ( 0.423 8.462 0.005) 8.473 5.152 ( 4.616 5.737 -1.386) 7.493 5.258 ( 0.419 -3.563 2.072) 4.143 5.315 ( -2.088 2.037 2.597) 3.905 5.509 ( 7.760 -5.711 5.106) 10.905 5.615 ( -1.857 -6.309 0.491) 6.594 5.884 ( 0.744 -2.089 -1.733) 2.814 5.993 ( 7.695 1.356 2.296) 8.144 6.074 ( -2.733 0.900 -3.738) 4.717 6.180 ( 3.749 -2.217 -4.895) 6.552 6.308 ( 1.728 -1.820 -3.104) 3.992 6.385 ( 3.463 -3.822 -2.947) 5.940 6.439 ( 1.744 -1.878 1.385) 2.914 6.584 ( 2.392 -0.611 3.956) 4.663 6.682 ( 0.664 -1.108 -3.254) 3.501 6.746 ( -2.956 -3.085 -2.309) 4.857 6.775 ( 0.163 -2.273 5.613) 6.058 6.850 ( 4.892 1.568 0.120) 5.139 7.034 ( 1.422 -1.023 -1.359) 2.217 7.122 ( 7.140 -1.668 1.966) 7.591 7.411 ( -4.878 0.709 3.952) 6.317 7.533 ( -4.873 1.771 -3.473) 6.240 7.867 ( 3.617 -0.385 -1.805) 4.060 7.946 ( -3.748 3.640 1.104) 5.340 8.238 ( -4.956 1.625 3.535) 6.301 8.421 ( -12.909 -1.188 1.599) 13.062 8.468 ( -5.822 -2.950 -0.448) 6.542 8.709 ( -14.669 0.131 -0.083) 14.670 9.034 ( 5.045 -0.364 0.850) 5.129 9.404 ( -11.607 0.484 -1.373) 11.698 9.623 ( 5.714 0.642 4.385) 7.231 9.948 ( 17.302 -1.745 -6.551) 18.583 10.490 ( -2.207 6.837 0.326) 7.192 10.931 ( 1.874 -0.798 -5.485) 5.851 10.992 ( -2.979 0.328 3.370) 4.510 11.172 ( -4.387 0.192 -2.375) 4.992 11.309 ( -3.961 -2.582 8.800) 9.990 11.801 ( -5.023 -1.008 -1.617) 5.372 12.075 ( -0.325 -1.356 0.297) 1.426 12.248 ( 0.379 0.267 2.343) 2.389 12.372 ( -0.343 -2.718 -1.099) 2.952 12.771 ( -6.164 3.472 -3.547) 7.914 12.849 ( 5.381 2.186 -10.036) 11.595 12.992 ( 4.962 -0.174 -0.300) 4.974 13.513 ( -0.887 4.058 8.265) 9.250 13.557 ( 1.253 -0.315 3.994) 4.198 13.651 ( 2.909 6.348 -2.194) 7.319 13.778 ( -0.844 -6.257 -7.064) 9.474 14.242 ( -0.912 -0.361 11.776) 11.817 14.907 ( -2.039 -1.551 -6.403) 6.896 15.176 ( 0.434 0.214 -1.589) 1.661 15.301 ( 5.747 -0.027 1.813) 6.027 ======================= Grid point 164 (74/141) ======================= q-point: (-0.30 0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.710 ( 7.794 10.076 4.573) 13.534 1.823 ( 2.642 5.665 0.176) 6.253 1.928 ( -3.028 10.268 -0.744) 10.731 1.962 ( 5.157 3.167 3.422) 6.952 2.355 ( 1.620 -3.413 -0.024) 3.778 2.484 ( 1.293 2.261 -6.877) 7.353 2.805 ( 6.489 -0.467 0.953) 6.575 2.858 ( 6.408 1.075 0.803) 6.547 2.938 ( -1.246 3.218 0.541) 3.492 3.089 ( -6.639 4.432 -1.882) 8.201 3.285 ( -8.112 -6.857 -0.169) 10.623 3.438 ( -6.909 -11.210 -0.336) 13.173 3.784 ( 1.542 0.927 -1.921) 2.632 3.938 ( -2.197 -1.070 0.531) 2.501 3.997 ( -1.235 0.268 0.289) 1.297 4.054 ( -2.534 -4.305 0.674) 5.041 4.230 ( 2.528 0.729 -0.644) 2.709 4.292 ( 2.530 6.631 0.546) 7.118 4.427 ( -1.396 -7.711 -3.158) 8.448 4.514 ( 0.700 -2.870 5.202) 5.982 4.919 ( 1.510 8.892 -1.774) 9.192 5.150 ( 3.799 7.009 -3.692) 8.785 5.237 ( -3.567 2.696 6.336) 7.755 5.314 ( -0.075 -1.977 1.041) 2.235 5.665 ( 0.278 -5.543 1.501) 5.749 5.707 ( 5.978 -5.265 1.859) 8.180 5.939 ( -0.141 0.171 -4.245) 4.251 5.977 ( 0.877 -3.302 -0.340) 3.433 6.156 ( 6.117 1.084 1.529) 6.397 6.254 ( 2.211 -2.833 -1.209) 3.792 6.341 ( 0.765 -2.097 -3.587) 4.225 6.468 ( 4.291 0.435 -2.556) 5.014 6.514 ( 2.807 -5.127 1.063) 5.941 6.619 ( -1.763 0.539 0.808) 2.013 6.701 ( 1.383 -5.456 -1.099) 5.735 6.779 ( 2.835 -3.080 -0.372) 4.202 6.845 ( 4.190 -3.796 1.630) 5.884 6.989 ( 6.650 -1.818 2.523) 7.341 7.055 ( 2.346 0.627 -2.361) 3.387 7.224 ( 0.380 -3.155 3.339) 4.609 7.347 ( -2.876 -1.196 3.599) 4.760 7.374 ( -10.220 -0.167 -4.565) 11.194 7.778 ( -6.673 4.578 1.199) 8.181 7.987 ( 5.086 -3.681 -3.634) 7.254 8.058 ( -13.784 -2.858 2.322) 14.268 8.254 ( -14.200 -0.479 2.402) 14.410 8.316 ( -3.243 1.502 3.296) 4.861 8.621 ( -0.444 -1.422 -5.634) 5.827 9.138 ( 4.796 -5.752 1.288) 7.599 9.219 ( -7.496 0.939 0.086) 7.555 9.689 ( 4.307 9.726 7.584) 13.063 10.176 ( 9.638 3.796 -7.466) 12.769 10.395 ( 1.511 6.283 -2.489) 6.925 10.800 ( -10.828 2.178 -1.753) 11.183 11.018 ( 1.027 -1.739 -4.698) 5.114 11.131 ( -0.475 -3.862 2.566) 4.661 11.308 ( -1.796 -1.844 8.905) 9.270 11.731 ( -3.978 -2.501 -2.567) 5.355 12.071 ( -2.073 -0.588 -0.126) 2.159 12.271 ( 1.110 -1.936 5.197) 5.656 12.355 ( -4.201 -2.136 -1.392) 4.915 12.658 ( -0.808 4.857 -1.272) 5.085 12.915 ( 7.335 3.201 -8.219) 11.471 13.075 ( 4.333 0.065 -1.088) 4.468 13.370 ( -7.362 4.820 0.419) 8.810 13.527 ( -1.360 2.464 2.925) 4.059 13.710 ( 0.104 -0.579 -1.920) 2.008 13.846 ( 5.882 0.657 0.255) 5.924 14.281 ( 1.259 -2.167 10.161) 10.465 14.859 ( -3.650 -2.867 -6.141) 7.697 15.194 ( 2.445 0.289 -2.698) 3.652 15.393 ( 3.990 0.703 2.299) 4.659 ======================= Grid point 165 (75/141) ======================= q-point: (-0.20 0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.731 ( -0.197 10.235 2.264) 10.484 1.772 ( 0.947 6.109 0.914) 6.249 1.814 ( 5.481 8.485 -0.054) 10.101 2.088 ( 8.830 1.808 2.796) 9.437 2.397 ( -2.270 -2.086 -1.781) 3.560 2.445 ( 2.757 3.521 -3.022) 5.397 2.835 ( -0.441 2.735 -1.209) 3.022 2.903 ( -4.533 -1.081 -3.482) 5.817 2.974 ( 9.378 3.220 5.554) 11.365 3.083 ( 8.657 -1.251 -2.694) 9.152 3.254 ( -4.539 -8.322 -0.672) 9.504 3.440 ( -5.511 -11.896 0.751) 13.132 3.777 ( -0.336 1.097 -2.375) 2.638 3.920 ( -1.309 -0.566 1.071) 1.784 3.983 ( -1.215 -0.116 1.828) 2.198 4.037 ( -5.357 -5.857 1.090) 8.012 4.229 ( -1.071 6.717 -1.207) 6.908 4.254 ( 1.315 0.887 -1.473) 2.164 4.435 ( -4.085 -5.634 -2.674) 7.456 4.548 ( -1.407 -1.787 5.819) 6.248 4.854 ( 1.625 8.323 -1.422) 8.598 5.097 ( -3.396 4.126 -0.076) 5.345 5.174 ( 1.103 7.610 0.254) 7.694 5.321 ( -2.710 -2.925 4.193) 5.786 5.707 ( 0.109 -1.695 0.951) 1.947 5.842 ( 5.675 -2.539 -2.980) 6.894 5.863 ( -4.229 -2.184 -2.655) 5.451 6.102 ( 2.736 -2.461 3.521) 5.093 6.172 ( -1.890 -1.252 -2.224) 3.176 6.252 ( -3.607 -1.183 -2.962) 4.815 6.387 ( 3.345 0.443 0.889) 3.490 6.468 ( -3.224 3.283 0.484) 4.626 6.597 ( 3.539 -1.494 -2.873) 4.797 6.625 ( 0.937 -5.081 3.421) 6.196 6.759 ( -0.719 -3.792 2.010) 4.351 6.882 ( 3.607 -3.542 -3.113) 5.937 6.929 ( -3.391 2.756 1.109) 4.508 6.969 ( -0.395 -3.768 -1.087) 3.941 7.123 ( -7.208 -6.660 2.041) 10.024 7.174 ( -2.095 -4.657 -3.169) 6.010 7.284 ( 2.173 -1.844 -0.045) 2.850 7.469 ( 6.652 -6.818 2.564) 9.865 7.685 ( -1.751 0.833 1.678) 2.564 7.909 ( -6.755 -2.780 2.540) 7.733 8.047 ( -4.175 3.088 -1.622) 5.440 8.106 ( 0.606 -5.187 -3.198) 6.124 8.321 ( 3.968 0.904 5.453) 6.804 8.606 ( -1.480 -2.416 -5.455) 6.146 9.165 ( 1.600 -1.094 0.099) 1.941 9.325 ( 5.331 -9.586 1.194) 11.033 9.594 ( 0.102 20.909 8.946) 22.743 10.071 ( -5.211 16.222 -4.559) 17.638 10.441 ( 6.207 1.429 -6.954) 9.430 10.636 ( -4.946 -1.340 -1.311) 5.289 11.009 ( -0.192 -0.066 -3.377) 3.383 11.238 ( 2.660 -6.996 -1.820) 7.703 11.350 ( 3.691 -1.331 10.561) 11.266 11.708 ( -1.885 -4.101 -1.715) 4.829 12.022 ( -3.411 -0.102 0.439) 3.441 12.283 ( -4.827 -0.745 0.104) 4.885 12.361 ( 2.979 -4.370 7.295) 9.010 12.615 ( 1.630 5.741 -3.528) 6.932 12.931 ( 0.515 3.873 -7.731) 8.663 13.135 ( 3.014 -1.253 -0.529) 3.306 13.239 ( -4.754 1.897 0.099) 5.120 13.506 ( 1.473 3.175 5.645) 6.642 13.646 ( -5.075 1.592 -5.585) 7.713 13.893 ( 1.855 3.837 0.872) 4.350 14.394 ( 3.394 -5.018 9.303) 11.102 14.817 ( -2.353 -3.046 -5.874) 7.022 15.228 ( 2.812 0.551 -3.061) 4.193 15.425 ( 0.474 1.456 2.160) 2.648 ======================= Grid point 166 (76/141) ======================= q-point: (-0.10 0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.638 ( -1.370 4.383 2.710) 5.332 1.701 ( -2.066 4.639 3.541) 6.191 1.892 ( 9.071 5.492 -2.293) 10.850 2.181 ( 3.254 2.513 -3.679) 5.517 2.333 ( -2.700 0.674 -0.274) 2.797 2.489 ( 2.820 0.743 -0.032) 2.916 2.815 ( -1.960 -1.149 -2.405) 3.308 2.849 ( 2.205 1.101 -0.058) 2.465 3.121 ( 5.130 -1.870 4.036) 6.790 3.178 ( 0.740 -1.382 -5.736) 5.947 3.299 ( 2.452 -4.012 1.931) 5.083 3.530 ( 3.636 -9.781 1.397) 10.528 3.738 ( -2.118 0.768 -3.253) 3.957 3.876 ( -5.212 0.410 -0.266) 5.235 3.965 ( -5.625 -1.320 0.989) 5.861 3.973 ( -0.550 3.957 3.895) 5.579 4.172 ( -0.544 -1.256 -2.222) 2.610 4.266 ( 1.895 1.272 -0.441) 2.325 4.397 ( -2.777 0.523 0.896) 2.964 4.549 ( -3.096 -5.841 1.081) 6.698 4.813 ( 1.915 5.839 -0.069) 6.145 4.981 ( -5.702 2.404 1.985) 6.499 5.108 ( 1.407 8.863 -3.736) 9.721 5.311 ( -3.491 -3.414 6.049) 7.774 5.716 ( 0.354 -0.061 -1.022) 1.083 5.838 ( -0.276 -2.846 0.094) 2.861 5.920 ( -0.194 -0.200 -2.038) 2.057 6.031 ( -3.458 1.235 -4.979) 6.187 6.182 ( -4.288 -1.049 0.807) 4.487 6.234 ( 1.946 -2.620 1.657) 3.660 6.349 ( -3.487 2.043 0.315) 4.054 6.452 ( 1.087 -0.495 3.112) 3.334 6.647 ( 1.140 -1.085 -3.615) 3.943 6.692 ( 1.235 -0.826 2.332) 2.765 6.761 ( -2.693 -0.657 2.703) 3.872 6.799 ( -3.927 -2.230 -1.333) 4.708 6.943 ( 1.480 -2.840 -3.277) 4.582 7.036 ( -1.059 -4.677 -0.400) 4.812 7.097 ( -1.389 -4.144 3.607) 5.667 7.222 ( 2.502 2.685 -5.520) 6.629 7.307 ( 0.567 -3.169 0.006) 3.220 7.556 ( -2.288 -0.897 1.696) 2.986 7.732 ( 0.121 -8.325 2.661) 8.741 7.856 ( -2.159 0.440 1.397) 2.609 7.992 ( 1.613 2.784 -1.698) 3.638 8.218 ( 7.449 -3.829 1.518) 8.512 8.471 ( 6.150 -8.355 1.167) 10.440 8.609 ( 0.510 -4.999 -2.234) 5.499 9.198 ( -0.932 7.930 -1.021) 8.050 9.303 ( -3.582 13.245 5.241) 14.687 9.548 ( 3.868 -4.260 2.577) 6.304 9.790 ( -4.951 14.905 -4.475) 16.330 10.488 ( 2.163 -0.148 -5.878) 6.265 10.633 ( 2.682 0.924 0.674) 2.916 11.005 ( 0.532 0.234 -1.589) 1.692 11.293 ( -1.150 -3.760 6.443) 7.548 11.509 ( 7.639 -2.196 -5.977) 9.945 11.744 ( 1.619 -4.925 2.644) 5.819 11.983 ( -2.165 -1.625 1.896) 3.305 12.202 ( -5.266 0.715 2.669) 5.947 12.468 ( 1.078 -1.173 2.870) 3.283 12.581 ( 3.374 2.786 -3.968) 5.907 12.867 ( -0.804 1.896 -4.045) 4.539 13.119 ( -5.473 3.133 3.510) 7.217 13.216 ( 1.044 -6.522 -5.321) 8.482 13.473 ( -7.419 2.120 -4.729) 9.050 13.577 ( 6.331 6.889 8.529) 12.661 13.870 ( -0.273 1.795 -0.559) 1.900 14.486 ( -2.045 -5.314 3.484) 6.675 14.819 ( 1.925 -1.075 -2.610) 3.417 15.254 ( 2.136 1.116 -3.154) 3.969 15.409 ( -1.083 0.986 1.971) 2.455 ======================= Grid point 173 (77/141) ======================= q-point: ( 0.60 -0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 141 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.815 ( 3.486 -0.000 3.446) 4.902 1.868 ( 6.913 -0.000 2.967) 7.523 1.975 ( -2.335 0.000 1.208) 2.629 2.127 ( 3.878 -0.000 -3.490) 5.217 2.271 ( -1.136 0.000 2.504) 2.750 2.497 ( 0.645 -0.000 -8.126) 8.152 2.795 ( 7.807 -0.000 2.338) 8.149 2.864 ( 7.422 -0.000 -0.310) 7.429 2.950 ( -5.131 0.000 -0.216) 5.135 3.179 ( -7.329 0.000 -1.377) 7.457 3.231 ( -10.126 0.000 0.294) 10.130 3.270 ( -6.741 0.000 1.636) 6.936 3.794 ( 2.138 -0.000 -3.130) 3.790 3.924 ( -1.637 0.000 -0.728) 1.792 3.999 ( -3.231 0.000 0.849) 3.340 4.020 ( -1.792 0.000 1.350) 2.244 4.249 ( 1.077 -0.000 0.381) 1.143 4.328 ( 0.629 -0.000 -5.769) 5.803 4.378 ( 1.712 -0.000 -0.181) 1.722 4.479 ( 5.046 -0.000 7.101) 8.711 5.023 ( 0.319 -0.000 -3.948) 3.961 5.210 ( -4.347 0.000 8.453) 9.505 5.229 ( -0.152 0.000 -1.272) 1.281 5.373 ( 5.187 -0.000 -2.052) 5.578 5.562 ( 0.186 -0.000 0.746) 0.769 5.655 ( 9.501 -0.000 7.396) 12.040 5.901 ( 3.424 -0.000 -2.679) 4.347 5.978 ( -5.718 0.000 -4.659) 7.375 6.184 ( 8.903 -0.000 2.615) 9.279 6.207 ( 1.290 -0.000 -2.409) 2.732 6.332 ( 3.400 -0.000 -3.653) 4.990 6.409 ( 2.445 -0.000 -0.344) 2.469 6.491 ( 5.101 -0.000 -2.633) 5.741 6.612 ( -4.788 0.000 -4.735) 6.734 6.655 ( 4.918 -0.000 3.209) 5.873 6.736 ( 2.436 -0.000 1.098) 2.672 6.804 ( 2.891 -0.000 3.975) 4.915 7.025 ( 14.458 -0.000 -3.875) 14.968 7.040 ( -0.606 0.000 0.768) 0.978 7.182 ( -3.706 0.000 5.024) 6.243 7.337 ( -2.877 0.000 3.196) 4.300 7.374 ( -14.950 0.000 -4.664) 15.661 7.834 ( -9.705 0.000 1.055) 9.762 7.930 ( -0.629 0.000 -0.142) 0.645 8.043 ( -7.761 0.000 -0.112) 7.762 8.247 ( -14.127 0.000 3.471) 14.547 8.338 ( 0.372 -0.000 2.652) 2.678 8.611 ( -0.081 0.000 -6.672) 6.672 9.081 ( 2.740 -0.000 1.007) 2.919 9.234 ( -8.333 0.000 1.034) 8.397 9.790 ( 10.186 -0.000 6.677) 12.180 10.201 ( 15.062 -0.000 -9.284) 17.693 10.481 ( -2.417 0.000 -1.551) 2.872 10.823 ( -12.665 0.000 -0.437) 12.673 10.991 ( 2.118 -0.000 0.538) 2.186 11.080 ( -4.249 0.000 0.175) 4.252 11.292 ( -0.202 0.000 8.353) 8.355 11.706 ( -4.192 0.000 -3.452) 5.430 12.066 ( -0.673 0.000 0.388) 0.777 12.265 ( 0.578 -0.000 3.671) 3.716 12.319 ( -3.415 0.000 -1.207) 3.622 12.711 ( -1.896 0.000 -0.962) 2.126 12.955 ( 8.187 -0.000 -11.215) 13.885 13.067 ( 3.359 -0.000 1.261) 3.588 13.435 ( -10.219 0.000 -2.839) 10.606 13.546 ( -1.745 0.000 5.541) 5.809 13.655 ( -2.528 0.000 -4.300) 4.989 13.878 ( 10.873 -0.000 5.880) 12.361 14.271 ( 0.848 -0.000 6.732) 6.785 14.825 ( -4.064 0.000 -5.413) 6.768 15.197 ( 2.493 -0.000 -2.805) 3.752 15.400 ( 4.332 -0.000 2.731) 5.121 ======================= Grid point 175 (78/141) ======================= q-point: (-0.30 0.60 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.843 ( 0.734 2.400 4.190) 4.884 1.914 ( -3.446 4.533 -1.078) 5.796 1.954 ( 4.145 5.453 -2.542) 7.306 2.148 ( 6.091 4.521 2.735) 8.063 2.316 ( 0.538 -5.707 0.865) 5.797 2.479 ( -0.131 0.033 -5.722) 5.724 2.850 ( -4.253 -0.702 -0.739) 4.373 2.906 ( 0.906 2.286 -2.005) 3.173 2.993 ( 2.741 -2.685 1.323) 4.059 3.071 ( 0.907 1.265 -1.462) 2.136 3.146 ( 1.171 -0.911 1.294) 1.969 3.239 ( -2.493 -7.876 2.894) 8.753 3.800 ( 0.093 0.863 -3.278) 3.391 3.904 ( -1.774 -0.770 -1.152) 2.252 3.955 ( -3.201 -2.103 1.580) 4.143 3.973 ( -2.554 -0.491 2.306) 3.476 4.265 ( 1.957 0.431 -0.694) 2.121 4.339 ( -0.633 -2.596 -5.276) 5.914 4.351 ( -2.241 3.554 -0.401) 4.220 4.544 ( -0.672 0.243 7.544) 7.578 4.979 ( -1.520 3.698 -4.687) 6.161 5.125 ( -8.113 -0.209 8.146) 11.499 5.231 ( 0.223 0.228 0.655) 0.728 5.402 ( 3.518 6.232 -3.177) 7.830 5.618 ( 1.500 -5.002 0.933) 5.305 5.799 ( 3.124 0.147 4.611) 5.571 5.881 ( -1.273 1.170 -3.488) 3.893 6.003 ( 5.634 -5.268 -0.157) 7.715 6.181 ( -3.579 1.602 -0.549) 3.960 6.223 ( -3.671 -1.729 -3.349) 5.261 6.399 ( 4.466 1.288 -0.950) 4.744 6.462 ( -1.134 -3.756 -1.583) 4.230 6.539 ( -2.079 -1.876 0.575) 2.859 6.578 ( 5.244 -0.241 -2.919) 6.006 6.734 ( 2.053 1.634 5.722) 6.295 6.815 ( 3.614 -3.289 -1.059) 5.000 6.897 ( 4.342 -1.958 -1.449) 4.979 6.995 ( -13.193 -3.389 3.106) 13.971 7.006 ( -5.063 2.346 0.628) 5.616 7.073 ( -12.442 -4.455 -3.204) 13.598 7.264 ( 11.002 -0.527 -4.669) 11.964 7.384 ( 5.100 -1.966 5.091) 7.469 7.707 ( -4.211 0.659 -0.538) 4.296 7.870 ( -2.358 -0.905 3.810) 4.571 8.069 ( -0.656 0.620 0.376) 0.978 8.081 ( -2.491 0.252 0.376) 2.532 8.366 ( 2.822 1.935 3.102) 4.618 8.584 ( -0.728 -0.324 -7.044) 7.089 9.155 ( 1.921 0.038 0.960) 2.148 9.186 ( 4.441 -4.082 1.780) 6.289 9.939 ( 8.794 11.392 9.210) 17.086 10.328 ( 2.722 8.300 -10.012) 13.286 10.448 ( 2.753 -0.439 -5.225) 5.922 10.591 ( -11.648 -2.448 1.387) 11.983 11.011 ( 0.341 1.032 -2.407) 2.641 11.088 ( 1.430 -6.888 -0.583) 7.059 11.344 ( 3.517 0.167 12.677) 13.157 11.652 ( -1.505 -1.451 -4.301) 4.782 12.036 ( -2.550 0.923 0.142) 2.716 12.256 ( -3.576 -1.076 -1.012) 3.869 12.310 ( 2.236 -1.337 5.754) 6.316 12.695 ( 0.875 1.984 -0.166) 2.175 13.008 ( 2.017 3.547 -11.921) 12.600 13.099 ( -0.190 -1.392 -3.105) 3.408 13.255 ( -8.536 -0.637 -0.299) 8.565 13.519 ( -4.824 -1.151 8.465) 9.811 13.629 ( 1.177 -0.653 -3.900) 4.125 14.010 ( 3.907 5.286 4.667) 8.062 14.318 ( 1.969 -2.723 3.498) 4.850 14.766 ( -1.428 -1.603 -3.893) 4.446 15.236 ( 3.006 0.213 -3.096) 4.321 15.446 ( 0.326 0.570 2.749) 2.826 ======================= Grid point 176 (79/141) ======================= q-point: (-0.20 -0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.761 ( -5.267 7.525 -1.426) 9.295 1.807 ( -1.800 5.556 4.231) 7.212 1.965 ( 1.542 1.181 -2.653) 3.288 2.209 ( 0.096 -0.689 0.137) 0.709 2.340 ( -0.162 1.232 0.624) 1.391 2.483 ( 0.657 -1.588 -2.671) 3.176 2.785 ( -3.109 -1.399 -3.653) 4.997 2.879 ( 1.861 1.935 0.001) 2.685 3.027 ( -1.363 -5.923 2.016) 6.404 3.109 ( -0.491 -4.588 -3.651) 5.884 3.272 ( 9.788 0.554 3.365) 10.365 3.367 ( 7.194 -5.620 2.529) 9.473 3.764 ( -1.616 1.755 -2.348) 3.347 3.852 ( -4.823 -2.362 -1.215) 5.506 3.935 ( -2.284 -1.870 0.798) 3.058 4.001 ( 2.609 -0.625 3.795) 4.648 4.216 ( -6.145 3.811 -3.197) 7.906 4.296 ( 2.066 1.506 -0.550) 2.615 4.370 ( 2.981 -2.264 -2.447) 4.472 4.499 ( -5.850 0.072 5.338) 7.919 4.896 ( -3.014 2.738 -2.066) 4.566 4.995 ( -9.555 -1.329 4.639) 10.705 5.212 ( -1.034 3.757 0.396) 3.917 5.378 ( 1.882 5.704 -0.369) 6.018 5.674 ( -0.228 -2.973 0.000) 2.982 5.796 ( -0.177 -1.192 0.758) 1.423 5.929 ( 4.781 1.075 -1.100) 5.022 6.050 ( -6.404 0.624 -6.627) 9.237 6.138 ( 1.968 -4.123 3.330) 5.653 6.174 ( -2.626 -2.029 1.297) 3.563 6.380 ( -6.188 0.874 -0.292) 6.257 6.424 ( -1.061 -1.458 -0.797) 1.971 6.587 ( 0.002 -5.996 0.556) 6.022 6.651 ( 3.120 -1.315 -1.157) 3.578 6.730 ( -2.131 -1.383 4.450) 5.124 6.764 ( -6.313 -1.096 -1.353) 6.548 6.874 ( -0.023 -2.923 0.358) 2.945 6.956 ( 1.339 -3.271 -2.283) 4.207 7.034 ( 1.656 -1.923 0.422) 2.573 7.133 ( 7.290 -7.595 -4.299) 11.371 7.332 ( -0.122 2.943 -3.114) 4.286 7.507 ( 1.303 -3.343 4.911) 6.082 7.650 ( -2.715 -0.346 1.776) 3.263 7.853 ( -1.920 0.483 2.038) 2.841 8.028 ( 1.001 -0.030 1.604) 1.891 8.150 ( 7.688 -1.151 -1.183) 7.863 8.421 ( 4.234 0.970 3.822) 5.786 8.568 ( 0.963 -0.257 -4.969) 5.068 9.240 ( 6.541 -0.033 0.502) 6.560 9.329 ( 3.905 -5.602 1.336) 6.958 9.846 ( -1.263 24.240 7.886) 25.522 10.118 ( -5.579 14.877 -7.598) 17.612 10.482 ( 0.953 -0.410 -6.573) 6.655 10.597 ( 3.830 -4.675 3.732) 7.103 11.005 ( 0.675 0.178 -2.375) 2.475 11.180 ( 0.367 -7.528 0.098) 7.538 11.492 ( 9.416 0.519 5.327) 10.830 11.662 ( 1.717 -3.206 -0.865) 3.738 11.978 ( -2.507 1.050 1.201) 2.972 12.204 ( -3.479 -0.704 -0.459) 3.579 12.406 ( 3.913 -2.714 7.298) 8.715 12.683 ( 1.711 4.416 -5.113) 6.969 12.897 ( -4.744 2.414 -7.195) 8.950 13.084 ( -4.184 -5.534 -9.537) 11.794 13.156 ( -5.364 -0.505 5.805) 7.920 13.440 ( -8.952 -3.622 2.840) 10.066 13.702 ( 8.386 4.580 4.240) 10.453 13.946 ( -3.344 5.892 0.975) 6.845 14.380 ( -1.623 -5.409 -0.196) 5.650 14.799 ( 4.396 -0.824 -1.073) 4.600 15.273 ( 2.793 0.745 -3.085) 4.228 15.423 ( -2.681 0.450 2.584) 3.751 ======================= Grid point 177 (80/141) ======================= q-point: (-0.10 -0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.610 ( -6.571 2.054 1.443) 7.034 1.722 ( -2.401 5.128 3.582) 6.701 1.938 ( -5.296 -2.934 -3.285) 6.888 2.173 ( -2.936 -0.007 -4.105) 5.047 2.312 ( -1.159 1.138 1.036) 1.927 2.488 ( -1.646 -2.397 -1.784) 3.411 2.776 ( 0.313 -2.571 -1.870) 3.194 2.894 ( -1.680 -0.745 2.284) 2.932 3.107 ( 0.024 0.243 -2.292) 2.305 3.125 ( 2.666 -7.404 -0.150) 7.871 3.409 ( 5.401 3.309 3.789) 7.381 3.548 ( 5.749 -6.726 -1.397) 8.958 3.741 ( 2.705 1.356 -0.510) 3.069 3.779 ( -5.252 0.998 -0.851) 5.413 3.878 ( -4.099 0.790 0.557) 4.212 4.064 ( 3.955 2.279 4.079) 6.122 4.123 ( -1.277 -1.652 -3.922) 4.443 4.322 ( 4.245 2.361 0.456) 4.879 4.371 ( -5.665 1.308 2.175) 6.208 4.514 ( 7.063 -4.066 -1.027) 8.214 4.784 ( -9.517 -1.551 2.611) 9.990 4.914 ( -1.389 -1.024 -2.377) 2.937 5.136 ( -2.139 4.089 0.126) 4.617 5.367 ( 3.106 6.116 3.714) 7.801 5.680 ( -0.867 -2.160 -1.528) 2.784 5.844 ( 1.801 -1.318 -0.044) 2.232 5.918 ( 0.734 2.075 0.865) 2.365 6.028 ( 2.767 -0.406 -6.102) 6.712 6.120 ( -2.544 -0.412 2.271) 3.435 6.230 ( 1.243 -3.107 2.768) 4.343 6.310 ( -1.452 -1.289 -0.810) 2.104 6.410 ( -3.088 -3.282 0.832) 4.583 6.615 ( -0.982 -2.760 -1.968) 3.529 6.693 ( -0.515 0.752 0.592) 1.087 6.734 ( 0.062 -3.271 4.099) 5.245 6.778 ( 3.865 -3.948 -2.018) 5.882 6.930 ( 1.774 -2.458 -2.543) 3.956 6.994 ( 1.314 -3.668 -0.212) 3.902 7.101 ( 2.880 -0.845 4.554) 5.454 7.239 ( -4.479 2.693 -3.294) 6.178 7.302 ( 7.062 -4.576 -8.565) 12.007 7.474 ( -6.607 -2.034 3.002) 7.537 7.655 ( -1.621 -5.066 4.053) 6.687 7.832 ( -0.995 -0.702 1.191) 1.704 8.057 ( 2.241 2.488 0.730) 3.427 8.354 ( 10.043 -1.017 1.487) 10.203 8.485 ( 2.787 -2.871 -0.558) 4.040 8.636 ( 6.969 -3.131 0.859) 7.688 9.254 ( -4.435 10.592 -1.363) 11.564 9.372 ( 0.119 5.219 2.073) 5.617 9.637 ( 0.926 11.252 5.375) 12.504 9.867 ( -2.778 16.307 -6.501) 17.774 10.441 ( -4.050 -0.345 -4.179) 5.830 10.715 ( 4.362 -0.039 2.340) 4.950 11.021 ( 1.812 0.010 -0.932) 2.037 11.257 ( 0.315 -5.628 6.978) 8.970 11.554 ( 0.621 1.704 -11.593) 11.734 11.810 ( 7.804 -3.235 5.969) 10.343 11.969 ( 1.900 -0.768 2.063) 2.908 12.143 ( -3.275 1.671 1.342) 3.914 12.485 ( 0.232 1.058 1.842) 2.137 12.645 ( 1.722 3.121 -3.377) 4.910 12.841 ( -0.569 -2.953 -2.421) 3.861 13.005 ( -5.790 -3.386 -3.944) 7.781 13.131 ( -3.414 -5.664 1.442) 6.769 13.328 ( -7.322 -3.194 -1.974) 8.229 13.713 ( -4.893 5.877 6.662) 10.142 13.943 ( 9.592 2.637 2.500) 10.257 14.347 ( -7.205 -4.957 -4.811) 9.981 14.895 ( 5.839 0.611 1.091) 5.972 15.288 ( 1.132 1.481 -2.634) 3.227 15.388 ( -1.689 -0.562 1.773) 2.512 ======================= Grid point 185 (81/141) ======================= q-point: (-0.30 -0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.871 ( -5.183 0.000 -2.562) 5.782 1.874 ( -0.003 0.000 4.217) 4.217 1.954 ( -4.889 0.000 -3.538) 6.035 2.172 ( -3.593 0.000 1.808) 4.022 2.377 ( 4.599 -0.000 2.655) 5.311 2.451 ( -1.357 0.000 -5.367) 5.536 2.769 ( -2.745 0.000 -4.473) 5.248 2.921 ( 1.877 -0.000 -1.487) 2.394 2.945 ( -4.321 0.000 3.827) 5.772 3.055 ( 1.430 -0.000 -2.905) 3.238 3.289 ( 10.200 -0.000 -0.559) 10.215 3.307 ( 9.507 -0.000 7.245) 11.952 3.798 ( 0.439 -0.000 -3.348) 3.376 3.813 ( -6.729 0.000 0.126) 6.730 3.910 ( -1.213 0.000 1.513) 1.939 3.990 ( 3.001 -0.000 1.582) 3.393 4.254 ( -7.937 0.000 -2.832) 8.427 4.315 ( 4.111 -0.000 0.007) 4.111 4.348 ( 2.175 -0.000 -2.635) 3.417 4.504 ( -6.295 0.000 5.350) 8.261 4.929 ( -3.458 0.000 -5.407) 6.418 4.966 ( -12.641 0.000 8.267) 15.104 5.268 ( 2.222 -0.000 2.405) 3.274 5.414 ( -2.965 0.000 -6.411) 7.063 5.654 ( 3.904 -0.000 4.208) 5.740 5.785 ( -0.911 0.000 -0.941) 1.309 5.950 ( 3.109 -0.000 4.743) 5.671 6.040 ( -2.433 0.000 -8.057) 8.416 6.095 ( 0.826 -0.000 -2.278) 2.424 6.151 ( -3.387 0.000 4.988) 6.029 6.388 ( -5.629 0.000 -3.785) 6.784 6.414 ( -3.272 0.000 0.050) 3.272 6.502 ( -1.145 0.000 1.488) 1.877 6.623 ( -0.419 0.000 1.428) 1.488 6.758 ( 0.844 -0.000 -2.051) 2.218 6.776 ( -6.348 0.000 -0.448) 6.364 6.824 ( -1.346 0.000 1.455) 1.982 6.888 ( 4.589 -0.000 2.059) 5.030 7.015 ( 0.840 -0.000 0.412) 0.936 7.063 ( 9.635 -0.000 -6.453) 11.596 7.363 ( 1.265 -0.000 -5.228) 5.379 7.471 ( 2.422 -0.000 6.899) 7.312 7.652 ( -3.082 0.000 -0.019) 3.082 7.864 ( -1.279 0.000 3.276) 3.517 8.024 ( -0.359 0.000 2.946) 2.967 8.148 ( 6.597 -0.000 -0.207) 6.600 8.439 ( 3.344 -0.000 2.968) 4.471 8.569 ( 1.760 -0.000 -5.563) 5.835 9.243 ( 7.405 -0.000 1.280) 7.515 9.258 ( 5.185 -0.000 0.895) 5.262 10.196 ( 7.255 -0.000 9.825) 12.213 10.238 ( -13.394 0.000 -7.781) 15.490 10.470 ( 5.463 -0.000 0.112) 5.464 10.511 ( 1.008 -0.000 -4.070) 4.193 11.034 ( 0.194 -0.000 -7.399) 7.401 11.056 ( 1.894 -0.000 2.176) 2.885 11.506 ( 10.476 -0.000 13.947) 17.444 11.627 ( 0.924 -0.000 -6.324) 6.391 11.998 ( -2.680 0.000 1.033) 2.872 12.190 ( -2.651 0.000 -1.684) 3.141 12.380 ( 4.359 -0.000 6.911) 8.171 12.717 ( 0.884 -0.000 -0.991) 1.328 12.974 ( -4.507 0.000 -13.298) 14.041 12.999 ( -6.341 0.000 -13.045) 14.505 13.129 ( -6.198 0.000 8.637) 10.631 13.398 ( -9.670 0.000 7.672) 12.344 13.745 ( 10.285 -0.000 3.038) 10.724 14.032 ( -6.327 0.000 1.923) 6.613 14.308 ( -0.847 0.000 -2.325) 2.475 14.791 ( 5.378 -0.000 -0.436) 5.396 15.281 ( 3.236 -0.000 -2.979) 4.398 15.427 ( -3.555 0.000 2.682) 4.453 ======================= Grid point 186 (82/141) ======================= q-point: (-0.20 -0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.692 ( -10.413 5.263 -2.081) 11.852 1.832 ( -6.366 1.337 0.256) 6.510 1.865 ( -5.178 -0.391 -0.062) 5.194 2.110 ( -6.204 -5.035 1.884) 8.209 2.361 ( -2.113 3.287 -1.633) 4.235 2.427 ( -2.642 -3.409 -2.912) 5.204 2.734 ( -1.842 -1.319 -4.005) 4.601 2.868 ( -6.889 -1.194 3.590) 7.860 3.024 ( 7.615 -2.286 -0.158) 7.952 3.116 ( 4.985 0.312 -1.185) 5.134 3.461 ( 9.291 1.085 3.007) 9.826 3.471 ( 5.988 -0.861 1.125) 6.153 3.716 ( -3.416 -1.584 1.168) 3.943 3.808 ( 1.800 0.317 -3.614) 4.050 3.906 ( -0.446 2.191 0.941) 2.426 4.033 ( -2.002 -2.632 2.096) 3.915 4.140 ( 0.838 1.032 -1.649) 2.118 4.376 ( 1.262 2.123 -0.133) 2.473 4.390 ( -2.965 1.243 1.860) 3.714 4.442 ( 7.612 -3.201 -1.359) 8.369 4.756 ( -13.906 -0.937 4.948) 14.790 4.876 ( -1.770 -1.428 -4.341) 4.901 5.254 ( -0.991 6.625 1.270) 6.818 5.381 ( -0.509 -4.353 -1.169) 4.536 5.712 ( 2.734 4.300 2.559) 5.702 5.807 ( 2.186 -2.501 0.486) 3.357 5.949 ( -0.810 0.810 -5.008) 5.137 5.996 ( 1.047 -1.798 -0.224) 2.093 6.120 ( -1.457 0.213 3.396) 3.702 6.178 ( 3.820 -1.667 1.825) 4.550 6.282 ( -4.546 -0.746 -2.171) 5.093 6.356 ( -3.107 -2.011 -1.333) 3.933 6.513 ( -1.045 -5.217 1.585) 5.552 6.651 ( 1.497 -2.755 3.580) 4.759 6.708 ( -1.590 0.732 -0.076) 1.752 6.771 ( 2.851 3.701 -2.076) 5.112 6.861 ( 1.927 -4.234 -0.625) 4.693 6.982 ( 3.703 0.677 -0.425) 3.788 7.053 ( 2.476 -3.374 1.585) 4.475 7.219 ( 8.904 -1.657 -7.273) 11.616 7.300 ( -3.445 1.595 -6.362) 7.408 7.453 ( -6.974 -0.560 5.259) 8.753 7.603 ( -2.890 -0.743 2.697) 4.023 7.836 ( -1.842 0.753 2.923) 3.536 8.071 ( 3.846 -0.381 2.097) 4.397 8.326 ( 13.573 -0.589 -0.108) 13.586 8.490 ( 1.953 1.142 2.703) 3.525 8.617 ( 5.543 0.052 -2.347) 6.019 9.330 ( 2.635 0.336 -0.050) 2.657 9.377 ( 5.287 -0.991 1.207) 5.512 9.950 ( -9.609 10.565 -2.246) 14.456 10.190 ( -0.643 14.639 0.638) 14.667 10.464 ( -3.625 1.621 -3.541) 5.321 10.664 ( 8.367 -4.798 7.649) 12.310 11.010 ( 0.444 -0.894 -4.592) 4.699 11.133 ( 2.267 -5.071 0.444) 5.573 11.605 ( 0.519 2.757 -8.515) 8.965 11.750 ( 10.009 -2.387 8.948) 13.636 11.969 ( 0.087 0.402 2.220) 2.258 12.163 ( 0.055 0.316 -0.955) 1.007 12.478 ( 3.520 -0.311 7.330) 8.137 12.728 ( 1.834 0.948 -3.742) 4.274 12.802 ( -6.185 2.561 -8.244) 10.620 12.902 ( -5.590 -5.348 -11.415) 13.790 13.063 ( -6.099 -2.391 7.675) 10.091 13.256 ( -10.001 -2.496 3.696) 10.951 13.839 ( -9.555 5.439 2.001) 11.175 13.966 ( 10.951 -0.409 6.377) 12.679 14.266 ( -4.736 -2.677 -7.270) 9.080 14.901 ( 6.447 0.114 0.991) 6.523 15.321 ( 1.639 1.796 -1.982) 3.137 15.366 ( -2.915 -1.603 1.516) 3.656 ======================= Grid point 187 (83/141) ======================= q-point: (-0.10 -0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.453 ( -13.762 0.052 1.749) 13.873 1.674 ( -13.981 -6.642 -2.100) 15.620 1.749 ( -5.145 5.069 1.873) 7.461 2.085 ( -3.230 -5.051 -2.485) 6.490 2.309 ( -0.377 0.624 -0.086) 0.734 2.414 ( -1.629 -3.183 -2.047) 4.120 2.672 ( -8.856 -4.478 -1.614) 10.055 2.720 ( -15.945 -5.869 2.372) 17.156 3.133 ( 2.773 3.296 -0.982) 4.418 3.167 ( 0.853 -0.442 0.498) 1.082 3.476 ( -0.912 1.751 0.533) 2.045 3.607 ( 6.204 -1.643 0.502) 6.437 3.744 ( 0.320 1.131 -0.293) 1.212 3.838 ( 5.812 2.110 -1.159) 6.290 3.877 ( 3.869 1.425 -0.216) 4.128 4.069 ( 2.178 -3.704 0.881) 4.386 4.201 ( 4.654 2.648 0.525) 5.380 4.300 ( -1.413 0.050 0.944) 1.700 4.474 ( 8.834 4.136 0.720) 9.781 4.567 ( -8.314 -3.256 -0.196) 8.931 4.640 ( 8.842 -4.182 -0.087) 9.781 4.870 ( -0.105 -2.542 -3.726) 4.511 5.173 ( -1.013 6.777 3.262) 7.589 5.442 ( 2.690 -3.863 1.706) 5.007 5.689 ( 0.524 4.959 -0.013) 4.987 5.850 ( 0.443 -0.621 -1.781) 1.938 5.976 ( 3.178 -0.205 0.098) 3.186 6.031 ( 0.863 -2.479 -2.413) 3.565 6.104 ( -0.611 1.616 -0.203) 1.740 6.243 ( -1.987 -3.446 -1.829) 4.378 6.278 ( 5.749 -2.361 5.515) 8.309 6.339 ( -2.412 -3.056 0.545) 3.931 6.569 ( 0.561 -3.598 -0.116) 3.643 6.694 ( -0.488 -0.655 1.772) 1.951 6.727 ( 1.885 -3.844 2.428) 4.922 6.796 ( 2.481 -1.036 -3.487) 4.404 6.938 ( 2.773 -5.598 0.206) 6.251 7.024 ( 4.737 1.315 -1.062) 5.030 7.138 ( -1.319 -3.587 -1.105) 3.978 7.184 ( 0.387 2.786 1.638) 3.255 7.327 ( -8.632 -1.804 3.050) 9.331 7.395 ( 10.096 -0.791 -12.463) 16.059 7.595 ( -1.991 -4.162 4.856) 6.698 7.815 ( -1.154 -0.393 2.097) 2.425 8.144 ( 5.781 3.527 1.797) 7.006 8.469 ( -0.262 5.801 1.155) 5.921 8.593 ( 13.386 -2.966 -0.284) 13.714 8.752 ( 9.084 -2.399 1.571) 9.526 9.231 ( -10.345 11.261 -1.942) 15.415 9.421 ( 0.697 1.731 0.288) 1.888 9.785 ( 1.614 9.558 4.266) 10.591 9.969 ( -2.553 17.139 -4.781) 17.975 10.334 ( -8.539 2.049 -1.136) 8.855 10.783 ( 2.258 2.127 1.199) 3.326 11.060 ( 3.022 -0.815 0.132) 3.133 11.237 ( 2.332 -7.375 6.358) 10.013 11.510 ( -4.106 2.699 -13.925) 14.767 11.891 ( 1.955 -1.123 4.462) 4.999 12.026 ( 3.890 -1.532 1.584) 4.471 12.183 ( 5.148 3.850 1.697) 6.649 12.509 ( -0.579 2.708 4.836) 5.572 12.660 ( -3.106 3.083 -4.075) 5.980 12.783 ( -0.663 -5.470 0.832) 5.573 12.877 ( -0.941 -7.991 -7.321) 10.878 13.007 ( -6.218 -3.158 5.731) 9.027 13.167 ( -4.584 -6.586 -2.617) 8.441 13.611 ( -11.375 3.255 2.071) 12.012 14.116 ( -8.693 -4.035 3.562) 10.225 14.227 ( 12.602 3.389 -4.607) 13.840 14.991 ( 4.004 0.358 1.171) 4.187 15.271 ( -3.608 -0.607 1.038) 3.803 15.399 ( 3.419 0.862 -2.505) 4.325 ======================= Grid point 196 (84/141) ======================= q-point: (-0.20 -0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 141 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.484 ( -16.568 0.000 -0.572) 16.578 1.569 ( -17.080 0.000 -2.010) 17.198 1.902 ( 1.433 -0.000 -0.119) 1.438 1.926 ( -10.764 0.000 1.610) 10.883 2.335 ( -2.131 0.000 -6.854) 7.178 2.368 ( -0.248 0.000 3.180) 3.190 2.631 ( -8.736 0.000 -1.445) 8.855 2.657 ( -18.703 0.000 3.324) 18.996 3.144 ( 4.593 -0.000 -0.414) 4.612 3.193 ( 2.308 -0.000 -0.813) 2.447 3.497 ( -2.221 0.000 -1.333) 2.590 3.593 ( 4.546 -0.000 5.269) 6.959 3.730 ( 5.484 -0.000 -1.377) 5.655 3.850 ( 4.810 -0.000 -3.963) 6.233 3.963 ( 0.587 -0.000 2.945) 3.003 3.985 ( 5.027 -0.000 -0.505) 5.052 4.229 ( 5.269 -0.000 2.072) 5.662 4.292 ( -2.152 0.000 -0.513) 2.212 4.535 ( -5.903 0.000 -1.409) 6.069 4.546 ( 8.847 -0.000 -1.809) 9.031 4.565 ( 6.851 -0.000 3.026) 7.489 4.844 ( 0.025 -0.000 -2.953) 2.953 5.302 ( -2.023 0.000 4.363) 4.809 5.331 ( 1.914 -0.000 -1.562) 2.471 5.787 ( -1.213 0.000 -2.274) 2.577 5.814 ( 2.948 -0.000 2.079) 3.607 5.986 ( -0.212 0.000 1.589) 1.603 5.987 ( 5.150 -0.000 -5.174) 7.300 6.128 ( 0.861 -0.000 0.750) 1.142 6.204 ( -3.728 0.000 0.009) 3.728 6.259 ( 5.884 -0.000 3.770) 6.988 6.289 ( -3.754 0.000 -0.299) 3.766 6.495 ( 2.107 -0.000 2.350) 3.156 6.681 ( 2.022 -0.000 3.457) 4.005 6.697 ( -0.669 0.000 -0.299) 0.733 6.842 ( 0.872 -0.000 -3.891) 3.987 6.848 ( 2.569 -0.000 0.172) 2.575 7.059 ( 2.750 -0.000 -0.571) 2.808 7.072 ( 2.977 -0.000 0.654) 3.048 7.216 ( -1.146 0.000 -2.026) 2.327 7.311 ( -10.097 0.000 4.467) 11.041 7.383 ( 11.224 -0.000 -12.363) 16.698 7.559 ( -2.424 0.000 3.098) 3.934 7.815 ( -2.247 0.000 3.371) 4.051 8.179 ( 8.516 -0.000 2.285) 8.817 8.533 ( 1.456 -0.000 2.906) 3.250 8.563 ( 13.830 -0.000 -0.973) 13.865 8.729 ( 8.192 -0.000 -0.043) 8.193 9.377 ( 2.730 -0.000 -0.349) 2.752 9.391 ( -6.458 0.000 -1.487) 6.627 9.847 ( -3.261 0.000 0.120) 3.264 10.266 ( -2.108 0.000 0.162) 2.114 10.338 ( -9.741 0.000 -3.144) 10.236 10.843 ( 9.641 -0.000 15.517) 18.268 10.973 ( -0.588 0.000 -5.001) 5.035 11.154 ( 2.518 -0.000 -5.182) 5.761 11.554 ( -4.902 0.000 -10.767) 11.830 11.880 ( 2.989 -0.000 5.479) 6.241 12.007 ( 3.733 -0.000 2.636) 4.570 12.228 ( 6.380 -0.000 0.530) 6.402 12.539 ( 0.632 -0.000 7.908) 7.933 12.671 ( -6.263 0.000 -5.096) 8.074 12.753 ( -0.262 0.000 -1.494) 1.517 12.779 ( -2.252 0.000 -9.323) 9.591 12.977 ( -4.250 0.000 6.996) 8.186 13.087 ( -8.081 0.000 -0.371) 8.090 13.654 ( -12.969 0.000 0.421) 12.976 14.070 ( -8.952 0.000 2.985) 9.436 14.261 ( 13.897 -0.000 -3.554) 14.344 14.994 ( 3.950 -0.000 0.903) 4.052 15.265 ( -5.351 0.000 1.978) 5.705 15.405 ( 5.141 -0.000 -3.280) 6.098 ======================= Grid point 197 (85/141) ======================= q-point: (-0.10 -0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.178 ( -18.689 -0.471 5.544) 19.500 1.285 ( -20.453 -8.576 -0.650) 22.187 1.697 ( -9.802 5.064 -0.897) 11.069 1.970 ( -1.292 -8.485 -4.062) 9.496 2.220 ( -23.743 -5.562 -0.855) 24.401 2.323 ( -8.830 0.640 -2.554) 9.214 2.399 ( -1.771 -0.642 3.157) 3.676 2.452 ( -8.947 -1.882 2.315) 9.431 3.118 ( -6.998 2.455 -0.560) 7.437 3.163 ( -3.049 1.152 -1.240) 3.487 3.470 ( -0.330 -0.177 -0.213) 0.431 3.665 ( 1.443 -1.781 3.287) 4.007 3.803 ( 4.807 2.100 -0.209) 5.250 3.959 ( 8.459 -0.429 -3.885) 9.318 4.006 ( 4.485 3.007 -1.229) 5.538 4.109 ( 6.291 -3.323 -0.595) 7.139 4.264 ( 0.827 0.707 4.014) 4.159 4.316 ( 4.084 0.334 -1.506) 4.365 4.517 ( 5.994 1.041 -0.430) 6.099 4.665 ( 7.324 1.211 -3.421) 8.174 4.764 ( 9.876 -1.537 0.794) 10.027 4.877 ( 4.510 -1.414 0.345) 4.739 5.229 ( -1.689 6.511 3.198) 7.448 5.420 ( 1.792 -7.450 1.239) 7.762 5.715 ( -3.551 2.232 -3.738) 5.618 5.852 ( 0.967 1.213 0.455) 1.617 6.009 ( 2.002 -0.380 -0.810) 2.193 6.035 ( 0.724 0.786 -2.466) 2.688 6.116 ( -0.664 3.184 0.380) 3.274 6.171 ( -1.735 -3.244 0.200) 3.684 6.237 ( -4.521 -5.008 1.310) 6.873 6.392 ( 6.267 -1.778 3.879) 7.582 6.577 ( 3.130 -2.719 1.538) 4.422 6.677 ( -1.500 -0.439 1.315) 2.042 6.724 ( 0.371 -2.080 1.751) 2.744 6.801 ( -2.480 1.246 -4.272) 5.094 6.921 ( 2.526 -3.887 0.248) 4.642 7.080 ( -2.464 -0.027 0.983) 2.653 7.099 ( -2.675 -2.803 2.846) 4.808 7.220 ( 5.712 3.008 1.123) 6.552 7.287 ( 6.443 -1.413 -0.427) 6.610 7.495 ( 3.299 -4.110 -2.925) 6.028 7.576 ( 5.728 1.037 -7.912) 9.823 7.790 ( -1.675 -1.291 3.017) 3.685 8.358 ( 13.152 4.942 2.594) 14.287 8.534 ( 0.939 6.724 0.983) 6.860 8.755 ( 4.327 -3.354 1.335) 5.635 8.899 ( 10.326 -2.192 1.357) 10.643 9.097 ( -15.167 9.240 -0.880) 17.782 9.440 ( 2.381 -0.969 -0.404) 2.602 9.919 ( 9.099 0.354 3.308) 9.688 10.056 ( -6.907 13.904 -3.405) 15.894 10.208 ( -6.914 3.372 -1.337) 7.808 10.861 ( 0.667 10.180 -2.964) 10.624 11.096 ( 1.315 -0.758 2.477) 2.905 11.210 ( 4.489 -13.370 0.614) 14.117 11.377 ( -9.877 2.397 -13.274) 16.719 11.892 ( -2.177 0.354 2.580) 3.394 12.101 ( 5.494 -0.226 1.953) 5.836 12.320 ( 4.006 1.525 1.927) 4.700 12.540 ( -0.860 2.198 5.192) 5.704 12.593 ( -2.238 -1.380 -2.749) 3.804 12.722 ( -3.352 -1.482 5.366) 6.498 12.746 ( -4.468 -5.509 -0.485) 7.110 12.936 ( -1.838 0.341 1.168) 2.204 13.045 ( -0.279 -7.704 -4.464) 8.909 13.448 ( -10.448 0.883 3.422) 11.029 13.870 ( -13.765 -2.051 -5.159) 14.843 14.501 ( 13.646 2.002 2.708) 14.055 15.042 ( 1.621 0.075 0.695) 1.765 15.199 ( -3.418 -1.184 1.399) 3.879 15.469 ( 3.792 1.385 -5.533) 6.850 ======================= Grid point 207 (86/141) ======================= q-point: (-0.10 -0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.853 ( -23.409 0.000 1.455) 23.454 0.882 ( -18.617 0.000 14.902) 23.847 1.510 ( -15.315 0.000 -1.644) 15.402 1.603 ( -37.337 0.000 3.520) 37.503 1.792 ( -13.894 0.000 -6.994) 15.554 2.273 ( -2.995 0.000 1.754) 3.471 2.279 ( -0.506 0.000 -7.312) 7.329 2.501 ( 4.990 -0.000 4.647) 6.818 2.972 ( -11.363 0.000 -2.326) 11.599 3.076 ( -5.870 0.000 -0.637) 5.904 3.460 ( -0.828 0.000 0.865) 1.198 3.658 ( -1.272 0.000 2.172) 2.517 3.922 ( 5.117 -0.000 3.097) 5.982 3.996 ( -0.945 0.000 -4.328) 4.430 4.092 ( 8.756 -0.000 -2.360) 9.069 4.220 ( 6.940 -0.000 -2.692) 7.444 4.360 ( 6.242 -0.000 3.131) 6.983 4.425 ( 8.185 -0.000 -5.202) 9.699 4.658 ( 7.891 -0.000 0.184) 7.893 4.726 ( 3.278 -0.000 -3.881) 5.080 4.945 ( 8.652 -0.000 3.589) 9.366 4.966 ( 5.062 -0.000 3.107) 5.940 5.250 ( -0.284 0.000 -0.567) 0.634 5.388 ( -0.832 0.000 0.608) 1.030 5.639 ( -3.207 0.000 -5.562) 6.420 5.854 ( -4.072 0.000 2.933) 5.018 5.997 ( -5.145 0.000 1.282) 5.302 6.057 ( 3.820 -0.000 0.086) 3.821 6.117 ( -1.853 0.000 -1.057) 2.133 6.137 ( -0.975 0.000 2.739) 2.907 6.176 ( 1.793 -0.000 -2.558) 3.124 6.461 ( 2.482 -0.000 1.100) 2.715 6.620 ( 2.736 -0.000 -2.337) 3.599 6.636 ( -2.199 0.000 2.838) 3.590 6.693 ( -3.830 0.000 1.570) 4.139 6.739 ( -2.149 0.000 -3.826) 4.388 6.950 ( -4.073 0.000 -0.635) 4.122 6.966 ( -0.342 0.000 4.645) 4.658 7.106 ( 1.034 -0.000 3.252) 3.412 7.326 ( -1.556 0.000 5.456) 5.674 7.415 ( 8.182 -0.000 1.073) 8.252 7.537 ( 7.274 -0.000 -1.017) 7.345 7.677 ( 7.806 -0.000 -16.567) 18.314 7.765 ( -0.550 0.000 4.703) 4.735 8.433 ( -27.652 0.000 7.429) 28.633 8.657 ( 15.062 -0.000 2.459) 15.261 8.679 ( 4.087 -0.000 0.816) 4.168 9.070 ( 3.968 -0.000 0.405) 3.989 9.079 ( 12.590 -0.000 -2.226) 12.785 9.479 ( 0.485 -0.000 1.669) 1.738 9.922 ( -9.796 0.000 -5.399) 11.185 10.182 ( 18.520 -0.000 1.443) 18.577 10.192 ( 1.448 -0.000 -3.893) 4.154 10.946 ( -14.698 0.000 -44.405) 46.774 10.974 ( 2.216 -0.000 -2.847) 3.608 11.153 ( -4.264 0.000 8.104) 9.157 11.252 ( 0.568 -0.000 10.409) 10.425 11.828 ( -7.085 0.000 2.067) 7.380 12.193 ( 3.989 -0.000 0.282) 3.999 12.301 ( -4.498 0.000 0.176) 4.502 12.514 ( -6.894 0.000 0.325) 6.902 12.537 ( -2.725 0.000 -0.047) 2.726 12.735 ( 3.715 -0.000 15.799) 16.230 12.735 ( 5.868 -0.000 1.883) 6.163 12.925 ( -1.239 0.000 0.499) 1.336 12.992 ( 1.952 -0.000 -3.694) 4.178 13.318 ( -6.536 0.000 8.360) 10.611 13.605 ( -13.731 0.000 -6.266) 15.093 14.711 ( 8.708 -0.000 2.301) 9.007 15.060 ( 0.470 -0.000 0.466) 0.662 15.155 ( -1.365 0.000 1.048) 1.721 15.485 ( -1.098 0.000 -13.006) 13.053 ======================= Grid point 208 (87/141) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 141 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.709 ( 5.088 -0.000 18.003) 18.708 0.794 ( 0.355 -0.000 19.633) 19.637 1.004 ( -4.076 0.000 -13.580) 14.178 1.116 ( 0.585 -0.000 -15.277) 15.288 1.446 ( 2.516 -0.000 33.812) 33.905 1.975 ( -1.968 0.000 -23.242) 23.326 2.409 ( 13.958 -0.000 0.649) 13.974 2.444 ( -13.769 0.000 -3.587) 14.229 2.793 ( 5.242 -0.000 4.433) 6.865 2.868 ( -2.921 0.000 -3.530) 4.582 3.497 ( 1.897 -0.000 3.438) 3.927 3.557 ( -2.805 0.000 -2.977) 4.090 4.119 ( 12.241 -0.000 1.147) 12.295 4.153 ( -6.263 0.000 -2.355) 6.691 4.241 ( -10.561 0.000 6.428) 12.363 4.281 ( 1.815 -0.000 5.055) 5.371 4.341 ( 8.406 -0.000 -4.295) 9.440 4.407 ( -0.526 0.000 -8.814) 8.830 4.812 ( 0.887 -0.000 0.194) 0.908 4.812 ( -0.951 0.000 0.179) 0.968 5.026 ( -3.541 0.000 2.412) 4.285 5.069 ( 0.088 -0.000 -0.773) 0.778 5.234 ( 2.723 -0.000 1.375) 3.050 5.305 ( 0.525 -0.000 -4.860) 4.888 5.677 ( -9.237 0.000 1.969) 9.445 5.681 ( 9.079 -0.000 1.233) 9.162 5.953 ( 1.323 -0.000 2.231) 2.594 6.007 ( -1.254 0.000 -2.967) 3.221 6.150 ( -0.331 0.000 1.536) 1.572 6.187 ( 0.791 -0.000 -2.209) 2.346 6.224 ( 2.065 -0.000 4.360) 4.825 6.323 ( -2.643 0.000 -6.457) 6.977 6.566 ( -0.244 0.000 1.155) 1.181 6.584 ( 0.891 -0.000 -0.851) 1.232 6.740 ( 0.443 -0.000 3.022) 3.054 6.781 ( -0.041 0.000 -0.751) 0.752 6.960 ( 8.576 -0.000 2.129) 8.836 7.008 ( -5.611 0.000 -2.476) 6.133 7.104 ( 4.214 -0.000 3.667) 5.586 7.174 ( -15.935 0.000 -3.940) 16.415 7.615 ( -3.287 0.000 17.642) 17.945 7.699 ( -4.261 0.000 0.087) 4.262 7.731 ( -6.963 0.000 1.303) 7.084 7.906 ( 36.378 -0.000 -6.814) 37.011 7.919 ( -6.507 0.000 5.336) 8.415 8.104 ( -8.462 0.000 -17.313) 19.270 8.955 ( 2.042 -0.000 3.501) 4.052 9.025 ( -0.491 0.000 -4.048) 4.078 9.203 ( -3.871 0.000 5.313) 6.573 9.302 ( 4.652 -0.000 -4.947) 6.791 9.516 ( -9.468 0.000 9.138) 13.158 9.662 ( 6.665 -0.000 -6.580) 9.366 10.808 ( -2.687 0.000 0.615) 2.756 10.832 ( 7.914 -0.000 -2.042) 8.173 11.049 ( -6.044 0.000 3.227) 6.852 11.062 ( -3.112 0.000 1.497) 3.453 11.264 ( 9.789 -0.000 -0.311) 9.794 11.312 ( -5.256 0.000 -5.251) 7.429 12.205 ( -3.758 0.000 0.196) 3.763 12.213 ( 4.082 -0.000 -0.843) 4.168 12.453 ( 6.029 -0.000 4.804) 7.709 12.504 ( -7.182 0.000 -0.537) 7.202 12.860 ( 5.048 -0.000 3.536) 6.164 12.901 ( -4.039 0.000 -0.995) 4.160 13.001 ( -1.533 0.000 -2.575) 2.997 13.004 ( 1.504 -0.000 -2.709) 3.099 13.367 ( -19.901 0.000 0.727) 19.914 13.368 ( 13.038 -0.000 0.543) 13.050 14.825 ( -2.550 0.000 -0.109) 2.553 14.828 ( 5.080 -0.000 -0.445) 5.099 15.105 ( 2.006 -0.000 1.544) 2.531 15.127 ( -1.469 0.000 -0.822) 1.684 ======================= Grid point 209 (88/141) ======================= q-point: ( 0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.924 ( 13.927 -0.939 13.717) 19.570 1.060 ( 5.660 -15.781 -8.143) 18.638 1.171 ( 16.448 -13.283 11.440) 24.038 1.309 ( 22.130 -4.859 -13.496) 26.372 1.669 ( 12.355 -5.215 25.691) 28.981 1.887 ( -0.113 -1.396 -22.073) 22.118 2.228 ( -8.756 -0.328 -3.393) 9.396 2.556 ( 4.529 2.396 3.347) 6.120 2.842 ( 3.516 2.797 -3.246) 5.543 2.917 ( 6.740 -1.397 0.512) 6.902 3.516 ( -1.141 0.105 -1.853) 2.179 3.575 ( 3.536 -3.052 3.282) 5.709 4.053 ( -2.681 0.708 -3.479) 4.449 4.080 ( -8.444 -0.214 5.352) 9.999 4.191 ( -0.920 6.916 -3.612) 7.857 4.282 ( -3.703 -0.832 3.831) 5.393 4.352 ( -4.397 -3.670 -5.397) 7.869 4.458 ( 3.636 1.737 -4.417) 5.979 4.725 ( -5.594 4.343 -0.903) 7.139 4.753 ( -4.461 3.600 1.161) 5.849 4.993 ( -2.996 1.676 4.257) 5.468 5.108 ( -1.791 -6.016 1.497) 6.453 5.251 ( 0.606 5.216 -1.571) 5.481 5.375 ( 6.484 -7.355 -4.396) 10.746 5.558 ( -4.315 -0.313 -0.448) 4.349 5.808 ( 6.720 4.937 2.580) 8.729 5.986 ( 1.221 -0.094 3.270) 3.492 6.019 ( 1.389 -1.895 -3.830) 4.493 6.131 ( -1.861 -0.340 1.282) 2.285 6.209 ( 2.362 0.366 -0.896) 2.552 6.265 ( -2.737 -1.967 -5.446) 6.405 6.280 ( 1.610 -3.290 3.209) 4.870 6.537 ( -1.792 2.337 2.655) 3.965 6.615 ( 0.636 -4.196 -2.326) 4.839 6.787 ( 2.274 0.212 -1.610) 2.795 6.820 ( 4.707 -1.966 1.001) 5.199 6.933 ( -1.511 0.246 -4.316) 4.580 7.036 ( 0.561 -1.029 1.164) 1.652 7.113 ( 4.144 -3.366 1.174) 5.466 7.161 ( -2.833 -1.282 11.306) 11.726 7.393 ( -1.941 12.577 2.416) 12.953 7.627 ( -7.090 -0.341 -2.364) 7.481 7.706 ( -5.692 -8.058 -0.830) 9.900 8.032 ( 2.915 1.211 -4.160) 5.222 8.310 ( 22.779 -16.234 18.831) 33.720 8.576 ( 20.851 5.446 -18.276) 28.256 8.883 ( -11.082 2.422 -0.807) 11.372 8.991 ( 1.404 -12.407 -8.392) 15.044 9.113 ( 0.242 7.397 2.686) 7.873 9.291 ( -5.346 -1.103 -3.503) 6.486 9.577 ( 10.461 -10.952 3.230) 15.486 9.805 ( 11.399 1.771 -4.061) 12.229 10.448 ( -22.996 14.733 -3.970) 27.597 10.511 ( -23.163 7.845 1.145) 24.482 10.905 ( 2.529 4.728 1.871) 5.679 11.127 ( 6.315 0.698 0.013) 6.353 11.428 ( 8.381 -3.602 0.730) 9.152 11.664 ( 13.185 -8.522 -2.993) 15.982 12.188 ( -1.259 -4.385 -0.523) 4.592 12.308 ( 3.548 -2.792 1.634) 4.801 12.397 ( -2.977 -1.487 -2.709) 4.291 12.593 ( 7.495 -1.695 6.085) 9.802 12.777 ( -5.345 2.600 -1.691) 6.179 12.890 ( -2.325 8.941 2.387) 9.542 12.971 ( -1.098 -1.541 -3.740) 4.191 13.088 ( 8.007 -3.494 5.075) 10.103 13.206 ( -4.838 -10.473 2.582) 11.822 13.612 ( 10.638 -1.238 1.272) 10.785 14.803 ( 0.814 -0.183 3.237) 3.343 14.907 ( 2.045 -0.153 -5.520) 5.888 15.108 ( -0.550 -0.417 -1.045) 1.252 15.175 ( 4.334 -1.742 -1.488) 4.902 ======================= Grid point 210 (89/141) ======================= q-point: ( 0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.227 ( 13.614 -4.925 7.347) 16.235 1.328 ( 10.552 -11.724 -4.501) 16.403 1.514 ( 8.160 -6.790 14.441) 17.923 1.657 ( 11.955 -3.120 -15.614) 19.911 1.995 ( 12.107 -11.192 -5.387) 17.345 2.119 ( 20.933 -11.567 7.018) 24.925 2.176 ( 5.068 -3.883 -2.917) 7.019 2.571 ( -0.571 1.805 2.644) 3.252 2.906 ( 8.169 3.294 -0.694) 8.835 3.035 ( 5.566 0.430 -0.968) 5.666 3.492 ( -0.853 0.838 -1.014) 1.568 3.667 ( 1.160 -3.335 2.682) 4.434 3.949 ( -7.961 1.738 2.978) 8.676 4.019 ( -1.246 -1.655 -3.729) 4.266 4.065 ( -4.706 2.832 -4.315) 6.984 4.230 ( -5.284 -1.183 -0.299) 5.423 4.259 ( -5.103 1.356 2.330) 5.771 4.443 ( 0.286 1.573 -4.114) 4.414 4.568 ( -7.088 5.753 0.911) 9.175 4.630 ( -5.971 1.479 0.601) 6.181 4.877 ( -8.097 3.797 2.712) 9.345 5.051 ( -10.441 -2.947 1.120) 10.907 5.210 ( 1.789 5.873 0.207) 6.143 5.529 ( 0.370 -4.263 1.765) 4.628 5.597 ( 8.317 -5.713 -6.069) 11.775 5.833 ( 2.602 5.086 2.980) 6.444 5.982 ( -2.488 2.116 1.858) 3.758 6.014 ( -0.356 -0.132 -2.407) 2.437 6.168 ( -0.649 -3.844 -0.466) 3.926 6.209 ( 2.017 -0.058 -2.580) 3.276 6.268 ( 1.713 -1.295 -0.781) 2.285 6.382 ( 4.215 -4.434 1.719) 6.355 6.502 ( -1.579 0.705 5.436) 5.704 6.663 ( 0.069 -5.150 -3.144) 6.034 6.820 ( 3.188 0.589 -2.793) 4.279 6.885 ( -0.025 1.855 0.996) 2.106 6.924 ( 0.730 -1.962 -2.428) 3.206 7.110 ( -2.289 -2.994 7.013) 7.962 7.128 ( 2.863 -3.273 1.722) 4.677 7.177 ( -1.192 -3.249 2.788) 4.444 7.315 ( 0.058 5.544 -1.418) 5.723 7.522 ( -8.928 -6.313 -2.106) 11.135 7.696 ( -3.274 -6.891 -1.198) 7.722 8.007 ( -3.837 -0.899 -5.339) 6.636 8.428 ( -10.548 12.665 3.079) 16.767 8.480 ( -3.538 13.179 -1.823) 13.767 8.968 ( 13.598 14.780 7.204) 21.336 9.025 ( -2.291 -12.398 9.865) 16.009 9.089 ( -6.342 9.074 -2.327) 11.312 9.181 ( -3.744 -6.516 -7.409) 10.554 9.872 ( 0.783 10.108 -1.577) 10.260 10.012 ( 0.674 -0.040 0.120) 0.685 10.043 ( 11.315 -8.122 -6.995) 15.586 10.176 ( -4.870 6.376 -2.241) 8.330 10.930 ( 1.300 -1.160 1.161) 2.094 11.235 ( 7.410 1.542 -1.228) 7.668 11.537 ( 1.167 -2.009 1.721) 2.892 11.824 ( 4.834 0.965 -3.127) 5.838 12.177 ( -2.266 0.361 0.528) 2.354 12.356 ( -0.994 -1.766 2.276) 3.047 12.463 ( 3.042 -6.746 -2.075) 7.686 12.661 ( -2.433 5.379 4.290) 7.298 12.753 ( -2.468 5.217 5.318) 7.848 12.792 ( 4.694 -8.124 -0.132) 9.383 12.990 ( 3.460 -2.530 -6.248) 7.577 13.266 ( -1.376 -10.360 -3.149) 10.915 13.320 ( 10.150 -3.454 9.945) 14.624 13.695 ( 0.656 -0.215 -6.905) 6.939 14.839 ( -0.856 2.798 1.733) 3.401 14.898 ( 0.937 0.736 3.238) 3.451 15.115 ( 0.962 -1.154 -0.731) 1.671 15.249 ( 2.769 -2.913 -3.359) 5.238 ======================= Grid point 211 (90/141) ======================= q-point: ( 0.30 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.499 ( 10.558 -5.317 2.329) 12.049 1.564 ( 8.484 -3.930 -0.226) 9.353 1.696 ( 5.341 -2.263 8.195) 10.040 1.805 ( 5.981 -7.829 -9.687) 13.817 2.166 ( 4.134 -5.495 1.349) 7.008 2.511 ( 6.678 -3.110 -1.466) 7.511 2.550 ( 11.305 -7.989 -0.943) 13.875 2.567 ( 14.112 -7.239 -0.239) 15.862 3.047 ( 8.746 0.939 0.709) 8.825 3.069 ( 2.430 2.472 0.106) 3.468 3.456 ( -1.757 1.966 0.341) 2.659 3.665 ( -3.465 -0.795 0.860) 3.658 3.806 ( -7.038 1.653 -0.564) 7.251 3.961 ( -2.234 3.374 -1.946) 4.491 4.002 ( -4.433 -2.759 -4.773) 7.074 4.119 ( -5.407 2.091 3.239) 6.641 4.204 ( -0.955 1.209 0.173) 1.550 4.377 ( -6.534 6.066 0.950) 8.966 4.479 ( -0.868 -2.711 2.265) 3.638 4.582 ( 1.799 -4.382 -3.997) 6.198 4.714 ( -6.495 1.252 2.139) 6.952 4.876 ( -10.417 0.892 0.771) 10.484 5.171 ( -1.214 4.680 1.937) 5.208 5.564 ( -0.835 -3.005 1.395) 3.417 5.676 ( 0.539 4.506 -1.048) 4.657 5.900 ( 3.221 -4.164 2.075) 5.658 5.935 ( -0.086 1.274 -1.633) 2.073 5.972 ( -3.997 -0.634 -4.153) 5.799 6.145 ( -0.317 -1.060 -0.797) 1.364 6.282 ( 2.740 2.496 -3.100) 4.832 6.293 ( -1.029 -4.708 2.938) 5.644 6.473 ( 1.160 -2.377 5.098) 5.743 6.538 ( 3.579 -2.426 1.459) 4.563 6.688 ( -2.180 -3.975 -2.170) 5.027 6.805 ( -1.627 2.021 1.286) 2.896 6.893 ( -3.562 -0.124 0.546) 3.606 6.901 ( 1.599 0.268 -4.080) 4.390 7.123 ( -1.849 -2.550 0.118) 3.152 7.162 ( -1.802 -1.331 4.430) 4.964 7.232 ( -6.000 -0.070 -0.833) 6.058 7.274 ( 5.222 -3.666 0.359) 6.391 7.435 ( -7.973 -12.054 -3.027) 14.766 7.729 ( -0.373 -5.090 0.702) 5.152 7.921 ( -2.845 1.465 -4.368) 5.414 8.160 ( -6.431 11.390 2.541) 13.324 8.342 ( 1.625 8.821 1.465) 9.088 8.802 ( -12.168 7.658 -1.468) 14.452 8.909 ( 0.089 10.234 2.095) 10.446 9.095 ( -2.435 0.743 -2.447) 3.531 9.213 ( 3.949 2.601 5.272) 7.082 9.668 ( -4.218 7.777 0.808) 8.884 9.895 ( -2.704 12.753 -2.032) 13.194 10.314 ( 11.503 0.289 -4.796) 12.467 10.348 ( 10.607 -10.352 2.365) 15.009 10.965 ( 0.669 -1.624 1.198) 2.126 11.329 ( 6.967 3.085 -3.140) 8.241 11.541 ( -3.052 -1.945 2.800) 4.576 11.851 ( 2.480 3.127 -2.431) 4.674 12.134 ( -2.161 1.507 1.718) 3.145 12.315 ( -4.247 -0.884 -2.768) 5.146 12.475 ( -6.728 3.588 6.308) 9.896 12.619 ( 3.027 0.301 -0.944) 3.185 12.733 ( 0.895 -1.914 4.463) 4.938 12.964 ( 2.381 -10.114 0.494) 10.403 13.099 ( 8.135 -1.489 -6.532) 10.539 13.298 ( -3.751 -7.974 -5.525) 10.401 13.519 ( 6.321 -0.383 8.431) 10.544 13.706 ( 3.517 -3.708 -4.685) 6.933 14.726 ( -5.780 3.522 -7.951) 10.442 14.910 ( -1.041 3.270 10.778) 11.311 15.155 ( 2.024 -1.121 -0.006) 2.314 15.320 ( 2.759 -3.517 -1.814) 4.824 ======================= Grid point 212 (91/141) ======================= q-point: ( 0.40 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.665 ( 3.283 -3.759 2.090) 5.411 1.733 ( 8.414 1.099 2.990) 8.996 1.804 ( 3.919 -1.324 4.520) 6.127 1.927 ( 2.009 -7.234 -10.058) 12.552 2.309 ( 4.988 -3.914 2.256) 6.730 2.473 ( -1.491 0.955 -2.273) 2.881 2.762 ( 4.568 -4.732 -0.765) 6.622 2.856 ( 6.191 -0.976 0.872) 6.328 3.062 ( 3.466 -0.826 -2.870) 4.575 3.194 ( 2.342 -1.454 2.151) 3.497 3.409 ( -0.108 3.120 1.839) 3.624 3.630 ( -0.225 0.994 -2.726) 2.910 3.694 ( -3.096 -0.272 0.240) 3.117 3.886 ( -5.445 3.314 -2.868) 6.990 3.910 ( -2.190 -0.997 -1.433) 2.801 4.026 ( -6.331 0.477 4.038) 7.525 4.205 ( 1.724 2.001 -2.047) 3.342 4.285 ( 1.713 2.390 1.385) 3.250 4.406 ( -6.536 -0.236 1.661) 6.748 4.648 ( -4.865 0.571 1.276) 5.062 4.728 ( 0.389 -4.643 -2.515) 5.295 4.792 ( 6.484 -7.134 0.961) 9.688 5.085 ( -4.838 3.313 2.303) 6.300 5.515 ( -3.740 6.611 1.935) 7.839 5.664 ( 1.368 -2.194 -0.739) 2.689 5.875 ( -5.438 -0.756 -4.188) 6.905 5.911 ( -0.124 0.633 -0.437) 0.779 5.953 ( -0.106 1.294 3.239) 3.490 6.194 ( 1.110 -1.238 -3.403) 3.788 6.264 ( 0.157 -0.071 2.497) 2.503 6.314 ( -1.818 -2.460 1.029) 3.227 6.531 ( 1.372 -1.287 2.961) 3.508 6.602 ( 1.432 0.867 -2.636) 3.123 6.669 ( -1.269 -3.718 1.372) 4.161 6.757 ( -5.388 -1.917 -3.607) 6.761 6.830 ( -1.574 -2.050 4.724) 5.384 6.904 ( 1.103 3.438 -4.522) 5.786 7.094 ( -3.090 -2.244 -1.148) 3.988 7.123 ( -1.753 3.424 -2.207) 4.435 7.179 ( -2.977 -4.392 5.496) 7.639 7.336 ( 1.385 0.118 -1.431) 1.995 7.532 ( 3.043 -11.096 -2.128) 11.700 7.747 ( -2.428 -2.836 2.002) 4.236 7.872 ( -0.139 3.243 -2.398) 4.036 8.017 ( -1.690 6.042 1.288) 6.405 8.354 ( 4.597 3.422 2.965) 6.453 8.597 ( -3.416 3.602 -0.990) 5.062 8.819 ( -3.407 3.375 3.099) 5.709 9.030 ( -0.642 4.382 -1.960) 4.843 9.237 ( 1.286 3.227 2.412) 4.229 9.583 ( -1.515 1.168 1.030) 2.172 9.741 ( -0.960 10.272 -2.919) 10.722 10.409 ( 3.326 0.881 -6.076) 6.982 10.587 ( 7.720 -3.149 4.817) 9.629 10.990 ( 0.170 -1.466 1.455) 2.072 11.387 ( 4.983 3.842 -6.124) 8.780 11.510 ( -3.722 -2.260 5.237) 6.811 11.850 ( 2.334 3.746 0.328) 4.426 12.079 ( -2.821 2.114 1.948) 4.028 12.250 ( -3.249 -1.937 -5.197) 6.427 12.330 ( -6.536 1.981 4.204) 8.020 12.673 ( 2.693 0.162 0.115) 2.700 12.799 ( 2.380 -2.069 3.274) 4.546 13.031 ( -3.513 -5.463 -4.075) 7.668 13.196 ( 3.962 0.002 -4.385) 5.910 13.310 ( -0.256 -4.575 -2.819) 5.380 13.647 ( 7.929 -1.375 5.763) 9.898 13.818 ( 2.281 -3.714 2.678) 5.116 14.559 ( -6.434 3.447 -8.749) 11.394 14.876 ( -1.566 2.556 6.872) 7.497 15.193 ( 1.520 -0.618 -0.733) 1.797 15.389 ( 1.801 -2.390 -0.073) 2.993 ======================= Grid point 213 (92/141) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.721 ( -0.133 0.787 4.421) 4.492 1.774 ( -0.988 3.591 8.446) 9.230 1.891 ( 2.121 0.300 -3.832) 4.390 1.952 ( -1.008 -4.665 -10.476) 11.512 2.373 ( 1.086 0.722 3.966) 4.175 2.458 ( -1.053 -0.514 -3.918) 4.090 2.817 ( 0.709 0.526 0.025) 0.883 2.921 ( 1.611 -0.423 1.219) 2.064 3.053 ( -3.203 -0.092 -1.968) 3.760 3.225 ( 1.626 0.311 -0.396) 1.702 3.418 ( 0.737 -0.610 3.284) 3.420 3.580 ( -1.860 -0.021 -3.960) 4.375 3.737 ( 1.161 1.353 1.328) 2.223 3.780 ( -0.588 0.381 -0.234) 0.738 3.877 ( -2.270 0.652 0.616) 2.441 3.984 ( 1.935 -2.724 -0.582) 3.392 4.193 ( -1.501 1.768 1.374) 2.695 4.311 ( 2.571 -0.110 -0.052) 2.574 4.364 ( -2.272 -0.640 0.746) 2.475 4.564 ( 1.153 0.613 -0.454) 1.382 4.785 ( -0.236 -1.507 -0.075) 1.527 4.945 ( -2.292 2.172 1.230) 3.389 5.011 ( 3.254 -3.817 -1.478) 5.229 5.411 ( -1.230 1.968 3.303) 4.036 5.704 ( 0.940 0.637 -0.492) 1.238 5.804 ( -1.531 -0.473 -2.137) 2.671 5.913 ( 0.749 -1.213 -2.488) 2.868 5.967 ( 2.431 0.784 2.068) 3.286 6.165 ( -1.348 0.705 0.513) 1.605 6.287 ( 0.388 0.709 -0.139) 0.820 6.312 ( 0.017 -1.087 0.870) 1.392 6.531 ( -1.474 2.035 2.149) 3.307 6.583 ( 0.144 0.604 -2.487) 2.563 6.712 ( -1.434 -1.069 1.591) 2.394 6.740 ( 2.103 -2.932 0.374) 3.628 6.831 ( -1.132 0.954 0.170) 1.490 6.878 ( 1.574 0.643 -3.325) 3.734 7.052 ( -1.056 -0.761 1.220) 1.784 7.104 ( -0.782 -0.799 -3.637) 3.805 7.197 ( -0.467 -2.852 4.568) 5.405 7.335 ( 2.763 5.079 -3.224) 6.620 7.622 ( -0.250 2.857 2.445) 3.769 7.746 ( -0.410 -0.051 -1.200) 1.269 7.823 ( -1.652 -1.847 0.488) 2.525 7.981 ( 0.731 -0.775 -0.421) 1.146 8.390 ( -0.381 -1.235 1.706) 2.140 8.585 ( 0.787 1.094 0.634) 1.489 8.773 ( 1.496 0.974 1.548) 2.363 8.995 ( -1.153 -1.379 -0.522) 1.872 9.236 ( 0.054 -1.488 0.219) 1.505 9.585 ( -0.043 -3.463 -0.617) 3.518 9.654 ( -0.392 3.710 -0.834) 3.823 10.401 ( -1.092 1.056 -2.433) 2.868 10.695 ( 1.914 -1.055 0.454) 2.232 11.013 ( 0.731 -1.043 0.695) 1.450 11.374 ( -2.322 -0.649 -4.853) 5.419 11.504 ( 0.800 2.438 6.111) 6.628 11.874 ( 3.018 0.631 -0.945) 3.225 12.037 ( 0.518 1.162 1.302) 1.821 12.185 ( -3.691 1.576 2.100) 4.530 12.298 ( 0.353 -5.089 -3.043) 5.940 12.694 ( 0.062 0.871 0.378) 0.952 12.858 ( 2.210 -0.183 1.919) 2.932 12.977 ( -2.402 0.357 -4.982) 5.542 13.223 ( -0.397 0.839 1.017) 1.377 13.316 ( -0.544 1.311 -1.392) 1.988 13.786 ( -4.602 -0.321 6.746) 8.172 13.873 ( 8.588 -2.697 -2.457) 9.331 14.406 ( -5.445 3.496 -1.601) 6.666 14.883 ( 2.399 -1.322 0.707) 2.829 15.214 ( 0.677 -0.538 -1.798) 1.995 15.416 ( -0.378 -0.159 0.727) 0.835 ======================= Grid point 214 (93/141) ======================= q-point: (-0.40 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.642 ( -6.492 6.280 6.917) 11.376 1.712 ( -5.023 2.351 2.857) 6.238 1.810 ( -6.512 5.382 -1.745) 8.626 1.954 ( -0.144 -2.261 -7.259) 7.604 2.368 ( -3.967 4.029 -2.721) 6.275 2.421 ( 2.242 -0.457 1.829) 2.929 2.759 ( -5.864 5.161 -0.655) 7.839 2.860 ( -8.236 3.260 0.611) 8.879 3.033 ( -1.813 -3.221 0.279) 3.706 3.225 ( -1.120 3.544 -1.251) 3.921 3.436 ( -0.018 -2.470 -0.367) 2.497 3.586 ( 1.048 -4.879 0.449) 5.011 3.703 ( 1.842 1.707 0.399) 2.543 3.835 ( 2.599 -1.604 1.741) 3.515 3.891 ( 4.462 1.397 0.882) 4.758 4.091 ( 5.782 -1.471 -3.032) 6.693 4.163 ( -0.797 -1.714 2.586) 3.203 4.293 ( -2.839 -1.894 0.521) 3.453 4.422 ( 7.795 -1.915 -0.061) 8.027 4.672 ( 6.930 2.828 0.456) 7.499 4.682 ( -6.474 3.324 0.029) 7.277 4.847 ( -1.783 3.970 -3.773) 5.760 5.109 ( 3.641 -2.573 -0.366) 4.474 5.489 ( 3.805 -6.357 4.813) 8.835 5.672 ( -0.386 3.736 -1.432) 4.019 5.824 ( 3.044 0.444 0.149) 3.080 5.934 ( 0.969 -1.076 -2.440) 2.837 6.015 ( 0.770 -3.228 -2.404) 4.098 6.133 ( -1.872 4.294 2.886) 5.502 6.276 ( -0.511 0.985 -0.378) 1.172 6.347 ( 3.355 0.808 -1.013) 3.596 6.495 ( 0.933 3.541 5.472) 6.584 6.580 ( -0.435 0.051 -0.511) 0.673 6.695 ( 0.112 1.020 0.471) 1.128 6.751 ( 0.787 2.446 -3.684) 4.491 6.836 ( 0.301 -1.872 2.862) 3.433 6.927 ( 4.228 -0.060 -4.876) 6.454 7.062 ( -1.175 -2.136 0.582) 2.506 7.109 ( 2.843 -1.681 0.231) 3.311 7.241 ( 2.749 0.257 1.598) 3.190 7.321 ( 3.408 6.291 -3.319) 7.888 7.486 ( -4.956 11.445 3.014) 12.831 7.755 ( 2.234 3.008 1.478) 4.028 7.835 ( -0.730 -2.053 0.992) 2.394 8.041 ( 1.834 -6.481 -1.102) 6.825 8.378 ( -4.933 -4.857 0.570) 6.946 8.596 ( 2.750 -3.759 -0.611) 4.697 8.849 ( 5.042 -1.136 0.028) 5.168 8.997 ( -2.531 -4.111 1.131) 4.958 9.279 ( 0.447 -6.012 -1.597) 6.236 9.617 ( -0.457 -4.154 -2.084) 4.670 9.690 ( 2.661 -8.233 1.774) 8.832 10.341 ( -4.858 1.298 1.284) 5.190 10.681 ( -3.886 -0.683 -4.928) 6.313 11.031 ( 0.682 0.012 -2.105) 2.213 11.315 ( -6.299 -4.207 0.244) 7.578 11.518 ( 3.822 5.563 4.428) 8.073 11.897 ( -0.917 -1.463 -3.742) 4.121 12.082 ( 3.344 0.713 1.414) 3.700 12.169 ( 3.450 -0.812 3.078) 4.694 12.388 ( 3.793 -6.778 -1.620) 7.934 12.660 ( -2.703 1.587 0.957) 3.277 12.880 ( 0.598 1.345 -2.005) 2.487 12.940 ( 1.824 4.571 0.401) 4.938 13.157 ( -4.980 4.032 2.255) 6.793 13.266 ( -0.801 6.055 1.002) 6.189 13.648 ( -9.087 1.223 3.188) 9.708 13.968 ( -1.397 1.280 -11.249) 11.407 14.368 ( 4.014 -0.690 11.342) 12.051 14.969 ( 4.319 -2.811 -2.335) 5.657 15.221 ( 0.256 -1.203 -3.594) 3.799 15.383 ( -2.471 1.829 0.491) 3.113 ======================= Grid point 215 (94/141) ======================= q-point: (-0.30 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.455 ( -10.585 6.127 11.217) 16.595 1.553 ( -9.454 13.141 3.977) 16.670 1.592 ( -10.169 1.330 -2.413) 10.536 1.939 ( -0.291 1.439 -9.371) 9.486 2.239 ( -3.507 4.408 -6.301) 8.452 2.462 ( -13.706 6.667 3.042) 15.542 2.502 ( -7.757 5.873 3.897) 10.481 2.556 ( -12.361 6.470 1.110) 13.996 3.047 ( -5.131 -3.905 -0.003) 6.447 3.106 ( -6.222 0.004 -2.528) 6.716 3.469 ( 1.447 -0.333 -0.880) 1.726 3.668 ( 3.627 -2.161 0.500) 4.252 3.808 ( 8.000 -2.122 -0.158) 8.278 3.915 ( 4.464 -0.764 1.968) 4.938 3.948 ( 2.321 -0.206 0.849) 2.480 4.160 ( 4.768 0.534 -0.933) 4.887 4.211 ( 2.660 -3.236 -0.716) 4.249 4.373 ( 4.722 -2.935 1.606) 5.788 4.482 ( -4.625 3.100 0.795) 5.624 4.584 ( 7.645 -1.382 -2.483) 8.156 4.762 ( 4.723 1.171 -3.304) 5.882 4.888 ( 9.132 -0.668 -0.593) 9.176 5.176 ( -0.052 -3.999 1.573) 4.297 5.582 ( 2.579 3.367 0.164) 4.245 5.651 ( -1.306 -1.166 0.919) 1.977 5.870 ( 1.609 1.592 3.653) 4.298 5.931 ( -3.567 -1.328 -1.554) 4.112 5.991 ( 0.777 -0.146 -4.124) 4.199 6.110 ( 1.152 0.015 2.397) 2.659 6.240 ( -2.818 0.800 1.027) 3.104 6.339 ( -1.577 3.709 -1.127) 4.185 6.516 ( 2.164 4.384 0.905) 4.972 6.565 ( 0.669 1.073 -1.388) 1.877 6.698 ( -0.200 2.055 -3.651) 4.195 6.755 ( 0.952 -2.338 3.984) 4.716 6.828 ( -2.850 1.175 3.474) 4.644 6.968 ( 2.224 0.651 -4.657) 5.202 7.108 ( 4.454 -0.630 1.194) 4.654 7.200 ( 4.320 -0.931 0.878) 4.506 7.243 ( -5.021 4.030 2.175) 6.795 7.306 ( 3.915 3.428 -7.512) 9.138 7.387 ( 8.764 8.388 2.208) 12.331 7.714 ( -0.821 6.871 2.289) 7.288 7.861 ( 2.339 0.809 1.998) 3.180 8.202 ( 7.887 -11.410 -1.789) 13.985 8.353 ( -4.906 -9.162 0.372) 10.399 8.785 ( 10.600 -9.372 0.424) 14.155 8.908 ( -7.423 -10.814 2.550) 13.362 9.015 ( 6.172 5.342 3.331) 8.816 9.335 ( 1.375 -3.651 -5.033) 6.368 9.685 ( 0.671 -11.255 -0.498) 11.286 9.873 ( 6.424 -11.559 -0.162) 13.225 10.199 ( -9.830 4.390 3.407) 11.292 10.538 ( -10.982 -0.260 -13.384) 17.315 11.016 ( -0.569 1.613 -4.010) 4.360 11.251 ( -7.688 -5.605 3.764) 10.232 11.545 ( 5.214 7.511 3.427) 9.764 11.863 ( -2.951 -1.564 -3.009) 4.495 12.130 ( 2.688 0.012 1.359) 3.012 12.297 ( 6.806 -2.614 -0.003) 7.290 12.537 ( 4.768 -7.014 0.249) 8.485 12.582 ( -3.760 2.619 1.693) 4.885 12.837 ( -1.083 3.685 -4.960) 6.273 12.920 ( 0.160 7.804 5.939) 9.808 13.007 ( -7.782 4.041 1.505) 8.897 13.198 ( 1.984 8.867 3.696) 9.809 13.530 ( -4.951 -0.079 4.957) 7.006 13.780 ( -10.698 4.756 -9.892) 15.327 14.557 ( 9.033 -3.667 9.243) 13.434 15.039 ( 2.047 -1.176 -1.829) 2.986 15.223 ( -0.305 -1.035 -5.477) 5.582 15.311 ( -3.350 1.779 -2.352) 4.463 ======================= Grid point 216 (95/141) ======================= q-point: (-0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.184 ( -12.692 17.529 7.119) 22.783 1.291 ( -10.740 5.832 20.784) 24.111 1.392 ( -11.658 0.251 -7.827) 14.044 1.794 ( -10.174 11.728 -8.967) 17.929 1.868 ( -27.873 13.952 3.890) 31.412 2.179 ( -0.185 1.239 -4.110) 4.297 2.235 ( -12.308 4.099 -3.114) 13.341 2.576 ( 3.720 -0.372 2.280) 4.379 2.904 ( -11.103 -2.260 -0.764) 11.356 3.040 ( -5.295 -1.423 -1.391) 5.657 3.480 ( 0.312 0.523 0.346) 0.700 3.706 ( -0.817 1.742 -1.147) 2.240 3.941 ( 6.613 0.207 3.869) 7.664 3.976 ( -1.075 -2.351 2.021) 3.281 4.031 ( 8.505 -0.968 -3.054) 9.088 4.235 ( 6.495 2.656 -0.881) 7.072 4.306 ( 4.053 -3.258 -2.025) 5.580 4.392 ( 1.925 -1.074 1.813) 2.854 4.588 ( 6.312 -5.437 -1.561) 8.476 4.665 ( 4.686 -0.796 -3.138) 5.696 4.912 ( 9.055 -4.485 -0.936) 10.148 5.052 ( 9.769 2.679 0.988) 10.177 5.196 ( -2.795 -4.798 1.778) 5.830 5.520 ( -6.058 8.411 1.837) 10.528 5.576 ( -1.138 2.489 -2.946) 4.021 5.878 ( -2.274 -6.101 -0.967) 6.583 5.929 ( -1.059 -0.876 3.758) 4.001 6.042 ( 3.610 -1.745 -2.780) 4.879 6.129 ( 0.730 1.397 2.864) 3.269 6.175 ( -3.057 1.623 0.728) 3.537 6.251 ( -3.101 3.396 0.858) 4.678 6.472 ( -2.106 2.595 -5.163) 6.150 6.564 ( 2.625 4.075 -1.660) 5.124 6.647 ( -2.843 0.278 -2.464) 3.772 6.765 ( -2.071 1.365 2.711) 3.674 6.804 ( -0.227 -0.512 6.679) 6.702 6.948 ( -2.143 2.629 -1.866) 3.872 7.093 ( -5.157 3.737 2.834) 6.971 7.172 ( 2.943 3.304 0.666) 4.475 7.274 ( 0.051 -6.900 0.820) 6.949 7.369 ( 6.895 -0.050 -13.096) 14.800 7.487 ( 6.172 3.620 2.289) 7.512 7.668 ( 3.669 7.322 1.586) 8.341 7.911 ( 4.445 3.581 4.455) 7.241 8.419 ( -1.540 -10.107 4.700) 11.252 8.474 ( 7.863 -14.656 -1.796) 16.729 8.836 ( -8.035 -1.322 10.903) 13.609 9.054 ( 6.845 -7.508 -0.172) 10.162 9.108 ( 10.781 5.743 1.544) 12.313 9.353 ( -0.243 0.457 -12.380) 12.391 9.845 ( 0.334 -7.799 0.834) 7.851 9.963 ( -11.734 -4.481 0.474) 12.569 10.128 ( 9.138 -8.563 -6.995) 14.344 10.239 ( -11.162 2.524 -14.580) 18.535 10.970 ( -0.858 2.176 -2.860) 3.695 11.180 ( -8.804 -5.953 4.130) 11.402 11.547 ( 3.674 10.248 1.857) 11.044 11.813 ( -4.853 -1.580 -1.864) 5.434 12.174 ( 1.721 -0.762 0.334) 1.911 12.384 ( -0.078 3.232 0.537) 3.278 12.466 ( -2.552 3.386 -3.519) 5.511 12.672 ( 1.580 0.983 2.610) 3.205 12.782 ( -0.592 -3.738 1.702) 4.149 12.833 ( -3.045 4.136 3.249) 6.078 12.881 ( -2.003 1.920 -0.920) 2.923 13.182 ( 3.962 9.831 5.080) 11.754 13.486 ( -8.713 0.868 -4.147) 9.689 13.543 ( -2.207 3.304 5.497) 6.783 14.744 ( 5.949 -3.057 5.365) 8.575 15.057 ( -0.204 -0.606 -2.300) 2.387 15.183 ( -3.557 0.313 -9.265) 9.930 15.216 ( -4.206 2.339 -2.557) 5.450 ======================= Grid point 217 (96/141) ======================= q-point: (-0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.827 ( -8.398 20.740 13.018) 25.887 1.030 ( -23.498 5.653 16.105) 29.043 1.170 ( -10.229 -0.259 -11.811) 15.627 1.389 ( -15.073 8.329 11.123) 20.501 1.423 ( -10.998 11.193 6.809) 17.106 2.072 ( -3.283 -0.259 -17.183) 17.496 2.211 ( 6.547 0.499 -0.891) 6.626 2.622 ( -2.482 -1.484 -3.667) 4.670 2.751 ( -6.074 -0.353 5.318) 8.081 2.948 ( -5.427 -0.537 -2.033) 5.820 3.480 ( 0.099 0.320 1.654) 1.687 3.631 ( -3.444 2.379 -2.317) 4.784 3.976 ( 2.333 0.546 3.909) 4.585 4.102 ( 5.227 -6.151 4.999) 9.494 4.180 ( 8.250 -1.132 -3.517) 9.040 4.286 ( 3.525 6.431 -0.388) 7.344 4.369 ( -1.800 -4.306 -1.353) 4.859 4.428 ( 1.172 1.613 -3.586) 4.103 4.721 ( 4.788 -4.797 -0.738) 6.818 4.769 ( 4.280 -2.493 -0.474) 4.976 5.061 ( 3.654 -1.360 -2.017) 4.390 5.103 ( -1.002 3.724 1.476) 4.129 5.212 ( -0.336 -1.501 2.456) 2.898 5.353 ( -2.934 5.445 -2.322) 6.607 5.561 ( 2.800 -0.320 -0.814) 2.933 5.825 ( -9.139 -2.724 1.472) 9.649 5.935 ( -0.166 -0.921 3.226) 3.359 6.061 ( -1.300 2.394 -3.491) 4.428 6.139 ( 0.436 -2.683 0.957) 2.882 6.172 ( 2.681 1.446 3.817) 4.884 6.194 ( -0.127 2.432 -0.595) 2.507 6.391 ( -2.212 1.746 -7.133) 7.669 6.563 ( 1.074 2.196 1.045) 2.659 6.596 ( -1.547 0.453 -1.821) 2.432 6.743 ( -0.797 0.748 2.757) 2.965 6.823 ( -1.811 -0.311 5.004) 5.331 6.858 ( 0.257 3.150 -0.475) 3.196 7.045 ( 0.342 -0.348 0.439) 0.656 7.123 ( -4.772 1.745 0.122) 5.083 7.361 ( -4.398 -6.862 -5.504) 9.835 7.429 ( 8.611 -4.314 -6.387) 11.557 7.561 ( 2.338 -3.327 5.746) 7.040 7.692 ( 6.178 6.835 0.522) 9.228 7.933 ( 1.864 6.496 5.473) 8.696 8.235 ( -26.810 4.228 15.480) 31.246 8.672 ( -4.965 1.278 -13.100) 14.068 8.863 ( 5.248 3.031 -0.355) 6.070 9.049 ( -9.342 11.892 -16.593) 22.450 9.186 ( 0.645 -8.556 -4.932) 9.896 9.221 ( 3.183 3.656 3.066) 5.736 9.679 ( -5.310 3.340 -6.232) 8.842 9.725 ( -16.702 -0.130 3.080) 16.984 10.404 ( 20.551 -17.385 0.398) 26.921 10.533 ( 23.459 -5.069 -1.408) 24.041 10.950 ( -1.437 -5.129 -2.389) 5.838 11.097 ( -9.022 -6.599 3.098) 11.599 11.446 ( -2.447 14.750 -0.137) 14.952 11.650 ( -13.791 5.479 -1.679) 14.934 12.196 ( 1.807 3.545 -1.355) 4.203 12.281 ( -3.433 2.997 2.905) 5.404 12.401 ( -2.097 0.362 -1.265) 2.475 12.613 ( -2.818 5.840 3.630) 7.432 12.799 ( 0.593 -2.301 -2.997) 3.825 12.872 ( 1.858 -3.143 2.461) 4.403 12.921 ( 2.385 -7.354 1.403) 7.857 13.130 ( 0.056 11.579 -0.158) 11.580 13.289 ( -4.095 1.133 -5.736) 7.138 13.580 ( -1.593 0.475 5.844) 6.075 14.836 ( 1.039 -1.245 2.387) 2.885 14.929 ( -11.329 3.612 -11.355) 16.441 15.091 ( -0.218 0.743 0.652) 1.012 15.161 ( -1.682 1.171 0.568) 2.127 ======================= Grid point 219 (97/141) ======================= q-point: ( 0.10 0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.121 ( 14.239 -0.000 -8.444) 16.554 1.255 ( 17.250 -0.000 10.315) 20.099 1.411 ( 12.527 -0.000 11.716) 17.152 1.625 ( 14.700 -0.000 -17.958) 23.207 1.890 ( 11.416 -0.000 -7.172) 13.482 1.998 ( 21.652 -0.000 14.360) 25.981 2.152 ( 2.894 -0.000 -3.654) 4.661 2.590 ( -0.955 0.000 1.988) 2.205 2.958 ( 7.885 -0.000 -3.188) 8.505 3.028 ( 6.458 -0.000 1.118) 6.554 3.511 ( 0.294 -0.000 -1.684) 1.709 3.625 ( 2.432 -0.000 4.287) 4.928 3.957 ( -7.024 0.000 3.185) 7.713 3.975 ( -5.799 0.000 -3.980) 7.033 4.163 ( -2.683 0.000 -8.106) 8.538 4.165 ( -6.475 0.000 1.123) 6.572 4.271 ( -4.252 0.000 2.145) 4.762 4.473 ( -1.656 0.000 -3.380) 3.764 4.624 ( -7.644 0.000 0.003) 7.644 4.651 ( -9.048 0.000 1.539) 9.178 4.936 ( -7.258 0.000 3.002) 7.855 4.979 ( -9.638 0.000 2.098) 9.864 5.298 ( 2.030 -0.000 -2.976) 3.603 5.451 ( 5.131 -0.000 3.166) 6.029 5.538 ( 4.458 -0.000 -5.986) 7.464 5.940 ( 3.520 -0.000 4.156) 5.446 5.973 ( -3.160 0.000 2.479) 4.016 6.004 ( -2.539 0.000 -3.384) 4.231 6.124 ( 1.875 -0.000 1.585) 2.455 6.194 ( -2.361 0.000 -4.439) 5.028 6.278 ( 5.411 -0.000 -4.029) 6.746 6.306 ( 3.084 -0.000 7.013) 7.661 6.556 ( -1.773 0.000 -3.063) 3.539 6.563 ( -0.312 0.000 4.718) 4.729 6.817 ( 2.620 -0.000 -3.612) 4.462 6.879 ( 3.166 -0.000 -2.003) 3.746 6.937 ( 1.664 -0.000 -2.356) 2.885 7.078 ( -8.370 0.000 10.978) 13.805 7.083 ( 5.818 -0.000 -1.089) 5.919 7.140 ( -1.569 0.000 5.148) 5.381 7.402 ( -8.506 0.000 0.476) 8.519 7.475 ( -10.712 0.000 -2.121) 10.920 7.561 ( 2.691 -0.000 -2.319) 3.553 7.987 ( -3.087 0.000 -6.433) 7.135 8.640 ( -13.001 0.000 2.285) 13.200 8.678 ( -11.548 0.000 0.831) 11.578 8.807 ( 13.226 -0.000 15.968) 20.734 8.995 ( -0.771 0.000 -13.315) 13.337 9.211 ( 7.353 -0.000 -11.504) 13.653 9.231 ( 11.136 -0.000 8.613) 14.078 9.759 ( 16.123 -0.000 -2.206) 16.273 10.027 ( 12.574 -0.000 0.320) 12.578 10.129 ( -16.805 0.000 2.305) 16.963 10.255 ( -9.929 0.000 -2.719) 10.294 10.917 ( -0.334 0.000 -0.299) 0.448 11.229 ( 6.071 -0.000 4.789) 7.732 11.535 ( 4.102 -0.000 -7.677) 8.704 11.844 ( 8.807 -0.000 -0.561) 8.825 12.166 ( 0.682 -0.000 -1.145) 1.333 12.330 ( -0.998 0.000 5.764) 5.849 12.397 ( 3.958 -0.000 -4.237) 5.798 12.666 ( -2.379 0.000 -4.696) 5.264 12.715 ( 2.840 -0.000 7.729) 8.234 12.857 ( -7.010 0.000 4.674) 8.425 12.990 ( 3.223 -0.000 -5.136) 6.063 13.109 ( 2.408 -0.000 -3.256) 4.050 13.291 ( 11.143 -0.000 10.199) 15.106 13.694 ( 0.807 -0.000 -6.232) 6.284 14.881 ( 4.268 -0.000 11.789) 12.537 14.886 ( -2.376 0.000 -7.402) 7.774 15.102 ( 0.472 -0.000 -0.611) 0.771 15.217 ( 2.653 -0.000 -3.644) 4.508 ======================= Grid point 220 (98/141) ======================= q-point: ( 0.20 0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.392 ( 15.366 -4.286 -4.611) 16.606 1.547 ( 14.589 1.825 4.725) 15.443 1.637 ( 8.201 -3.790 8.542) 12.433 1.690 ( 3.563 -3.175 -13.011) 13.859 2.081 ( 6.046 -2.483 1.869) 6.798 2.392 ( 17.451 -4.208 2.924) 18.188 2.407 ( 21.774 -3.585 -2.036) 22.161 2.566 ( -1.273 0.773 -0.453) 1.557 3.071 ( 7.136 1.143 0.134) 7.228 3.113 ( 2.908 1.354 0.117) 3.210 3.493 ( -1.262 1.407 -0.836) 2.066 3.647 ( -2.258 -0.535 3.756) 4.415 3.829 ( -7.215 1.661 -0.901) 7.458 3.906 ( -3.870 -5.529 -2.665) 7.256 4.032 ( -4.870 3.140 -0.900) 5.864 4.140 ( -2.652 -0.570 -2.364) 3.598 4.223 ( -1.089 0.605 2.723) 2.995 4.437 ( -0.577 0.655 -4.505) 4.589 4.477 ( -7.678 1.833 2.337) 8.232 4.518 ( -5.667 -2.145 0.942) 6.132 4.765 ( -9.327 3.234 1.439) 9.976 4.835 ( -10.259 -3.571 1.309) 10.941 5.301 ( 1.619 6.406 0.175) 6.610 5.481 ( -2.434 -4.407 1.606) 5.284 5.680 ( 8.047 -2.640 -6.564) 10.715 5.897 ( -1.197 2.940 3.142) 4.466 5.939 ( -3.882 -1.000 -2.933) 4.967 5.976 ( -1.422 0.831 2.240) 2.781 6.136 ( -0.498 0.718 0.456) 0.985 6.193 ( -0.286 -4.763 1.296) 4.944 6.336 ( 3.928 2.527 -3.325) 5.733 6.424 ( 4.555 -3.442 3.243) 6.566 6.497 ( -1.768 -0.293 -0.765) 1.949 6.598 ( -0.759 -3.565 3.938) 5.366 6.835 ( -4.674 -1.162 1.410) 5.018 6.899 ( -2.022 2.147 -5.523) 6.261 6.913 ( 1.673 1.810 -0.368) 2.492 7.015 ( -2.813 -5.083 3.158) 6.612 7.117 ( -3.031 -3.329 3.399) 5.641 7.189 ( -0.314 -2.318 -1.405) 2.729 7.269 ( -5.404 0.219 1.289) 5.560 7.291 ( -3.979 -1.370 -1.680) 4.531 7.645 ( 3.791 -2.585 -2.165) 5.074 7.926 ( -1.971 -0.209 -4.265) 4.703 8.385 ( -10.065 10.153 2.583) 14.528 8.482 ( -6.537 2.481 2.025) 7.279 8.813 ( -13.057 -1.404 -0.958) 13.167 8.874 ( -9.125 -4.939 2.801) 10.748 9.287 ( 7.053 9.603 -8.600) 14.694 9.380 ( 5.639 6.676 4.521) 9.839 9.865 ( -2.334 10.067 3.031) 10.769 10.039 ( -0.242 -3.688 0.839) 3.790 10.192 ( 10.336 0.450 -3.405) 10.892 10.327 ( 16.551 0.003 6.342) 17.724 10.932 ( 1.054 -1.297 -1.326) 2.134 11.343 ( 4.598 -1.420 5.359) 7.203 11.527 ( -1.421 0.651 -9.376) 9.505 11.918 ( 3.556 3.351 -0.724) 4.939 12.159 ( -1.325 0.705 -0.689) 1.651 12.310 ( -3.960 -0.381 1.858) 4.390 12.455 ( 1.261 -1.903 1.063) 2.518 12.630 ( -1.799 -4.470 -0.808) 4.886 12.714 ( -7.011 3.274 3.112) 8.340 12.829 ( 5.041 -2.605 3.311) 6.570 13.080 ( 8.936 0.137 -5.472) 10.479 13.152 ( -0.083 -6.004 -5.435) 8.099 13.514 ( 10.339 -0.098 10.810) 14.959 13.668 ( 0.449 -0.601 -7.550) 7.587 14.781 ( -5.707 1.751 -9.931) 11.587 14.947 ( -1.142 0.768 12.232) 12.310 15.131 ( 2.126 -0.977 1.564) 2.814 15.263 ( 3.205 -1.825 -2.745) 4.598 ======================= Grid point 221 (99/141) ======================= q-point: ( 0.30 0.10 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.623 ( 8.434 -0.470 -0.807) 8.486 1.744 ( 11.174 0.729 0.266) 11.200 1.778 ( 6.506 -6.758 -10.710) 14.238 1.827 ( 6.471 1.349 9.578) 11.638 2.222 ( 6.559 -3.979 1.215) 7.767 2.511 ( -1.744 2.289 -2.950) 4.121 2.639 ( 5.845 -6.513 -0.124) 8.752 2.782 ( 14.034 -4.872 -0.070) 14.856 3.089 ( -1.716 2.921 0.119) 3.390 3.162 ( 1.160 -1.340 0.732) 1.917 3.445 ( -3.039 0.418 1.318) 3.338 3.626 ( 0.772 -0.006 0.884) 1.174 3.700 ( -5.418 1.504 -0.601) 5.655 3.873 ( -5.992 -3.243 -1.922) 7.079 3.954 ( -0.705 1.663 -2.294) 2.919 4.053 ( -4.984 2.470 1.827) 5.855 4.243 ( 2.563 1.976 -1.130) 3.428 4.319 ( -3.126 0.568 0.786) 3.273 4.401 ( -6.301 0.165 3.185) 7.062 4.557 ( -3.391 -7.060 -0.603) 7.855 4.671 ( 4.134 0.111 -1.379) 4.360 4.731 ( -2.610 -2.033 1.495) 3.631 5.212 ( -2.848 8.472 1.299) 9.032 5.518 ( 0.784 -5.452 -0.345) 5.519 5.704 ( -1.832 3.798 -0.704) 4.275 5.854 ( -3.982 -0.473 -4.422) 5.969 5.921 ( -3.372 1.253 2.112) 4.172 5.962 ( 4.260 -0.833 2.690) 5.107 6.158 ( 3.157 -1.766 -2.405) 4.344 6.235 ( -0.943 -3.831 3.455) 5.244 6.312 ( -1.624 3.270 -2.050) 4.187 6.486 ( 1.320 -2.496 0.160) 2.828 6.560 ( 2.231 -6.472 -1.707) 7.055 6.629 ( -0.020 -0.747 3.227) 3.312 6.710 ( -7.269 -0.882 1.445) 7.464 6.790 ( -6.923 -1.549 0.454) 7.109 6.948 ( 0.429 -1.973 -2.502) 3.215 7.015 ( -2.742 0.395 -0.855) 2.900 7.105 ( -5.705 -5.165 -1.280) 7.802 7.132 ( -1.245 -3.107 2.131) 3.968 7.240 ( 1.127 -5.412 -1.161) 5.649 7.414 ( 9.064 -0.156 -0.442) 9.076 7.705 ( 1.206 -1.674 -0.666) 2.168 7.901 ( -0.214 0.363 -1.785) 1.834 8.167 ( -5.504 8.545 1.837) 10.329 8.397 ( -3.953 -0.108 2.989) 4.957 8.603 ( -10.875 0.709 -0.764) 10.925 8.749 ( -9.860 -4.977 1.919) 11.211 9.254 ( 4.693 11.234 -3.688) 12.721 9.395 ( 2.116 4.494 1.981) 5.348 9.723 ( -1.790 13.431 4.691) 14.339 9.975 ( 1.074 11.361 -3.623) 11.973 10.372 ( 5.336 -3.886 -4.373) 7.918 10.587 ( 11.822 2.800 8.415) 14.779 10.954 ( -0.175 -1.766 0.160) 1.782 11.420 ( -5.402 -6.198 -1.658) 8.387 11.459 ( 3.031 3.091 -2.509) 5.004 11.930 ( 2.893 4.206 -0.993) 5.201 12.117 ( -1.838 1.581 -0.302) 2.443 12.227 ( -4.773 -0.138 -2.640) 5.456 12.387 ( -8.977 3.217 8.280) 12.629 12.652 ( 2.469 -1.438 -2.617) 3.874 12.704 ( -0.257 -7.910 2.098) 8.187 12.912 ( -0.295 -4.993 -3.326) 6.007 13.172 ( 3.376 -1.792 -4.134) 5.631 13.262 ( 9.184 -0.976 -3.278) 9.801 13.649 ( 5.591 1.414 4.938) 7.592 13.748 ( 5.405 -3.163 3.428) 7.139 14.620 ( -6.361 2.606 -11.713) 13.581 14.911 ( -4.630 1.177 8.757) 9.975 15.180 ( 1.768 -0.770 1.146) 2.243 15.340 ( 3.476 -2.346 -0.592) 4.235 ======================= Grid point 222 (100/141) ======================= q-point: ( 0.40 0.10 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.724 ( 4.278 0.214 2.381) 4.901 1.857 ( -0.214 -0.879 -1.258) 1.549 1.899 ( 3.953 2.515 -2.432) 5.279 1.921 ( 9.417 3.966 -0.070) 10.218 2.363 ( 4.250 -3.036 2.878) 5.963 2.452 ( -1.125 1.485 -4.152) 4.551 2.759 ( 2.017 -5.771 -0.708) 6.154 2.922 ( 1.205 0.223 1.063) 1.622 3.055 ( -4.514 0.052 -0.926) 4.609 3.143 ( -1.634 -5.887 -0.825) 6.165 3.405 ( -3.682 -2.941 4.302) 6.381 3.578 ( -5.194 2.427 -3.309) 6.620 3.708 ( 3.429 -1.713 1.254) 4.033 3.811 ( -1.445 -1.396 -1.399) 2.448 3.931 ( 1.835 2.372 -2.266) 3.758 3.974 ( -1.179 3.718 3.413) 5.183 4.209 ( -2.636 -0.062 -1.408) 2.989 4.307 ( -1.833 0.279 0.180) 1.863 4.374 ( 0.945 0.635 2.246) 2.518 4.518 ( -1.528 -4.425 -1.300) 4.859 4.727 ( 1.643 -3.566 3.067) 4.982 4.902 ( 11.912 -3.531 -0.983) 12.463 5.082 ( -2.783 8.467 1.606) 9.056 5.532 ( -2.272 6.430 0.742) 6.860 5.666 ( 2.007 -2.838 -1.473) 3.775 5.796 ( -0.923 -0.482 -2.486) 2.695 5.872 ( -3.320 -2.109 1.109) 4.087 6.018 ( 2.235 3.385 1.303) 4.260 6.182 ( 0.268 1.189 -3.472) 3.680 6.266 ( 1.463 -2.068 4.127) 4.842 6.289 ( 0.198 -1.570 -1.306) 2.051 6.525 ( -0.775 -2.802 -2.253) 3.678 6.592 ( -1.444 -0.375 -1.655) 2.228 6.636 ( 0.760 -4.648 1.710) 5.011 6.709 ( 2.747 -0.741 0.299) 2.860 6.761 ( -2.223 -6.006 4.236) 7.679 6.935 ( -3.956 -5.204 -0.647) 6.569 6.948 ( -1.489 2.514 -1.600) 3.332 7.074 ( -3.723 -3.210 -2.234) 5.400 7.164 ( 1.271 -2.017 2.915) 3.765 7.353 ( 3.689 -7.460 -4.824) 9.619 7.536 ( 5.231 -0.424 -0.118) 5.249 7.729 ( 1.010 -0.704 0.146) 1.240 7.880 ( -1.595 2.710 1.241) 3.381 8.025 ( -4.388 4.529 1.393) 6.458 8.336 ( -7.644 -4.881 2.171) 9.325 8.466 ( -5.916 -3.767 -0.490) 7.031 8.687 ( -4.028 -5.000 -0.063) 6.421 9.215 ( 4.788 12.481 -0.189) 13.370 9.374 ( 0.339 4.971 1.728) 5.274 9.592 ( -1.909 8.113 5.095) 9.769 9.853 ( 2.217 16.342 -4.875) 17.197 10.413 ( -0.828 -0.261 -3.252) 3.366 10.704 ( 3.493 2.471 2.698) 5.058 10.975 ( 0.209 -2.596 1.728) 3.126 11.322 ( -8.531 -5.524 -4.308) 11.038 11.522 ( 3.189 0.145 2.513) 4.063 11.921 ( 0.611 3.977 -2.241) 4.605 12.066 ( -0.503 1.706 -0.728) 1.922 12.188 ( -0.031 -3.136 -3.312) 4.561 12.251 ( -5.556 2.551 8.699) 10.633 12.694 ( 0.890 -0.624 -1.257) 1.662 12.788 ( 0.338 -7.067 1.853) 7.314 12.922 ( -1.386 -4.944 -6.574) 8.341 13.239 ( 3.953 1.361 -0.126) 4.183 13.377 ( 6.236 3.388 -2.498) 7.524 13.774 ( 3.164 -0.593 8.408) 9.003 13.832 ( 3.753 -1.407 -0.044) 4.008 14.473 ( -4.085 3.131 -7.663) 9.231 14.851 ( -3.589 -1.622 3.892) 5.537 15.208 ( 0.928 -0.165 -0.739) 1.198 15.405 ( 1.822 -0.906 0.849) 2.205 ======================= Grid point 223 (101/141) ======================= q-point: (-0.50 0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.761 ( -0.068 4.789 3.204) 5.762 1.800 ( -3.887 4.276 0.316) 5.787 1.864 ( -1.514 3.258 -1.556) 3.915 1.987 ( 3.170 5.307 -1.462) 6.352 2.408 ( -3.556 0.038 -3.243) 4.813 2.433 ( 3.547 1.556 2.246) 4.477 2.812 ( -0.889 -0.666 -1.779) 2.097 2.871 ( -6.106 -0.285 -1.932) 6.411 2.990 ( -2.205 -1.906 3.691) 4.703 3.222 ( 1.947 -4.913 -2.559) 5.871 3.421 ( -4.542 -9.368 1.582) 10.531 3.437 ( -4.007 1.874 0.318) 4.435 3.743 ( 1.981 0.876 -2.060) 2.989 3.845 ( 3.374 1.286 1.177) 3.798 3.953 ( 2.925 5.943 1.657) 6.828 4.004 ( 5.349 -5.189 -0.068) 7.453 4.155 ( -2.967 -0.249 0.328) 2.996 4.283 ( -4.085 0.698 -0.442) 4.168 4.372 ( 3.495 -3.344 0.647) 4.880 4.631 ( 7.617 -3.096 -1.078) 8.293 4.760 ( -2.096 1.078 1.473) 2.779 4.963 ( -2.272 8.077 0.872) 8.436 5.103 ( 8.325 0.061 -0.552) 8.344 5.434 ( -0.190 3.075 2.421) 3.919 5.717 ( 1.239 -0.236 -1.969) 2.338 5.816 ( -1.250 -2.172 -0.096) 2.508 5.887 ( 4.078 -2.823 -0.668) 5.005 5.981 ( -0.701 0.766 -3.054) 3.225 6.213 ( 1.642 3.078 2.577) 4.337 6.290 ( 0.423 0.384 -3.118) 3.170 6.335 ( 3.429 -1.638 1.936) 4.265 6.511 ( -1.032 -1.476 1.250) 2.192 6.592 ( 1.049 -0.032 -2.932) 3.114 6.687 ( -1.148 -2.319 5.210) 5.817 6.776 ( 3.632 -1.613 -0.246) 3.982 6.806 ( 0.251 -1.936 0.103) 1.955 6.896 ( 0.802 -0.229 -2.449) 2.587 6.989 ( 0.557 -5.514 0.893) 5.613 7.029 ( -2.416 -3.860 -2.053) 4.995 7.223 ( 2.368 -2.246 2.734) 4.257 7.425 ( 2.329 2.006 -5.150) 5.998 7.621 ( 0.502 -5.660 -0.360) 5.693 7.746 ( -2.882 -0.375 0.949) 3.058 7.807 ( 1.939 3.819 4.577) 6.268 7.965 ( -0.883 -1.005 -1.051) 1.701 8.245 ( -10.510 -7.195 0.563) 12.750 8.462 ( -1.654 -7.246 0.777) 7.473 8.672 ( -5.121 -7.272 -3.196) 9.451 9.170 ( 4.852 12.671 1.380) 13.638 9.345 ( 1.669 4.119 2.580) 5.139 9.552 ( 0.059 -0.614 4.815) 4.854 9.719 ( 1.951 14.133 -5.028) 15.127 10.365 ( -3.006 0.882 -1.420) 3.440 10.692 ( -2.390 1.472 -2.344) 3.657 11.012 ( 0.615 -1.967 0.137) 2.066 11.232 ( -7.478 -5.020 0.419) 9.016 11.570 ( 2.218 0.233 2.265) 3.179 11.875 ( -1.421 -0.148 -5.664) 5.842 12.098 ( 4.785 0.600 -1.819) 5.155 12.190 ( 0.030 3.165 7.370) 8.021 12.258 ( 1.950 -6.213 0.882) 6.571 12.681 ( -1.802 0.674 0.247) 1.940 12.850 ( -0.358 -4.238 -0.622) 4.299 12.950 ( 2.172 -2.827 -3.384) 4.916 13.246 ( -0.431 4.374 0.547) 4.429 13.409 ( 4.683 7.464 0.339) 8.818 13.687 ( -8.883 2.515 2.253) 9.503 13.974 ( 5.488 -0.696 -4.440) 7.094 14.385 ( -1.086 2.532 5.852) 6.468 14.875 ( 1.406 -6.334 -2.628) 7.001 15.210 ( -0.173 0.090 -2.128) 2.137 15.415 ( -0.774 1.335 1.504) 2.155 ======================= Grid point 224 (102/141) ======================= q-point: (-0.40 0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.619 ( -8.035 10.150 7.297) 14.860 1.653 ( -6.389 5.676 -2.446) 8.890 1.789 ( -4.025 8.350 1.200) 9.346 1.956 ( 0.406 2.599 -2.310) 3.501 2.299 ( -5.394 1.964 -4.611) 7.363 2.496 ( 4.142 0.758 1.040) 4.337 2.679 ( -7.631 6.639 1.393) 10.210 2.740 ( -12.147 9.693 0.432) 15.546 2.971 ( -1.792 -3.394 0.527) 3.874 3.128 ( -11.225 2.162 -2.535) 11.709 3.431 ( 4.297 -4.508 -1.886) 6.508 3.576 ( 5.234 -8.131 2.638) 10.024 3.783 ( 4.764 0.358 -2.423) 5.357 3.887 ( 1.892 0.164 3.643) 4.108 3.969 ( 3.292 1.525 0.729) 3.701 4.138 ( 0.684 -3.023 0.144) 3.103 4.155 ( 4.005 -2.435 -1.001) 4.793 4.258 ( 1.955 -5.178 0.266) 5.541 4.515 ( 6.697 -5.107 0.671) 8.449 4.630 ( -5.528 8.745 0.771) 10.375 4.799 ( 7.159 -5.034 -0.271) 8.756 4.848 ( -1.963 5.626 -3.899) 7.121 5.170 ( 2.963 2.687 0.651) 4.052 5.506 ( 3.318 -5.353 3.029) 6.989 5.706 ( 0.538 3.306 -2.592) 4.235 5.828 ( -1.005 -5.692 0.557) 5.806 5.938 ( 0.842 -0.330 -1.563) 1.806 6.029 ( 3.064 2.328 0.642) 3.901 6.138 ( -3.247 4.231 1.828) 5.638 6.250 ( -2.999 0.346 -2.157) 3.711 6.383 ( -0.566 0.438 -0.147) 0.730 6.548 ( -0.710 -1.238 1.066) 1.782 6.599 ( 3.628 1.727 -1.889) 4.440 6.702 ( -0.270 -2.151 4.332) 4.844 6.778 ( -0.988 3.968 -1.644) 4.408 6.828 ( -0.126 -0.633 0.832) 1.053 6.962 ( 1.609 -0.573 -5.592) 5.847 7.016 ( 4.264 -6.779 3.082) 8.581 7.121 ( 1.718 -6.124 -0.223) 6.364 7.297 ( 2.054 -0.316 1.532) 2.581 7.380 ( -1.644 3.508 -1.708) 4.234 7.583 ( 0.868 7.801 1.531) 7.998 7.762 ( -0.448 -4.701 0.372) 4.737 7.860 ( -1.089 -2.507 1.116) 2.952 8.015 ( 5.284 -4.741 -0.942) 7.161 8.188 ( -0.460 -7.081 0.428) 7.109 8.556 ( 3.217 -9.378 1.704) 10.059 8.641 ( -7.255 -11.340 -3.229) 13.844 9.164 ( 6.177 7.784 1.399) 10.035 9.378 ( 4.029 0.372 2.682) 4.855 9.623 ( 4.827 5.239 -2.948) 7.710 9.641 ( 0.029 -4.761 2.920) 5.586 10.288 ( -3.188 3.804 -1.840) 5.293 10.576 ( -7.537 3.247 -6.164) 10.264 11.024 ( -0.356 -0.710 -2.410) 2.537 11.169 ( -5.632 -3.084 4.011) 7.571 11.617 ( 2.959 0.340 2.479) 3.875 11.841 ( -1.697 -1.098 -6.100) 6.427 12.152 ( 3.052 2.034 -0.445) 3.695 12.248 ( 5.158 -1.888 3.451) 6.487 12.378 ( 3.374 -7.691 1.964) 8.625 12.634 ( -2.379 1.997 1.908) 3.645 12.848 ( -1.971 -1.659 -5.382) 5.967 13.005 ( 0.846 0.688 2.328) 2.570 13.151 ( -2.646 8.073 1.217) 8.582 13.387 ( 2.482 10.352 1.915) 10.817 13.533 ( -6.023 0.422 2.249) 6.443 13.902 ( -6.292 7.144 -7.772) 12.290 14.477 ( 6.333 -3.889 11.147) 13.397 14.969 ( 2.256 -6.613 -5.763) 9.057 15.193 ( -1.033 -0.786 -3.971) 4.178 15.364 ( -2.965 3.099 1.657) 4.597 ======================= Grid point 225 (103/141) ======================= q-point: (-0.30 0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.394 ( -9.837 9.329 14.822) 20.087 1.464 ( -7.046 6.929 -5.515) 11.317 1.558 ( -9.803 14.843 5.718) 18.684 1.927 ( -0.491 1.849 -11.366) 11.526 2.196 ( -6.477 3.076 -2.325) 7.538 2.271 ( -14.387 22.763 2.030) 27.005 2.430 ( -11.793 12.442 3.112) 17.423 2.580 ( 3.826 1.831 -0.076) 4.243 2.876 ( -10.330 -0.192 0.111) 10.333 3.001 ( -4.221 -2.332 -1.688) 5.109 3.509 ( 2.870 1.391 -1.625) 3.579 3.703 ( 2.411 -2.208 1.302) 3.519 3.881 ( 3.640 -4.389 -1.601) 5.923 3.972 ( 4.869 -5.160 -0.185) 7.097 4.006 ( 2.539 2.955 4.043) 5.615 4.200 ( -0.415 -4.045 1.592) 4.367 4.231 ( 5.474 -4.723 -2.555) 7.668 4.411 ( 4.027 -5.100 -0.228) 6.502 4.481 ( 0.749 2.997 0.511) 3.132 4.655 ( 2.763 -0.941 -2.954) 4.152 4.825 ( 4.562 -3.142 -1.672) 5.787 4.974 ( 4.918 -8.696 -0.379) 9.998 5.189 ( 2.468 2.781 1.768) 4.117 5.575 ( -2.821 -3.090 0.964) 4.293 5.671 ( 0.312 3.802 -3.338) 5.069 5.852 ( -5.256 4.348 0.503) 6.840 5.896 ( -0.163 -1.586 5.680) 5.899 5.994 ( 1.713 -1.845 -3.728) 4.498 6.154 ( 0.046 0.361 2.388) 2.415 6.194 ( -0.750 0.519 -0.877) 1.265 6.310 ( -4.946 2.352 -0.428) 5.493 6.513 ( -2.133 0.868 -2.165) 3.161 6.639 ( 2.580 1.823 -4.793) 5.740 6.663 ( -5.429 1.299 2.312) 6.043 6.762 ( 1.484 0.173 3.678) 3.970 6.817 ( -0.429 1.751 2.157) 2.812 6.979 ( -0.421 -0.411 -3.114) 3.169 7.114 ( -0.928 -3.678 2.039) 4.306 7.170 ( -2.228 -2.688 -0.468) 3.523 7.268 ( 0.767 4.860 -0.212) 4.925 7.358 ( 1.723 -2.045 -4.593) 5.315 7.563 ( 0.330 4.056 4.125) 5.794 7.722 ( -5.491 -0.331 -0.230) 5.506 7.883 ( -2.540 -9.453 1.758) 9.945 8.251 ( 14.962 -5.284 0.177) 15.869 8.349 ( 13.484 1.739 0.081) 13.596 8.660 ( -3.536 -12.753 3.092) 13.591 8.774 ( 5.596 -15.205 -0.460) 16.208 9.251 ( 11.847 6.478 3.871) 14.047 9.476 ( 6.329 0.509 -0.479) 6.368 9.609 ( 0.633 -2.609 -6.162) 6.721 9.776 ( -1.472 -12.364 7.710) 14.646 10.177 ( 0.485 8.595 -8.176) 11.872 10.333 ( -11.987 6.813 -8.277) 16.082 11.000 ( -1.420 0.862 -3.185) 3.592 11.112 ( -5.367 -1.022 4.815) 7.283 11.666 ( 2.417 1.479 2.739) 3.941 11.804 ( -1.049 0.379 -6.008) 6.111 12.174 ( 2.053 1.149 0.132) 2.357 12.373 ( 5.171 -2.840 -0.046) 5.900 12.526 ( 3.343 -9.254 1.859) 10.014 12.565 ( -3.044 4.690 1.969) 5.928 12.796 ( -3.491 0.429 -3.354) 4.860 12.918 ( -6.178 2.990 -1.434) 7.011 13.033 ( -1.788 11.526 3.207) 12.096 13.355 ( 3.493 7.618 5.655) 10.110 13.492 ( -1.095 0.533 2.171) 2.489 13.670 ( -7.081 9.059 -3.427) 11.998 14.658 ( 5.220 -5.442 7.639) 10.733 15.020 ( -0.526 -4.019 -6.696) 7.827 15.165 ( -2.128 -1.288 -6.597) 7.050 15.277 ( -3.489 3.604 1.776) 5.321 ======================= Grid point 226 (104/141) ======================= q-point: (-0.20 0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.195 ( -10.951 9.425 12.837) 19.328 1.232 ( -9.217 14.941 9.250) 19.843 1.281 ( -3.394 10.562 -2.030) 11.279 1.700 ( -13.358 27.311 11.294) 32.433 1.766 ( -6.968 15.392 -12.681) 21.125 2.114 ( -6.594 7.919 -6.935) 12.421 2.236 ( 4.775 2.480 0.269) 5.387 2.583 ( -5.107 -1.665 -4.500) 7.008 2.757 ( -1.758 1.384 3.711) 4.333 2.929 ( -5.222 -1.268 -1.340) 5.538 3.519 ( 2.213 3.382 0.354) 4.057 3.690 ( -3.178 2.585 -1.918) 4.523 3.958 ( 1.429 -3.254 3.721) 5.146 4.035 ( 2.311 -0.300 2.165) 3.181 4.127 ( 6.871 -4.480 -1.626) 8.362 4.233 ( -4.180 -7.835 3.426) 9.519 4.352 ( 5.103 -1.190 -2.359) 5.747 4.451 ( 4.009 1.156 -3.468) 5.425 4.603 ( 3.515 -7.177 -1.463) 8.125 4.679 ( 0.627 -4.412 -1.972) 4.873 4.977 ( 4.696 -6.806 -0.684) 8.297 5.094 ( -2.015 -7.581 0.748) 7.880 5.231 ( 5.937 4.132 2.155) 7.548 5.471 ( -5.775 3.840 0.353) 6.944 5.614 ( 0.258 5.932 -2.974) 6.641 5.745 ( -5.446 -2.163 -1.405) 6.026 5.936 ( -0.026 -0.429 5.760) 5.776 6.056 ( 2.436 -2.969 -3.625) 5.281 6.114 ( -1.454 -0.286 -0.066) 1.483 6.209 ( -0.429 1.746 1.326) 2.234 6.231 ( 0.342 1.566 1.427) 2.146 6.440 ( -2.715 2.497 -6.026) 7.065 6.588 ( -3.432 -0.106 4.811) 5.911 6.637 ( 2.131 3.206 -5.219) 6.485 6.775 ( -0.619 1.979 2.639) 3.356 6.809 ( -0.290 -0.265 3.991) 4.011 6.931 ( -1.036 2.924 -1.099) 3.291 7.061 ( -4.571 1.461 1.578) 5.052 7.141 ( -3.034 -0.816 0.380) 3.165 7.272 ( 0.252 0.182 -0.460) 0.555 7.409 ( 4.721 -0.876 -11.830) 12.767 7.514 ( -6.143 0.554 8.065) 10.153 7.685 ( -0.758 -6.780 1.972) 7.101 7.912 ( -4.885 -7.865 -0.754) 9.289 8.423 ( 7.125 10.278 8.708) 15.239 8.682 ( 20.064 -0.679 1.017) 20.101 8.781 ( 4.409 -9.919 6.373) 12.588 8.950 ( 0.266 -12.402 -4.797) 13.300 9.323 ( -3.217 6.961 3.175) 8.300 9.428 ( -6.083 12.299 -15.124) 20.421 9.715 ( 0.269 -2.189 -0.945) 2.399 9.779 ( -1.146 4.975 -0.563) 5.136 10.078 ( 3.762 -5.944 -4.549) 8.377 10.296 ( 9.501 -12.298 -4.672) 16.227 10.941 ( -2.406 2.520 -3.193) 4.726 11.028 ( -6.395 0.403 3.616) 7.358 11.662 ( -1.486 4.234 3.301) 5.571 11.747 ( -1.200 4.522 -7.336) 8.700 12.234 ( 6.210 0.636 2.985) 6.919 12.416 ( -1.441 6.521 0.671) 6.712 12.451 ( -2.300 5.111 -1.553) 5.816 12.670 ( 1.223 -7.628 2.608) 8.154 12.713 ( -4.500 -2.069 -0.359) 4.966 12.783 ( -5.998 0.631 -5.603) 8.232 12.950 ( 3.255 7.232 6.193) 10.062 13.342 ( -6.745 5.130 -4.937) 9.807 13.362 ( 3.035 11.045 3.121) 11.872 13.596 ( -0.651 1.153 4.631) 4.816 14.783 ( 1.555 -4.247 4.533) 6.404 14.975 ( -4.699 -0.291 -11.158) 12.111 15.118 ( -0.324 1.553 -1.666) 2.301 15.199 ( -2.704 2.482 0.908) 3.781 ======================= Grid point 227 (105/141) ======================= q-point: (-0.10 0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.873 ( -7.849 14.069 15.253) 22.185 1.104 ( 6.198 19.231 12.738) 23.885 1.155 ( 7.466 13.357 -11.030) 18.863 1.342 ( -8.027 21.879 -6.981) 24.328 1.533 ( 3.985 12.503 23.982) 27.338 1.978 ( -1.639 1.286 -20.347) 20.454 2.370 ( 9.517 -2.009 2.339) 10.004 2.426 ( -10.834 -0.847 -4.123) 11.623 2.789 ( 2.724 -0.086 4.645) 5.386 2.869 ( -0.883 -0.052 -3.809) 3.911 3.532 ( 2.512 3.497 3.021) 5.260 3.589 ( -2.995 3.019 -3.220) 5.334 4.048 ( 3.393 -4.034 4.032) 6.636 4.085 ( 1.165 -3.629 -0.661) 3.868 4.196 ( -7.860 -4.263 4.468) 9.995 4.268 ( 3.552 -3.163 0.591) 4.793 4.404 ( 3.399 2.151 -3.407) 5.271 4.459 ( -0.881 1.813 -6.445) 6.753 4.708 ( 0.777 -7.407 0.852) 7.497 4.736 ( -1.245 -6.761 -1.848) 7.118 5.038 ( -5.105 -1.455 3.524) 6.372 5.106 ( 3.265 -2.012 -3.537) 5.217 5.259 ( -0.237 4.614 6.195) 7.728 5.378 ( 1.513 5.614 -6.684) 8.859 5.633 ( 4.340 -1.465 1.353) 4.776 5.667 ( -4.422 -2.213 -2.229) 5.424 5.955 ( 0.634 -0.005 5.137) 5.176 6.044 ( -0.830 1.719 -4.151) 4.569 6.148 ( 1.002 -0.168 1.207) 1.578 6.181 ( -0.064 -0.759 -1.555) 1.731 6.260 ( 2.828 2.520 2.766) 4.691 6.354 ( -2.561 2.393 -6.328) 7.234 6.558 ( -2.533 -0.273 4.224) 4.933 6.630 ( 2.190 3.260 -3.312) 5.138 6.761 ( 1.049 2.170 2.486) 3.462 6.788 ( -0.494 0.737 0.189) 0.907 6.961 ( 5.494 0.526 0.904) 5.592 6.991 ( -2.667 -0.939 -1.767) 3.334 7.131 ( 2.989 2.419 3.075) 4.924 7.183 ( -7.574 1.182 -2.173) 7.968 7.397 ( -11.252 -5.627 9.241) 15.610 7.545 ( 10.704 -4.217 -6.752) 13.339 7.798 ( -1.118 -5.723 4.729) 7.507 7.891 ( 2.209 -3.731 -5.386) 6.915 8.341 ( 5.497 31.898 18.612) 37.338 8.750 ( -12.494 24.853 -21.553) 35.189 8.934 ( 5.559 -6.707 2.342) 9.021 8.994 ( -1.715 -1.621 -5.854) 6.312 9.142 ( -9.310 0.128 0.869) 9.351 9.223 ( 14.004 1.027 -7.587) 15.960 9.596 ( -3.230 8.163 6.912) 11.173 9.734 ( 4.237 8.640 -7.790) 12.381 10.476 ( 6.945 -28.286 4.586) 29.485 10.579 ( -5.720 -27.456 -6.355) 28.757 10.894 ( -7.134 2.317 0.958) 7.562 10.913 ( 8.048 3.252 -1.213) 8.765 11.528 ( -6.296 11.474 5.894) 14.354 11.649 ( 3.790 12.407 -7.199) 14.837 12.288 ( -2.514 7.736 1.660) 8.302 12.314 ( 3.252 9.384 -1.292) 10.015 12.435 ( 6.590 -0.701 5.932) 8.894 12.535 ( -9.303 1.507 -4.285) 10.353 12.768 ( -0.966 -7.728 2.738) 8.255 12.813 ( 0.559 -8.508 -2.404) 8.859 12.989 ( 5.042 5.378 7.761) 10.704 13.120 ( -6.604 6.960 -6.314) 11.485 13.418 ( 6.909 5.236 3.708) 9.428 13.472 ( -7.122 6.721 -1.973) 9.989 14.816 ( -1.949 -1.465 2.186) 3.275 14.887 ( 1.928 3.325 -6.208) 7.302 15.123 ( 1.958 1.637 1.021) 2.748 15.143 ( -0.853 1.662 -0.991) 2.114 ======================= Grid point 230 (106/141) ======================= q-point: ( 0.20 0.20 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 141 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.634 ( 15.287 -0.000 -5.259) 16.166 1.684 ( 3.281 -0.000 -8.270) 8.897 1.769 ( 8.507 -0.000 5.601) 10.185 1.833 ( 13.183 -0.000 5.397) 14.245 2.181 ( 6.617 -0.000 0.172) 6.619 2.537 ( -1.117 0.000 -3.851) 4.010 2.567 ( 5.208 -0.000 1.534) 5.429 2.726 ( 15.619 -0.000 0.112) 15.619 3.131 ( -1.128 0.000 0.083) 1.131 3.144 ( -1.548 0.000 0.824) 1.753 3.445 ( -5.047 0.000 1.134) 5.172 3.622 ( -0.139 0.000 3.760) 3.762 3.770 ( -1.485 0.000 -4.020) 4.285 3.784 ( -6.009 0.000 -1.124) 6.113 3.973 ( -2.374 0.000 0.712) 2.478 4.080 ( -3.661 0.000 -0.779) 3.743 4.268 ( 5.367 -0.000 1.364) 5.538 4.319 ( -8.530 0.000 -1.484) 8.658 4.416 ( -4.943 0.000 3.303) 5.945 4.466 ( -3.097 0.000 -1.082) 3.281 4.685 ( 3.878 -0.000 -2.598) 4.668 4.700 ( -4.654 0.000 3.069) 5.575 5.359 ( -5.994 0.000 -0.482) 6.014 5.402 ( 4.239 -0.000 -0.160) 4.242 5.732 ( 0.179 -0.000 -1.643) 1.653 5.844 ( -4.899 0.000 -3.957) 6.298 5.943 ( 5.148 -0.000 2.549) 5.745 5.961 ( -3.395 0.000 2.989) 4.523 6.153 ( 1.704 -0.000 -2.434) 2.972 6.168 ( 1.173 -0.000 4.410) 4.564 6.392 ( 1.749 -0.000 -4.565) 4.889 6.407 ( -5.131 0.000 -3.898) 6.443 6.484 ( 2.699 -0.000 4.844) 5.545 6.621 ( 2.261 -0.000 6.366) 6.756 6.711 ( -8.831 0.000 5.094) 10.195 6.772 ( -8.477 0.000 -7.749) 11.485 6.927 ( -0.925 0.000 -2.802) 2.951 6.994 ( -0.704 0.000 0.902) 1.144 7.040 ( -2.966 0.000 1.997) 3.575 7.128 ( -0.074 0.000 -3.617) 3.617 7.186 ( -1.900 0.000 1.678) 2.535 7.419 ( 10.602 -0.000 0.246) 10.605 7.688 ( 2.484 -0.000 -2.495) 3.521 7.903 ( -0.148 0.000 -0.971) 0.983 8.306 ( -5.657 0.000 -4.528) 7.246 8.343 ( -10.956 0.000 9.180) 14.294 8.659 ( -13.343 0.000 3.519) 13.799 8.659 ( -4.633 0.000 -2.468) 5.250 9.397 ( -2.163 0.000 -1.013) 2.388 9.400 ( 1.693 -0.000 -1.660) 2.372 9.899 ( -2.131 0.000 -3.836) 4.388 10.089 ( 4.149 -0.000 8.294) 9.273 10.331 ( 7.769 -0.000 -3.635) 8.578 10.629 ( 13.490 -0.000 10.970) 17.388 10.938 ( 0.769 -0.000 -2.628) 2.738 11.335 ( -7.024 0.000 -6.396) 9.500 11.491 ( 1.248 -0.000 -0.113) 1.253 11.985 ( 2.440 -0.000 0.076) 2.441 12.133 ( -1.271 0.000 -3.158) 3.405 12.228 ( -6.154 0.000 0.867) 6.215 12.440 ( -5.452 0.000 7.678) 9.416 12.570 ( -0.781 0.000 -0.940) 1.222 12.650 ( -0.258 0.000 -1.301) 1.326 12.856 ( -1.083 0.000 -4.562) 4.689 13.154 ( 6.427 -0.000 -2.522) 6.904 13.253 ( 10.968 -0.000 -2.788) 11.317 13.679 ( 3.643 -0.000 -2.475) 4.405 13.705 ( 7.560 -0.000 10.193) 12.690 14.648 ( -6.413 0.000 -13.063) 14.552 14.924 ( -5.448 0.000 9.273) 10.755 15.170 ( 1.951 -0.000 2.731) 3.356 15.313 ( 4.273 -0.000 -1.258) 4.454 ======================= Grid point 231 (107/141) ======================= q-point: ( 0.30 0.20 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.730 ( 4.444 0.289 -1.634) 4.744 1.822 ( 5.880 -1.319 -2.543) 6.541 1.940 ( 10.540 1.769 -1.650) 10.814 2.027 ( 9.472 3.720 4.850) 11.272 2.292 ( 4.629 -2.683 -0.198) 5.355 2.492 ( -1.133 1.408 -4.137) 4.515 2.645 ( 2.514 -4.039 -0.006) 4.757 2.913 ( 4.974 -0.944 0.935) 5.148 3.047 ( -4.748 -0.922 -0.788) 4.901 3.070 ( -8.241 -0.876 -0.170) 8.289 3.350 ( -7.490 -1.678 3.574) 8.467 3.627 ( -8.300 1.249 1.904) 8.607 3.690 ( 5.129 0.195 -0.658) 5.175 3.775 ( 0.475 -1.522 -1.991) 2.551 3.952 ( -0.556 0.814 -1.380) 1.696 4.051 ( 1.943 2.189 1.814) 3.444 4.200 ( -4.463 -0.560 -3.219) 5.531 4.329 ( -4.003 1.721 1.437) 4.588 4.365 ( -1.979 -1.191 2.502) 3.405 4.433 ( 4.992 -3.319 -0.844) 6.054 4.677 ( 0.259 -1.237 4.099) 4.289 4.863 ( 13.198 -0.752 -1.241) 13.278 5.248 ( -1.679 6.975 -0.181) 7.176 5.504 ( 3.551 -5.181 -2.020) 6.598 5.698 ( -2.059 2.572 1.411) 3.584 5.768 ( -2.939 -1.956 -2.334) 4.232 5.881 ( -4.237 2.510 1.605) 5.179 6.058 ( 6.312 0.237 2.453) 6.776 6.193 ( 2.990 -0.158 -5.354) 6.134 6.234 ( 3.242 -1.525 3.049) 4.705 6.283 ( -4.119 2.263 -2.260) 5.215 6.426 ( -0.941 -5.610 -4.301) 7.131 6.548 ( 1.535 -2.569 5.073) 5.890 6.580 ( -5.891 -1.315 3.338) 6.898 6.667 ( -2.629 -2.439 -3.149) 4.773 6.702 ( 4.157 -0.129 2.479) 4.842 6.879 ( -3.603 1.215 0.116) 3.804 6.959 ( -5.168 -4.573 0.305) 6.907 7.015 ( -0.784 -0.757 -1.808) 2.111 7.127 ( 1.363 -0.008 -2.364) 2.729 7.228 ( 2.180 -3.122 -0.397) 3.828 7.575 ( 7.467 1.530 0.145) 7.624 7.712 ( 1.144 -0.713 -2.143) 2.532 7.905 ( 0.428 0.488 0.758) 0.997 8.127 ( -9.582 4.927 4.696) 11.753 8.243 ( -6.816 -3.941 -2.080) 8.144 8.457 ( -9.517 0.724 4.270) 10.456 8.627 ( -0.857 -1.376 -2.332) 2.840 9.341 ( -2.193 1.985 -0.331) 2.976 9.383 ( -3.898 -0.742 0.943) 4.079 9.827 ( 0.115 9.615 0.921) 9.659 10.137 ( 4.410 7.578 1.921) 8.976 10.410 ( 1.940 0.863 -1.383) 2.534 10.797 ( 5.165 5.982 5.594) 9.682 10.933 ( -0.521 -0.714 0.011) 0.884 11.158 ( -12.702 -9.380 -9.663) 18.512 11.530 ( 1.690 0.429 4.025) 4.386 11.999 ( 0.155 2.884 -2.872) 4.073 12.097 ( -2.994 1.372 -0.763) 3.381 12.130 ( -2.464 -2.206 -0.739) 3.389 12.341 ( -3.346 5.446 7.976) 10.221 12.615 ( 0.420 -8.031 1.611) 8.202 12.690 ( 3.340 0.074 -1.321) 3.593 12.821 ( -1.576 -4.091 -8.903) 9.924 13.267 ( 6.346 1.035 -1.559) 6.617 13.419 ( 8.956 0.911 -0.630) 9.024 13.774 ( 6.814 0.467 5.151) 8.554 13.812 ( 1.966 -0.670 3.987) 4.496 14.519 ( -3.004 1.308 -12.113) 12.548 14.830 ( -7.883 -0.486 6.779) 10.409 15.204 ( 1.288 -0.174 0.462) 1.379 15.386 ( 3.555 -0.684 0.593) 3.669 ======================= Grid point 232 (108/141) ======================= q-point: (-0.60 0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.798 ( 3.385 0.074 -0.203) 3.392 1.858 ( 0.188 2.975 0.208) 2.988 1.998 ( 1.603 7.035 -2.810) 7.743 2.110 ( 5.135 6.631 2.281) 8.692 2.368 ( -1.071 -3.945 -0.288) 4.098 2.473 ( 2.778 2.267 -1.551) 3.907 2.745 ( 3.955 -4.675 -2.272) 6.531 2.888 ( -6.915 1.680 -1.538) 7.280 2.946 ( -3.010 -2.059 2.988) 4.714 3.091 ( 2.875 -7.207 -1.328) 7.872 3.265 ( -6.661 -5.383 3.431) 9.225 3.461 ( -9.820 0.238 -0.006) 9.823 3.768 ( 4.268 1.288 -1.986) 4.880 3.834 ( 3.954 -1.730 -0.312) 4.327 3.937 ( 0.986 -0.718 -0.267) 1.249 4.085 ( 3.826 5.359 3.507) 7.460 4.145 ( -2.362 -0.754 -2.490) 3.515 4.295 ( -0.855 -0.140 -0.877) 1.233 4.305 ( -3.835 -2.474 0.798) 4.633 4.587 ( 7.820 -1.437 0.702) 7.982 4.741 ( 2.684 -1.878 3.263) 4.624 5.080 ( 9.824 0.232 2.446) 10.127 5.154 ( 0.464 8.638 -0.238) 8.654 5.545 ( -2.392 1.637 -3.781) 4.764 5.649 ( -1.225 -1.686 -0.252) 2.099 5.774 ( -1.688 -1.499 2.826) 3.617 5.857 ( 5.842 -0.641 0.659) 5.914 6.043 ( -3.364 5.201 -5.481) 8.271 6.229 ( 0.427 -1.630 -0.953) 1.936 6.290 ( 6.074 -0.739 -2.880) 6.763 6.310 ( 2.239 0.004 4.884) 5.372 6.439 ( -2.034 -5.591 -2.309) 6.382 6.545 ( -1.737 -4.751 1.030) 5.162 6.609 ( 0.015 -3.920 1.397) 4.161 6.731 ( 3.666 -1.741 1.736) 4.414 6.784 ( 5.122 0.192 0.198) 5.130 6.848 ( 2.260 -4.214 1.678) 5.067 6.909 ( -4.271 -2.223 -1.702) 5.107 7.012 ( 0.276 0.220 -3.262) 3.281 7.155 ( 0.020 -3.989 0.041) 3.989 7.280 ( -1.842 -8.292 -1.139) 8.570 7.616 ( -0.428 2.697 0.388) 2.759 7.728 ( -0.829 -1.309 -1.164) 1.938 7.906 ( 0.453 3.150 4.119) 5.205 7.955 ( -6.858 0.592 1.512) 7.047 8.175 ( -2.357 -0.618 -3.318) 4.117 8.360 ( -4.587 -2.251 4.782) 6.998 8.616 ( -1.010 -0.506 -4.489) 4.629 9.272 ( -4.819 -0.399 -0.368) 4.849 9.327 ( -4.513 -3.117 1.786) 5.769 9.733 ( 1.884 14.297 7.196) 16.116 10.096 ( 5.261 18.303 -3.897) 19.439 10.377 ( -2.358 1.283 -0.871) 2.822 10.727 ( -4.771 1.941 -3.743) 6.367 10.962 ( 0.299 -2.679 0.968) 2.864 11.093 ( -5.343 -9.066 1.060) 10.576 11.557 ( 0.644 -0.777 1.787) 2.052 11.899 ( -4.455 1.936 -5.735) 7.516 12.101 ( 3.211 -0.229 -1.002) 3.372 12.157 ( 1.138 -3.517 0.721) 3.767 12.288 ( 1.037 6.391 8.282) 10.513 12.693 ( -0.140 0.016 1.278) 1.286 12.732 ( 1.396 -6.273 -1.316) 6.560 12.858 ( 2.508 -5.859 -6.401) 9.033 13.315 ( 1.689 2.527 -1.136) 3.245 13.520 ( 5.418 3.464 1.993) 6.732 13.744 ( -6.219 3.151 -0.637) 7.001 13.953 ( 8.673 -1.096 2.877) 9.203 14.452 ( -0.659 3.658 -2.590) 4.530 14.750 ( -4.592 -5.651 0.808) 7.326 15.215 ( 0.141 0.245 -1.546) 1.571 15.433 ( 0.999 0.442 1.854) 2.152 ======================= Grid point 233 (109/141) ======================= q-point: (-0.50 0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.772 ( -2.679 6.130 -2.936) 7.306 1.822 ( -1.945 7.537 3.104) 8.380 1.893 ( -1.412 6.273 0.516) 6.450 2.073 ( -2.050 7.405 1.685) 7.866 2.318 ( -5.762 -0.379 -1.427) 5.948 2.512 ( 2.989 0.717 -2.557) 3.998 2.765 ( -2.787 3.073 0.913) 4.247 2.830 ( 2.611 -0.074 -1.820) 3.184 2.937 ( -3.864 -0.526 2.708) 4.748 3.158 ( -7.193 -0.386 -1.697) 7.401 3.289 ( 3.114 -9.091 -1.636) 9.747 3.393 ( 2.609 -8.417 1.784) 8.990 3.804 ( 2.680 1.669 -3.041) 4.384 3.894 ( 2.062 -0.992 1.886) 2.965 4.026 ( 3.602 -2.527 0.500) 4.429 4.056 ( -0.345 2.767 0.498) 2.833 4.136 ( 1.519 1.001 1.127) 2.140 4.224 ( -3.237 0.107 0.250) 3.248 4.388 ( 4.277 -7.070 -0.312) 8.269 4.708 ( 3.451 -2.982 1.156) 4.705 4.766 ( 0.170 4.320 0.233) 4.329 5.012 ( -2.864 9.638 0.551) 10.070 5.239 ( 4.979 2.997 0.445) 5.828 5.464 ( -0.307 1.681 0.040) 1.710 5.675 ( -3.337 -8.974 1.065) 9.633 5.760 ( 0.913 2.102 0.084) 2.293 5.935 ( -0.757 0.737 -5.945) 6.038 6.031 ( 8.029 -0.972 3.021) 8.633 6.201 ( -4.008 -0.394 -0.952) 4.138 6.275 ( -4.609 2.000 -2.087) 5.440 6.356 ( -0.757 -2.574 1.308) 2.985 6.518 ( 3.570 -2.383 0.883) 4.382 6.556 ( -2.878 -4.806 -2.049) 5.965 6.658 ( -0.051 -2.698 3.034) 4.061 6.770 ( 0.771 -3.120 -0.537) 3.259 6.849 ( -1.429 0.336 -3.270) 3.584 6.902 ( 5.179 -2.785 4.721) 7.541 6.987 ( 1.389 2.630 -3.124) 4.313 7.006 ( 3.403 -4.059 0.583) 5.329 7.242 ( 5.337 -4.793 1.289) 7.288 7.347 ( -2.515 -11.739 -4.308) 12.755 7.526 ( -8.208 -3.251 3.329) 9.435 7.705 ( -0.631 0.654 0.429) 1.005 7.855 ( -2.975 0.788 3.756) 4.856 7.971 ( 6.528 -1.027 -1.714) 6.827 8.162 ( 5.212 3.707 -2.997) 7.063 8.375 ( -1.319 -7.200 6.071) 9.510 8.575 ( -1.240 0.601 -6.507) 6.651 9.214 ( -2.170 -2.166 -1.858) 3.585 9.303 ( -3.687 -5.262 2.453) 6.877 9.670 ( 1.373 10.158 12.395) 16.084 9.954 ( 4.009 19.707 -7.786) 21.565 10.346 ( 1.051 2.250 -3.028) 3.916 10.625 ( -5.457 0.688 -2.816) 6.179 10.990 ( 0.222 -2.421 -1.385) 2.798 11.110 ( -1.745 -3.327 4.904) 6.178 11.589 ( 0.872 -2.464 1.655) 3.094 11.822 ( -1.593 -0.479 -7.445) 7.629 12.169 ( 4.469 -0.863 -4.565) 6.447 12.220 ( 0.225 -3.983 5.873) 7.100 12.299 ( 3.730 3.286 6.172) 7.925 12.669 ( -0.308 1.925 -1.180) 2.279 12.786 ( -1.416 -4.199 -2.543) 5.110 12.966 ( 4.157 -4.472 -0.797) 6.157 13.274 ( -1.578 4.599 0.897) 4.944 13.541 ( -4.459 0.633 2.383) 5.095 13.587 ( 0.051 9.030 -1.731) 9.194 14.028 ( -0.010 4.901 -4.325) 6.536 14.431 ( 1.416 -0.099 10.904) 10.996 14.800 ( 1.231 -9.575 -6.919) 11.877 15.196 ( -1.204 0.569 -2.372) 2.720 15.417 ( -2.080 2.074 2.326) 3.747 ======================= Grid point 234 (110/141) ======================= q-point: (-0.40 0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.616 ( -8.161 12.613 9.897) 17.990 1.634 ( -3.130 10.081 -4.215) 11.367 1.805 ( -5.911 9.911 1.719) 11.667 1.958 ( -2.707 2.709 -3.033) 4.885 2.223 ( -3.229 0.834 -2.549) 4.198 2.529 ( -0.194 0.505 -1.591) 1.681 2.699 ( -5.494 14.720 0.880) 15.736 2.714 ( -1.616 9.037 1.642) 9.326 2.896 ( -6.630 1.884 1.913) 7.153 2.973 ( -3.859 0.886 -3.376) 5.203 3.472 ( 6.719 -6.069 -1.838) 9.239 3.595 ( 6.167 -9.585 0.717) 11.420 3.826 ( 1.868 -0.659 -3.208) 3.770 3.898 ( -2.197 -0.105 3.720) 4.322 4.041 ( 3.300 -0.117 1.785) 3.754 4.114 ( 0.189 -4.781 0.601) 4.822 4.166 ( -0.428 -0.614 0.083) 0.753 4.247 ( 3.787 -6.972 -0.914) 7.987 4.556 ( 5.430 -8.125 0.847) 9.809 4.655 ( -2.800 9.731 2.095) 10.341 4.785 ( -0.577 -5.523 -3.142) 6.381 4.893 ( 0.083 5.569 -2.212) 5.992 5.246 ( 1.726 3.192 1.677) 3.998 5.488 ( -1.174 -4.203 -0.229) 4.370 5.692 ( -1.693 -2.806 0.878) 3.393 5.804 ( 3.798 -2.728 1.180) 4.823 5.917 ( -1.452 -1.686 -1.814) 2.871 6.064 ( -5.805 6.168 -1.383) 8.583 6.153 ( -2.197 0.034 0.794) 2.336 6.192 ( 1.913 -0.590 0.382) 2.038 6.322 ( -5.704 -1.470 -0.563) 5.918 6.504 ( -2.707 -1.499 -0.905) 3.224 6.606 ( -1.207 -4.277 -0.182) 4.448 6.664 ( -1.715 -1.978 2.003) 3.297 6.794 ( -0.114 1.608 0.727) 1.769 6.838 ( 0.768 -2.078 -2.412) 3.275 6.938 ( 0.058 -1.425 -2.367) 2.763 7.003 ( -2.557 -5.550 -1.717) 6.347 7.128 ( 5.482 -2.829 4.549) 7.664 7.283 ( -7.280 -3.624 -0.065) 8.132 7.309 ( -2.661 -1.415 0.882) 3.141 7.563 ( -0.860 -9.132 -2.139) 9.419 7.691 ( -3.146 1.259 6.179) 7.047 7.788 ( -0.275 5.215 -3.153) 6.100 8.202 ( 18.389 -2.362 -0.304) 18.542 8.357 ( 17.880 -2.092 0.265) 18.004 8.448 ( -1.344 -8.222 3.753) 9.137 8.573 ( 2.354 -4.145 -3.942) 6.185 9.258 ( 4.500 -5.170 -1.802) 7.087 9.333 ( -0.660 -7.337 0.363) 7.376 9.626 ( -3.859 3.566 14.264) 15.201 9.850 ( 5.565 12.460 -7.830) 15.733 10.334 ( 4.725 7.058 -9.050) 12.412 10.477 ( -8.071 6.949 0.927) 10.691 11.006 ( 0.830 -0.038 -2.925) 3.041 11.111 ( -1.841 0.228 4.929) 5.267 11.641 ( 0.690 -3.113 3.588) 4.800 11.803 ( 0.973 -0.726 -8.237) 8.326 12.209 ( 1.683 1.493 -0.831) 2.398 12.299 ( 3.142 -4.716 2.831) 6.335 12.379 ( 2.797 -4.214 3.138) 5.952 12.647 ( 0.446 3.923 1.747) 4.318 12.764 ( -2.743 -3.081 -8.492) 9.440 12.983 ( -4.815 2.458 0.342) 5.417 13.219 ( -0.147 6.922 2.959) 7.529 13.434 ( -1.757 0.512 3.185) 3.673 13.568 ( 3.209 7.276 2.473) 8.328 13.863 ( -6.987 9.721 -4.847) 12.915 14.547 ( 3.337 -5.290 11.313) 12.927 14.890 ( 0.882 -8.470 -10.515) 13.531 15.159 ( -1.395 0.448 -2.345) 2.766 15.343 ( -4.156 2.871 2.170) 5.498 ======================= Grid point 235 (111/141) ======================= q-point: (-0.30 0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.401 ( -5.884 11.907 14.408) 19.596 1.481 ( -0.514 11.911 -5.269) 13.034 1.534 ( -10.949 14.170 9.349) 20.201 1.885 ( -1.769 2.242 -14.056) 14.343 2.170 ( -0.502 7.960 -0.949) 8.032 2.395 ( -2.596 20.723 3.542) 21.183 2.417 ( -7.176 15.314 3.786) 17.331 2.580 ( -5.008 2.309 -5.546) 7.821 2.817 ( 2.386 4.977 0.136) 5.521 2.914 ( -4.436 0.779 0.650) 4.551 3.578 ( 4.120 1.264 -2.097) 4.793 3.694 ( -1.573 -2.322 0.176) 2.811 3.879 ( 2.842 -4.505 0.339) 5.337 3.962 ( 1.857 -8.612 -0.274) 8.815 4.070 ( 0.229 0.717 4.163) 4.231 4.120 ( -3.420 -3.184 1.998) 5.082 4.253 ( 4.924 -7.824 -2.529) 9.584 4.385 ( 1.762 -9.838 -2.607) 10.329 4.558 ( 1.746 6.303 1.121) 6.635 4.657 ( -0.367 0.126 -1.922) 1.961 4.820 ( 1.421 -7.940 -0.042) 8.066 4.923 ( 0.070 -7.737 -1.867) 7.960 5.277 ( 3.890 1.022 2.065) 4.521 5.467 ( -5.244 -3.011 -0.101) 6.047 5.682 ( -0.355 1.466 -0.494) 1.587 5.837 ( -4.816 6.805 -1.537) 8.477 5.899 ( 1.254 -2.805 4.553) 5.492 5.988 ( 1.823 -3.237 -3.643) 5.203 6.095 ( -2.194 -1.386 -0.363) 2.620 6.224 ( -4.955 -0.504 -2.163) 5.430 6.259 ( 2.900 1.137 3.585) 4.749 6.465 ( -2.708 -0.346 -4.787) 5.511 6.577 ( -3.658 -0.878 6.016) 7.096 6.671 ( 0.659 -0.522 -4.680) 4.755 6.784 ( -0.197 -0.120 4.439) 4.445 6.843 ( -0.707 1.542 1.584) 2.321 6.944 ( -0.590 -1.128 -2.003) 2.373 7.013 ( -3.395 -6.090 -3.349) 7.735 7.188 ( 0.697 4.255 3.243) 5.396 7.271 ( -2.180 -3.069 1.737) 4.146 7.310 ( 2.858 -8.840 -3.910) 10.080 7.537 ( -9.855 -3.066 1.048) 10.374 7.615 ( 1.306 5.166 3.882) 6.593 7.768 ( -0.916 -1.969 -3.907) 4.470 8.531 ( 12.636 -0.886 4.016) 13.289 8.554 ( 5.639 -8.611 2.938) 10.704 8.621 ( 8.252 -5.927 -2.079) 10.371 8.746 ( 8.777 -8.035 0.313) 11.904 9.348 ( -8.326 -4.419 4.513) 10.450 9.435 ( 2.182 -7.068 -6.756) 10.018 9.612 ( 8.019 -1.995 7.449) 11.125 9.873 ( 7.547 1.611 -1.728) 7.908 10.204 ( -11.478 13.424 1.617) 17.736 10.313 ( 5.698 10.854 -13.995) 18.604 11.000 ( 1.423 3.040 -3.351) 4.743 11.066 ( -3.574 2.468 3.774) 5.754 11.671 ( -1.911 -1.722 5.372) 5.956 11.805 ( 1.689 1.152 -9.325) 9.547 12.246 ( 4.658 0.562 4.990) 6.849 12.413 ( 3.764 -4.314 -0.348) 5.736 12.478 ( 0.164 -8.464 2.353) 8.786 12.599 ( 0.740 6.787 0.141) 6.828 12.718 ( -3.573 -1.366 -6.798) 7.800 12.812 ( -9.758 4.578 -3.289) 11.269 13.136 ( 1.866 9.810 5.375) 11.341 13.446 ( -0.551 4.758 3.610) 5.998 13.563 ( 3.242 7.542 0.525) 8.226 13.641 ( -6.077 5.234 -0.450) 8.033 14.675 ( 1.065 -6.415 8.564) 10.753 14.920 ( -1.039 -4.795 -11.738) 12.723 15.139 ( 0.657 0.742 -1.312) 1.645 15.247 ( -4.311 2.271 1.147) 5.006 ======================= Grid point 236 (112/141) ======================= q-point: (-0.20 0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.193 ( -6.766 17.310 9.732) 20.979 1.337 ( 2.500 10.102 11.995) 15.880 1.413 ( 5.397 10.921 1.683) 12.297 1.732 ( -4.589 11.015 -14.771) 18.988 1.993 ( 5.583 28.288 7.001) 29.672 2.133 ( -2.785 16.477 -6.898) 18.079 2.358 ( 3.587 1.247 4.504) 5.892 2.448 ( -4.705 4.116 -4.814) 7.890 2.805 ( -1.694 2.204 3.419) 4.407 2.870 ( 2.768 0.694 -3.382) 4.425 3.607 ( 0.803 3.102 1.401) 3.497 3.648 ( -0.933 1.924 -2.944) 3.639 3.980 ( 2.713 -3.280 3.134) 5.286 4.009 ( -1.717 -5.252 -0.602) 5.558 4.089 ( -4.153 -5.138 4.648) 8.078 4.170 ( 4.258 -5.566 -1.657) 7.201 4.391 ( 2.848 -5.197 -0.573) 5.954 4.442 ( -2.709 -5.198 -5.083) 7.758 4.591 ( 2.053 -2.595 0.363) 3.329 4.614 ( -2.336 -1.604 -2.305) 3.653 4.930 ( -1.553 -8.364 3.827) 9.328 4.989 ( 0.255 -8.773 -2.444) 9.111 5.345 ( 0.326 1.870 4.316) 4.715 5.414 ( 0.676 -1.914 -2.859) 3.506 5.661 ( -0.569 2.483 0.086) 2.549 5.699 ( 0.050 7.073 -3.695) 7.980 5.932 ( -1.026 -2.304 6.173) 6.669 6.037 ( 0.156 -2.399 -4.299) 4.925 6.138 ( 4.179 -1.520 0.387) 4.464 6.160 ( -2.539 -0.916 -2.714) 3.828 6.302 ( 2.734 1.593 3.696) 4.866 6.396 ( -2.568 1.586 -5.832) 6.567 6.554 ( -2.381 -0.142 7.198) 7.583 6.672 ( 1.379 0.556 -5.122) 5.334 6.799 ( 0.857 0.866 3.369) 3.583 6.824 ( 0.621 2.457 0.401) 2.566 6.963 ( 2.594 -2.145 -0.416) 3.391 6.975 ( -2.384 -0.649 -1.723) 3.013 7.182 ( 2.808 2.875 3.194) 5.133 7.215 ( -4.853 2.274 0.518) 5.384 7.378 ( -9.475 1.100 4.302) 10.464 7.484 ( 8.929 -5.415 -5.725) 11.909 7.668 ( 0.663 -4.276 4.241) 6.059 7.773 ( 2.257 -5.491 -7.526) 9.586 8.648 ( -3.140 -9.735 11.249) 15.205 8.796 ( 5.285 -0.573 1.868) 5.635 8.815 ( 7.747 -9.926 -3.951) 13.196 8.834 ( -4.316 -3.052 -0.154) 5.288 9.135 ( -19.101 2.598 12.226) 22.827 9.433 ( 9.346 4.223 -16.904) 19.772 9.848 ( -10.133 15.990 7.865) 20.499 9.945 ( 14.021 -6.329 2.942) 15.662 10.047 ( 2.687 -11.912 -3.024) 12.580 10.227 ( 0.255 6.892 -20.646) 21.767 10.966 ( -4.730 4.047 1.729) 6.461 10.998 ( 4.664 4.556 -1.788) 6.761 11.640 ( -3.755 1.611 6.945) 8.058 11.779 ( 1.184 2.753 -7.970) 8.515 12.373 ( 4.393 -0.649 9.096) 10.123 12.480 ( -1.035 -1.917 3.002) 3.709 12.495 ( 0.494 6.106 -1.192) 6.241 12.551 ( -6.193 6.375 -5.178) 10.286 12.635 ( -0.296 -3.338 -0.917) 3.474 12.662 ( -0.820 -5.392 -2.811) 6.135 13.150 ( 7.434 10.010 7.677) 14.642 13.277 ( -7.557 8.969 -5.687) 13.034 13.529 ( 0.816 5.066 4.606) 6.896 13.585 ( 1.480 5.046 -1.354) 5.430 14.750 ( -1.413 -5.246 6.654) 8.590 14.903 ( -0.198 -1.487 -9.549) 9.666 15.153 ( -0.158 1.362 0.897) 1.638 15.180 ( 1.383 1.662 -1.975) 2.929 ======================= Grid point 237 (113/141) ======================= q-point: (-0.10 0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.062 ( 7.675 12.088 10.038) 17.486 1.372 ( 5.107 9.574 12.134) 16.278 1.472 ( 8.513 11.554 1.757) 14.458 1.495 ( 7.771 15.997 -12.349) 21.652 1.944 ( 15.005 22.058 10.605) 28.708 1.995 ( 5.895 12.228 -15.835) 20.857 2.258 ( -6.550 3.712 -2.225) 7.851 2.503 ( 5.268 -2.167 4.211) 7.084 2.793 ( 1.441 -1.548 0.052) 2.116 2.936 ( 6.056 0.642 -2.145) 6.456 3.534 ( -3.197 1.789 -0.960) 3.787 3.659 ( 3.565 4.473 0.922) 5.794 3.999 ( -3.612 -5.802 1.129) 6.927 4.053 ( -3.198 -2.600 0.020) 4.122 4.095 ( 0.771 -2.065 0.347) 2.232 4.267 ( -0.121 -4.282 1.450) 4.522 4.363 ( -7.464 -2.571 -3.146) 8.498 4.436 ( 0.743 0.972 -4.293) 4.465 4.594 ( -4.319 -7.556 0.212) 8.706 4.658 ( -0.996 -4.786 0.125) 4.890 4.935 ( -4.882 -4.609 3.368) 7.511 5.102 ( 1.071 -9.252 0.034) 9.314 5.240 ( -6.370 4.692 1.347) 8.026 5.508 ( 7.753 2.799 -3.344) 8.895 5.588 ( -1.832 3.326 -0.425) 3.821 5.728 ( 5.511 0.617 0.055) 5.545 5.963 ( -0.177 -2.727 5.227) 5.899 6.029 ( -1.338 -1.023 -3.369) 3.767 6.145 ( 1.854 0.170 -2.729) 3.304 6.207 ( 2.381 0.428 0.790) 2.545 6.311 ( -2.382 1.974 -5.370) 6.197 6.349 ( 3.297 3.108 2.133) 5.008 6.524 ( -2.913 0.690 6.750) 7.384 6.681 ( 2.556 1.932 -4.346) 5.400 6.807 ( 0.820 2.283 -0.947) 2.605 6.840 ( 3.158 0.024 0.877) 3.277 6.941 ( -0.505 0.714 -2.335) 2.493 7.090 ( 6.374 1.031 -1.221) 6.571 7.129 ( -1.394 -1.465 3.489) 4.033 7.218 ( 0.622 3.144 6.153) 6.937 7.250 ( -2.789 0.891 2.323) 3.737 7.635 ( 1.607 1.143 -4.681) 5.080 7.704 ( 2.718 -7.403 -0.188) 7.888 7.944 ( 7.539 -8.179 -4.329) 11.936 8.536 ( -14.626 1.736 -2.693) 14.973 8.666 ( -17.129 9.229 5.614) 20.251 8.731 ( -4.713 -12.835 9.594) 16.703 8.989 ( 1.108 -9.929 -7.152) 12.287 9.058 ( 9.494 6.445 10.346) 15.450 9.457 ( -5.637 10.540 -2.476) 12.207 9.714 ( 3.711 -8.183 -2.276) 9.269 9.972 ( 11.579 25.476 -18.757) 33.689 10.116 ( -8.574 -11.750 -4.576) 15.249 10.219 ( -9.612 -18.086 0.643) 20.492 10.900 ( 1.956 2.399 0.888) 3.221 11.083 ( 8.696 0.141 -2.200) 8.971 11.567 ( -2.348 5.463 8.573) 10.433 11.771 ( 3.511 2.393 -5.331) 6.817 12.272 ( -8.762 2.733 -0.732) 9.207 12.382 ( -0.376 3.609 3.284) 4.894 12.487 ( 2.777 6.267 -3.706) 7.793 12.611 ( 2.921 -1.588 5.894) 6.767 12.670 ( 1.416 -7.034 5.086) 8.795 12.757 ( 3.984 -1.846 -2.133) 4.881 13.070 ( -4.124 7.397 -5.915) 10.330 13.205 ( 7.554 8.751 8.336) 14.253 13.415 ( -3.710 9.339 -1.217) 10.122 13.650 ( 7.232 2.288 -0.966) 7.646 14.786 ( -0.216 -2.654 7.105) 7.587 14.896 ( 0.018 -1.607 -6.673) 6.864 15.122 ( -0.462 0.885 -0.918) 1.356 15.225 ( 4.566 2.749 -2.255) 5.787 ======================= Grid point 241 (114/141) ======================= q-point: ( 0.30 0.30 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.800 ( 3.935 -0.000 0.819) 4.019 1.888 ( 2.367 -0.000 0.022) 2.368 2.084 ( 5.017 -0.000 -5.554) 7.485 2.189 ( 4.933 -0.000 2.309) 5.446 2.309 ( -1.002 0.000 1.204) 1.567 2.497 ( 2.071 -0.000 -2.643) 3.358 2.686 ( 5.723 -0.000 -1.734) 5.980 2.925 ( -4.586 0.000 -2.098) 5.043 2.926 ( -6.956 0.000 1.996) 7.236 2.991 ( 2.986 -0.000 0.435) 3.017 3.215 ( -7.612 0.000 3.771) 8.495 3.461 ( -10.935 0.000 0.837) 10.967 3.780 ( 5.076 -0.000 -1.654) 5.339 3.812 ( 3.695 -0.000 -0.311) 3.708 3.942 ( -0.510 0.000 -1.001) 1.123 4.131 ( 0.450 -0.000 -1.042) 1.135 4.140 ( 2.502 -0.000 0.890) 2.655 4.273 ( -3.281 0.000 -0.243) 3.290 4.299 ( -2.553 0.000 0.472) 2.596 4.572 ( 7.991 -0.000 1.527) 8.136 4.719 ( 4.061 -0.000 3.981) 5.687 5.079 ( 11.988 -0.000 1.875) 12.134 5.281 ( 0.091 -0.000 0.622) 0.629 5.466 ( -3.290 0.000 -6.922) 7.664 5.706 ( 0.647 -0.000 2.251) 2.342 5.744 ( -1.958 0.000 3.687) 4.174 5.856 ( 3.350 -0.000 -0.535) 3.393 6.147 ( 0.512 -0.000 -1.005) 1.127 6.169 ( -5.419 0.000 -8.373) 9.973 6.276 ( 7.965 -0.000 -2.494) 8.346 6.317 ( 2.364 -0.000 5.995) 6.444 6.361 ( -1.783 0.000 -1.790) 2.526 6.487 ( -2.552 0.000 3.827) 4.600 6.561 ( -0.845 0.000 0.167) 0.861 6.710 ( 9.799 -0.000 -0.661) 9.822 6.781 ( 4.043 -0.000 1.490) 4.309 6.837 ( -3.867 0.000 -0.370) 3.885 6.870 ( 0.463 -0.000 -0.116) 0.477 6.995 ( 0.146 -0.000 -1.547) 1.554 7.120 ( -0.825 0.000 -3.829) 3.917 7.212 ( -4.138 0.000 2.269) 4.719 7.640 ( -1.986 0.000 -0.508) 2.050 7.710 ( -0.196 0.000 -2.124) 2.133 7.928 ( 1.566 -0.000 0.928) 1.820 7.978 ( -10.088 0.000 6.813) 12.173 8.170 ( 1.248 -0.000 -3.445) 3.664 8.350 ( -5.129 0.000 4.621) 6.904 8.614 ( 0.227 -0.000 -4.762) 4.767 9.273 ( -5.545 0.000 0.672) 5.585 9.276 ( -7.042 0.000 0.631) 7.071 9.905 ( 0.986 -0.000 4.505) 4.612 10.248 ( 4.813 -0.000 1.639) 5.084 10.450 ( 1.888 -0.000 0.327) 1.916 10.759 ( -18.411 0.000 -11.624) 21.774 10.935 ( 1.042 -0.000 -0.416) 1.122 10.951 ( 3.473 -0.000 6.177) 7.086 11.550 ( -0.317 0.000 2.384) 2.405 11.920 ( -6.525 0.000 -4.257) 7.791 12.097 ( 1.645 -0.000 2.349) 2.868 12.125 ( 2.064 -0.000 -3.953) 4.459 12.386 ( 0.760 -0.000 8.967) 8.999 12.614 ( 3.770 -0.000 4.521) 5.887 12.748 ( -0.094 0.000 -12.550) 12.550 12.757 ( 3.436 -0.000 0.325) 3.451 13.340 ( 2.100 -0.000 -2.236) 3.068 13.551 ( 4.443 -0.000 3.544) 5.683 13.783 ( -3.739 0.000 -3.548) 5.154 13.941 ( 9.046 -0.000 6.802) 11.318 14.497 ( 3.168 -0.000 -9.645) 10.152 14.686 ( -10.180 0.000 6.043) 11.838 15.218 ( 0.375 -0.000 -1.383) 1.433 15.436 ( 1.766 -0.000 1.955) 2.635 ======================= Grid point 242 (115/141) ======================= q-point: (-0.60 0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.856 ( 2.490 1.968 1.327) 3.439 1.901 ( 0.949 2.397 1.229) 2.856 2.059 ( -1.437 7.251 -4.332) 8.568 2.189 ( -3.398 3.163 0.844) 4.718 2.274 ( -5.336 -3.155 1.890) 6.481 2.517 ( 1.274 -0.102 -5.523) 5.668 2.816 ( 3.268 1.251 0.001) 3.499 2.830 ( 3.161 1.554 -0.304) 3.536 2.903 ( -0.911 -2.459 1.477) 3.010 3.089 ( 3.679 -4.676 -0.030) 5.950 3.157 ( -0.606 -3.056 2.859) 4.228 3.298 ( -6.995 -1.755 -0.357) 7.220 3.830 ( 2.221 0.698 -3.777) 4.437 3.876 ( 2.819 -0.394 0.160) 2.851 3.960 ( 2.360 -1.672 0.813) 3.005 4.110 ( -0.559 0.738 -5.035) 5.119 4.190 ( 1.322 2.609 7.051) 7.634 4.232 ( -2.851 0.618 0.121) 2.920 4.276 ( 0.242 -3.575 -0.883) 3.690 4.675 ( 2.817 -0.770 1.755) 3.408 4.810 ( 4.674 0.747 2.327) 5.275 5.198 ( -2.168 8.604 2.231) 9.149 5.268 ( 6.847 0.705 1.229) 6.992 5.423 ( -4.396 -8.198 -5.773) 10.949 5.628 ( -5.300 5.124 3.688) 8.243 5.760 ( 1.130 -2.350 2.984) 3.963 5.987 ( 3.612 2.584 -4.783) 6.527 6.024 ( 1.835 2.682 -0.280) 3.261 6.147 ( -4.011 -5.321 -3.887) 7.714 6.245 ( -6.756 -2.859 -1.867) 7.570 6.340 ( -0.843 0.656 4.377) 4.506 6.423 ( -0.782 -4.442 -1.104) 4.644 6.523 ( 0.990 0.816 0.293) 1.316 6.588 ( 4.643 -4.139 -1.939) 6.515 6.742 ( -2.510 1.441 1.036) 3.075 6.804 ( -3.124 -3.925 -0.421) 5.034 6.891 ( 5.575 0.196 2.677) 6.188 7.001 ( 8.482 3.376 -1.600) 9.269 7.044 ( 0.683 2.592 -0.599) 2.747 7.125 ( 8.876 -6.912 -2.221) 11.467 7.132 ( -3.232 -6.102 1.330) 7.032 7.510 ( -12.225 -0.406 0.371) 12.237 7.717 ( 2.747 0.482 -0.638) 2.861 7.866 ( -3.997 0.439 4.413) 5.970 7.967 ( 4.054 0.174 -0.254) 4.065 8.241 ( 7.353 2.184 -4.240) 8.764 8.295 ( -3.265 -1.083 7.142) 7.927 8.591 ( -0.831 0.558 -6.570) 6.646 9.178 ( -3.556 -0.355 0.485) 3.607 9.214 ( -3.491 -3.423 1.160) 5.025 9.864 ( -3.581 6.667 9.227) 11.933 10.289 ( -1.253 11.068 -7.379) 13.362 10.387 ( -0.098 3.723 -1.463) 4.001 10.570 ( -2.335 -6.289 -1.506) 6.876 10.966 ( 2.913 0.719 0.008) 3.000 11.036 ( 1.766 -3.806 4.493) 6.147 11.548 ( -0.750 -1.269 1.133) 1.859 11.820 ( -3.111 0.013 -6.366) 7.086 12.139 ( 1.866 -1.481 1.835) 3.007 12.162 ( 2.405 -1.117 -2.767) 3.832 12.401 ( 0.799 4.530 9.545) 10.596 12.691 ( 0.388 -2.213 -10.776) 11.008 12.737 ( 3.628 2.755 5.111) 6.847 12.850 ( 4.685 -6.377 -1.453) 8.045 13.333 ( -1.237 1.456 -0.156) 1.917 13.547 ( -6.001 0.096 2.320) 6.435 13.722 ( 1.604 3.940 -4.071) 5.888 14.081 ( 4.277 0.916 3.233) 5.439 14.485 ( -2.516 5.212 4.200) 7.151 14.622 ( 0.481 -8.217 -4.919) 9.589 15.205 ( -1.043 0.285 -2.426) 2.656 15.443 ( -1.576 0.643 2.662) 3.160 ======================= Grid point 243 (116/141) ======================= q-point: (-0.50 0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.817 ( -0.292 8.587 -1.191) 8.675 1.861 ( -4.746 9.566 5.329) 11.935 1.940 ( 0.309 5.751 -2.361) 6.225 2.043 ( -8.473 4.539 2.047) 9.828 2.217 ( -3.860 -2.025 -0.388) 4.376 2.524 ( 1.364 -0.771 -5.806) 6.014 2.784 ( -1.470 1.411 -0.180) 2.046 2.845 ( -7.830 0.527 1.247) 7.947 2.946 ( 7.476 3.606 1.230) 8.391 3.071 ( -1.251 5.969 -1.041) 6.187 3.308 ( 8.996 -8.592 -0.738) 12.462 3.388 ( 7.055 -9.621 0.561) 11.944 3.832 ( 0.527 0.604 -3.997) 4.076 3.911 ( -0.427 0.256 2.029) 2.089 4.027 ( 0.703 -4.162 1.050) 4.350 4.046 ( -2.618 1.559 -1.906) 3.594 4.177 ( -2.916 0.881 2.705) 4.074 4.203 ( 2.282 1.988 2.122) 3.696 4.377 ( 3.785 -8.809 -0.208) 9.590 4.690 ( -2.813 -2.828 -0.549) 4.026 4.833 ( 0.960 6.696 0.665) 6.797 5.055 ( -2.867 9.201 0.527) 9.652 5.317 ( 0.152 3.487 1.558) 3.822 5.412 ( -2.973 -5.186 -4.049) 7.220 5.576 ( -1.161 -4.686 6.841) 8.373 5.801 ( 0.557 -0.767 3.363) 3.494 5.891 ( -2.124 1.079 -7.005) 7.399 6.096 ( -5.061 -1.773 -4.213) 6.819 6.142 ( -2.338 -2.348 -0.105) 3.316 6.174 ( 1.858 -2.185 0.581) 2.927 6.290 ( -5.876 0.122 2.512) 6.392 6.423 ( -4.441 -6.643 -2.178) 8.282 6.526 ( -0.583 -2.752 1.942) 3.418 6.631 ( -1.531 -0.420 -0.040) 1.588 6.732 ( 0.167 -4.901 -3.945) 6.294 6.784 ( -2.469 -3.215 -1.420) 4.295 6.937 ( 0.120 -0.185 -0.988) 1.012 6.953 ( -4.162 -0.312 2.297) 4.764 7.047 ( -1.846 -3.962 1.149) 4.520 7.246 ( 7.550 -1.228 0.581) 7.671 7.250 ( -12.933 -1.530 3.300) 13.435 7.449 ( 9.456 -2.266 -1.404) 9.825 7.763 ( 3.196 4.321 0.926) 5.454 7.875 ( 3.506 1.913 -0.102) 3.995 8.141 ( 16.112 -3.146 -1.377) 16.474 8.312 ( 6.528 -2.551 6.351) 9.458 8.355 ( 5.375 -0.611 0.362) 5.421 8.550 ( -0.745 0.157 -6.293) 6.339 9.177 ( 1.576 -2.724 -0.147) 3.151 9.231 ( 1.531 -2.502 0.080) 2.934 9.738 ( -6.901 5.733 11.294) 14.423 10.052 ( -7.226 6.942 -9.955) 14.124 10.443 ( 7.263 3.795 -4.917) 9.557 10.584 ( -0.450 3.857 4.308) 5.799 11.013 ( 3.855 1.218 -1.490) 4.308 11.102 ( 1.220 -1.347 3.779) 4.193 11.570 ( -0.153 -3.579 3.194) 4.799 11.784 ( 0.838 -0.961 -8.692) 8.785 12.196 ( -0.189 -3.591 5.080) 6.224 12.210 ( 3.702 -1.755 -4.075) 5.779 12.382 ( -1.401 2.670 7.414) 8.003 12.679 ( 0.332 -2.600 -13.972) 14.216 12.752 ( 1.230 4.455 3.071) 5.549 12.981 ( 1.435 -2.825 0.965) 3.312 13.306 ( 1.129 2.403 3.773) 4.614 13.437 ( -4.598 0.254 1.430) 4.822 13.708 ( 2.169 5.892 0.098) 6.279 14.021 ( -6.614 5.775 -4.468) 9.852 14.474 ( 0.473 -1.790 13.504) 13.630 14.727 ( 3.828 -7.345 -10.698) 13.530 15.171 ( -1.361 0.552 -2.071) 2.539 15.385 ( -4.694 1.424 2.435) 5.476 ======================= Grid point 244 (117/141) ======================= q-point: (-0.40 0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.656 ( -5.272 13.530 10.425) 17.876 1.708 ( -0.240 10.790 -3.304) 11.287 1.786 ( -9.073 10.862 5.883) 15.326 1.936 ( -0.152 3.189 -7.969) 8.584 2.213 ( 2.399 -0.419 0.277) 2.451 2.541 ( 1.485 1.224 -3.311) 3.829 2.618 ( -11.594 3.560 -0.227) 12.131 2.755 ( -2.569 4.034 -2.998) 5.644 2.967 ( 2.771 11.592 5.383) 13.078 3.028 ( 4.228 9.412 -1.818) 10.477 3.522 ( 6.563 -5.908 -1.271) 8.921 3.597 ( 4.695 -8.043 -1.645) 9.457 3.815 ( -3.761 0.229 2.558) 4.554 3.854 ( -0.309 -2.935 -1.211) 3.190 4.046 ( -2.397 -2.306 3.630) 4.924 4.085 ( 2.826 -4.360 0.546) 5.224 4.136 ( -1.998 -1.153 -0.576) 2.378 4.232 ( 0.429 -3.038 -1.922) 3.621 4.541 ( 3.066 -10.141 1.287) 10.672 4.671 ( -3.701 -7.469 -3.732) 9.133 4.746 ( 0.837 10.589 3.679) 11.241 4.933 ( -1.932 7.826 -3.118) 8.643 5.293 ( 0.698 1.042 2.430) 2.734 5.402 ( -2.768 -3.507 -1.959) 4.878 5.649 ( -0.021 -5.552 5.686) 7.947 5.820 ( -2.146 -3.838 3.432) 5.578 5.879 ( 2.928 -1.376 -5.396) 6.291 5.988 ( -5.662 1.320 -3.885) 6.993 6.076 ( -3.359 -0.757 -0.272) 3.454 6.183 ( -6.334 -2.981 -1.140) 7.093 6.268 ( 3.218 -0.397 3.347) 4.660 6.414 ( -2.326 -5.286 -4.634) 7.404 6.548 ( -1.767 -2.481 4.159) 5.155 6.629 ( 0.324 -2.261 -0.594) 2.360 6.748 ( -3.191 -4.233 0.598) 5.334 6.809 ( 0.875 -4.827 -3.757) 6.179 6.908 ( -2.868 -1.783 1.542) 3.712 6.940 ( 1.205 0.390 -2.913) 3.177 7.077 ( -2.000 -8.588 -0.784) 8.853 7.120 ( -7.561 -8.976 5.532) 12.975 7.332 ( 5.016 4.941 2.518) 7.477 7.521 ( -0.350 1.935 -2.585) 3.248 7.750 ( 2.268 6.814 1.240) 7.288 7.847 ( -0.700 6.381 -1.861) 6.684 8.387 ( -0.754 -4.907 6.070) 7.842 8.467 ( 9.128 -5.530 -4.127) 11.442 8.567 ( 10.419 -0.452 -1.490) 10.535 8.626 ( 13.018 -4.719 3.240) 14.221 9.254 ( 1.035 -2.926 3.047) 4.350 9.317 ( 5.728 -4.413 -5.067) 8.829 9.620 ( -3.762 1.553 9.265) 10.119 9.880 ( -6.096 -0.394 -7.957) 10.032 10.475 ( -5.250 11.938 8.074) 15.338 10.504 ( 8.665 7.386 -10.761) 15.666 11.054 ( 3.347 2.245 -2.221) 4.601 11.109 ( -1.249 2.083 2.818) 3.720 11.615 ( -1.007 -3.744 6.154) 7.274 11.803 ( 2.334 -1.065 -10.068) 10.389 12.237 ( 0.761 -2.229 7.652) 8.006 12.306 ( 4.438 -5.337 -2.624) 7.421 12.364 ( -2.501 -2.319 5.089) 6.126 12.656 ( -1.931 -3.328 -14.100) 14.615 12.736 ( 2.950 6.457 -0.263) 7.104 12.914 ( -6.936 4.220 -0.030) 8.119 13.299 ( 2.547 6.552 4.688) 8.450 13.484 ( 5.333 -0.754 7.409) 9.160 13.671 ( -0.236 5.279 -0.726) 5.334 13.791 ( -9.248 7.220 -5.469) 12.945 14.556 ( -0.230 -5.019 13.034) 13.968 14.811 ( 2.421 -5.609 -12.500) 13.913 15.153 ( 0.939 0.697 -0.898) 1.475 15.284 ( -5.663 1.451 1.369) 6.004 ======================= Grid point 245 (118/141) ======================= q-point: (-0.30 0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.513 ( -1.026 14.476 7.147) 16.177 1.548 ( -4.834 12.435 16.043) 20.866 1.623 ( 4.148 9.753 -4.215) 11.406 1.864 ( 0.155 5.843 -13.531) 14.740 2.296 ( 6.965 1.891 2.954) 7.798 2.371 ( -8.796 5.429 -4.431) 11.247 2.525 ( 1.503 11.695 5.519) 13.019 2.636 ( -0.130 10.933 -5.489) 12.234 2.894 ( -2.594 8.304 4.328) 9.717 2.966 ( 3.764 11.001 -2.919) 11.988 3.615 ( -4.286 -2.904 0.523) 5.204 3.641 ( 3.557 -2.046 -2.194) 4.653 3.860 ( -0.646 -8.292 2.593) 8.711 3.910 ( 1.611 -4.057 -2.225) 4.900 4.037 ( -0.558 -0.847 4.343) 4.460 4.103 ( 1.443 -0.574 -0.527) 1.640 4.224 ( 2.254 -9.539 -0.495) 9.815 4.267 ( -2.886 -9.013 -3.764) 10.185 4.627 ( -0.912 -1.079 1.956) 2.413 4.656 ( -0.023 2.316 -0.967) 2.510 4.772 ( 3.293 -4.837 2.433) 6.337 4.836 ( -2.798 -1.151 -4.389) 5.331 5.339 ( 2.464 -1.551 2.142) 3.615 5.372 ( -2.490 -1.684 -1.000) 3.169 5.703 ( 1.068 -0.434 4.764) 4.902 5.806 ( -1.597 1.264 -4.899) 5.305 5.884 ( -1.440 -1.069 3.452) 3.890 5.968 ( 0.710 -3.922 -3.495) 5.301 6.089 ( 2.664 -2.791 1.919) 4.309 6.133 ( -1.142 -2.453 -4.075) 4.891 6.320 ( 1.851 0.118 3.283) 3.771 6.403 ( -1.604 -1.337 -5.143) 5.551 6.551 ( -1.009 -0.455 6.055) 6.155 6.655 ( 1.013 -1.925 -4.820) 5.289 6.771 ( -0.056 -5.471 4.697) 7.210 6.825 ( -1.411 -0.884 2.073) 2.659 6.901 ( -1.621 -4.343 -1.215) 4.793 6.954 ( 1.800 0.171 -4.194) 4.567 7.139 ( -2.966 -10.442 4.267) 11.663 7.189 ( 2.258 -8.093 -0.549) 8.420 7.379 ( 5.686 2.222 1.556) 6.300 7.423 ( -4.817 4.837 -2.848) 7.396 7.719 ( 2.127 7.379 1.393) 7.805 7.770 ( -0.003 4.384 -4.552) 6.320 8.436 ( -4.057 -8.437 8.996) 12.984 8.575 ( 2.538 -9.771 -6.244) 11.871 8.750 ( -5.533 -4.070 2.801) 7.418 8.800 ( 9.544 -1.738 -2.368) 9.985 9.180 ( -11.312 1.128 14.649) 18.543 9.439 ( 5.779 -1.639 -12.703) 14.051 9.717 ( 5.457 -7.764 5.316) 10.877 9.823 ( -3.280 -8.201 -6.049) 10.705 10.248 ( -5.477 17.797 11.028) 21.642 10.513 ( 8.064 12.485 -17.958) 23.310 11.038 ( -4.006 3.139 2.497) 5.669 11.079 ( 3.679 3.653 -2.036) 5.570 11.633 ( -2.658 -1.908 8.494) 9.102 11.799 ( -0.055 -0.329 -9.225) 9.231 12.332 ( 1.797 -5.156 12.137) 13.309 12.360 ( -3.488 -4.099 4.462) 6.991 12.440 ( 4.500 -6.829 -3.210) 8.786 12.592 ( -4.853 -1.733 -13.860) 14.787 12.712 ( -4.629 7.609 1.729) 9.073 12.744 ( 4.741 8.023 -2.071) 9.547 13.344 ( 8.958 9.063 7.126) 14.600 13.454 ( -7.731 8.615 -3.628) 12.130 13.593 ( -1.788 1.504 4.426) 5.005 13.677 ( 2.999 4.051 -3.536) 6.157 14.627 ( -2.182 -6.535 11.649) 13.534 14.847 ( 0.685 -3.711 -11.654) 12.250 15.178 ( -0.698 1.137 1.141) 1.755 15.204 ( 1.526 0.860 -1.638) 2.399 ======================= Grid point 246 (119/141) ======================= q-point: (-0.20 0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.345 ( 1.918 15.749 6.219) 17.041 1.532 ( 4.212 8.309 17.915) 20.192 1.645 ( 9.683 7.312 -6.804) 13.911 1.742 ( -0.860 10.213 -9.371) 13.888 2.213 ( -0.165 5.277 -5.556) 7.665 2.405 ( 10.839 20.031 1.663) 22.836 2.448 ( 4.039 7.622 7.206) 11.240 2.512 ( 1.280 11.069 -4.253) 11.926 2.800 ( -0.175 3.068 1.656) 3.491 2.960 ( 3.795 2.655 -3.457) 5.780 3.555 ( -4.473 -0.681 0.250) 4.532 3.703 ( 1.838 -1.098 -0.799) 2.285 3.877 ( -3.965 -5.812 0.837) 7.085 3.963 ( -1.377 -5.626 -0.838) 5.852 4.087 ( 3.913 0.671 2.801) 4.859 4.170 ( 2.355 -3.660 -1.978) 4.781 4.251 ( -7.346 -8.274 -2.744) 11.400 4.345 ( -0.556 -9.944 0.685) 9.983 4.586 ( -1.640 6.160 -2.076) 6.704 4.627 ( 1.031 1.163 1.479) 2.145 4.822 ( -3.760 -6.183 -0.282) 7.242 4.896 ( 0.718 -9.551 0.983) 9.629 5.296 ( -4.492 1.401 0.368) 4.720 5.456 ( 4.784 -4.790 0.782) 6.815 5.674 ( -1.547 4.270 0.320) 4.553 5.827 ( 7.685 4.404 -1.813) 9.041 5.900 ( -1.148 -2.598 5.322) 6.032 5.979 ( -2.131 -3.801 -2.970) 5.274 6.135 ( 2.385 -1.009 -3.987) 4.754 6.208 ( 5.195 -0.865 0.090) 5.268 6.338 ( -1.719 1.099 -3.424) 3.986 6.384 ( 2.587 -0.046 1.572) 3.028 6.550 ( -1.276 1.513 7.249) 7.515 6.686 ( 2.759 -1.173 -4.553) 5.451 6.827 ( 0.261 -1.388 1.405) 1.992 6.843 ( 0.662 -1.532 1.915) 2.540 6.920 ( -0.267 -3.131 -1.141) 3.343 6.989 ( 2.466 -3.328 -0.595) 4.185 7.212 ( 2.305 -2.840 2.736) 4.568 7.246 ( 0.796 2.908 1.290) 3.279 7.293 ( -2.788 2.262 -1.619) 3.938 7.519 ( 4.575 -8.418 1.875) 9.763 7.687 ( 1.137 4.520 -0.155) 4.663 7.793 ( 6.123 -3.977 -8.551) 11.244 8.472 ( -5.488 -10.725 9.066) 15.078 8.560 ( -16.934 -0.120 -0.529) 16.943 8.660 ( -10.054 -7.345 -2.752) 12.752 8.785 ( -8.236 -7.814 -2.804) 11.694 9.182 ( 9.470 1.656 13.400) 16.492 9.473 ( -3.825 -9.508 -4.538) 11.209 9.656 ( -13.923 5.124 3.633) 15.274 9.935 ( 3.738 -8.783 -7.999) 12.454 10.114 ( 1.453 9.049 6.226) 11.080 10.417 ( 5.740 18.088 -19.526) 27.228 10.955 ( -1.399 2.802 1.244) 3.370 11.116 ( 4.896 2.296 -1.443) 5.597 11.615 ( -3.478 -0.006 10.447) 11.010 11.781 ( 0.391 -1.002 -6.320) 6.411 12.282 ( -10.149 -2.095 2.341) 10.624 12.416 ( -0.006 -0.164 2.306) 2.312 12.496 ( -3.137 -5.511 0.699) 6.380 12.561 ( 0.455 -4.077 3.816) 5.603 12.617 ( 3.965 5.185 -2.997) 7.183 12.823 ( 10.729 6.247 -1.578) 12.515 13.234 ( -4.906 8.636 -4.986) 11.113 13.402 ( 5.959 10.487 6.925) 13.908 13.556 ( -1.086 4.939 1.548) 5.288 13.695 ( 4.046 2.257 -4.530) 6.480 14.690 ( -1.348 -6.709 11.598) 13.466 14.847 ( -0.903 -3.144 -9.369) 9.924 15.139 ( -0.603 0.763 -0.736) 1.220 15.271 ( 5.397 1.945 -1.549) 5.942 ======================= Grid point 247 (120/141) ======================= q-point: (-0.10 0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.353 ( 10.722 8.929 5.223) 14.899 1.564 ( 2.822 9.823 6.715) 12.229 1.630 ( 3.387 5.874 1.641) 6.977 1.753 ( 10.939 6.762 -6.524) 14.421 2.191 ( 0.630 4.091 -1.894) 4.552 2.358 ( 16.527 20.436 -5.868) 26.930 2.463 ( 12.188 16.744 0.453) 20.715 2.529 ( -0.107 -1.704 4.575) 4.884 2.868 ( 8.712 -0.382 0.922) 8.769 3.008 ( 2.944 -1.923 -2.258) 4.179 3.490 ( -3.351 -0.103 0.251) 3.362 3.712 ( -1.190 0.190 0.247) 1.230 3.867 ( -4.295 -5.308 -0.017) 6.828 3.973 ( -2.561 -3.830 -0.698) 4.660 4.102 ( -1.134 2.976 -4.773) 5.738 4.171 ( -6.779 -5.668 2.550) 9.197 4.221 ( -1.963 -2.927 0.067) 3.525 4.398 ( -4.370 -8.825 0.651) 9.869 4.506 ( 0.488 5.656 -1.615) 5.902 4.623 ( -0.946 1.306 -0.135) 1.618 4.794 ( -6.287 -4.474 1.781) 7.919 4.963 ( -4.822 -9.126 0.648) 10.343 5.197 ( -3.849 2.754 1.083) 4.856 5.573 ( 1.316 -4.192 1.116) 4.533 5.628 ( 1.159 2.465 0.780) 2.834 5.885 ( 6.167 8.082 -1.982) 10.357 5.920 ( -1.432 -3.704 2.325) 4.601 5.988 ( 0.971 -2.324 -2.954) 3.882 6.191 ( 2.120 -1.049 -1.116) 2.615 6.229 ( -1.366 1.284 -4.038) 4.452 6.311 ( 2.723 2.484 -1.079) 3.841 6.447 ( 3.595 1.878 3.721) 5.505 6.524 ( -0.936 2.471 6.615) 7.123 6.741 ( 4.174 1.180 -4.448) 6.213 6.793 ( -4.114 0.680 -0.206) 4.174 6.869 ( 1.916 -1.441 -1.152) 2.660 6.933 ( -1.182 -1.293 0.236) 1.768 7.088 ( 2.107 -4.934 3.758) 6.550 7.203 ( 0.555 3.267 -2.674) 4.258 7.255 ( 0.279 3.890 1.566) 4.203 7.286 ( 2.037 1.448 2.003) 3.203 7.615 ( -1.588 0.068 -0.951) 1.852 7.729 ( 3.907 -2.350 -0.790) 4.627 7.939 ( 2.625 -7.694 -4.165) 9.134 8.261 ( -17.618 -3.406 -1.279) 17.990 8.338 ( -13.252 -0.899 1.775) 13.401 8.622 ( 2.179 -16.928 5.094) 17.812 8.831 ( -4.084 -13.841 -4.461) 15.104 9.264 ( -4.656 5.324 6.581) 9.661 9.344 ( -11.135 10.952 6.144) 16.783 9.575 ( 2.918 -14.293 -1.750) 14.692 9.907 ( -10.085 -4.531 -2.148) 11.263 10.139 ( 9.538 2.493 -5.248) 11.168 10.335 ( 8.627 14.486 -9.186) 19.200 10.953 ( 1.649 0.979 1.321) 2.329 11.198 ( 6.636 -1.132 -4.327) 8.003 11.583 ( -2.887 1.301 9.903) 10.397 11.800 ( 1.749 -2.009 -4.350) 5.101 12.166 ( -4.360 -0.449 1.674) 4.691 12.393 ( -1.966 1.857 -2.095) 3.421 12.497 ( -4.509 -6.938 4.206) 9.282 12.579 ( 0.976 0.751 3.278) 3.501 12.696 ( 3.930 -0.182 1.826) 4.337 12.937 ( 9.389 5.536 -1.186) 10.964 13.100 ( -0.018 8.090 -3.920) 8.990 13.421 ( 4.469 6.304 5.725) 9.618 13.456 ( -1.839 8.236 -1.401) 8.554 13.714 ( 1.928 2.149 -6.422) 7.041 14.768 ( -1.734 -4.804 5.067) 7.194 14.845 ( -0.153 -4.337 0.012) 4.340 15.137 ( 1.377 0.952 -1.059) 1.981 15.313 ( 3.276 3.337 -2.234) 5.182 ======================= Grid point 252 (121/141) ======================= q-point: (-0.60 0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 141 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.915 ( 1.247 -0.000 4.247) 4.427 1.936 ( 1.328 -0.000 -0.580) 1.450 2.062 ( -1.573 0.000 -7.191) 7.361 2.078 ( -9.754 0.000 4.562) 10.768 2.164 ( -5.394 0.000 2.922) 6.134 2.511 ( 1.699 -0.000 -8.068) 8.245 2.804 ( -2.392 0.000 2.387) 3.379 2.833 ( -7.971 0.000 -0.768) 8.008 3.003 ( 10.461 -0.000 -2.734) 10.813 3.112 ( 2.101 -0.000 3.980) 4.501 3.241 ( 9.241 -0.000 0.849) 9.280 3.260 ( 6.469 -0.000 -0.556) 6.493 3.839 ( -0.039 0.000 -4.832) 4.832 3.919 ( 1.632 -0.000 0.089) 1.634 3.978 ( 0.377 -0.000 1.568) 1.613 4.064 ( -4.509 0.000 -2.752) 5.282 4.220 ( -1.521 0.000 7.605) 7.755 4.235 ( 0.312 -0.000 -0.242) 0.394 4.249 ( 2.434 -0.000 -0.896) 2.594 4.664 ( -4.348 0.000 -0.845) 4.430 4.901 ( 4.319 -0.000 1.846) 4.697 5.218 ( -3.709 0.000 3.395) 5.028 5.268 ( -3.353 0.000 -4.586) 5.681 5.355 ( 1.618 -0.000 2.392) 2.888 5.567 ( -5.086 0.000 3.517) 6.183 5.761 ( -1.962 0.000 4.730) 5.121 5.984 ( -1.373 0.000 -9.426) 9.525 5.994 ( -4.653 0.000 -3.502) 5.823 6.112 ( -6.769 0.000 -0.827) 6.819 6.152 ( 6.091 -0.000 2.781) 6.696 6.311 ( -4.207 0.000 -0.171) 4.210 6.333 ( -5.851 0.000 0.298) 5.859 6.491 ( -2.447 0.000 1.659) 2.956 6.631 ( 1.664 -0.000 -6.332) 6.547 6.713 ( -2.095 0.000 -1.383) 2.510 6.714 ( -3.863 0.000 1.719) 4.228 6.929 ( -0.892 0.000 1.528) 1.770 6.953 ( -3.455 0.000 -1.812) 3.901 7.016 ( -4.508 0.000 2.632) 5.221 7.237 ( -14.189 0.000 2.984) 14.499 7.241 ( 12.660 -0.000 0.933) 12.694 7.429 ( 13.504 -0.000 -1.811) 13.625 7.838 ( -0.174 0.000 1.287) 1.298 7.859 ( 10.799 -0.000 -0.280) 10.802 8.107 ( 14.912 -0.000 -1.748) 15.014 8.283 ( 1.769 -0.000 8.738) 8.915 8.362 ( 5.945 -0.000 -1.547) 6.143 8.554 ( -1.161 0.000 -6.497) 6.600 9.147 ( 1.590 -0.000 -1.781) 2.388 9.216 ( 3.283 -0.000 2.630) 4.206 9.802 ( -9.172 0.000 8.753) 12.678 10.114 ( -14.506 0.000 -9.848) 17.533 10.480 ( 7.864 -0.000 -2.699) 8.314 10.624 ( 3.995 -0.000 4.899) 6.322 11.049 ( 1.197 -0.000 3.944) 4.122 11.067 ( 6.969 -0.000 -1.994) 7.249 11.529 ( -0.983 0.000 3.104) 3.256 11.773 ( 0.270 -0.000 -8.313) 8.317 12.155 ( 0.212 -0.000 4.330) 4.335 12.195 ( 2.978 -0.000 -3.383) 4.507 12.418 ( -4.282 0.000 9.470) 10.393 12.643 ( 0.010 -0.000 -15.305) 15.305 12.836 ( 1.995 -0.000 -1.899) 2.754 12.914 ( 6.735 -0.000 5.239) 8.533 13.328 ( 0.627 -0.000 3.497) 3.552 13.440 ( -5.112 0.000 1.229) 5.257 13.770 ( 1.634 -0.000 -1.765) 2.405 14.077 ( -6.563 0.000 -2.228) 6.931 14.467 ( -2.379 0.000 12.773) 12.992 14.642 ( 6.733 -0.000 -10.494) 12.468 15.177 ( -1.349 0.000 -2.252) 2.625 15.399 ( -4.873 0.000 2.589) 5.518 ======================= Grid point 254 (122/141) ======================= q-point: (-0.50 0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.880 ( -3.495 5.582 3.535) 7.475 1.882 ( -4.246 7.758 4.519) 9.932 1.933 ( -6.449 3.139 1.648) 7.360 2.001 ( 1.655 3.655 -6.082) 7.286 2.171 ( 2.163 -3.419 3.493) 5.345 2.542 ( 3.101 -0.521 -8.349) 8.921 2.653 ( -10.071 0.666 -0.007) 10.093 2.763 ( -3.249 -0.629 -0.763) 3.396 3.118 ( 5.615 4.444 1.681) 7.355 3.161 ( 3.744 1.522 0.292) 4.052 3.431 ( 11.434 -2.365 -0.737) 11.699 3.461 ( 9.786 -3.766 0.214) 10.488 3.802 ( -2.201 -1.122 -4.562) 5.188 3.864 ( -8.435 2.173 3.661) 9.448 3.992 ( -1.089 -2.410 1.839) 3.221 4.014 ( 0.931 -2.282 -2.953) 3.846 4.169 ( -1.627 4.875 4.196) 6.635 4.258 ( 1.249 2.333 1.261) 2.931 4.345 ( 2.834 -8.598 -0.358) 9.060 4.544 ( -8.703 -4.160 -3.781) 10.361 4.944 ( 3.684 7.240 1.992) 8.364 5.103 ( -2.234 8.244 0.568) 8.560 5.297 ( -0.691 -6.535 -0.931) 6.637 5.328 ( -2.958 0.883 0.695) 3.164 5.536 ( -1.347 -3.376 6.776) 7.690 5.724 ( -4.735 -4.497 1.080) 6.619 5.905 ( 1.320 3.735 -3.090) 5.023 5.991 ( -4.347 -0.946 -3.027) 5.381 6.010 ( -3.546 -4.794 -1.396) 6.124 6.170 ( -5.669 1.394 -2.652) 6.412 6.248 ( 1.021 -1.012 1.614) 2.162 6.286 ( -2.487 -5.806 -3.035) 7.008 6.489 ( -0.462 -2.409 4.187) 4.852 6.620 ( 0.075 0.743 -1.927) 2.067 6.674 ( -1.927 -1.855 0.393) 2.704 6.717 ( 0.417 -3.519 -4.518) 5.742 6.910 ( -1.037 0.254 0.154) 1.079 6.941 ( 1.151 -0.039 -1.711) 2.063 6.963 ( -2.727 -2.524 0.054) 3.716 7.016 ( -11.987 -2.122 6.661) 13.877 7.400 ( 6.710 1.813 2.973) 7.560 7.560 ( 3.119 1.312 -3.017) 4.533 7.850 ( 3.579 2.904 -1.344) 4.801 7.932 ( -1.712 1.775 1.419) 2.845 8.349 ( 0.823 0.230 4.678) 4.755 8.398 ( 9.709 -1.829 -3.222) 10.392 8.547 ( 13.708 -1.375 4.633) 14.535 8.573 ( 10.429 -0.645 -3.089) 10.896 9.228 ( 7.542 -0.560 -4.698) 8.903 9.271 ( 1.118 -0.452 3.914) 4.096 9.651 ( -8.580 1.280 6.532) 10.860 9.861 ( -12.329 -1.129 -7.613) 14.534 10.597 ( 8.353 2.313 -5.630) 10.336 10.638 ( -1.861 4.306 5.968) 7.591 11.076 ( 1.145 0.195 3.016) 3.232 11.154 ( 3.567 2.002 -2.788) 4.950 11.543 ( -0.823 -2.748 7.206) 7.756 11.778 ( 2.270 -0.952 -10.585) 10.867 12.178 ( -0.724 -2.205 7.923) 8.256 12.245 ( 3.534 -1.376 -3.595) 5.226 12.352 ( -4.800 0.181 7.526) 8.928 12.606 ( -0.066 -1.473 -16.574) 16.639 12.843 ( 2.444 3.695 -1.755) 4.765 12.958 ( -3.385 0.445 0.992) 3.556 13.394 ( 4.303 3.402 5.349) 7.662 13.448 ( 6.181 -2.413 6.811) 9.509 13.756 ( -1.433 2.658 -2.004) 3.624 13.885 ( -11.327 2.237 -6.305) 13.155 14.494 ( -1.061 -1.393 14.970) 15.072 14.727 ( 4.910 -2.512 -11.991) 13.199 15.163 ( 1.038 0.298 -1.117) 1.554 15.303 ( -6.373 0.467 1.635) 6.596 ======================= Grid point 255 (123/141) ======================= q-point: (-0.40 0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.759 ( -1.880 10.056 12.253) 15.962 1.770 ( -1.995 7.647 2.619) 8.326 1.804 ( -0.251 9.817 -0.731) 9.847 1.976 ( 2.334 4.826 -9.165) 10.617 2.287 ( 5.871 -1.861 6.010) 8.605 2.428 ( -8.227 1.255 -7.852) 11.442 2.640 ( 4.504 2.088 2.399) 5.513 2.708 ( -2.367 -0.549 -4.741) 5.327 3.102 ( -1.483 7.658 5.105) 9.322 3.182 ( 2.317 7.284 -3.445) 8.384 3.548 ( -1.749 -1.796 1.677) 3.016 3.592 ( 0.421 -2.195 -3.184) 3.890 3.740 ( -2.740 -3.312 5.098) 6.669 3.835 ( 4.652 -3.068 -4.892) 7.415 4.010 ( -0.351 -2.992 2.821) 4.127 4.068 ( 0.920 -5.675 -3.081) 6.523 4.132 ( 1.456 3.773 4.272) 5.883 4.207 ( -1.299 3.588 -3.612) 5.255 4.467 ( -0.685 -10.129 2.802) 10.532 4.528 ( -0.826 -10.118 -3.072) 10.607 4.903 ( 2.204 11.746 3.895) 12.569 4.976 ( -0.996 9.947 -4.261) 10.867 5.301 ( 0.136 -2.273 2.153) 3.134 5.341 ( -0.292 -2.049 -1.942) 2.838 5.616 ( 1.627 -6.896 8.236) 10.865 5.723 ( -2.163 -7.041 -1.745) 7.570 5.901 ( -3.664 0.524 -1.100) 3.861 5.927 ( 3.100 0.401 -1.376) 3.415 6.042 ( 1.912 -3.069 -0.277) 3.627 6.078 ( -1.984 -1.306 -3.328) 4.089 6.289 ( 0.715 -3.348 0.509) 3.461 6.328 ( 0.647 -5.742 -3.978) 7.015 6.524 ( -0.042 -2.348 5.264) 5.764 6.621 ( 0.437 -0.981 -3.994) 4.136 6.667 ( -1.771 -3.318 3.981) 5.477 6.751 ( 0.144 -4.504 -4.846) 6.618 6.877 ( -1.964 0.897 4.517) 5.007 6.935 ( -3.640 -5.406 3.628) 7.459 6.970 ( 1.249 -1.351 -2.188) 2.859 7.023 ( 5.071 -6.270 -2.621) 8.479 7.462 ( 2.942 3.705 3.161) 5.690 7.520 ( -2.916 3.922 -3.026) 5.748 7.853 ( -2.984 3.644 0.638) 4.753 7.875 ( 3.509 5.762 -1.486) 6.908 8.349 ( -1.893 -0.809 6.130) 6.466 8.449 ( 0.708 -3.138 -4.658) 5.661 8.689 ( -4.132 -1.991 5.040) 6.815 8.781 ( 7.636 -0.162 -4.746) 8.993 9.187 ( -10.210 -0.032 12.254) 15.950 9.404 ( 7.524 -1.566 -10.831) 13.281 9.622 ( 3.538 -2.569 4.256) 6.101 9.709 ( -3.467 -3.798 -5.153) 7.280 10.520 ( -5.266 9.720 6.958) 13.062 10.679 ( 7.610 4.928 -10.338) 13.750 11.083 ( -1.912 1.298 3.725) 4.383 11.144 ( 1.065 2.959 -3.024) 4.363 11.577 ( -2.240 -3.340 10.529) 11.271 11.776 ( -0.837 -1.673 -10.446) 10.612 12.217 ( -2.166 -4.511 9.204) 10.476 12.322 ( 0.429 -2.418 4.319) 4.968 12.330 ( 2.518 -2.777 -0.420) 3.772 12.567 ( -0.505 -0.803 -16.458) 16.486 12.836 ( -3.856 4.698 1.590) 6.283 12.867 ( 3.290 4.264 -1.838) 5.690 13.487 ( 9.960 5.326 6.816) 13.192 13.595 ( 3.246 1.453 7.487) 8.288 13.604 ( -9.167 4.076 -5.339) 11.365 13.725 ( -2.243 0.519 -6.534) 6.927 14.526 ( -2.917 -3.322 14.834) 15.479 14.778 ( 2.100 -2.896 -12.416) 12.921 15.198 ( -1.448 0.871 0.962) 1.944 15.215 ( 1.855 0.226 -0.861) 2.057 ======================= Grid point 256 (124/141) ======================= q-point: (-0.30 0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.640 ( -0.341 13.294 5.936) 14.563 1.715 ( 3.425 9.969 9.369) 14.103 1.781 ( 6.319 7.264 -1.761) 9.787 1.921 ( 0.831 7.394 -6.067) 9.601 2.282 ( -1.794 2.545 -6.319) 7.045 2.426 ( 3.378 -1.898 6.217) 7.326 2.671 ( 5.056 3.243 -3.422) 6.913 2.719 ( 5.496 4.887 0.532) 7.374 2.966 ( -3.922 11.462 3.686) 12.663 3.072 ( -2.680 8.167 -4.351) 9.634 3.491 ( -6.863 -5.114 1.294) 8.656 3.600 ( -2.849 -8.006 -1.176) 8.579 3.787 ( -0.791 -3.378 2.068) 4.039 3.910 ( 3.978 0.625 -4.011) 5.683 4.050 ( -2.101 -5.630 2.859) 6.655 4.126 ( 1.174 -4.490 -4.000) 6.127 4.151 ( 1.567 -0.072 -0.304) 1.597 4.197 ( 2.327 0.329 0.735) 2.463 4.546 ( -2.075 -9.622 2.222) 10.091 4.611 ( -0.317 -7.023 0.785) 7.074 4.805 ( -1.092 8.314 -1.636) 8.543 4.912 ( 4.842 9.589 -1.553) 10.854 5.315 ( -2.086 0.701 0.275) 2.217 5.371 ( 2.372 -3.839 1.501) 4.756 5.709 ( -0.162 -1.560 2.259) 2.750 5.775 ( 0.489 -6.916 1.340) 7.062 5.877 ( 1.450 -1.927 -1.066) 2.637 5.952 ( 1.867 1.514 -0.699) 2.503 6.101 ( 3.311 -2.458 -1.784) 4.493 6.165 ( 6.446 -3.281 0.216) 7.237 6.340 ( -0.668 -3.913 -1.561) 4.265 6.358 ( 2.169 -0.142 -2.021) 2.968 6.561 ( 0.481 -1.040 4.660) 4.799 6.641 ( 1.671 -3.227 -4.631) 5.886 6.719 ( 0.116 -6.320 4.805) 7.940 6.789 ( 0.193 -4.649 -2.325) 5.201 6.865 ( 0.186 -0.687 3.888) 3.953 6.976 ( 1.987 -0.766 -3.473) 4.074 7.033 ( 1.851 -9.299 3.293) 10.037 7.191 ( 6.727 -5.859 -1.654) 9.073 7.394 ( -4.719 5.212 -3.990) 8.084 7.461 ( -0.298 1.263 3.722) 3.942 7.792 ( 0.043 3.671 -2.315) 4.340 7.835 ( 1.276 7.396 -1.452) 7.644 8.343 ( -3.661 -2.825 7.791) 9.060 8.484 ( -6.612 -6.738 -2.822) 9.853 8.542 ( -10.339 -2.565 0.717) 10.676 8.692 ( -15.343 -2.997 -3.236) 15.964 9.154 ( 2.669 -2.830 8.286) 9.154 9.353 ( -8.817 -2.228 -4.034) 9.949 9.718 ( 1.111 1.515 6.560) 6.823 9.832 ( 11.052 -2.910 -10.176) 15.303 10.346 ( -3.698 11.757 6.362) 13.870 10.676 ( 3.260 8.759 -13.699) 16.584 11.007 ( -3.688 2.657 2.097) 5.006 11.150 ( 2.060 0.878 -0.898) 2.412 11.585 ( -3.953 -2.630 12.335) 13.218 11.742 ( -1.892 -2.727 -7.278) 7.999 12.211 ( -5.817 -3.803 5.653) 8.959 12.382 ( 0.703 -3.201 7.258) 7.964 12.396 ( -0.845 -4.565 -2.831) 5.438 12.526 ( 1.961 1.036 -8.723) 9.000 12.732 ( -0.055 5.495 -0.222) 5.499 12.931 ( 7.680 4.204 -1.297) 8.851 13.388 ( -5.826 6.786 -4.705) 10.106 13.564 ( -2.038 3.729 2.011) 4.701 13.631 ( 6.182 4.703 3.775) 8.637 13.733 ( 4.203 1.351 -2.524) 5.085 14.557 ( -2.914 -5.847 14.561) 15.960 14.784 ( -0.619 -3.014 -11.472) 11.877 15.151 ( -0.876 0.480 -0.520) 1.127 15.302 ( 6.295 1.222 -0.534) 6.435 ======================= Grid point 257 (125/141) ======================= q-point: (-0.20 0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.566 ( 5.412 12.127 2.832) 13.579 1.719 ( 3.222 7.185 10.570) 13.181 1.772 ( 0.741 8.193 -4.577) 9.414 1.899 ( 7.997 7.192 -0.280) 10.759 2.266 ( 3.983 3.761 -5.530) 7.784 2.471 ( -1.283 -2.831 4.046) 5.102 2.730 ( 5.102 8.033 -1.489) 9.632 2.743 ( 8.072 15.511 -1.643) 17.563 2.889 ( 7.790 2.724 2.768) 8.705 2.977 ( -1.870 -0.604 -3.702) 4.191 3.440 ( -6.259 -5.869 1.129) 8.654 3.624 ( -4.462 -9.554 -1.679) 10.678 3.786 ( -2.095 -1.813 0.839) 2.895 3.947 ( 2.592 2.006 -1.525) 3.615 4.043 ( -6.001 -6.267 1.420) 8.792 4.158 ( 0.664 0.677 -2.595) 2.763 4.176 ( 0.486 -1.051 -2.099) 2.397 4.223 ( -2.675 -5.603 1.609) 6.414 4.575 ( -5.531 -7.612 -0.916) 9.454 4.643 ( 1.008 3.065 3.613) 4.844 4.748 ( 1.146 1.806 0.265) 2.156 4.896 ( 2.204 6.105 -2.681) 7.022 5.250 ( -3.729 2.629 1.449) 4.787 5.459 ( 0.901 -5.638 2.546) 6.251 5.694 ( 0.154 2.940 0.226) 2.953 5.828 ( -1.323 -6.390 0.093) 6.526 5.908 ( -1.611 -2.544 -1.506) 3.367 6.032 ( 8.935 2.892 1.175) 9.465 6.175 ( 3.189 -0.623 -0.977) 3.393 6.232 ( -2.715 -0.625 -3.731) 4.656 6.342 ( 3.732 0.102 -2.320) 4.396 6.447 ( 4.817 -1.249 3.743) 6.227 6.570 ( -0.855 1.211 3.651) 3.941 6.705 ( 1.881 -3.658 -1.418) 4.351 6.786 ( 0.671 -4.192 0.765) 4.313 6.827 ( -0.048 -3.097 -0.584) 3.152 6.918 ( 1.384 0.576 -0.190) 1.511 6.992 ( 1.710 -2.911 -0.238) 3.385 7.195 ( 0.401 -7.107 -0.457) 7.132 7.264 ( -0.720 0.099 -0.528) 0.898 7.312 ( 2.309 0.125 0.252) 2.326 7.505 ( 1.698 -7.551 3.969) 8.698 7.724 ( -1.550 2.394 1.817) 3.382 7.861 ( 6.829 0.664 -9.356) 11.602 8.199 ( -18.805 -4.332 0.185) 19.299 8.339 ( -18.329 -2.268 1.786) 18.555 8.401 ( -0.183 -3.211 6.864) 7.581 8.607 ( -2.736 -8.403 -5.387) 10.350 9.232 ( -5.935 -3.129 0.990) 6.782 9.329 ( 6.276 -10.273 1.199) 12.098 9.623 ( -5.128 14.200 10.903) 18.623 9.921 ( -0.455 3.379 -11.447) 11.944 10.238 ( 2.581 7.300 0.778) 7.782 10.569 ( 1.210 9.193 -8.798) 12.783 10.966 ( 0.207 0.463 0.693) 0.859 11.187 ( 3.179 -0.637 -2.736) 4.242 11.575 ( -3.742 -1.758 12.009) 12.701 11.740 ( -0.311 -3.971 -3.693) 5.431 12.150 ( -5.213 -1.402 4.399) 6.964 12.374 ( -2.790 -4.608 -2.033) 5.758 12.438 ( 0.426 1.675 -2.278) 2.860 12.539 ( -1.131 -2.500 7.276) 7.776 12.742 ( 5.718 3.320 -3.804) 7.628 13.016 ( 6.779 2.482 -2.134) 7.528 13.255 ( -1.534 6.890 -1.306) 7.178 13.503 ( -0.926 1.534 -0.739) 1.938 13.602 ( -2.021 6.626 -2.305) 7.301 13.795 ( 5.652 5.976 1.106) 8.299 14.639 ( -0.986 -7.880 12.973) 15.211 14.761 ( -1.701 -3.681 -8.912) 9.791 15.152 ( 1.509 0.608 -1.052) 1.937 15.372 ( 4.049 2.559 -0.975) 4.888 ======================= Grid point 258 (126/141) ======================= q-point: (-0.10 0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.604 ( 8.397 5.905 1.670) 10.401 1.685 ( 0.760 7.678 1.428) 7.847 1.752 ( 3.467 4.071 7.002) 8.811 1.959 ( 6.494 7.429 -5.581) 11.336 2.273 ( 3.867 5.100 -1.466) 6.566 2.486 ( -1.288 -2.077 1.970) 3.138 2.719 ( 5.701 6.257 -2.299) 8.772 2.765 ( 9.418 9.211 -2.181) 13.353 2.999 ( 2.793 -2.428 -2.324) 4.370 3.072 ( 11.505 1.531 3.144) 12.024 3.400 ( -4.494 -4.794 1.180) 6.676 3.627 ( -3.792 -6.971 -1.798) 8.137 3.759 ( -3.667 -1.627 -0.596) 4.056 3.939 ( -0.410 2.361 -1.839) 3.020 3.985 ( -6.004 -2.601 -0.081) 6.544 4.115 ( -4.148 0.823 1.646) 4.537 4.177 ( -0.807 -2.511 -2.983) 3.982 4.244 ( -1.564 -5.184 1.667) 5.665 4.512 ( -6.933 -2.157 1.271) 7.371 4.640 ( 2.117 2.130 -0.633) 3.069 4.770 ( 1.172 1.236 4.082) 4.423 4.835 ( -1.826 5.419 -3.890) 6.916 5.156 ( -4.613 2.151 2.252) 5.565 5.506 ( -2.962 -6.379 2.654) 7.518 5.672 ( 0.812 3.235 0.507) 3.374 5.878 ( 0.997 -4.500 -2.207) 5.110 5.900 ( -1.693 -2.819 0.514) 3.328 6.061 ( -4.543 4.792 -2.849) 7.191 6.169 ( 3.286 1.576 -1.030) 3.787 6.239 ( 1.595 -1.452 -1.072) 2.408 6.371 ( -0.266 2.609 0.724) 2.720 6.513 ( 0.478 1.032 6.639) 6.736 6.566 ( 2.359 0.268 -0.946) 2.556 6.724 ( -2.492 -0.058 1.244) 2.785 6.814 ( 2.525 2.075 -3.387) 4.707 6.864 ( 0.872 -3.919 -2.202) 4.579 6.888 ( -3.748 0.355 1.176) 3.944 7.070 ( -0.638 -5.748 -2.086) 6.147 7.129 ( -3.301 -3.522 -1.331) 5.007 7.300 ( -3.860 2.711 4.305) 6.386 7.324 ( 1.073 0.377 0.176) 1.151 7.597 ( -0.151 0.938 0.521) 1.084 7.775 ( 3.867 -3.562 0.452) 5.277 7.884 ( -3.381 1.995 -2.289) 4.544 7.999 ( -6.312 -4.478 0.152) 7.741 8.200 ( 0.781 -6.742 -0.274) 6.793 8.529 ( 2.242 -12.165 3.746) 12.924 8.643 ( 0.390 -10.998 -2.903) 11.381 9.175 ( -4.211 2.739 -0.324) 5.033 9.360 ( -7.969 12.693 6.017) 16.150 9.547 ( 4.342 -5.198 1.460) 6.929 9.741 ( -7.080 1.851 -4.626) 8.657 10.309 ( 8.309 0.479 -4.239) 9.340 10.529 ( 4.744 7.142 -1.401) 8.687 10.983 ( 0.998 0.089 1.247) 1.600 11.266 ( 5.694 -2.965 -5.628) 8.538 11.558 ( -3.367 -0.545 8.820) 9.456 11.782 ( 1.233 -4.032 -0.834) 4.298 12.104 ( -3.412 -1.580 3.788) 5.338 12.351 ( -5.137 -0.001 -1.119) 5.257 12.380 ( -2.015 -1.317 -3.748) 4.454 12.598 ( 2.000 -2.948 6.546) 7.452 12.779 ( 2.700 2.849 -0.708) 3.988 13.106 ( 5.979 -0.526 -4.924) 7.764 13.157 ( -1.932 7.584 -0.392) 7.836 13.451 ( -4.474 7.531 -4.953) 10.063 13.533 ( 4.420 1.132 3.450) 5.720 13.811 ( 3.810 6.434 1.166) 7.567 14.650 ( -5.761 -4.259 -4.908) 8.684 14.814 ( 0.934 -6.166 7.300) 9.601 15.173 ( 1.984 0.837 -1.109) 2.422 15.388 ( 1.998 3.239 -0.889) 3.908 ======================= Grid point 264 (127/141) ======================= q-point: ( 0.50 -0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.838 ( -3.127 0.000 7.078) 7.738 1.874 ( -2.340 0.000 7.637) 7.988 1.923 ( 1.004 0.000 -3.590) 3.728 2.029 ( 1.874 0.000 -7.555) 7.784 2.254 ( 6.411 0.000 8.605) 10.730 2.436 ( -7.590 0.000 -10.199) 12.714 2.655 ( 5.286 0.000 1.077) 5.395 2.694 ( -3.355 0.000 -2.554) 4.217 3.159 ( -2.967 0.000 4.497) 5.388 3.238 ( 3.707 0.000 -3.827) 5.328 3.543 ( -4.191 0.000 1.481) 4.445 3.573 ( 4.233 0.000 -1.902) 4.641 3.716 ( -8.153 0.000 4.849) 9.486 3.804 ( 8.248 0.000 -4.424) 9.360 3.975 ( -0.333 0.000 0.499) 0.600 4.006 ( 0.902 0.000 -2.686) 2.833 4.228 ( 1.729 -0.000 7.528) 7.724 4.301 ( 0.878 0.000 0.395) 0.963 4.334 ( 2.855 -0.000 -1.712) 3.329 4.355 ( -6.171 0.000 -5.062) 7.982 5.088 ( -5.107 -0.000 0.559) 5.138 5.088 ( 6.821 0.000 0.753) 6.862 5.262 ( -3.874 0.000 1.052) 4.014 5.290 ( 4.304 0.000 -2.010) 4.750 5.534 ( 1.283 0.000 8.352) 8.450 5.630 ( -3.071 0.000 -1.349) 3.354 5.901 ( -4.296 0.000 1.042) 4.420 5.968 ( 2.982 -0.000 5.120) 5.925 5.970 ( 3.113 0.000 -6.569) 7.269 6.083 ( -3.334 -0.000 -6.980) 7.736 6.235 ( 1.253 0.000 -0.715) 1.443 6.255 ( 0.851 -0.000 -2.449) 2.593 6.493 ( -0.109 0.000 6.307) 6.308 6.612 ( -0.342 0.000 -5.692) 5.702 6.643 ( -1.550 0.000 4.178) 4.456 6.707 ( 1.073 0.000 -3.639) 3.794 6.868 ( -4.733 0.000 4.723) 6.686 6.905 ( -3.081 -0.000 4.501) 5.455 6.942 ( 4.214 0.000 -3.527) 5.495 6.978 ( 4.304 0.000 -2.933) 5.209 7.499 ( 2.397 0.000 3.458) 4.207 7.560 ( -2.549 0.000 -3.056) 3.980 7.882 ( -4.213 0.000 2.592) 4.946 7.934 ( 4.577 0.000 -2.847) 5.390 8.353 ( -1.162 0.000 4.439) 4.589 8.426 ( 0.080 0.000 -3.410) 3.411 8.670 ( -4.117 0.000 6.098) 7.358 8.782 ( 7.784 0.000 -5.803) 9.709 9.186 ( -11.260 0.000 11.275) 15.935 9.387 ( 9.621 0.000 -10.179) 14.006 9.599 ( 1.976 0.000 3.470) 3.993 9.671 ( -3.239 0.000 -4.268) 5.358 10.619 ( -4.515 0.000 4.478) 6.359 10.723 ( 6.933 0.000 -6.929) 9.802 11.093 ( -0.364 0.000 4.816) 4.830 11.179 ( -0.955 0.000 -4.449) 4.550 11.535 ( -1.954 0.000 12.077) 12.234 11.755 ( -1.114 0.000 -11.110) 11.165 12.172 ( -1.701 0.000 8.718) 8.882 12.284 ( 3.154 0.000 -4.088) 5.164 12.316 ( -1.460 0.000 7.938) 8.071 12.560 ( 1.216 0.000 -17.168) 17.211 12.885 ( -5.199 0.000 1.104) 5.315 12.908 ( 4.341 0.000 -1.260) 4.520 13.548 ( 9.828 0.000 6.817) 11.961 13.579 ( 4.767 -0.000 6.178) 7.804 13.693 ( -7.390 0.000 -6.463) 9.817 13.699 ( -5.909 -0.000 -4.468) 7.408 14.496 ( -2.933 0.000 15.098) 15.380 14.748 ( 2.649 0.000 -12.225) 12.508 15.209 ( -4.792 0.000 0.484) 4.816 15.215 ( 5.026 0.000 -0.191) 5.030 ======================= Grid point 266 (128/141) ======================= q-point: (-0.40 0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( 0.687 5.043 7.822) 9.331 1.864 ( 1.800 4.275 5.298) 7.041 1.938 ( 5.807 6.533 -1.159) 8.817 2.014 ( -0.639 2.288 -4.354) 4.960 2.316 ( -1.307 1.106 -8.900) 9.063 2.378 ( 1.680 -2.696 6.286) 7.043 2.683 ( 4.418 -0.321 -2.211) 4.951 2.752 ( 5.767 0.128 0.389) 5.781 3.080 ( -6.447 1.347 3.210) 7.327 3.220 ( -3.002 4.589 -3.353) 6.427 3.413 ( -10.385 -1.664 1.058) 10.570 3.466 ( -9.626 -4.527 -0.251) 10.641 3.742 ( 2.943 -1.190 1.721) 3.611 3.940 ( 5.840 0.757 -3.945) 7.088 3.974 ( -0.406 -0.988 1.165) 1.581 4.031 ( 0.628 -3.055 -1.886) 3.645 4.204 ( 0.514 4.942 -0.218) 4.973 4.289 ( 2.629 5.328 -1.481) 6.123 4.349 ( -1.645 -8.986 0.209) 9.137 4.473 ( 6.111 -5.897 2.807) 8.944 4.975 ( -2.907 6.346 -1.251) 7.091 5.122 ( 4.044 9.957 -1.512) 10.853 5.275 ( 1.098 -5.341 0.853) 5.519 5.347 ( 1.539 1.303 -0.152) 2.022 5.619 ( -1.017 -5.398 -1.196) 5.621 5.648 ( 6.008 -4.342 8.278) 11.111 5.860 ( -0.713 -0.087 0.215) 0.750 5.976 ( -0.736 0.590 -2.759) 2.916 6.064 ( 4.260 -0.489 -3.691) 5.657 6.100 ( 7.741 -2.742 2.758) 8.663 6.267 ( 0.893 -2.001 -1.339) 2.568 6.310 ( 4.111 -3.693 -3.986) 6.814 6.515 ( -0.373 -2.117 6.169) 6.533 6.585 ( -1.191 -1.782 -5.902) 6.279 6.652 ( 1.012 -0.992 2.859) 3.191 6.720 ( 0.892 -1.446 -1.589) 2.326 6.872 ( 1.935 -2.311 2.502) 3.917 6.881 ( -0.772 -0.373 4.795) 4.871 6.997 ( 3.136 0.058 -2.455) 3.984 7.111 ( 9.987 -1.993 -3.151) 10.661 7.464 ( -6.375 1.877 -3.881) 7.696 7.491 ( -3.895 0.998 4.407) 5.966 7.842 ( 0.111 1.393 -0.614) 1.527 7.951 ( -1.103 3.088 -0.511) 3.318 8.321 ( -6.882 -0.270 4.911) 8.459 8.419 ( -1.497 -0.397 -2.521) 2.959 8.495 ( -12.446 -1.814 3.736) 13.121 8.654 ( -16.993 -0.964 -5.329) 17.836 9.110 ( -1.336 -1.258 6.487) 6.742 9.356 ( -6.744 1.157 -3.881) 7.866 9.725 ( 8.824 -0.366 6.849) 11.176 9.800 ( 14.155 -0.661 -9.088) 16.834 10.519 ( -5.169 5.028 2.914) 7.778 10.777 ( 2.604 2.104 -9.082) 9.680 11.063 ( -3.967 2.775 3.789) 6.148 11.142 ( -1.497 -1.554 -1.240) 2.489 11.536 ( -3.388 -1.687 14.355) 14.846 11.692 ( -3.119 -1.712 -8.590) 9.297 12.161 ( -3.030 -1.200 6.103) 6.919 12.313 ( -0.193 -2.262 -4.663) 5.187 12.347 ( 1.028 -1.206 9.108) 9.245 12.554 ( 4.200 1.041 -14.036) 14.687 12.812 ( -1.816 2.308 1.255) 3.194 12.983 ( 5.184 1.265 -1.149) 5.459 13.495 ( -5.865 4.187 -5.819) 9.262 13.565 ( -6.922 -1.923 -4.366) 8.407 13.703 ( 2.830 1.036 3.343) 4.500 13.760 ( 11.755 1.647 6.348) 13.461 14.484 ( -4.009 -1.642 14.144) 14.793 14.739 ( -0.332 -1.329 -11.778) 11.857 15.157 ( -1.061 0.150 -0.393) 1.142 15.318 ( 6.772 0.426 0.026) 6.785 ======================= Grid point 267 (129/141) ======================= q-point: (-0.30 0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.794 ( 2.702 10.015 2.360) 10.638 1.858 ( 1.826 6.587 4.912) 8.417 1.921 ( -1.749 6.009 -0.928) 6.327 2.017 ( 7.556 5.022 2.510) 9.413 2.318 ( 4.853 1.109 -7.995) 9.418 2.411 ( -1.896 -3.450 4.280) 5.815 2.798 ( 5.759 1.085 -1.237) 5.990 2.864 ( 8.368 0.294 -0.490) 8.388 2.960 ( -5.767 0.867 0.790) 5.885 3.059 ( -3.557 8.526 -0.601) 9.258 3.291 ( -8.642 -7.269 0.793) 11.321 3.416 ( -6.125 -10.104 -1.879) 11.964 3.779 ( 0.193 0.091 1.491) 1.507 3.941 ( -2.669 -2.556 -0.869) 3.796 4.004 ( 2.536 1.381 1.239) 3.143 4.056 ( -2.114 -4.134 -0.717) 4.699 4.203 ( 1.965 0.784 -1.675) 2.698 4.266 ( 0.881 5.386 -2.899) 6.180 4.391 ( -3.609 -8.804 -1.422) 9.621 4.620 ( 3.907 -2.023 5.832) 7.306 4.875 ( -0.226 7.171 -2.842) 7.717 5.085 ( 4.033 9.896 -2.877) 11.067 5.310 ( -1.388 3.726 2.086) 4.490 5.360 ( 0.674 -4.699 2.668) 5.445 5.670 ( 0.480 -6.794 -2.773) 7.354 5.758 ( 1.634 2.317 5.398) 6.097 5.872 ( -0.675 -1.306 -3.359) 3.667 6.010 ( 5.049 -4.754 3.999) 8.005 6.153 ( 5.009 -1.141 -1.475) 5.345 6.215 ( -1.657 -0.883 -2.896) 3.451 6.310 ( 5.124 -2.197 0.408) 5.590 6.418 ( 5.278 -2.584 -2.234) 6.287 6.547 ( -0.834 -2.636 1.595) 3.192 6.602 ( 0.144 -5.793 -0.462) 5.814 6.713 ( 3.451 -2.353 0.582) 4.217 6.766 ( 2.128 -2.547 -0.187) 3.324 6.895 ( 1.904 -0.213 3.046) 3.599 7.003 ( 5.106 -1.523 -2.629) 5.942 7.041 ( 4.124 -3.126 1.914) 5.518 7.267 ( 1.935 -1.175 0.745) 2.383 7.289 ( -9.605 -0.518 -3.557) 10.256 7.412 ( -4.210 -2.324 2.840) 5.585 7.786 ( -5.412 3.529 -0.734) 6.502 7.903 ( 2.799 1.429 -3.726) 4.875 8.108 ( -16.215 -4.006 2.344) 16.866 8.305 ( -13.903 -0.045 2.858) 14.193 8.404 ( -0.706 1.384 4.643) 4.897 8.497 ( -1.353 -3.447 -6.279) 7.289 9.165 ( 1.855 -5.138 1.236) 5.601 9.224 ( -3.881 0.812 0.525) 4.000 9.856 ( 6.005 8.491 10.280) 14.623 9.976 ( 9.271 2.063 -13.177) 16.244 10.387 ( -3.180 6.747 1.375) 7.584 10.697 ( -4.703 4.028 -7.573) 9.782 10.981 ( -2.143 1.496 1.026) 2.808 11.150 ( -0.258 -3.399 -0.755) 3.491 11.541 ( -2.348 -1.006 13.235) 13.479 11.657 ( -1.645 -3.961 -3.629) 5.618 12.126 ( -3.860 -0.595 4.802) 6.190 12.296 ( -2.652 -3.295 -4.513) 6.185 12.419 ( 1.977 -2.426 9.777) 10.266 12.568 ( 1.916 3.870 -7.855) 8.964 12.798 ( 3.223 2.248 -3.268) 5.111 13.034 ( 1.964 -0.343 -3.439) 3.975 13.354 ( -4.431 3.172 -1.685) 5.704 13.504 ( -0.060 -0.736 -4.804) 4.861 13.693 ( -2.417 2.576 1.154) 3.716 13.923 ( 8.371 6.256 5.822) 11.963 14.499 ( -2.369 -5.628 12.854) 14.231 14.703 ( -1.652 -2.186 -10.626) 10.974 15.161 ( 1.565 0.294 -0.820) 1.791 15.411 ( 4.648 1.353 -0.269) 4.849 ======================= Grid point 268 (130/141) ======================= q-point: (-0.20 0.50 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.738 ( 1.212 7.637 0.619) 7.757 1.837 ( 0.019 7.015 1.207) 7.118 1.853 ( 2.369 5.573 5.112) 7.925 2.092 ( 6.110 6.163 -1.396) 8.790 2.349 ( 1.543 1.974 -3.538) 4.335 2.447 ( 1.711 -2.064 3.396) 4.327 2.799 ( 0.835 2.749 -2.436) 3.766 2.840 ( -5.221 -0.364 -2.724) 5.900 2.995 ( 7.256 0.495 -3.172) 7.935 3.099 ( 8.065 1.081 4.261) 9.185 3.261 ( -3.518 -8.106 1.236) 8.923 3.429 ( -3.260 -10.493 -1.777) 11.130 3.763 ( -1.601 1.108 1.003) 2.190 3.919 ( -3.061 -2.604 -0.920) 4.123 4.016 ( -1.553 0.478 1.434) 2.168 4.057 ( -1.570 -4.186 0.593) 4.510 4.181 ( -2.063 4.901 -3.221) 6.217 4.232 ( 2.267 1.592 -0.782) 2.878 4.396 ( -4.266 -7.291 -1.303) 8.547 4.655 ( -2.881 -0.351 5.109) 5.876 4.816 ( 1.160 4.734 -2.871) 5.656 5.041 ( 3.546 10.689 -3.073) 11.673 5.222 ( -5.093 3.944 2.427) 6.884 5.410 ( -1.017 -2.927 4.691) 5.622 5.725 ( -2.590 -2.842 -0.266) 3.854 5.770 ( 5.400 0.040 -3.639) 6.512 5.856 ( -1.554 -1.992 2.330) 3.437 6.100 ( -8.222 0.152 -4.243) 9.254 6.166 ( 5.228 -3.015 2.229) 6.433 6.232 ( 1.873 -0.103 1.555) 2.437 6.392 ( 1.862 0.063 -1.217) 2.225 6.496 ( -1.436 -3.013 2.394) 4.107 6.554 ( 1.607 -1.087 -1.585) 2.505 6.669 ( 0.509 -5.782 1.546) 6.007 6.792 ( 1.834 -1.653 -0.312) 2.489 6.819 ( 2.241 -1.314 -1.535) 3.018 6.946 ( -3.218 3.378 1.233) 4.825 6.952 ( -3.040 -4.368 -1.046) 5.424 7.058 ( -7.129 -2.942 -4.902) 9.138 7.234 ( -3.691 -8.230 4.342) 10.010 7.280 ( 2.808 -5.545 0.652) 6.249 7.522 ( 6.691 -4.277 2.585) 8.351 7.714 ( -0.360 -0.996 0.726) 1.284 7.931 ( -2.842 -1.880 -1.832) 3.869 7.961 ( 0.322 2.763 -3.297) 4.314 8.113 ( -5.862 0.078 2.149) 6.244 8.442 ( 3.199 -0.024 7.126) 7.811 8.495 ( -1.007 -4.366 -6.256) 7.695 9.181 ( 1.821 -0.775 1.560) 2.520 9.332 ( 4.773 -7.585 -0.575) 8.980 9.780 ( -1.306 20.229 10.752) 22.946 9.911 ( -4.700 11.396 -12.668) 17.676 10.339 ( 3.583 2.474 -2.696) 5.121 10.612 ( 0.863 1.110 -1.038) 1.748 10.972 ( 0.660 -0.887 -0.124) 1.113 11.199 ( 2.415 -4.526 -3.792) 6.379 11.540 ( -2.294 -0.363 8.469) 8.782 11.699 ( 1.610 -4.192 2.504) 5.141 12.079 ( -3.859 -0.680 4.858) 6.242 12.276 ( -3.094 -3.927 -1.079) 5.114 12.473 ( 0.102 6.312 -10.420) 12.183 12.526 ( 0.938 -3.448 9.809) 10.439 12.824 ( 2.054 1.457 -3.935) 4.672 13.048 ( -1.329 -4.829 -7.156) 8.735 13.269 ( -2.169 3.596 1.549) 4.476 13.555 ( 7.257 1.764 -0.389) 7.479 13.585 ( -5.728 4.824 -0.383) 7.498 13.945 ( 1.296 7.243 4.275) 8.510 14.547 ( -4.746 -6.463 3.475) 8.739 14.709 ( 2.883 -3.712 -2.421) 5.287 15.188 ( 2.121 0.572 -1.198) 2.502 15.441 ( 1.307 2.137 -0.300) 2.523 ======================= Grid point 269 (131/141) ======================= q-point: (-0.10 0.50 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.712 ( -0.276 0.955 5.271) 5.364 1.774 ( 0.194 5.908 2.974) 6.617 1.865 ( 3.288 3.789 -0.278) 5.024 2.062 ( -0.380 6.600 -7.831) 10.249 2.350 ( 0.779 0.622 2.160) 2.380 2.479 ( 0.478 0.587 -1.668) 1.832 2.792 ( -0.409 -2.073 0.082) 2.114 2.850 ( 5.472 0.608 0.358) 5.517 3.073 ( 1.720 -1.132 -5.382) 5.762 3.178 ( 0.064 -4.110 2.444) 4.782 3.361 ( 6.062 -1.170 4.290) 7.518 3.510 ( 2.012 -8.664 -3.623) 9.604 3.715 ( -1.675 1.352 0.749) 2.280 3.864 ( -5.109 -0.324 -0.958) 5.208 3.989 ( -1.734 6.822 -1.731) 7.249 3.991 ( -5.438 -3.045 1.309) 6.368 4.159 ( 1.376 -2.466 0.181) 2.830 4.264 ( 2.643 0.583 0.781) 2.817 4.391 ( -1.606 -2.335 -1.062) 3.027 4.592 ( -6.204 -2.764 2.786) 7.341 4.796 ( 1.233 2.693 -1.819) 3.476 4.982 ( 2.382 9.473 -1.332) 9.858 5.088 ( -6.833 2.261 0.940) 7.258 5.414 ( -1.890 -1.241 4.295) 4.854 5.697 ( -1.015 -0.334 -0.360) 1.127 5.863 ( 0.994 -0.658 -0.958) 1.529 5.874 ( 2.256 -2.512 -1.363) 3.641 5.948 ( -5.529 0.273 -1.102) 5.645 6.215 ( -3.129 1.020 1.938) 3.819 6.254 ( 2.208 -1.629 0.758) 2.846 6.355 ( -3.217 1.552 -0.019) 3.572 6.509 ( -0.567 -3.651 2.389) 4.400 6.583 ( 0.501 -0.650 -2.697) 2.819 6.731 ( 1.231 -0.349 1.596) 2.046 6.770 ( -4.832 -0.740 -1.108) 5.012 6.828 ( -1.783 -0.783 3.992) 4.441 6.856 ( 1.338 -1.211 -5.275) 5.575 7.023 ( -1.783 -6.826 -0.610) 7.081 7.049 ( 4.849 -3.682 -5.086) 7.933 7.252 ( -2.128 -1.684 1.492) 3.097 7.316 ( -2.623 -0.058 4.142) 4.903 7.598 ( -0.979 -2.774 2.203) 3.675 7.758 ( -1.009 -3.824 -0.000) 3.955 7.868 ( -1.665 3.650 -0.941) 4.121 7.955 ( 2.782 0.817 -1.057) 3.086 8.241 ( 11.194 -8.266 0.833) 13.940 8.481 ( -0.096 -3.405 -0.692) 3.476 8.609 ( 6.416 -9.132 2.648) 11.470 9.187 ( -2.143 9.322 -0.466) 9.576 9.365 ( -4.001 7.637 0.942) 8.673 9.611 ( 1.032 6.564 3.641) 7.576 9.682 ( -3.459 8.296 -6.018) 10.817 10.387 ( 2.866 -0.496 -3.899) 4.864 10.653 ( 4.389 2.453 1.583) 5.271 10.999 ( 0.958 -0.650 0.783) 1.398 11.304 ( 5.448 -5.358 -5.744) 9.560 11.518 ( -3.373 -0.232 6.666) 7.474 11.789 ( 3.886 -2.375 2.945) 5.424 12.043 ( -2.885 -1.335 3.781) 4.940 12.244 ( -4.852 -2.395 1.162) 5.534 12.366 ( -0.684 5.216 -9.436) 10.803 12.633 ( 3.394 -3.363 5.483) 7.273 12.823 ( 0.688 0.487 -0.384) 0.926 13.031 ( -4.066 -5.328 -8.869) 11.116 13.223 ( -0.013 2.752 2.882) 3.985 13.420 ( -6.358 5.599 -1.303) 8.572 13.695 ( 10.685 3.103 2.878) 11.493 13.886 ( -2.686 3.373 3.321) 5.442 14.487 ( -6.776 -4.001 -3.814) 8.745 14.817 ( 3.795 -3.057 2.648) 5.546 15.208 ( 1.477 0.843 -1.600) 2.335 15.428 ( -0.193 1.564 0.155) 1.583 ======================= Grid point 276 (132/141) ======================= q-point: ( 0.60 -0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 141 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.901 ( 2.119 -0.000 4.352) 4.841 1.938 ( 2.172 -0.000 5.151) 5.591 1.977 ( -3.405 0.000 -1.800) 3.851 2.084 ( 7.245 -0.000 -0.363) 7.254 2.322 ( 3.774 -0.000 -10.539) 11.194 2.357 ( -2.047 0.000 7.387) 7.665 2.823 ( 9.178 -0.000 0.670) 9.203 2.845 ( 5.568 -0.000 -1.846) 5.866 2.966 ( -8.071 0.000 1.666) 8.241 3.159 ( -6.217 0.000 -1.332) 6.358 3.243 ( -8.590 0.000 0.982) 8.646 3.267 ( -6.432 0.000 -1.525) 6.610 3.778 ( 1.000 -0.000 1.412) 1.730 3.919 ( -2.121 0.000 0.071) 2.122 4.001 ( -1.644 0.000 -0.705) 1.789 4.036 ( 1.098 -0.000 0.687) 1.296 4.242 ( -0.276 0.000 -0.767) 0.815 4.250 ( -0.127 0.000 -2.147) 2.150 4.341 ( 1.253 -0.000 -4.478) 4.650 4.600 ( 6.288 -0.000 5.649) 8.453 4.954 ( -2.282 0.000 -3.553) 4.223 5.220 ( 1.021 -0.000 0.709) 1.243 5.273 ( 3.296 -0.000 -1.774) 3.743 5.366 ( -1.741 0.000 1.117) 2.068 5.594 ( 1.912 -0.000 1.192) 2.253 5.792 ( 8.178 -0.000 5.030) 9.601 5.878 ( 2.507 -0.000 1.450) 2.896 5.912 ( -3.189 0.000 -0.235) 3.198 6.144 ( 5.626 -0.000 -3.631) 6.696 6.205 ( -0.983 0.000 -1.800) 2.051 6.292 ( 6.861 -0.000 0.626) 6.889 6.370 ( 5.230 -0.000 -3.041) 6.049 6.515 ( -0.147 0.000 4.968) 4.970 6.537 ( -0.756 0.000 -3.447) 3.529 6.694 ( 3.499 -0.000 1.439) 3.784 6.738 ( 2.602 -0.000 -0.784) 2.717 6.896 ( 1.132 -0.000 4.259) 4.407 6.967 ( 10.663 -0.000 -2.245) 10.896 7.041 ( 1.870 -0.000 -0.541) 1.947 7.248 ( 3.061 -0.000 1.852) 3.577 7.288 ( -15.019 0.000 -4.173) 15.588 7.390 ( -6.905 0.000 2.538) 7.356 7.851 ( -10.902 0.000 0.686) 10.923 7.884 ( 3.913 -0.000 -3.555) 5.287 8.070 ( -13.911 0.000 2.253) 14.092 8.310 ( -11.482 0.000 3.351) 11.961 8.429 ( 0.088 -0.000 6.712) 6.712 8.458 ( -0.914 0.000 -9.538) 9.582 9.112 ( 1.770 -0.000 2.071) 2.724 9.242 ( -6.083 0.000 -0.331) 6.092 9.936 ( 12.360 -0.000 9.282) 15.458 9.999 ( 11.984 -0.000 -12.042) 16.989 10.462 ( -4.578 0.000 -0.321) 4.589 10.734 ( -6.567 0.000 -6.975) 9.580 11.020 ( -4.143 0.000 2.865) 5.037 11.085 ( -1.956 0.000 -0.229) 1.970 11.538 ( -0.141 0.000 15.442) 15.442 11.610 ( -2.649 0.000 -5.883) 6.452 12.124 ( -2.873 0.000 4.436) 5.285 12.259 ( -2.473 0.000 -5.317) 5.864 12.392 ( 1.581 -0.000 10.894) 11.008 12.614 ( 4.714 -0.000 -10.690) 11.683 12.823 ( 1.471 -0.000 -1.469) 2.079 13.025 ( -0.737 0.000 -5.346) 5.397 13.383 ( -7.215 0.000 -2.792) 7.736 13.494 ( 2.434 -0.000 -4.514) 5.129 13.715 ( -2.514 0.000 4.399) 5.067 13.994 ( 10.332 -0.000 6.207) 12.053 14.440 ( -4.255 0.000 11.116) 11.903 14.681 ( -1.444 0.000 -10.283) 10.384 15.164 ( 1.597 -0.000 -0.745) 1.762 15.424 ( 4.857 -0.000 -0.069) 4.858 ======================= Grid point 278 (133/141) ======================= q-point: (-0.30 0.60 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.879 ( -3.234 5.498 -1.737) 6.611 1.925 ( 0.758 1.663 -0.017) 1.827 1.952 ( 0.010 3.807 5.465) 6.660 2.181 ( 4.756 1.903 0.960) 5.212 2.354 ( 1.401 0.029 -3.798) 4.048 2.399 ( 2.757 -2.624 4.267) 5.718 2.826 ( -8.077 -0.373 -1.455) 8.216 2.863 ( 0.756 3.905 -2.528) 4.713 2.956 ( 3.920 -3.978 -3.883) 6.802 3.074 ( -4.646 -3.017 1.365) 5.706 3.188 ( 3.600 1.022 0.720) 3.811 3.272 ( 3.048 -5.064 1.587) 6.120 3.780 ( -0.902 0.458 1.093) 1.490 3.886 ( -2.422 -0.804 -0.821) 2.681 3.969 ( -3.214 -1.602 0.070) 3.591 4.031 ( -0.789 -0.778 3.800) 3.958 4.242 ( 2.418 1.124 -1.614) 3.117 4.275 ( -0.533 -1.819 -1.729) 2.566 4.309 ( -1.744 1.686 -4.165) 4.820 4.651 ( -1.991 -0.084 3.917) 4.395 4.886 ( -2.648 1.866 -5.172) 6.103 5.209 ( 1.140 6.523 1.174) 6.725 5.268 ( -6.469 0.377 2.102) 6.812 5.365 ( 2.336 -3.336 0.050) 4.073 5.654 ( 3.019 -0.151 1.407) 3.334 5.807 ( -3.216 -1.578 -2.273) 4.242 5.883 ( 4.900 7.063 3.393) 9.241 6.048 ( 4.107 -7.839 4.543) 9.948 6.099 ( -6.935 -0.357 -5.019) 8.568 6.222 ( 3.284 -0.394 1.031) 3.464 6.394 ( 3.244 0.221 -0.923) 3.380 6.427 ( -0.726 -2.493 -1.687) 3.096 6.531 ( 1.508 -1.004 -1.136) 2.138 6.555 ( 0.076 -4.232 1.124) 4.379 6.773 ( 4.786 -0.110 -2.010) 5.193 6.798 ( 3.191 -1.369 0.524) 3.511 6.924 ( -0.653 1.767 2.067) 2.796 6.970 ( -17.052 -1.022 -1.722) 17.169 7.044 ( -6.763 0.814 0.057) 6.812 7.072 ( -6.946 -5.642 3.454) 9.591 7.182 ( 8.610 -3.350 -4.000) 10.068 7.469 ( 8.206 -1.362 4.067) 9.259 7.708 ( -4.003 0.044 0.421) 4.026 7.919 ( -0.864 0.101 0.796) 1.179 7.997 ( 4.253 0.961 -4.702) 6.413 8.153 ( -7.666 2.000 4.848) 9.288 8.439 ( 1.461 -0.614 -7.242) 7.413 8.464 ( 1.222 0.349 5.811) 5.949 9.174 ( 2.578 0.353 0.848) 2.737 9.214 ( 3.862 -3.914 1.003) 5.589 10.086 ( 3.183 5.069 -14.286) 15.489 10.121 ( 8.807 11.720 10.338) 17.939 10.391 ( -0.602 2.136 -1.824) 2.873 10.582 ( -6.052 -2.915 -1.661) 6.920 10.968 ( -1.046 0.745 -0.960) 1.604 11.092 ( -0.509 -5.052 -0.902) 5.157 11.557 ( -0.599 1.539 1.842) 2.474 11.629 ( 3.089 -2.624 9.904) 10.702 12.082 ( -3.201 0.660 4.059) 5.211 12.212 ( -2.725 -2.261 -3.564) 5.024 12.465 ( 2.403 -1.640 10.932) 11.312 12.603 ( -0.033 4.828 -10.298) 11.374 12.838 ( 0.945 0.227 -5.155) 5.246 12.947 ( -6.053 -4.154 -10.163) 12.537 13.304 ( -2.825 0.476 2.957) 4.117 13.577 ( 7.965 0.587 -1.231) 8.081 13.647 ( -5.825 1.402 4.545) 7.520 14.080 ( 0.423 5.360 2.683) 6.009 14.424 ( -3.897 -4.843 7.249) 9.550 14.667 ( 3.414 -0.863 -6.354) 7.264 15.195 ( 2.251 0.198 -1.145) 2.534 15.470 ( 0.886 0.717 -0.133) 1.148 ======================= Grid point 279 (134/141) ======================= q-point: (-0.20 -0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 252 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.763 ( -4.147 4.023 1.631) 6.003 1.893 ( -2.061 5.226 2.052) 5.981 1.918 ( -1.047 1.506 0.526) 1.908 2.175 ( -1.815 4.167 -3.500) 5.736 2.355 ( -0.359 0.010 0.864) 0.936 2.460 ( -0.236 -2.105 0.052) 2.119 2.734 ( -3.030 -2.942 -1.353) 4.435 2.876 ( 5.263 1.789 -0.001) 5.559 3.017 ( 0.660 -3.423 -4.380) 5.598 3.067 ( -1.661 -5.915 1.128) 6.247 3.309 ( 8.263 -3.753 -0.584) 9.094 3.422 ( 8.039 -0.427 3.503) 8.780 3.744 ( -2.021 1.595 0.251) 2.587 3.837 ( -4.726 -2.024 -0.521) 5.168 3.938 ( -1.596 -1.569 -0.134) 2.242 4.075 ( 2.171 -1.311 3.708) 4.492 4.157 ( -5.769 4.071 -3.001) 7.672 4.288 ( 1.688 1.154 -0.194) 2.054 4.331 ( 4.261 -2.548 -1.874) 5.307 4.571 ( -7.958 -0.186 2.403) 8.315 4.821 ( -1.732 0.108 -4.910) 5.208 5.080 ( -11.997 0.109 3.215) 12.421 5.176 ( 0.424 7.712 -2.981) 8.280 5.440 ( 1.979 -1.023 5.849) 6.259 5.667 ( -0.194 1.114 -0.929) 1.463 5.823 ( 2.169 -2.937 0.425) 3.676 5.886 ( -1.801 1.421 -4.192) 4.779 5.965 ( -0.436 2.933 1.089) 3.159 6.195 ( 2.304 -4.566 2.532) 5.707 6.230 ( -4.253 0.480 3.752) 5.692 6.371 ( -4.424 -0.372 -1.167) 4.591 6.412 ( -1.453 -4.390 -0.152) 4.627 6.572 ( 0.533 -1.234 -1.651) 2.129 6.631 ( 3.228 -6.180 -1.004) 7.044 6.746 ( -5.387 -1.008 -0.316) 5.489 6.806 ( -5.395 -3.439 1.179) 6.506 6.853 ( 1.753 0.143 -0.678) 1.885 6.911 ( 2.900 -3.003 -2.252) 4.743 6.995 ( 1.528 -1.079 -1.812) 2.604 7.136 ( 0.996 -7.719 2.062) 8.051 7.287 ( 0.672 -1.500 -1.720) 2.379 7.583 ( 0.192 0.386 3.327) 3.355 7.697 ( -0.566 -2.454 2.555) 3.588 7.890 ( -1.631 1.339 2.105) 2.981 8.034 ( 3.152 4.422 -2.510) 5.983 8.130 ( 7.420 -2.571 0.441) 7.865 8.457 ( 1.601 -0.214 -4.751) 5.018 8.522 ( 4.215 -1.169 4.647) 6.381 9.257 ( 5.771 0.235 1.126) 5.884 9.344 ( 3.927 -4.586 0.072) 6.038 9.898 ( -6.659 14.073 -8.436) 17.707 10.015 ( -0.879 21.975 3.553) 22.278 10.395 ( 2.439 1.393 -2.935) 4.063 10.656 ( 5.852 -2.752 3.345) 7.281 10.971 ( 0.948 -1.822 -0.813) 2.209 11.160 ( 1.972 -8.618 -3.793) 9.620 11.536 ( -1.048 1.881 2.419) 3.239 11.758 ( 6.406 -0.851 8.360) 10.566 12.034 ( -2.659 0.543 4.330) 5.110 12.188 ( -2.671 -3.017 -1.412) 4.269 12.489 ( -1.178 6.656 -10.519) 12.504 12.570 ( 3.972 -2.430 7.040) 8.441 12.815 ( -1.993 -1.032 -2.731) 3.535 12.887 ( -4.837 -8.241 -10.184) 13.965 13.260 ( -3.328 0.808 4.730) 5.840 13.500 ( -9.027 2.438 3.254) 9.900 13.750 ( 12.166 2.049 0.123) 12.338 13.965 ( -6.905 4.704 1.063) 8.422 14.401 ( -6.068 -4.533 2.307) 7.918 14.773 ( 7.621 -1.252 -1.474) 7.862 15.223 ( 1.902 0.617 -2.059) 2.869 15.449 ( -2.085 0.563 0.204) 2.169 ======================= Grid point 280 (135/141) ======================= q-point: (-0.10 -0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.681 ( -5.040 -1.185 5.742) 7.731 1.792 ( -4.842 3.417 3.576) 6.921 1.874 ( -3.783 -1.465 -2.622) 4.830 2.054 ( -3.747 4.963 -8.121) 10.228 2.359 ( -0.471 -1.406 3.589) 3.883 2.440 ( -2.737 -1.686 -3.171) 4.515 2.756 ( -0.366 -4.768 -0.408) 4.800 2.923 ( -1.152 -0.434 0.843) 1.492 3.066 ( 2.111 0.953 -1.826) 2.949 3.129 ( 3.217 -6.519 0.586) 7.293 3.481 ( -0.785 1.853 -0.319) 2.038 3.500 ( 8.279 -2.804 0.966) 8.795 3.733 ( 0.297 1.192 -0.780) 1.455 3.787 ( -0.238 -1.746 1.184) 2.123 3.894 ( -4.941 1.835 1.454) 5.468 4.040 ( 2.140 2.691 -3.811) 5.132 4.156 ( 0.968 -1.582 4.185) 4.578 4.319 ( 4.548 1.132 -0.670) 4.734 4.394 ( -4.229 1.596 0.150) 4.523 4.504 ( 4.592 -4.461 0.092) 6.403 4.784 ( -3.639 -0.876 -2.474) 4.487 4.894 ( -10.100 -3.620 0.041) 10.729 5.111 ( 1.835 6.798 -1.766) 7.260 5.475 ( 2.286 4.099 6.223) 7.795 5.658 ( -0.548 -1.325 -0.637) 1.569 5.809 ( -1.683 -0.217 -3.034) 3.476 5.905 ( 3.029 -1.642 -2.593) 4.312 6.002 ( 4.869 3.573 2.907) 6.702 6.146 ( -4.542 -1.278 0.596) 4.756 6.256 ( 0.817 -2.060 1.360) 2.600 6.315 ( -1.393 -0.779 -0.423) 1.651 6.450 ( -1.585 -5.702 3.967) 7.125 6.580 ( 0.526 -0.081 -1.159) 1.275 6.690 ( -1.575 -2.579 -1.281) 3.282 6.735 ( 0.754 -2.309 -2.885) 3.771 6.808 ( 0.615 -4.423 2.156) 4.959 6.882 ( 2.395 2.412 -0.825) 3.498 6.978 ( 3.802 -4.620 -1.505) 6.169 7.091 ( 4.633 -3.444 -4.234) 7.159 7.210 ( 0.464 -4.136 -1.458) 4.410 7.258 ( -3.849 -1.649 4.246) 5.964 7.519 ( -6.078 -1.409 1.759) 6.483 7.712 ( -0.803 -2.598 2.050) 3.406 7.865 ( -1.302 0.687 2.096) 2.561 8.053 ( 3.843 4.801 -1.142) 6.255 8.363 ( 10.515 -5.509 -0.553) 11.884 8.472 ( 2.737 -0.420 -0.851) 2.897 8.665 ( 7.384 -5.515 1.932) 9.417 9.230 ( -5.681 11.444 -1.346) 12.847 9.390 ( 0.159 3.756 -0.015) 3.760 9.704 ( 1.275 8.894 -4.211) 9.923 9.765 ( -2.910 18.846 2.088) 19.183 10.393 ( -1.351 0.453 -0.939) 1.706 10.729 ( 1.482 2.221 -0.322) 2.689 11.011 ( 1.586 -1.206 -1.100) 2.276 11.311 ( 5.180 -8.937 -2.648) 10.664 11.482 ( -4.068 2.244 4.753) 6.646 11.882 ( 5.119 0.945 2.449) 5.752 12.024 ( 1.023 -0.064 3.344) 3.497 12.161 ( -2.397 -0.967 0.570) 2.646 12.406 ( 2.203 5.847 -8.061) 10.199 12.662 ( 1.021 -1.918 2.813) 3.554 12.818 ( 1.168 -3.684 0.655) 3.919 12.885 ( -2.120 -8.299 -5.813) 10.352 13.205 ( -4.273 -0.587 3.895) 5.812 13.331 ( -8.319 1.470 1.889) 8.657 13.797 ( -9.187 1.276 2.612) 9.636 13.924 ( 9.927 2.173 -5.297) 11.459 14.343 ( -4.931 -2.798 4.857) 7.466 14.898 ( 6.308 0.268 -0.967) 6.388 15.232 ( 1.036 1.225 -2.943) 3.351 15.409 ( -2.455 -0.829 0.426) 2.626 ======================= Grid point 288 (136/141) ======================= q-point: (-0.30 -0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.826 ( -5.700 0.000 -2.099) 6.074 1.903 ( -3.272 0.000 -1.621) 3.651 1.972 ( -2.306 0.000 6.016) 6.443 2.202 ( -2.987 0.000 0.885) 3.116 2.359 ( -1.119 0.000 -4.262) 4.407 2.436 ( 0.674 -0.000 3.750) 3.810 2.699 ( -4.315 0.000 -2.822) 5.156 2.907 ( 3.528 -0.000 0.041) 3.528 2.982 ( 2.911 -0.000 -3.472) 4.531 2.989 ( -1.372 0.000 0.414) 1.433 3.271 ( 8.093 -0.000 -2.067) 8.353 3.423 ( 10.330 -0.000 4.855) 11.414 3.764 ( -1.538 0.000 -0.374) 1.583 3.812 ( -5.135 0.000 -0.134) 5.136 3.930 ( -0.934 0.000 0.664) 1.146 4.043 ( 2.373 -0.000 4.236) 4.856 4.206 ( -6.729 0.000 -2.601) 7.214 4.298 ( 2.847 -0.000 -2.710) 3.930 4.310 ( 4.017 -0.000 -0.548) 4.054 4.568 ( -8.267 0.000 1.787) 8.458 4.819 ( -3.172 0.000 -6.295) 7.049 5.076 ( -13.808 0.000 3.125) 14.157 5.316 ( -1.921 0.000 -3.816) 4.272 5.344 ( 3.908 -0.000 5.898) 7.076 5.747 ( -0.895 0.000 -2.364) 2.528 5.753 ( 5.439 -0.000 4.910) 7.328 5.892 ( -7.731 0.000 -6.647) 10.195 6.068 ( 1.806 -0.000 6.831) 7.066 6.082 ( 5.920 -0.000 1.110) 6.023 6.235 ( -4.715 0.000 3.353) 5.786 6.340 ( -4.330 0.000 -0.770) 4.398 6.394 ( -2.915 0.000 -2.486) 3.831 6.536 ( -0.289 0.000 2.159) 2.178 6.573 ( 5.401 -0.000 -5.053) 7.396 6.739 ( -7.698 0.000 -2.901) 8.227 6.764 ( -4.919 0.000 1.662) 5.192 6.855 ( -1.673 0.000 1.521) 2.261 6.884 ( 7.550 -0.000 -3.183) 8.194 6.984 ( 2.785 -0.000 -0.998) 2.958 7.051 ( -0.095 0.000 3.295) 3.297 7.276 ( 2.509 -0.000 -4.374) 5.043 7.583 ( 2.374 -0.000 5.227) 5.741 7.673 ( -1.367 0.000 1.913) 2.351 7.912 ( -1.358 0.000 1.844) 2.289 8.092 ( -1.576 0.000 4.419) 4.691 8.103 ( 9.061 -0.000 -5.185) 10.439 8.458 ( 4.301 -0.000 -6.466) 7.766 8.515 ( 1.900 -0.000 5.423) 5.746 9.270 ( 7.188 -0.000 1.241) 7.294 9.273 ( 4.852 -0.000 0.582) 4.887 10.050 ( -6.372 0.000 -10.720) 12.471 10.285 ( -0.556 0.000 -0.755) 0.938 10.468 ( -2.126 0.000 -1.552) 2.632 10.551 ( 15.324 -0.000 9.768) 18.172 10.949 ( -0.731 0.000 -2.341) 2.453 11.050 ( -0.673 0.000 -3.392) 3.458 11.561 ( 0.476 -0.000 -0.818) 0.946 11.752 ( 7.434 -0.000 12.590) 14.621 12.049 ( -2.471 0.000 4.071) 4.763 12.148 ( -1.884 0.000 -2.789) 3.365 12.536 ( 3.462 -0.000 10.147) 10.722 12.594 ( -0.303 0.000 -12.058) 12.062 12.771 ( -6.435 0.000 -11.394) 13.085 12.803 ( -3.196 0.000 -4.756) 5.730 13.264 ( -4.205 0.000 6.016) 7.340 13.522 ( -9.789 0.000 5.558) 11.257 13.770 ( 12.274 -0.000 -0.541) 12.286 14.028 ( -8.773 0.000 -2.540) 9.133 14.344 ( -4.659 0.000 6.155) 7.719 14.762 ( 8.558 -0.000 -2.632) 8.954 15.229 ( 2.226 -0.000 -2.284) 3.189 15.453 ( -2.986 0.000 0.184) 2.992 ======================= Grid point 289 (137/141) ======================= q-point: (-0.20 -0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.691 ( -8.245 1.509 1.814) 8.576 1.808 ( -9.343 -2.185 -0.955) 9.643 1.902 ( -4.577 4.186 2.426) 6.660 2.104 ( -7.519 -0.454 -2.767) 8.024 2.311 ( -3.398 -1.761 -2.326) 4.479 2.427 ( -1.183 0.046 2.291) 2.579 2.671 ( -1.132 -2.782 -2.672) 4.020 2.911 ( -5.801 -0.540 1.159) 5.940 3.032 ( 6.820 -2.349 0.787) 7.256 3.085 ( 6.774 0.423 -1.636) 6.982 3.417 ( 7.300 -1.884 -3.458) 8.294 3.572 ( 5.154 3.140 5.369) 8.077 3.741 ( 0.602 -0.324 -3.819) 3.880 3.743 ( -2.351 -1.899 1.612) 3.426 3.927 ( 0.045 1.611 1.350) 2.102 4.067 ( -4.960 -0.406 0.514) 5.003 4.140 ( 5.584 0.095 2.319) 6.047 4.355 ( 4.935 2.483 -1.563) 5.741 4.407 ( 0.300 -0.476 -1.254) 1.375 4.421 ( -1.591 -3.225 0.147) 3.599 4.769 ( -1.557 -0.459 -5.339) 5.580 4.836 ( -14.679 -1.689 2.005) 14.911 5.249 ( 0.566 6.125 -0.629) 6.183 5.434 ( -0.057 -5.099 5.045) 7.173 5.725 ( 1.460 4.215 -1.093) 4.593 5.795 ( -1.278 -0.851 -4.293) 4.560 5.872 ( 5.360 -1.096 1.542) 5.684 6.075 ( 1.413 2.938 5.549) 6.436 6.118 ( -6.568 -1.062 -2.276) 7.032 6.211 ( 4.178 -2.386 2.030) 5.222 6.303 ( -2.760 0.205 0.632) 2.839 6.342 ( -2.243 -4.176 2.364) 5.297 6.552 ( -0.010 -2.210 2.680) 3.473 6.655 ( 1.481 -0.350 -4.197) 4.464 6.688 ( 3.413 -3.528 -2.207) 5.382 6.730 ( -0.765 0.229 -1.191) 1.433 6.867 ( 1.226 -2.381 1.187) 2.929 6.985 ( 3.542 2.729 0.626) 4.515 7.032 ( 5.849 -0.914 -6.441) 8.748 7.097 ( 1.450 -5.573 0.142) 5.760 7.246 ( -3.519 -0.069 -1.809) 3.957 7.539 ( -7.634 1.172 3.827) 8.619 7.663 ( -1.591 -1.639 3.284) 4.000 7.886 ( -1.481 1.096 2.227) 2.890 8.120 ( 3.713 1.651 3.078) 5.098 8.290 ( 13.375 -1.329 -4.038) 14.035 8.519 ( 4.142 3.466 -1.160) 5.524 8.586 ( 5.658 -3.262 0.726) 6.571 9.334 ( 1.818 1.263 0.394) 2.248 9.392 ( 4.042 -0.912 0.129) 4.146 9.878 ( -4.929 5.982 -4.306) 8.867 10.178 ( -2.521 15.706 -1.932) 16.024 10.414 ( -2.654 1.160 -1.749) 3.383 10.798 ( 6.795 5.954 5.278) 10.463 10.974 ( 3.314 -2.881 -0.175) 4.395 11.073 ( 1.076 -12.279 -4.074) 12.982 11.546 ( -1.694 2.629 0.632) 3.190 11.902 ( 5.507 0.923 7.357) 9.236 12.032 ( 0.279 0.550 4.317) 4.361 12.144 ( 1.635 -0.686 -1.140) 2.108 12.526 ( 1.817 6.281 -10.121) 12.049 12.636 ( 2.995 -0.898 5.504) 6.330 12.709 ( -2.505 -7.828 -8.144) 11.570 12.737 ( -3.054 -3.516 -1.721) 4.965 13.194 ( -6.251 -0.465 6.127) 8.765 13.349 ( -11.782 0.414 5.688) 13.090 13.833 ( -10.967 1.702 -2.061) 11.288 13.950 ( 8.574 0.529 -7.916) 11.681 14.302 ( -2.517 -1.214 10.339) 10.710 14.900 ( 7.534 0.033 -1.322) 7.649 15.255 ( 2.261 0.935 -4.331) 4.974 15.388 ( -4.626 -0.987 0.563) 4.764 ======================= Grid point 290 (138/141) ======================= q-point: (-0.10 -0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.555 ( -9.670 -2.444 8.499) 13.104 1.645 ( -12.648 -5.985 -0.290) 13.995 1.763 ( -7.683 3.303 -0.254) 8.367 1.987 ( -4.261 -0.874 -7.656) 8.805 2.272 ( -4.065 -4.667 -3.599) 7.159 2.437 ( 1.645 0.841 4.057) 4.458 2.649 ( -6.493 -4.816 -0.985) 8.144 2.762 ( -15.824 -5.021 1.962) 16.717 3.107 ( 2.259 3.497 -1.541) 4.439 3.171 ( 0.539 -1.401 -0.111) 1.505 3.471 ( -0.280 0.414 -1.138) 1.243 3.614 ( 4.597 1.889 0.798) 5.033 3.729 ( 2.344 0.887 -2.008) 3.212 3.835 ( 3.782 -2.946 1.577) 5.046 3.906 ( 2.842 4.020 2.573) 5.555 4.076 ( 3.214 -1.848 -0.399) 3.729 4.217 ( 1.874 3.019 1.271) 3.774 4.316 ( 0.550 -0.500 0.816) 1.104 4.457 ( 8.277 1.577 -2.331) 8.743 4.561 ( -2.430 -4.831 -0.644) 5.446 4.650 ( 0.462 -1.709 1.003) 2.035 4.788 ( 1.885 -2.111 -4.413) 5.243 5.214 ( 2.046 6.945 1.131) 7.328 5.493 ( 0.444 -6.174 2.561) 6.699 5.694 ( 0.297 5.065 0.586) 5.107 5.815 ( 2.681 -0.367 -0.927) 2.861 5.946 ( 2.886 0.721 -1.113) 3.176 6.032 ( -4.929 -2.484 -3.257) 6.409 6.094 ( 1.157 1.244 2.943) 3.398 6.256 ( -0.463 -1.186 1.818) 2.220 6.311 ( 1.356 -1.856 -1.977) 3.032 6.399 ( 2.162 -5.325 6.283) 8.516 6.574 ( -0.910 -1.504 0.017) 1.758 6.687 ( 4.150 0.097 -1.538) 4.427 6.712 ( -0.314 -1.055 -3.227) 3.409 6.801 ( 2.854 -4.404 2.558) 5.838 6.936 ( 2.176 -1.943 -0.808) 3.027 7.012 ( 3.912 -0.900 -0.464) 4.041 7.106 ( 2.039 -2.255 -1.725) 3.496 7.186 ( 2.751 -4.994 -3.257) 6.567 7.235 ( 4.236 -1.006 -2.154) 4.857 7.383 ( -9.652 -0.324 2.871) 10.075 7.671 ( -1.632 -4.004 3.219) 5.390 7.858 ( -1.257 0.917 2.522) 2.963 8.171 ( 5.538 5.772 0.958) 8.056 8.459 ( 2.297 3.353 -2.503) 4.773 8.592 ( 11.681 -0.818 0.291) 11.713 8.768 ( 10.418 -4.505 -0.016) 11.350 9.215 ( -8.838 11.481 0.484) 14.497 9.417 ( -0.434 1.776 -0.617) 1.930 9.819 ( 4.447 6.339 -3.626) 8.550 9.911 ( -4.233 20.827 1.717) 21.322 10.328 ( -6.963 -0.073 0.701) 6.998 10.734 ( -4.627 5.283 -6.164) 9.344 11.012 ( 0.600 -1.942 -5.777) 6.124 11.307 ( 6.449 -11.178 4.622) 13.708 11.444 ( -5.647 4.116 3.102) 7.646 11.927 ( -1.239 1.828 0.069) 2.210 12.075 ( 2.698 -0.126 3.305) 4.268 12.205 ( 6.283 2.368 0.764) 6.757 12.511 ( 5.242 5.138 -5.095) 8.935 12.623 ( -3.844 -1.634 0.671) 4.231 12.767 ( 0.811 -9.452 -4.764) 10.616 12.824 ( 3.559 -5.198 4.443) 7.709 13.106 ( -6.988 -1.536 4.226) 8.310 13.181 ( -9.120 -2.814 3.969) 10.337 13.645 ( -9.223 0.713 1.792) 9.422 13.938 ( -5.884 -1.416 -12.966) 14.309 14.393 ( 8.203 1.325 12.742) 15.212 14.996 ( 4.479 0.494 -1.093) 4.637 15.250 ( 0.193 1.679 -4.368) 4.684 15.344 ( -2.483 -2.334 -1.669) 3.794 ======================= Grid point 299 (139/141) ======================= q-point: (-0.20 -0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 141 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.539 ( -11.099 0.000 6.428) 12.826 1.567 ( -16.693 0.000 1.880) 16.798 1.861 ( -3.067 0.000 -4.145) 5.156 1.913 ( -12.001 0.000 -2.954) 12.359 2.228 ( -3.772 0.000 -4.614) 5.959 2.445 ( 1.523 -0.000 5.291) 5.506 2.601 ( -5.493 0.000 -1.939) 5.825 2.708 ( -17.936 0.000 2.041) 18.051 3.137 ( 3.011 -0.000 -0.384) 3.036 3.168 ( 2.146 -0.000 -1.598) 2.676 3.471 ( 1.327 -0.000 -1.559) 2.048 3.659 ( 2.118 -0.000 1.036) 2.358 3.723 ( 2.303 -0.000 0.956) 2.494 3.784 ( 5.402 -0.000 -2.260) 5.855 3.980 ( 3.605 -0.000 -0.200) 3.610 4.033 ( 1.392 -0.000 3.996) 4.232 4.272 ( 7.758 -0.000 2.763) 8.235 4.281 ( -4.226 0.000 -0.596) 4.267 4.488 ( 1.578 -0.000 -2.513) 2.967 4.493 ( 6.639 -0.000 -4.030) 7.767 4.634 ( -1.611 0.000 3.366) 3.731 4.768 ( 2.906 -0.000 -4.413) 5.283 5.332 ( 4.926 -0.000 1.525) 5.156 5.379 ( -3.636 0.000 2.970) 4.695 5.741 ( -2.138 0.000 -2.153) 3.034 5.813 ( 3.735 -0.000 -0.807) 3.822 5.966 ( 4.243 -0.000 1.697) 4.570 5.996 ( -4.243 0.000 -2.059) 4.717 6.113 ( 0.790 -0.000 1.199) 1.436 6.243 ( -0.778 0.000 -3.736) 3.816 6.286 ( -3.238 0.000 6.261) 7.049 6.335 ( 5.994 -0.000 3.838) 7.118 6.547 ( -0.430 0.000 0.814) 0.920 6.672 ( 3.534 -0.000 0.514) 3.571 6.711 ( 0.233 -0.000 -1.683) 1.699 6.770 ( 4.099 -0.000 -2.887) 5.014 6.878 ( 1.892 -0.000 2.558) 3.182 7.072 ( 3.218 -0.000 -0.978) 3.363 7.074 ( 1.481 -0.000 2.129) 2.594 7.097 ( 3.195 -0.000 -9.726) 10.237 7.231 ( 5.081 -0.000 -3.586) 6.219 7.388 ( -10.948 0.000 3.535) 11.504 7.630 ( -2.760 0.000 3.783) 4.683 7.869 ( -1.820 0.000 2.487) 3.082 8.233 ( 7.798 -0.000 3.575) 8.579 8.487 ( 9.939 -0.000 -6.173) 11.700 8.605 ( 5.265 -0.000 3.469) 6.305 8.711 ( 10.989 -0.000 -1.996) 11.169 9.377 ( -6.583 0.000 0.300) 6.590 9.381 ( 2.302 -0.000 0.657) 2.394 9.860 ( 1.467 -0.000 1.215) 1.905 10.217 ( -2.228 0.000 -5.242) 5.696 10.301 ( -9.390 0.000 -0.453) 9.401 10.893 ( -6.976 0.000 -17.214) 18.573 10.921 ( -0.568 0.000 -0.854) 1.025 11.124 ( 11.199 -0.000 13.938) 17.880 11.506 ( -5.207 0.000 0.508) 5.231 11.958 ( -0.632 0.000 3.008) 3.074 12.070 ( 2.873 -0.000 3.832) 4.789 12.236 ( 7.349 -0.000 0.179) 7.351 12.564 ( -3.170 0.000 -6.183) 6.949 12.587 ( -1.519 0.000 -2.667) 3.069 12.684 ( 4.916 -0.000 -4.557) 6.703 12.746 ( 5.074 -0.000 6.042) 7.890 13.088 ( -7.367 0.000 4.990) 8.898 13.155 ( -12.799 0.000 6.298) 14.265 13.657 ( -9.577 0.000 0.324) 9.583 13.923 ( -6.928 0.000 -12.534) 14.321 14.407 ( 9.416 -0.000 12.944) 16.006 15.000 ( 4.354 -0.000 -0.654) 4.403 15.291 ( 2.905 -0.000 -8.453) 8.938 15.293 ( -5.341 0.000 1.154) 5.464 ======================= Grid point 300 (140/141) ======================= q-point: (-0.10 -0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 250 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.307 ( -18.095 -8.328 3.764) 20.271 1.384 ( -11.213 -1.730 15.138) 18.918 1.643 ( -11.871 5.258 -4.708) 13.811 1.841 ( -4.668 -7.672 -9.576) 13.129 2.154 ( -6.377 -2.814 -5.211) 8.703 2.339 ( -25.193 -2.766 3.482) 25.583 2.435 ( -11.140 -1.792 -0.232) 11.286 2.516 ( 1.194 -0.064 4.294) 4.457 3.093 ( -7.537 0.526 -1.848) 7.778 3.132 ( -3.074 2.063 -1.732) 4.087 3.479 ( 0.309 0.702 0.850) 1.145 3.692 ( 1.963 0.367 -0.657) 2.102 3.812 ( 6.551 -0.900 0.969) 6.683 3.896 ( 7.343 -1.237 -2.015) 7.715 4.010 ( 2.094 4.818 1.351) 5.424 4.107 ( 3.095 -4.557 0.674) 5.550 4.264 ( 3.225 1.780 -2.027) 4.204 4.358 ( 0.819 -1.107 4.180) 4.401 4.506 ( 6.855 1.675 -0.944) 7.120 4.583 ( 5.527 -0.683 -4.959) 7.457 4.778 ( 10.962 1.561 0.181) 11.075 4.858 ( 8.404 -1.971 -1.384) 8.742 5.285 ( -2.496 5.289 2.109) 6.217 5.460 ( 2.543 -5.716 2.902) 6.897 5.652 ( -6.889 -1.277 -2.510) 7.442 5.875 ( 3.279 1.059 2.279) 4.131 5.971 ( 0.926 0.717 -3.257) 3.461 6.003 ( 2.013 2.006 -1.004) 3.014 6.121 ( 0.229 1.119 0.997) 1.517 6.212 ( -3.432 -2.000 1.168) 4.140 6.262 ( -2.973 -3.225 2.644) 5.122 6.447 ( 3.945 -2.133 2.718) 5.244 6.526 ( -1.433 -1.590 -5.687) 6.077 6.690 ( -0.838 0.716 -4.627) 4.756 6.766 ( 2.242 -2.183 6.845) 7.527 6.794 ( -2.260 -1.508 3.145) 4.156 6.930 ( 1.795 -1.008 0.151) 2.064 7.085 ( 3.547 0.883 -1.342) 3.894 7.150 ( 0.684 -3.496 2.615) 4.419 7.221 ( 9.441 -3.670 -7.785) 12.775 7.253 ( 0.685 1.537 1.789) 2.456 7.327 ( 6.549 0.062 -5.569) 8.597 7.597 ( -3.410 -3.659 3.085) 5.877 7.851 ( -0.845 -0.282 3.723) 3.828 8.392 ( 12.736 6.561 1.069) 14.366 8.529 ( 1.811 6.818 -1.801) 7.280 8.785 ( 10.561 -3.511 1.756) 11.267 8.908 ( 9.958 -3.824 -0.611) 10.684 9.142 ( -13.419 8.981 5.939) 17.205 9.429 ( 1.513 1.374 -1.162) 2.351 9.929 ( 3.029 1.108 -3.126) 4.491 10.031 ( -1.717 13.817 1.650) 14.021 10.179 ( -7.685 0.144 -1.456) 7.823 10.602 ( -14.703 5.805 -21.619) 26.781 10.950 ( -0.410 -5.209 -4.252) 6.736 11.344 ( 2.830 -3.854 10.284) 11.341 11.382 ( -4.488 0.179 1.634) 4.780 11.914 ( -3.143 3.051 0.177) 4.384 12.138 ( 3.297 0.097 1.664) 3.694 12.338 ( 5.025 1.497 -0.161) 5.246 12.490 ( -3.921 -3.297 -4.066) 6.540 12.604 ( 0.576 -5.354 1.182) 5.513 12.764 ( 5.625 3.566 -0.680) 6.695 12.849 ( 0.875 -1.263 3.845) 4.141 12.966 ( -9.283 -0.266 4.367) 10.262 13.038 ( -2.133 -7.025 4.604) 8.665 13.535 ( -5.280 0.270 6.160) 8.117 13.722 ( -12.372 -1.323 -10.388) 16.209 14.607 ( 10.084 1.355 8.385) 13.184 15.047 ( 1.751 0.104 -0.452) 1.811 15.220 ( -3.131 -0.419 0.428) 3.187 15.294 ( -0.590 -0.481 -11.630) 11.655 ======================= Grid point 310 (141/141) ======================= q-point: (-0.10 -0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 140 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.949 ( -18.965 0.000 8.464) 20.768 1.244 ( -11.353 0.000 21.775) 24.557 1.426 ( -13.771 0.000 -6.824) 15.369 1.629 ( -12.807 0.000 -10.946) 16.847 1.727 ( -33.081 0.000 9.328) 34.371 2.168 ( -0.203 0.000 -4.408) 4.413 2.212 ( -9.688 0.000 -8.243) 12.720 2.581 ( 3.647 -0.000 3.204) 4.854 2.934 ( -11.067 0.000 -0.944) 11.107 3.053 ( -5.783 0.000 -1.563) 5.991 3.485 ( -0.527 0.000 1.419) 1.514 3.674 ( -2.533 0.000 -0.792) 2.654 3.935 ( 5.561 -0.000 -0.136) 5.562 4.024 ( 0.396 -0.000 6.555) 6.567 4.027 ( 9.536 -0.000 -4.294) 10.458 4.184 ( 7.041 -0.000 -1.288) 7.158 4.334 ( 4.718 -0.000 -4.567) 6.566 4.417 ( 3.004 -0.000 3.103) 4.319 4.656 ( 5.620 -0.000 -3.259) 6.496 4.663 ( 8.369 -0.000 0.079) 8.369 4.979 ( 7.640 -0.000 -1.289) 7.747 4.992 ( 10.239 -0.000 1.029) 10.291 5.257 ( -3.294 0.000 1.321) 3.549 5.420 ( -6.740 0.000 3.326) 7.516 5.548 ( -0.683 0.000 -4.300) 4.354 5.925 ( -0.069 0.000 4.538) 4.539 5.995 ( -4.899 0.000 -1.471) 5.115 6.026 ( 4.185 -0.000 -2.983) 5.139 6.131 ( -0.296 0.000 2.429) 2.447 6.146 ( -0.227 0.000 -1.110) 1.133 6.200 ( -3.195 0.000 4.160) 5.245 6.442 ( -2.307 0.000 -6.275) 6.686 6.518 ( 2.431 -0.000 -0.353) 2.457 6.648 ( -2.985 0.000 -4.516) 5.413 6.752 ( -1.933 0.000 3.246) 3.778 6.777 ( 0.179 -0.000 7.596) 7.599 6.933 ( -3.384 0.000 -0.796) 3.477 7.051 ( -3.650 0.000 3.331) 4.941 7.141 ( 1.742 -0.000 0.471) 1.804 7.367 ( 8.613 -0.000 -15.953) 18.130 7.398 ( 5.376 -0.000 1.743) 5.652 7.441 ( 10.026 -0.000 1.682) 10.166 7.533 ( 0.679 -0.000 0.318) 0.749 7.863 ( 1.338 -0.000 6.431) 6.568 8.634 ( -4.789 0.000 9.281) 10.443 8.684 ( 13.953 -0.000 0.454) 13.960 8.706 ( -11.539 0.000 7.088) 13.542 9.010 ( 6.033 -0.000 -6.219) 8.664 9.102 ( 5.066 -0.000 3.171) 5.977 9.433 ( -6.304 0.000 -9.045) 11.025 9.816 ( -10.533 0.000 -5.741) 11.996 10.104 ( -15.224 0.000 -6.444) 16.532 10.212 ( 13.919 -0.000 1.988) 14.061 10.276 ( -2.028 0.000 -20.977) 21.075 10.933 ( 2.487 -0.000 -1.724) 3.026 11.265 ( -8.255 0.000 1.983) 8.490 11.398 ( 0.628 -0.000 7.170) 7.198 11.843 ( -8.389 0.000 -0.049) 8.389 12.173 ( 0.807 -0.000 -1.631) 1.820 12.326 ( -4.651 0.000 2.876) 5.468 12.449 ( -0.388 0.000 -6.409) 6.420 12.576 ( 0.162 -0.000 4.533) 4.536 12.836 ( -0.709 0.000 7.398) 7.432 12.840 ( -1.832 0.000 -4.986) 5.312 12.940 ( 4.253 -0.000 -2.066) 4.728 13.004 ( 1.739 -0.000 8.442) 8.620 13.469 ( -12.537 0.000 -8.794) 15.314 13.521 ( 0.757 -0.000 12.098) 12.122 14.774 ( 6.040 -0.000 4.763) 7.692 15.062 ( -0.009 0.000 -1.432) 1.432 15.177 ( -1.758 0.000 1.412) 2.255 15.186 ( -7.931 0.000 -15.907) 17.775 =================== End of collection of collisions =================== ----------- Thermal conductivity (W/m-k) with tetrahedron method ----------- # T(K) xx yy zz yz xz xy #ipm 0.0 0.000 0.000 0.000 0.000 0.000 0.000 3/36000 10.0 466.701 373.923 329.941 0.000 7.021 0.000 3/36000 20.0 138.051 126.176 84.581 0.000 1.773 0.000 3/36000 30.0 61.062 57.291 35.947 0.000 0.731 0.000 3/36000 40.0 33.995 32.029 19.705 0.000 0.458 0.000 3/36000 50.0 21.648 20.408 12.479 0.000 0.310 0.000 3/36000 60.0 15.133 14.260 8.711 0.000 0.219 0.000 3/36000 70.0 11.332 10.667 6.525 0.000 0.161 0.000 3/36000 80.0 8.935 8.400 5.151 0.000 0.123 0.000 3/36000 90.0 7.325 6.877 4.232 0.000 0.096 0.000 3/36000 100.0 6.189 5.801 3.584 0.000 0.077 0.000 3/36000 110.0 5.351 5.010 3.108 0.000 0.064 0.000 3/36000 120.0 4.713 4.407 2.746 0.000 0.053 0.000 3/36000 130.0 4.212 3.935 2.462 0.000 0.046 0.000 3/36000 140.0 3.810 3.556 2.234 0.000 0.040 0.000 3/36000 150.0 3.480 3.245 2.048 0.000 0.035 0.000 3/36000 160.0 3.205 2.987 1.892 0.000 0.031 0.000 3/36000 170.0 2.972 2.768 1.759 0.000 0.028 0.000 3/36000 180.0 2.772 2.580 1.646 0.000 0.026 0.000 3/36000 190.0 2.598 2.417 1.547 0.000 0.024 0.000 3/36000 200.0 2.446 2.274 1.460 0.000 0.022 0.000 3/36000 210.0 2.312 2.148 1.383 0.000 0.020 0.000 3/36000 220.0 2.192 2.036 1.315 0.000 0.019 0.000 3/36000 230.0 2.084 1.936 1.253 0.000 0.018 0.000 3/36000 240.0 1.987 1.845 1.197 0.000 0.017 0.000 3/36000 250.0 1.899 1.763 1.146 0.000 0.016 0.000 3/36000 260.0 1.819 1.688 1.100 0.000 0.015 0.000 3/36000 270.0 1.746 1.619 1.057 0.000 0.015 0.000 3/36000 280.0 1.678 1.556 1.018 0.000 0.014 0.000 3/36000 290.0 1.616 1.498 0.981 0.000 0.014 0.000 3/36000 300.0 1.558 1.445 0.947 0.000 0.013 0.000 3/36000 310.0 1.504 1.395 0.916 0.000 0.013 0.000 3/36000 320.0 1.454 1.348 0.886 0.000 0.012 0.000 3/36000 330.0 1.408 1.305 0.859 0.000 0.012 0.000 3/36000 340.0 1.364 1.264 0.833 0.000 0.011 0.000 3/36000 350.0 1.323 1.226 0.809 0.000 0.011 0.000 3/36000 360.0 1.285 1.190 0.786 0.000 0.011 0.000 3/36000 370.0 1.248 1.156 0.764 0.000 0.010 0.000 3/36000 380.0 1.214 1.124 0.744 0.000 0.010 0.000 3/36000 390.0 1.182 1.094 0.724 0.000 0.010 0.000 3/36000 400.0 1.151 1.066 0.706 0.000 0.010 0.000 3/36000 410.0 1.122 1.039 0.689 0.000 0.009 0.000 3/36000 420.0 1.094 1.013 0.672 0.000 0.009 0.000 3/36000 430.0 1.068 0.989 0.656 0.000 0.009 0.000 3/36000 440.0 1.043 0.966 0.641 0.000 0.009 0.000 3/36000 450.0 1.019 0.943 0.627 0.000 0.008 0.000 3/36000 460.0 0.996 0.922 0.613 0.000 0.008 0.000 3/36000 470.0 0.975 0.902 0.600 0.000 0.008 0.000 3/36000 480.0 0.954 0.883 0.587 0.000 0.008 0.000 3/36000 490.0 0.934 0.864 0.575 0.000 0.008 0.000 3/36000 500.0 0.915 0.846 0.564 0.000 0.008 0.000 3/36000 510.0 0.896 0.829 0.553 0.000 0.007 0.000 3/36000 520.0 0.879 0.813 0.542 0.000 0.007 0.000 3/36000 530.0 0.862 0.797 0.532 0.000 0.007 0.000 3/36000 540.0 0.846 0.782 0.522 0.000 0.007 0.000 3/36000 550.0 0.830 0.768 0.512 0.000 0.007 0.000 3/36000 560.0 0.815 0.754 0.503 0.000 0.007 0.000 3/36000 570.0 0.800 0.740 0.494 0.000 0.007 0.000 3/36000 580.0 0.786 0.727 0.486 0.000 0.006 0.000 3/36000 590.0 0.773 0.715 0.477 0.000 0.006 0.000 3/36000 600.0 0.760 0.703 0.469 0.000 0.006 0.000 3/36000 610.0 0.747 0.691 0.462 0.000 0.006 0.000 3/36000 620.0 0.735 0.680 0.454 0.000 0.006 0.000 3/36000 630.0 0.723 0.669 0.447 0.000 0.006 0.000 3/36000 640.0 0.711 0.658 0.440 0.000 0.006 0.000 3/36000 650.0 0.700 0.648 0.433 0.000 0.006 0.000 3/36000 660.0 0.690 0.638 0.427 0.000 0.006 0.000 3/36000 670.0 0.679 0.628 0.420 0.000 0.006 0.000 3/36000 680.0 0.669 0.619 0.414 0.000 0.006 0.000 3/36000 690.0 0.659 0.610 0.408 0.000 0.005 0.000 3/36000 700.0 0.650 0.601 0.402 0.000 0.005 0.000 3/36000 710.0 0.640 0.592 0.397 0.000 0.005 0.000 3/36000 720.0 0.631 0.584 0.391 0.000 0.005 0.000 3/36000 730.0 0.623 0.576 0.386 0.000 0.005 0.000 3/36000 740.0 0.614 0.568 0.380 0.000 0.005 0.000 3/36000 750.0 0.606 0.560 0.375 0.000 0.005 0.000 3/36000 760.0 0.598 0.553 0.370 0.000 0.005 0.000 3/36000 770.0 0.590 0.546 0.366 0.000 0.005 0.000 3/36000 780.0 0.582 0.539 0.361 0.000 0.005 0.000 3/36000 790.0 0.575 0.532 0.356 0.000 0.005 0.000 3/36000 800.0 0.568 0.525 0.352 0.000 0.005 0.000 3/36000 810.0 0.561 0.518 0.348 0.000 0.005 0.000 3/36000 820.0 0.554 0.512 0.343 0.000 0.005 0.000 3/36000 830.0 0.547 0.506 0.339 0.000 0.005 0.000 3/36000 840.0 0.540 0.500 0.335 0.000 0.004 0.000 3/36000 850.0 0.534 0.494 0.331 0.000 0.004 0.000 3/36000 860.0 0.528 0.488 0.327 0.000 0.004 0.000 3/36000 870.0 0.522 0.482 0.324 0.000 0.004 0.000 3/36000 880.0 0.516 0.477 0.320 0.000 0.004 0.000 3/36000 890.0 0.510 0.471 0.316 0.000 0.004 0.000 3/36000 900.0 0.504 0.466 0.313 0.000 0.004 0.000 3/36000 910.0 0.499 0.461 0.309 0.000 0.004 0.000 3/36000 920.0 0.493 0.456 0.306 0.000 0.004 0.000 3/36000 930.0 0.488 0.451 0.303 0.000 0.004 0.000 3/36000 940.0 0.483 0.446 0.299 0.000 0.004 0.000 3/36000 950.0 0.477 0.441 0.296 0.000 0.004 0.000 3/36000 960.0 0.472 0.437 0.293 0.000 0.004 0.000 3/36000 970.0 0.468 0.432 0.290 0.000 0.004 0.000 3/36000 980.0 0.463 0.428 0.287 0.000 0.004 0.000 3/36000 990.0 0.458 0.424 0.284 0.000 0.004 0.000 3/36000 1000.0 0.453 0.419 0.281 0.000 0.004 0.000 3/36000 Thermal conductivity related properties were written into "kappa-m10105.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 00:35:02]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|