----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 08:27:03]------------------------- 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 3 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 24 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.640167201494036 0.000000000000000 0.000000000000000 b 0.000000000000000 4.726940890000000 0.000000000000000 c -1.181443298996707 0.000000000000000 10.279280049385614 Atomic positions (fractional): *1 Li 0.00000000000000 0.50000000000000 0.50000000000000 6.941 2 Li 0.00000000000000 0.00000000000000 0.00000000000000 6.941 *3 O 0.23512466235372 0.67237470534073 0.08148990851002 15.999 4 O 0.76487533764628 0.17237470534073 0.41851009148998 15.999 5 O 0.76487533764628 0.32762529465927 0.91851009148998 15.999 6 O 0.23512466235372 0.82762529465927 0.58148990851002 15.999 *7 O 0.47930012272829 0.78211518861726 0.32607336418752 15.999 8 O 0.52069987727171 0.28211518861726 0.17392663581248 15.999 9 O 0.52069987727171 0.21788481138274 0.67392663581248 15.999 10 O 0.47930012272829 0.71788481138274 0.82607336418752 15.999 *11 O 0.27896181431345 0.29380665496568 0.42129761782721 15.999 12 O 0.72103818568655 0.79380665496568 0.07870238217279 15.999 13 O 0.72103818568655 0.70619334503432 0.57870238217279 15.999 14 O 0.27896181431345 0.20619334503432 0.92129761782721 15.999 *15 O 0.98736526538959 0.80945442364808 0.82570454541609 15.999 16 O 0.01263473461041 0.30945442364808 0.67429545458391 15.999 17 O 0.01263473461041 0.19054557635192 0.17429545458391 15.999 18 O 0.98736526538959 0.69054557635192 0.32570454541609 15.999 *19 Sb 0.50000000000000 0.50000000000000 0.00000000000000 121.760 20 Sb 0.50000000000000 0.00000000000000 0.50000000000000 121.760 *21 Sb 0.23670357760703 0.02153033079316 0.75100572803817 121.760 22 Sb 0.76329642239297 0.52153033079316 0.74899427196183 121.760 23 Sb 0.76329642239297 0.97846966920684 0.24899427196183 121.760 24 Sb 0.23670357760703 0.47846966920684 0.25100572803817 121.760 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.640167201494036 0.000000000000000 0.000000000000000 b 0.000000000000000 4.726940890000000 0.000000000000000 c -1.181443298996707 0.000000000000000 10.279280049385614 Atomic positions (fractional): *1 Li 0.00000000000000 0.50000000000000 0.50000000000000 6.941 > 1 2 Li 0.00000000000000 0.00000000000000 0.00000000000000 6.941 > 2 *3 O 0.23512466235372 0.67237470534073 0.08148990851002 15.999 > 3 4 O 0.76487533764628 0.17237470534073 0.41851009148998 15.999 > 4 5 O 0.76487533764628 0.32762529465927 0.91851009148998 15.999 > 5 6 O 0.23512466235372 0.82762529465927 0.58148990851002 15.999 > 6 *7 O 0.47930012272829 0.78211518861726 0.32607336418752 15.999 > 7 8 O 0.52069987727171 0.28211518861726 0.17392663581248 15.999 > 8 9 O 0.52069987727171 0.21788481138274 0.67392663581248 15.999 > 9 10 O 0.47930012272829 0.71788481138274 0.82607336418752 15.999 > 10 *11 O 0.27896181431345 0.29380665496568 0.42129761782721 15.999 > 11 12 O 0.72103818568655 0.79380665496568 0.07870238217279 15.999 > 12 13 O 0.72103818568655 0.70619334503432 0.57870238217279 15.999 > 13 14 O 0.27896181431345 0.20619334503432 0.92129761782721 15.999 > 14 *15 O 0.98736526538959 0.80945442364808 0.82570454541609 15.999 > 15 16 O 0.01263473461041 0.30945442364808 0.67429545458391 15.999 > 16 17 O 0.01263473461041 0.19054557635192 0.17429545458391 15.999 > 17 18 O 0.98736526538959 0.69054557635192 0.32570454541609 15.999 > 18 *19 Sb 0.50000000000000 0.50000000000000 0.00000000000000 121.760 > 19 20 Sb 0.50000000000000 0.00000000000000 0.50000000000000 121.760 > 20 *21 Sb 0.23670357760703 0.02153033079316 0.75100572803817 121.760 > 21 22 Sb 0.76329642239297 0.52153033079316 0.74899427196183 121.760 > 22 23 Sb 0.76329642239297 0.97846966920684 0.24899427196183 121.760 > 23 24 Sb 0.23670357760703 0.47846966920684 0.25100572803817 121.760 > 24 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.280334402988071 0.000000000000000 0.000000000000000 b 0.000000000000000 14.180822670000000 0.000000000000000 c -1.181443298996707 0.000000000000000 10.279280049385614 Atomic positions (fractional): *1 Li 0.00000000000000 0.16666666666667 0.50000000000000 6.941 > 1 2 Li 0.50000000000000 0.16666666666667 0.50000000000000 6.941 > 1 3 Li 0.00000000000000 0.50000000000000 0.50000000000000 6.941 > 1 4 Li 0.50000000000000 0.50000000000000 0.50000000000000 6.941 > 1 5 Li 0.00000000000000 0.83333333333333 0.50000000000000 6.941 > 1 6 Li 0.50000000000000 0.83333333333333 0.50000000000000 6.941 > 1 7 Li 0.00000000000000 0.00000000000000 0.00000000000000 6.941 > 2 8 Li 0.50000000000000 0.00000000000000 0.00000000000000 6.941 > 2 9 Li 0.00000000000000 0.33333333333333 0.00000000000000 6.941 > 2 10 Li 0.50000000000000 0.33333333333333 0.00000000000000 6.941 > 2 11 Li 0.00000000000000 0.66666666666667 0.00000000000000 6.941 > 2 12 Li 0.50000000000000 0.66666666666667 0.00000000000000 6.941 > 2 *13 O 0.11756233117686 0.22412490178024 0.08148990851002 15.999 > 3 14 O 0.61756233117686 0.22412490178024 0.08148990851002 15.999 > 3 15 O 0.11756233117686 0.55745823511358 0.08148990851002 15.999 > 3 16 O 0.61756233117686 0.55745823511358 0.08148990851002 15.999 > 3 17 O 0.11756233117686 0.89079156844691 0.08148990851002 15.999 > 3 18 O 0.61756233117686 0.89079156844691 0.08148990851002 15.999 > 3 19 O 0.38243766882314 0.05745823511358 0.41851009148998 15.999 > 4 20 O 0.88243766882314 0.05745823511358 0.41851009148998 15.999 > 4 21 O 0.38243766882314 0.39079156844691 0.41851009148998 15.999 > 4 22 O 0.88243766882314 0.39079156844691 0.41851009148998 15.999 > 4 23 O 0.38243766882314 0.72412490178024 0.41851009148998 15.999 > 4 24 O 0.88243766882314 0.72412490178024 0.41851009148998 15.999 > 4 25 O 0.38243766882314 0.10920843155309 0.91851009148998 15.999 > 5 26 O 0.88243766882314 0.10920843155309 0.91851009148998 15.999 > 5 27 O 0.38243766882314 0.44254176488642 0.91851009148998 15.999 > 5 28 O 0.88243766882314 0.44254176488642 0.91851009148998 15.999 > 5 29 O 0.38243766882314 0.77587509821976 0.91851009148998 15.999 > 5 30 O 0.88243766882314 0.77587509821976 0.91851009148998 15.999 > 5 31 O 0.11756233117686 0.27587509821976 0.58148990851002 15.999 > 6 32 O 0.61756233117686 0.27587509821976 0.58148990851002 15.999 > 6 33 O 0.11756233117686 0.60920843155309 0.58148990851002 15.999 > 6 34 O 0.61756233117686 0.60920843155309 0.58148990851002 15.999 > 6 35 O 0.11756233117686 0.94254176488642 0.58148990851002 15.999 > 6 36 O 0.61756233117686 0.94254176488642 0.58148990851002 15.999 > 6 *37 O 0.23965006136414 0.26070506287242 0.32607336418752 15.999 > 7 38 O 0.73965006136414 0.26070506287242 0.32607336418752 15.999 > 7 39 O 0.23965006136414 0.59403839620575 0.32607336418752 15.999 > 7 40 O 0.73965006136414 0.59403839620575 0.32607336418752 15.999 > 7 41 O 0.23965006136414 0.92737172953909 0.32607336418752 15.999 > 7 42 O 0.73965006136414 0.92737172953909 0.32607336418752 15.999 > 7 43 O 0.26034993863586 0.09403839620575 0.17392663581248 15.999 > 8 44 O 0.76034993863586 0.09403839620575 0.17392663581248 15.999 > 8 45 O 0.26034993863586 0.42737172953909 0.17392663581248 15.999 > 8 46 O 0.76034993863586 0.42737172953909 0.17392663581248 15.999 > 8 47 O 0.26034993863586 0.76070506287242 0.17392663581248 15.999 > 8 48 O 0.76034993863586 0.76070506287242 0.17392663581248 15.999 > 8 49 O 0.26034993863586 0.07262827046091 0.67392663581248 15.999 > 9 50 O 0.76034993863586 0.07262827046091 0.67392663581248 15.999 > 9 51 O 0.26034993863586 0.40596160379425 0.67392663581248 15.999 > 9 52 O 0.76034993863586 0.40596160379425 0.67392663581248 15.999 > 9 53 O 0.26034993863586 0.73929493712758 0.67392663581248 15.999 > 9 54 O 0.76034993863586 0.73929493712758 0.67392663581248 15.999 > 9 55 O 0.23965006136414 0.23929493712758 0.82607336418752 15.999 > 10 56 O 0.73965006136414 0.23929493712758 0.82607336418752 15.999 > 10 57 O 0.23965006136414 0.57262827046091 0.82607336418752 15.999 > 10 58 O 0.73965006136414 0.57262827046091 0.82607336418752 15.999 > 10 59 O 0.23965006136414 0.90596160379425 0.82607336418752 15.999 > 10 60 O 0.73965006136414 0.90596160379425 0.82607336418752 15.999 > 10 *61 O 0.13948090715673 0.09793555165523 0.42129761782721 15.999 > 11 62 O 0.63948090715673 0.09793555165523 0.42129761782721 15.999 > 11 63 O 0.13948090715673 0.43126888498856 0.42129761782721 15.999 > 11 64 O 0.63948090715673 0.43126888498856 0.42129761782721 15.999 > 11 65 O 0.13948090715673 0.76460221832189 0.42129761782721 15.999 > 11 66 O 0.63948090715673 0.76460221832189 0.42129761782721 15.999 > 11 67 O 0.36051909284327 0.26460221832189 0.07870238217279 15.999 > 12 68 O 0.86051909284327 0.26460221832189 0.07870238217279 15.999 > 12 69 O 0.36051909284327 0.59793555165523 0.07870238217279 15.999 > 12 70 O 0.86051909284327 0.59793555165523 0.07870238217279 15.999 > 12 71 O 0.36051909284327 0.93126888498856 0.07870238217279 15.999 > 12 72 O 0.86051909284327 0.93126888498856 0.07870238217279 15.999 > 12 73 O 0.36051909284327 0.23539778167811 0.57870238217279 15.999 > 13 74 O 0.86051909284327 0.23539778167811 0.57870238217279 15.999 > 13 75 O 0.36051909284327 0.56873111501144 0.57870238217279 15.999 > 13 76 O 0.86051909284327 0.56873111501144 0.57870238217279 15.999 > 13 77 O 0.36051909284327 0.90206444834477 0.57870238217279 15.999 > 13 78 O 0.86051909284327 0.90206444834477 0.57870238217279 15.999 > 13 79 O 0.13948090715673 0.06873111501144 0.92129761782721 15.999 > 14 80 O 0.63948090715673 0.06873111501144 0.92129761782721 15.999 > 14 81 O 0.13948090715673 0.40206444834477 0.92129761782721 15.999 > 14 82 O 0.63948090715673 0.40206444834477 0.92129761782721 15.999 > 14 83 O 0.13948090715673 0.73539778167811 0.92129761782721 15.999 > 14 84 O 0.63948090715673 0.73539778167811 0.92129761782721 15.999 > 14 *85 O 0.49368263269479 0.26981814121603 0.82570454541609 15.999 > 15 86 O 0.99368263269479 0.26981814121603 0.82570454541609 15.999 > 15 87 O 0.49368263269479 0.60315147454936 0.82570454541609 15.999 > 15 88 O 0.99368263269479 0.60315147454936 0.82570454541609 15.999 > 15 89 O 0.49368263269479 0.93648480788269 0.82570454541609 15.999 > 15 90 O 0.99368263269479 0.93648480788269 0.82570454541609 15.999 > 15 91 O 0.00631736730521 0.10315147454936 0.67429545458391 15.999 > 16 92 O 0.50631736730521 0.10315147454936 0.67429545458391 15.999 > 16 93 O 0.00631736730521 0.43648480788269 0.67429545458391 15.999 > 16 94 O 0.50631736730521 0.43648480788269 0.67429545458391 15.999 > 16 95 O 0.00631736730521 0.76981814121603 0.67429545458391 15.999 > 16 96 O 0.50631736730521 0.76981814121603 0.67429545458391 15.999 > 16 97 O 0.00631736730521 0.06351519211731 0.17429545458391 15.999 > 17 98 O 0.50631736730521 0.06351519211731 0.17429545458391 15.999 > 17 99 O 0.00631736730521 0.39684852545064 0.17429545458391 15.999 > 17 100 O 0.50631736730521 0.39684852545064 0.17429545458391 15.999 > 17 101 O 0.00631736730521 0.73018185878397 0.17429545458391 15.999 > 17 102 O 0.50631736730521 0.73018185878397 0.17429545458391 15.999 > 17 103 O 0.49368263269479 0.23018185878397 0.32570454541609 15.999 > 18 104 O 0.99368263269479 0.23018185878397 0.32570454541609 15.999 > 18 105 O 0.49368263269479 0.56351519211731 0.32570454541609 15.999 > 18 106 O 0.99368263269479 0.56351519211731 0.32570454541609 15.999 > 18 107 O 0.49368263269479 0.89684852545064 0.32570454541609 15.999 > 18 108 O 0.99368263269479 0.89684852545064 0.32570454541609 15.999 > 18 *109 Sb 0.25000000000000 0.16666666666667 0.00000000000000 121.760 > 19 110 Sb 0.75000000000000 0.16666666666667 0.00000000000000 121.760 > 19 111 Sb 0.25000000000000 0.50000000000000 0.00000000000000 121.760 > 19 112 Sb 0.75000000000000 0.50000000000000 0.00000000000000 121.760 > 19 113 Sb 0.25000000000000 0.83333333333333 0.00000000000000 121.760 > 19 114 Sb 0.75000000000000 0.83333333333333 0.00000000000000 121.760 > 19 115 Sb 0.25000000000000 0.00000000000000 0.50000000000000 121.760 > 20 116 Sb 0.75000000000000 0.00000000000000 0.50000000000000 121.760 > 20 117 Sb 0.25000000000000 0.33333333333333 0.50000000000000 121.760 > 20 118 Sb 0.75000000000000 0.33333333333333 0.50000000000000 121.760 > 20 119 Sb 0.25000000000000 0.66666666666667 0.50000000000000 121.760 > 20 120 Sb 0.75000000000000 0.66666666666667 0.50000000000000 121.760 > 20 *121 Sb 0.11835178880351 0.00717677693105 0.75100572803817 121.760 > 21 122 Sb 0.61835178880351 0.00717677693105 0.75100572803817 121.760 > 21 123 Sb 0.11835178880351 0.34051011026439 0.75100572803817 121.760 > 21 124 Sb 0.61835178880351 0.34051011026439 0.75100572803817 121.760 > 21 125 Sb 0.11835178880351 0.67384344359772 0.75100572803817 121.760 > 21 126 Sb 0.61835178880351 0.67384344359772 0.75100572803817 121.760 > 21 127 Sb 0.38164821119649 0.17384344359772 0.74899427196183 121.760 > 22 128 Sb 0.88164821119649 0.17384344359772 0.74899427196183 121.760 > 22 129 Sb 0.38164821119649 0.50717677693105 0.74899427196183 121.760 > 22 130 Sb 0.88164821119649 0.50717677693105 0.74899427196183 121.760 > 22 131 Sb 0.38164821119649 0.84051011026439 0.74899427196183 121.760 > 22 132 Sb 0.88164821119649 0.84051011026439 0.74899427196183 121.760 > 22 133 Sb 0.38164821119649 0.32615655640228 0.24899427196183 121.760 > 23 134 Sb 0.88164821119649 0.32615655640228 0.24899427196183 121.760 > 23 135 Sb 0.38164821119649 0.65948988973561 0.24899427196183 121.760 > 23 136 Sb 0.88164821119649 0.65948988973561 0.24899427196183 121.760 > 23 137 Sb 0.38164821119649 0.99282322306895 0.24899427196183 121.760 > 23 138 Sb 0.88164821119649 0.99282322306895 0.24899427196183 121.760 > 23 139 Sb 0.11835178880351 0.15948988973561 0.25100572803817 121.760 > 24 140 Sb 0.61835178880351 0.15948988973561 0.25100572803817 121.760 > 24 141 Sb 0.11835178880351 0.49282322306895 0.25100572803817 121.760 > 24 142 Sb 0.61835178880351 0.49282322306895 0.25100572803817 121.760 > 24 143 Sb 0.11835178880351 0.82615655640228 0.25100572803817 121.760 > 24 144 Sb 0.61835178880351 0.82615655640228 0.25100572803817 121.760 > 24 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.4506372 0.0000000 -0.0954582 0.0000000 4.3976362 0.0000000 -0.0954587 0.0000000 4.5418063 -------------------------- Born effective charges -------------------------- 1 Li 1.2283165 0.1086725 -0.0442969 0.1479634 1.2157724 0.1793820 -0.0594680 0.0981400 1.2830340 2 Li 1.2283165 -0.1086725 -0.0442969 -0.1479634 1.2157724 -0.1793820 -0.0594680 -0.0981400 1.2830340 3 O -1.7517760 0.1416333 0.5301756 0.1075162 -1.4645035 0.1149421 0.4030298 0.1491676 -2.1448317 4 O -1.7517760 -0.1416333 0.5301756 -0.1075162 -1.4645035 -0.1149421 0.4030298 -0.1491676 -2.1448317 5 O -1.7517760 0.1416333 0.5301756 0.1075162 -1.4645035 0.1149421 0.4030298 0.1491676 -2.1448317 6 O -1.7517760 -0.1416333 0.5301756 -0.1075162 -1.4645035 -0.1149421 0.4030298 -0.1491676 -2.1448317 7 O -2.0753339 -0.6214092 0.1458230 -0.6254900 -2.1142487 -0.6446681 0.2015235 -0.4350754 -2.2643866 8 O -2.0753339 0.6214092 0.1458230 0.6254900 -2.1142487 0.6446681 0.2015235 0.4350754 -2.2643866 9 O -2.0753339 -0.6214092 0.1458230 -0.6254900 -2.1142487 -0.6446681 0.2015235 -0.4350754 -2.2643866 10 O -2.0753339 0.6214092 0.1458230 0.6254900 -2.1142487 0.6446681 0.2015235 0.4350754 -2.2643866 11 O -1.6510884 0.5302165 -0.4071956 0.5575222 -1.9962113 0.6095871 -0.2499771 0.7082058 -2.1879081 12 O -1.6510884 -0.5302165 -0.4071956 -0.5575222 -1.9962113 -0.6095871 -0.2499771 -0.7082058 -2.1879081 13 O -1.6510884 0.5302165 -0.4071956 0.5575222 -1.9962113 0.6095871 -0.2499771 0.7082058 -2.1879081 14 O -1.6510884 -0.5302165 -0.4071956 -0.5575222 -1.9962113 -0.6095871 -0.2499771 -0.7082058 -2.1879081 15 O -2.4341847 -0.8802512 -0.0175799 -0.8467012 -2.1044627 -0.0828864 -0.0904498 -0.2027457 -1.4812826 16 O -2.4341847 0.8802512 -0.0175799 0.8467012 -2.1044627 0.0828864 -0.0904498 0.2027457 -1.4812826 17 O -2.4341847 -0.8802512 -0.0175799 -0.8467012 -2.1044627 -0.0828864 -0.0904498 -0.2027457 -1.4812826 18 O -2.4341847 0.8802512 -0.0175799 0.8467012 -2.1044627 0.0828864 -0.0904498 0.2027457 -1.4812826 19 Sb 4.0213145 0.3411024 -0.2056543 1.3009621 4.4226308 -0.6743487 -0.2230519 0.8204688 5.9833835 20 Sb 4.0213145 -0.3411024 -0.2056543 -1.3009621 4.4226308 0.6743487 -0.2230519 -0.8204688 5.9833835 21 Sb 5.2875675 -0.4762388 -0.1262474 -0.1220238 4.8602248 -0.6312617 -0.1228665 0.0448988 4.4452003 22 Sb 5.2875675 0.4762388 -0.1262474 0.1220238 4.8602248 0.6312617 -0.1228665 -0.0448988 4.4452003 23 Sb 5.2875675 -0.4762388 -0.1262474 -0.1220238 4.8602248 -0.6312617 -0.1228665 0.0448988 4.4452003 24 Sb 5.2875675 0.4762388 -0.1262474 0.1220238 4.8602248 0.6312617 -0.1228665 -0.0448988 4.4452003 ---------------------------------------------------------------------------- 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: 432/432 Permutation basis: 16056/16056 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 4050 Number of blocks in projector: 4050 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: 868 Use submatrix version of eigh solver. (1) Block: 500 / 868 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 868 / 868 (1) 357 eigenvectors found. (1) Complementary block size: 25 (1) Compute compressed projector. (1) Use standard solver. (1) 11 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 868 Use submatrix version of eigh solver. (1) Block: 500 / 868 (2) Block: 250 / 500 (2) 237 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 487 eigenvectors found. (1) Block: 868 / 868 (1) 359 eigenvectors found. (1) Complementary block size: 22 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 868 Use submatrix version of eigh solver. (1) Block: 500 / 868 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 868 / 868 (1) 357 eigenvectors found. (1) Complementary block size: 25 (1) Compute compressed projector. (1) Use standard solver. (1) 11 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 482 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 482 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 482 Use standard eigh solver. Tree of FC basis block matrices: - (4050, 3988), data: False |-- (482, 475), data: True |-- (482, 475), data: True |-- (482, 475), data: True |-- (868, 854), data: False |-- (868, 11), data: (868, 25) @ (25, 11) |-- (368, 357), data: True |-- (500, 486), data: False |-- (500, 12), data: (500, 26) @ (26, 12) |-- (250, 238), data: True |-- (250, 236), data: True |-- (868, 855), data: False |-- (868, 9), data: (868, 22) @ (22, 9) |-- (368, 359), data: True |-- (500, 487), data: False |-- (500, 11), data: (500, 24) @ (24, 11) |-- (250, 239), data: True |-- (250, 237), data: True |-- (868, 854), data: False |-- (868, 11), data: (868, 25) @ (25, 11) |-- (368, 357), data: True |-- (500, 486), data: False |-- (500, 12), data: (500, 26) @ (26, 12) |-- (250, 238), data: True |-- (250, 236), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.005 Solver_block: 100 / 720 - Time: 1.392 Solver_block: 200 / 720 - Time: 1.389 Solver_block: 300 / 720 - Time: 2.600 Solver_block: 400 / 720 - Time: 1.188 Solver_block: 500 / 720 - Time: 2.511 Solver_block: 600 / 720 - Time: 1.225 Solver_block: 700 / 720 - Time: 1.724 Solver_block: 720 / 720 - Time: 0.817 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 13.601 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 432/432 Permutation basis: 16056/16056 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 4050 Number of blocks in projector: 4050 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: 868 Use submatrix version of eigh solver. (1) Block: 500 / 868 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 868 / 868 (1) 357 eigenvectors found. (1) Complementary block size: 25 (1) Compute compressed projector. (1) Use standard solver. (1) 11 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 868 Use submatrix version of eigh solver. (1) Block: 500 / 868 (2) Block: 250 / 500 (2) 237 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 487 eigenvectors found. (1) Block: 868 / 868 (1) 359 eigenvectors found. (1) Complementary block size: 22 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 868 Use submatrix version of eigh solver. (1) Block: 500 / 868 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 868 / 868 (1) 357 eigenvectors found. (1) Complementary block size: 25 (1) Compute compressed projector. (1) Use standard solver. (1) 11 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 482 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 482 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 482 Use standard eigh solver. Tree of FC basis block matrices: - (4050, 3988), data: False |-- (482, 475), data: True |-- (482, 475), data: True |-- (482, 475), data: True |-- (868, 854), data: False |-- (868, 11), data: (868, 25) @ (25, 11) |-- (368, 357), data: True |-- (500, 486), data: False |-- (500, 12), data: (500, 26) @ (26, 12) |-- (250, 238), data: True |-- (250, 236), data: True |-- (868, 855), data: False |-- (868, 9), data: (868, 22) @ (22, 9) |-- (368, 359), data: True |-- (500, 487), data: False |-- (500, 11), data: (500, 24) @ (24, 11) |-- (250, 239), data: True |-- (250, 237), data: True |-- (868, 854), data: False |-- (868, 11), data: (868, 25) @ (25, 11) |-- (368, 357), data: True |-- (500, 486), data: False |-- (500, 12), data: (500, 26) @ (26, 12) |-- (250, 238), data: True |-- (250, 236), data: True Max drift after symmetrization by symfc projector: 0.00000000 (xx) 0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 08:28:08]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 08:28:09]------------------------- 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 3 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.640167201494036 0.000000000000000 0.000000000000000 b 0.000000000000000 4.726940890000000 0.000000000000000 c -1.181443298996707 0.000000000000000 10.279280049385614 Atomic positions (fractional): 1 Li 0.00000000000000 0.50000000000000 0.50000000000000 6.941 2 Li 0.00000000000000 0.00000000000000 0.00000000000000 6.941 3 O 0.23512466235372 0.67237470534073 0.08148990851002 15.999 4 O 0.76487533764628 0.17237470534073 0.41851009148998 15.999 5 O 0.76487533764628 0.32762529465927 0.91851009148998 15.999 6 O 0.23512466235372 0.82762529465927 0.58148990851002 15.999 7 O 0.47930012272829 0.78211518861726 0.32607336418752 15.999 8 O 0.52069987727171 0.28211518861726 0.17392663581248 15.999 9 O 0.52069987727171 0.21788481138274 0.67392663581248 15.999 10 O 0.47930012272829 0.71788481138274 0.82607336418752 15.999 11 O 0.27896181431345 0.29380665496568 0.42129761782721 15.999 12 O 0.72103818568655 0.79380665496568 0.07870238217279 15.999 13 O 0.72103818568655 0.70619334503432 0.57870238217279 15.999 14 O 0.27896181431345 0.20619334503432 0.92129761782721 15.999 15 O 0.98736526538959 0.80945442364808 0.82570454541609 15.999 16 O 0.01263473461041 0.30945442364808 0.67429545458391 15.999 17 O 0.01263473461041 0.19054557635192 0.17429545458391 15.999 18 O 0.98736526538959 0.69054557635192 0.32570454541609 15.999 19 Sb 0.50000000000000 0.50000000000000 0.00000000000000 121.760 20 Sb 0.50000000000000 0.00000000000000 0.50000000000000 121.760 21 Sb 0.23670357760703 0.02153033079316 0.75100572803817 121.760 22 Sb 0.76329642239297 0.52153033079316 0.74899427196183 121.760 23 Sb 0.76329642239297 0.97846966920684 0.24899427196183 121.760 24 Sb 0.23670357760703 0.47846966920684 0.25100572803817 121.760 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.280334402988071 0.000000000000000 0.000000000000000 b 0.000000000000000 14.180822670000000 0.000000000000000 c -1.181443298996707 0.000000000000000 10.279280049385614 Atomic positions (fractional): 1 Li 0.00000000000000 0.16666666666667 0.50000000000000 6.941 > 1 2 Li 0.50000000000000 0.16666666666667 0.50000000000000 6.941 > 1 3 Li 0.00000000000000 0.50000000000000 0.50000000000000 6.941 > 1 4 Li 0.50000000000000 0.50000000000000 0.50000000000000 6.941 > 1 5 Li 0.00000000000000 0.83333333333333 0.50000000000000 6.941 > 1 6 Li 0.50000000000000 0.83333333333333 0.50000000000000 6.941 > 1 7 Li 0.00000000000000 0.00000000000000 0.00000000000000 6.941 > 7 8 Li 0.50000000000000 0.00000000000000 0.00000000000000 6.941 > 7 9 Li 0.00000000000000 0.33333333333333 0.00000000000000 6.941 > 7 10 Li 0.50000000000000 0.33333333333333 0.00000000000000 6.941 > 7 11 Li 0.00000000000000 0.66666666666667 0.00000000000000 6.941 > 7 12 Li 0.50000000000000 0.66666666666667 0.00000000000000 6.941 > 7 13 O 0.11756233117686 0.22412490178024 0.08148990851002 15.999 > 13 14 O 0.61756233117686 0.22412490178024 0.08148990851002 15.999 > 13 15 O 0.11756233117686 0.55745823511358 0.08148990851002 15.999 > 13 16 O 0.61756233117686 0.55745823511358 0.08148990851002 15.999 > 13 17 O 0.11756233117686 0.89079156844691 0.08148990851002 15.999 > 13 18 O 0.61756233117686 0.89079156844691 0.08148990851002 15.999 > 13 19 O 0.38243766882314 0.05745823511358 0.41851009148998 15.999 > 19 20 O 0.88243766882314 0.05745823511358 0.41851009148998 15.999 > 19 21 O 0.38243766882314 0.39079156844691 0.41851009148998 15.999 > 19 22 O 0.88243766882314 0.39079156844691 0.41851009148998 15.999 > 19 23 O 0.38243766882314 0.72412490178024 0.41851009148998 15.999 > 19 24 O 0.88243766882314 0.72412490178024 0.41851009148998 15.999 > 19 25 O 0.38243766882314 0.10920843155309 0.91851009148998 15.999 > 25 26 O 0.88243766882314 0.10920843155309 0.91851009148998 15.999 > 25 27 O 0.38243766882314 0.44254176488642 0.91851009148998 15.999 > 25 28 O 0.88243766882314 0.44254176488642 0.91851009148998 15.999 > 25 29 O 0.38243766882314 0.77587509821976 0.91851009148998 15.999 > 25 30 O 0.88243766882314 0.77587509821976 0.91851009148998 15.999 > 25 31 O 0.11756233117686 0.27587509821976 0.58148990851002 15.999 > 31 32 O 0.61756233117686 0.27587509821976 0.58148990851002 15.999 > 31 33 O 0.11756233117686 0.60920843155309 0.58148990851002 15.999 > 31 34 O 0.61756233117686 0.60920843155309 0.58148990851002 15.999 > 31 35 O 0.11756233117686 0.94254176488642 0.58148990851002 15.999 > 31 36 O 0.61756233117686 0.94254176488642 0.58148990851002 15.999 > 31 37 O 0.23965006136414 0.26070506287242 0.32607336418752 15.999 > 37 38 O 0.73965006136414 0.26070506287242 0.32607336418752 15.999 > 37 39 O 0.23965006136414 0.59403839620575 0.32607336418752 15.999 > 37 40 O 0.73965006136414 0.59403839620575 0.32607336418752 15.999 > 37 41 O 0.23965006136414 0.92737172953909 0.32607336418752 15.999 > 37 42 O 0.73965006136414 0.92737172953909 0.32607336418752 15.999 > 37 43 O 0.26034993863586 0.09403839620575 0.17392663581248 15.999 > 43 44 O 0.76034993863586 0.09403839620575 0.17392663581248 15.999 > 43 45 O 0.26034993863586 0.42737172953909 0.17392663581248 15.999 > 43 46 O 0.76034993863586 0.42737172953909 0.17392663581248 15.999 > 43 47 O 0.26034993863586 0.76070506287242 0.17392663581248 15.999 > 43 48 O 0.76034993863586 0.76070506287242 0.17392663581248 15.999 > 43 49 O 0.26034993863586 0.07262827046091 0.67392663581248 15.999 > 49 50 O 0.76034993863586 0.07262827046091 0.67392663581248 15.999 > 49 51 O 0.26034993863586 0.40596160379425 0.67392663581248 15.999 > 49 52 O 0.76034993863586 0.40596160379425 0.67392663581248 15.999 > 49 53 O 0.26034993863586 0.73929493712758 0.67392663581248 15.999 > 49 54 O 0.76034993863586 0.73929493712758 0.67392663581248 15.999 > 49 55 O 0.23965006136414 0.23929493712758 0.82607336418752 15.999 > 55 56 O 0.73965006136414 0.23929493712758 0.82607336418752 15.999 > 55 57 O 0.23965006136414 0.57262827046091 0.82607336418752 15.999 > 55 58 O 0.73965006136414 0.57262827046091 0.82607336418752 15.999 > 55 59 O 0.23965006136414 0.90596160379425 0.82607336418752 15.999 > 55 60 O 0.73965006136414 0.90596160379425 0.82607336418752 15.999 > 55 61 O 0.13948090715673 0.09793555165523 0.42129761782721 15.999 > 61 62 O 0.63948090715673 0.09793555165523 0.42129761782721 15.999 > 61 63 O 0.13948090715673 0.43126888498856 0.42129761782721 15.999 > 61 64 O 0.63948090715673 0.43126888498856 0.42129761782721 15.999 > 61 65 O 0.13948090715673 0.76460221832189 0.42129761782721 15.999 > 61 66 O 0.63948090715673 0.76460221832189 0.42129761782721 15.999 > 61 67 O 0.36051909284327 0.26460221832189 0.07870238217279 15.999 > 67 68 O 0.86051909284327 0.26460221832189 0.07870238217279 15.999 > 67 69 O 0.36051909284327 0.59793555165523 0.07870238217279 15.999 > 67 70 O 0.86051909284327 0.59793555165523 0.07870238217279 15.999 > 67 71 O 0.36051909284327 0.93126888498856 0.07870238217279 15.999 > 67 72 O 0.86051909284327 0.93126888498856 0.07870238217279 15.999 > 67 73 O 0.36051909284327 0.23539778167811 0.57870238217279 15.999 > 73 74 O 0.86051909284327 0.23539778167811 0.57870238217279 15.999 > 73 75 O 0.36051909284327 0.56873111501144 0.57870238217279 15.999 > 73 76 O 0.86051909284327 0.56873111501144 0.57870238217279 15.999 > 73 77 O 0.36051909284327 0.90206444834477 0.57870238217279 15.999 > 73 78 O 0.86051909284327 0.90206444834477 0.57870238217279 15.999 > 73 79 O 0.13948090715673 0.06873111501144 0.92129761782721 15.999 > 79 80 O 0.63948090715673 0.06873111501144 0.92129761782721 15.999 > 79 81 O 0.13948090715673 0.40206444834477 0.92129761782721 15.999 > 79 82 O 0.63948090715673 0.40206444834477 0.92129761782721 15.999 > 79 83 O 0.13948090715673 0.73539778167811 0.92129761782721 15.999 > 79 84 O 0.63948090715673 0.73539778167811 0.92129761782721 15.999 > 79 85 O 0.49368263269479 0.26981814121603 0.82570454541609 15.999 > 85 86 O 0.99368263269479 0.26981814121603 0.82570454541609 15.999 > 85 87 O 0.49368263269479 0.60315147454936 0.82570454541609 15.999 > 85 88 O 0.99368263269479 0.60315147454936 0.82570454541609 15.999 > 85 89 O 0.49368263269479 0.93648480788269 0.82570454541609 15.999 > 85 90 O 0.99368263269479 0.93648480788269 0.82570454541609 15.999 > 85 91 O 0.00631736730521 0.10315147454936 0.67429545458391 15.999 > 91 92 O 0.50631736730521 0.10315147454936 0.67429545458391 15.999 > 91 93 O 0.00631736730521 0.43648480788269 0.67429545458391 15.999 > 91 94 O 0.50631736730521 0.43648480788269 0.67429545458391 15.999 > 91 95 O 0.00631736730521 0.76981814121603 0.67429545458391 15.999 > 91 96 O 0.50631736730521 0.76981814121603 0.67429545458391 15.999 > 91 97 O 0.00631736730521 0.06351519211731 0.17429545458391 15.999 > 97 98 O 0.50631736730521 0.06351519211731 0.17429545458391 15.999 > 97 99 O 0.00631736730521 0.39684852545064 0.17429545458391 15.999 > 97 100 O 0.50631736730521 0.39684852545064 0.17429545458391 15.999 > 97 101 O 0.00631736730521 0.73018185878397 0.17429545458391 15.999 > 97 102 O 0.50631736730521 0.73018185878397 0.17429545458391 15.999 > 97 103 O 0.49368263269479 0.23018185878397 0.32570454541609 15.999 > 103 104 O 0.99368263269479 0.23018185878397 0.32570454541609 15.999 > 103 105 O 0.49368263269479 0.56351519211731 0.32570454541609 15.999 > 103 106 O 0.99368263269479 0.56351519211731 0.32570454541609 15.999 > 103 107 O 0.49368263269479 0.89684852545064 0.32570454541609 15.999 > 103 108 O 0.99368263269479 0.89684852545064 0.32570454541609 15.999 > 103 109 Sb 0.25000000000000 0.16666666666667 0.00000000000000 121.760 > 109 110 Sb 0.75000000000000 0.16666666666667 0.00000000000000 121.760 > 109 111 Sb 0.25000000000000 0.50000000000000 0.00000000000000 121.760 > 109 112 Sb 0.75000000000000 0.50000000000000 0.00000000000000 121.760 > 109 113 Sb 0.25000000000000 0.83333333333333 0.00000000000000 121.760 > 109 114 Sb 0.75000000000000 0.83333333333333 0.00000000000000 121.760 > 109 115 Sb 0.25000000000000 0.00000000000000 0.50000000000000 121.760 > 115 116 Sb 0.75000000000000 0.00000000000000 0.50000000000000 121.760 > 115 117 Sb 0.25000000000000 0.33333333333333 0.50000000000000 121.760 > 115 118 Sb 0.75000000000000 0.33333333333333 0.50000000000000 121.760 > 115 119 Sb 0.25000000000000 0.66666666666667 0.50000000000000 121.760 > 115 120 Sb 0.75000000000000 0.66666666666667 0.50000000000000 121.760 > 115 121 Sb 0.11835178880351 0.00717677693105 0.75100572803817 121.760 > 121 122 Sb 0.61835178880351 0.00717677693105 0.75100572803817 121.760 > 121 123 Sb 0.11835178880351 0.34051011026439 0.75100572803817 121.760 > 121 124 Sb 0.61835178880351 0.34051011026439 0.75100572803817 121.760 > 121 125 Sb 0.11835178880351 0.67384344359772 0.75100572803817 121.760 > 121 126 Sb 0.61835178880351 0.67384344359772 0.75100572803817 121.760 > 121 127 Sb 0.38164821119649 0.17384344359772 0.74899427196183 121.760 > 127 128 Sb 0.88164821119649 0.17384344359772 0.74899427196183 121.760 > 127 129 Sb 0.38164821119649 0.50717677693105 0.74899427196183 121.760 > 127 130 Sb 0.88164821119649 0.50717677693105 0.74899427196183 121.760 > 127 131 Sb 0.38164821119649 0.84051011026439 0.74899427196183 121.760 > 127 132 Sb 0.88164821119649 0.84051011026439 0.74899427196183 121.760 > 127 133 Sb 0.38164821119649 0.32615655640228 0.24899427196183 121.760 > 133 134 Sb 0.88164821119649 0.32615655640228 0.24899427196183 121.760 > 133 135 Sb 0.38164821119649 0.65948988973561 0.24899427196183 121.760 > 133 136 Sb 0.88164821119649 0.65948988973561 0.24899427196183 121.760 > 133 137 Sb 0.38164821119649 0.99282322306895 0.24899427196183 121.760 > 133 138 Sb 0.88164821119649 0.99282322306895 0.24899427196183 121.760 > 133 139 Sb 0.11835178880351 0.15948988973561 0.25100572803817 121.760 > 139 140 Sb 0.61835178880351 0.15948988973561 0.25100572803817 121.760 > 139 141 Sb 0.11835178880351 0.49282322306895 0.25100572803817 121.760 > 139 142 Sb 0.61835178880351 0.49282322306895 0.25100572803817 121.760 > 139 143 Sb 0.11835178880351 0.82615655640228 0.25100572803817 121.760 > 139 144 Sb 0.61835178880351 0.82615655640228 0.25100572803817 121.760 > 139 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.4506372 0.0000000 -0.0954582 0.0000000 4.3976362 0.0000000 -0.0954587 0.0000000 4.5418063 -------------------------- Born effective charges -------------------------- 1 Li 1.2283165 0.1086725 -0.0442969 0.1479634 1.2157724 0.1793820 -0.0594680 0.0981400 1.2830340 2 Li 1.2283165 -0.1086725 -0.0442969 -0.1479634 1.2157724 -0.1793820 -0.0594680 -0.0981400 1.2830340 3 O -1.7517760 0.1416333 0.5301756 0.1075162 -1.4645035 0.1149421 0.4030298 0.1491676 -2.1448317 4 O -1.7517760 -0.1416333 0.5301756 -0.1075162 -1.4645035 -0.1149421 0.4030298 -0.1491676 -2.1448317 5 O -1.7517760 0.1416333 0.5301756 0.1075162 -1.4645035 0.1149421 0.4030298 0.1491676 -2.1448317 6 O -1.7517760 -0.1416333 0.5301756 -0.1075162 -1.4645035 -0.1149421 0.4030298 -0.1491676 -2.1448317 7 O -2.0753339 -0.6214092 0.1458230 -0.6254900 -2.1142487 -0.6446681 0.2015235 -0.4350754 -2.2643866 8 O -2.0753339 0.6214092 0.1458230 0.6254900 -2.1142487 0.6446681 0.2015235 0.4350754 -2.2643866 9 O -2.0753339 -0.6214092 0.1458230 -0.6254900 -2.1142487 -0.6446681 0.2015235 -0.4350754 -2.2643866 10 O -2.0753339 0.6214092 0.1458230 0.6254900 -2.1142487 0.6446681 0.2015235 0.4350754 -2.2643866 11 O -1.6510884 0.5302165 -0.4071956 0.5575222 -1.9962113 0.6095871 -0.2499771 0.7082058 -2.1879081 12 O -1.6510884 -0.5302165 -0.4071956 -0.5575222 -1.9962113 -0.6095871 -0.2499771 -0.7082058 -2.1879081 13 O -1.6510884 0.5302165 -0.4071956 0.5575222 -1.9962113 0.6095871 -0.2499771 0.7082058 -2.1879081 14 O -1.6510884 -0.5302165 -0.4071956 -0.5575222 -1.9962113 -0.6095871 -0.2499771 -0.7082058 -2.1879081 15 O -2.4341847 -0.8802512 -0.0175799 -0.8467012 -2.1044627 -0.0828864 -0.0904498 -0.2027457 -1.4812826 16 O -2.4341847 0.8802512 -0.0175799 0.8467012 -2.1044627 0.0828864 -0.0904498 0.2027457 -1.4812826 17 O -2.4341847 -0.8802512 -0.0175799 -0.8467012 -2.1044627 -0.0828864 -0.0904498 -0.2027457 -1.4812826 18 O -2.4341847 0.8802512 -0.0175799 0.8467012 -2.1044627 0.0828864 -0.0904498 0.2027457 -1.4812826 19 Sb 4.0213145 0.3411024 -0.2056543 1.3009621 4.4226308 -0.6743487 -0.2230519 0.8204688 5.9833835 20 Sb 4.0213145 -0.3411024 -0.2056543 -1.3009621 4.4226308 0.6743487 -0.2230519 -0.8204688 5.9833835 21 Sb 5.2875675 -0.4762388 -0.1262474 -0.1220238 4.8602248 -0.6312617 -0.1228665 0.0448988 4.4452003 22 Sb 5.2875675 0.4762388 -0.1262474 0.1220238 4.8602248 0.6312617 -0.1228665 -0.0448988 4.4452003 23 Sb 5.2875675 -0.4762388 -0.1262474 -0.1220238 4.8602248 -0.6312617 -0.1228665 0.0448988 4.4452003 24 Sb 5.2875675 0.4762388 -0.1262474 0.1220238 4.8602248 0.6312617 -0.1228665 -0.0448988 4.4452003 ---------------------------------------------------------------------------- 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] [-0.0011 0.0000 0.0099] [ 0.0011 0.0000 -0.0099] Computing fc3[ 13, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0011 0.0000 0.0099] [ 0.0011 0.0000 -0.0099] Computing fc3[ 37, 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] [-0.0011 0.0000 0.0099] [ 0.0011 0.0000 -0.0099] Computing fc3[ 61, 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] [-0.0011 0.0000 0.0099] [ 0.0011 0.0000 -0.0099] Computing fc3[ 85, 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] [-0.0011 0.0000 0.0099] [ 0.0011 0.0000 -0.0099] Computing fc3[ 109, 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] [-0.0011 0.0000 0.0099] [ 0.0011 0.0000 -0.0099] Computing fc3[ 121, 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] [-0.0011 0.0000 0.0099] [ 0.0011 0.0000 -0.0099] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (zzz) -0.00000000 (zzz) -0.00000000 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (xz) 0.00000000 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 08:28:58]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 08:28:58]------------------------- 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 3 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.640167201494036 0.000000000000000 0.000000000000000 b 0.000000000000000 4.726940890000000 0.000000000000000 c -1.181443298996707 0.000000000000000 10.279280049385614 Atomic positions (fractional): 1 Li 0.00000000000000 0.50000000000000 0.50000000000000 6.941 2 Li 0.00000000000000 0.00000000000000 0.00000000000000 6.941 3 O 0.23512466235372 0.67237470534073 0.08148990851002 15.999 4 O 0.76487533764628 0.17237470534073 0.41851009148998 15.999 5 O 0.76487533764628 0.32762529465927 0.91851009148998 15.999 6 O 0.23512466235372 0.82762529465927 0.58148990851002 15.999 7 O 0.47930012272829 0.78211518861726 0.32607336418752 15.999 8 O 0.52069987727171 0.28211518861726 0.17392663581248 15.999 9 O 0.52069987727171 0.21788481138274 0.67392663581248 15.999 10 O 0.47930012272829 0.71788481138274 0.82607336418752 15.999 11 O 0.27896181431345 0.29380665496568 0.42129761782721 15.999 12 O 0.72103818568655 0.79380665496568 0.07870238217279 15.999 13 O 0.72103818568655 0.70619334503432 0.57870238217279 15.999 14 O 0.27896181431345 0.20619334503432 0.92129761782721 15.999 15 O 0.98736526538959 0.80945442364808 0.82570454541609 15.999 16 O 0.01263473461041 0.30945442364808 0.67429545458391 15.999 17 O 0.01263473461041 0.19054557635192 0.17429545458391 15.999 18 O 0.98736526538959 0.69054557635192 0.32570454541609 15.999 19 Sb 0.50000000000000 0.50000000000000 0.00000000000000 121.760 20 Sb 0.50000000000000 0.00000000000000 0.50000000000000 121.760 21 Sb 0.23670357760703 0.02153033079316 0.75100572803817 121.760 22 Sb 0.76329642239297 0.52153033079316 0.74899427196183 121.760 23 Sb 0.76329642239297 0.97846966920684 0.24899427196183 121.760 24 Sb 0.23670357760703 0.47846966920684 0.25100572803817 121.760 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.280334402988071 0.000000000000000 0.000000000000000 b 0.000000000000000 14.180822670000000 0.000000000000000 c -1.181443298996707 0.000000000000000 10.279280049385614 Atomic positions (fractional): 1 Li 0.00000000000000 0.16666666666667 0.50000000000000 6.941 > 1 2 Li 0.50000000000000 0.16666666666667 0.50000000000000 6.941 > 1 3 Li 0.00000000000000 0.50000000000000 0.50000000000000 6.941 > 1 4 Li 0.50000000000000 0.50000000000000 0.50000000000000 6.941 > 1 5 Li 0.00000000000000 0.83333333333333 0.50000000000000 6.941 > 1 6 Li 0.50000000000000 0.83333333333333 0.50000000000000 6.941 > 1 7 Li 0.00000000000000 0.00000000000000 0.00000000000000 6.941 > 7 8 Li 0.50000000000000 0.00000000000000 0.00000000000000 6.941 > 7 9 Li 0.00000000000000 0.33333333333333 0.00000000000000 6.941 > 7 10 Li 0.50000000000000 0.33333333333333 0.00000000000000 6.941 > 7 11 Li 0.00000000000000 0.66666666666667 0.00000000000000 6.941 > 7 12 Li 0.50000000000000 0.66666666666667 0.00000000000000 6.941 > 7 13 O 0.11756233117686 0.22412490178024 0.08148990851002 15.999 > 13 14 O 0.61756233117686 0.22412490178024 0.08148990851002 15.999 > 13 15 O 0.11756233117686 0.55745823511358 0.08148990851002 15.999 > 13 16 O 0.61756233117686 0.55745823511358 0.08148990851002 15.999 > 13 17 O 0.11756233117686 0.89079156844691 0.08148990851002 15.999 > 13 18 O 0.61756233117686 0.89079156844691 0.08148990851002 15.999 > 13 19 O 0.38243766882314 0.05745823511358 0.41851009148998 15.999 > 19 20 O 0.88243766882314 0.05745823511358 0.41851009148998 15.999 > 19 21 O 0.38243766882314 0.39079156844691 0.41851009148998 15.999 > 19 22 O 0.88243766882314 0.39079156844691 0.41851009148998 15.999 > 19 23 O 0.38243766882314 0.72412490178024 0.41851009148998 15.999 > 19 24 O 0.88243766882314 0.72412490178024 0.41851009148998 15.999 > 19 25 O 0.38243766882314 0.10920843155309 0.91851009148998 15.999 > 25 26 O 0.88243766882314 0.10920843155309 0.91851009148998 15.999 > 25 27 O 0.38243766882314 0.44254176488642 0.91851009148998 15.999 > 25 28 O 0.88243766882314 0.44254176488642 0.91851009148998 15.999 > 25 29 O 0.38243766882314 0.77587509821976 0.91851009148998 15.999 > 25 30 O 0.88243766882314 0.77587509821976 0.91851009148998 15.999 > 25 31 O 0.11756233117686 0.27587509821976 0.58148990851002 15.999 > 31 32 O 0.61756233117686 0.27587509821976 0.58148990851002 15.999 > 31 33 O 0.11756233117686 0.60920843155309 0.58148990851002 15.999 > 31 34 O 0.61756233117686 0.60920843155309 0.58148990851002 15.999 > 31 35 O 0.11756233117686 0.94254176488642 0.58148990851002 15.999 > 31 36 O 0.61756233117686 0.94254176488642 0.58148990851002 15.999 > 31 37 O 0.23965006136414 0.26070506287242 0.32607336418752 15.999 > 37 38 O 0.73965006136414 0.26070506287242 0.32607336418752 15.999 > 37 39 O 0.23965006136414 0.59403839620575 0.32607336418752 15.999 > 37 40 O 0.73965006136414 0.59403839620575 0.32607336418752 15.999 > 37 41 O 0.23965006136414 0.92737172953909 0.32607336418752 15.999 > 37 42 O 0.73965006136414 0.92737172953909 0.32607336418752 15.999 > 37 43 O 0.26034993863586 0.09403839620575 0.17392663581248 15.999 > 43 44 O 0.76034993863586 0.09403839620575 0.17392663581248 15.999 > 43 45 O 0.26034993863586 0.42737172953909 0.17392663581248 15.999 > 43 46 O 0.76034993863586 0.42737172953909 0.17392663581248 15.999 > 43 47 O 0.26034993863586 0.76070506287242 0.17392663581248 15.999 > 43 48 O 0.76034993863586 0.76070506287242 0.17392663581248 15.999 > 43 49 O 0.26034993863586 0.07262827046091 0.67392663581248 15.999 > 49 50 O 0.76034993863586 0.07262827046091 0.67392663581248 15.999 > 49 51 O 0.26034993863586 0.40596160379425 0.67392663581248 15.999 > 49 52 O 0.76034993863586 0.40596160379425 0.67392663581248 15.999 > 49 53 O 0.26034993863586 0.73929493712758 0.67392663581248 15.999 > 49 54 O 0.76034993863586 0.73929493712758 0.67392663581248 15.999 > 49 55 O 0.23965006136414 0.23929493712758 0.82607336418752 15.999 > 55 56 O 0.73965006136414 0.23929493712758 0.82607336418752 15.999 > 55 57 O 0.23965006136414 0.57262827046091 0.82607336418752 15.999 > 55 58 O 0.73965006136414 0.57262827046091 0.82607336418752 15.999 > 55 59 O 0.23965006136414 0.90596160379425 0.82607336418752 15.999 > 55 60 O 0.73965006136414 0.90596160379425 0.82607336418752 15.999 > 55 61 O 0.13948090715673 0.09793555165523 0.42129761782721 15.999 > 61 62 O 0.63948090715673 0.09793555165523 0.42129761782721 15.999 > 61 63 O 0.13948090715673 0.43126888498856 0.42129761782721 15.999 > 61 64 O 0.63948090715673 0.43126888498856 0.42129761782721 15.999 > 61 65 O 0.13948090715673 0.76460221832189 0.42129761782721 15.999 > 61 66 O 0.63948090715673 0.76460221832189 0.42129761782721 15.999 > 61 67 O 0.36051909284327 0.26460221832189 0.07870238217279 15.999 > 67 68 O 0.86051909284327 0.26460221832189 0.07870238217279 15.999 > 67 69 O 0.36051909284327 0.59793555165523 0.07870238217279 15.999 > 67 70 O 0.86051909284327 0.59793555165523 0.07870238217279 15.999 > 67 71 O 0.36051909284327 0.93126888498856 0.07870238217279 15.999 > 67 72 O 0.86051909284327 0.93126888498856 0.07870238217279 15.999 > 67 73 O 0.36051909284327 0.23539778167811 0.57870238217279 15.999 > 73 74 O 0.86051909284327 0.23539778167811 0.57870238217279 15.999 > 73 75 O 0.36051909284327 0.56873111501144 0.57870238217279 15.999 > 73 76 O 0.86051909284327 0.56873111501144 0.57870238217279 15.999 > 73 77 O 0.36051909284327 0.90206444834477 0.57870238217279 15.999 > 73 78 O 0.86051909284327 0.90206444834477 0.57870238217279 15.999 > 73 79 O 0.13948090715673 0.06873111501144 0.92129761782721 15.999 > 79 80 O 0.63948090715673 0.06873111501144 0.92129761782721 15.999 > 79 81 O 0.13948090715673 0.40206444834477 0.92129761782721 15.999 > 79 82 O 0.63948090715673 0.40206444834477 0.92129761782721 15.999 > 79 83 O 0.13948090715673 0.73539778167811 0.92129761782721 15.999 > 79 84 O 0.63948090715673 0.73539778167811 0.92129761782721 15.999 > 79 85 O 0.49368263269479 0.26981814121603 0.82570454541609 15.999 > 85 86 O 0.99368263269479 0.26981814121603 0.82570454541609 15.999 > 85 87 O 0.49368263269479 0.60315147454936 0.82570454541609 15.999 > 85 88 O 0.99368263269479 0.60315147454936 0.82570454541609 15.999 > 85 89 O 0.49368263269479 0.93648480788269 0.82570454541609 15.999 > 85 90 O 0.99368263269479 0.93648480788269 0.82570454541609 15.999 > 85 91 O 0.00631736730521 0.10315147454936 0.67429545458391 15.999 > 91 92 O 0.50631736730521 0.10315147454936 0.67429545458391 15.999 > 91 93 O 0.00631736730521 0.43648480788269 0.67429545458391 15.999 > 91 94 O 0.50631736730521 0.43648480788269 0.67429545458391 15.999 > 91 95 O 0.00631736730521 0.76981814121603 0.67429545458391 15.999 > 91 96 O 0.50631736730521 0.76981814121603 0.67429545458391 15.999 > 91 97 O 0.00631736730521 0.06351519211731 0.17429545458391 15.999 > 97 98 O 0.50631736730521 0.06351519211731 0.17429545458391 15.999 > 97 99 O 0.00631736730521 0.39684852545064 0.17429545458391 15.999 > 97 100 O 0.50631736730521 0.39684852545064 0.17429545458391 15.999 > 97 101 O 0.00631736730521 0.73018185878397 0.17429545458391 15.999 > 97 102 O 0.50631736730521 0.73018185878397 0.17429545458391 15.999 > 97 103 O 0.49368263269479 0.23018185878397 0.32570454541609 15.999 > 103 104 O 0.99368263269479 0.23018185878397 0.32570454541609 15.999 > 103 105 O 0.49368263269479 0.56351519211731 0.32570454541609 15.999 > 103 106 O 0.99368263269479 0.56351519211731 0.32570454541609 15.999 > 103 107 O 0.49368263269479 0.89684852545064 0.32570454541609 15.999 > 103 108 O 0.99368263269479 0.89684852545064 0.32570454541609 15.999 > 103 109 Sb 0.25000000000000 0.16666666666667 0.00000000000000 121.760 > 109 110 Sb 0.75000000000000 0.16666666666667 0.00000000000000 121.760 > 109 111 Sb 0.25000000000000 0.50000000000000 0.00000000000000 121.760 > 109 112 Sb 0.75000000000000 0.50000000000000 0.00000000000000 121.760 > 109 113 Sb 0.25000000000000 0.83333333333333 0.00000000000000 121.760 > 109 114 Sb 0.75000000000000 0.83333333333333 0.00000000000000 121.760 > 109 115 Sb 0.25000000000000 0.00000000000000 0.50000000000000 121.760 > 115 116 Sb 0.75000000000000 0.00000000000000 0.50000000000000 121.760 > 115 117 Sb 0.25000000000000 0.33333333333333 0.50000000000000 121.760 > 115 118 Sb 0.75000000000000 0.33333333333333 0.50000000000000 121.760 > 115 119 Sb 0.25000000000000 0.66666666666667 0.50000000000000 121.760 > 115 120 Sb 0.75000000000000 0.66666666666667 0.50000000000000 121.760 > 115 121 Sb 0.11835178880351 0.00717677693105 0.75100572803817 121.760 > 121 122 Sb 0.61835178880351 0.00717677693105 0.75100572803817 121.760 > 121 123 Sb 0.11835178880351 0.34051011026439 0.75100572803817 121.760 > 121 124 Sb 0.61835178880351 0.34051011026439 0.75100572803817 121.760 > 121 125 Sb 0.11835178880351 0.67384344359772 0.75100572803817 121.760 > 121 126 Sb 0.61835178880351 0.67384344359772 0.75100572803817 121.760 > 121 127 Sb 0.38164821119649 0.17384344359772 0.74899427196183 121.760 > 127 128 Sb 0.88164821119649 0.17384344359772 0.74899427196183 121.760 > 127 129 Sb 0.38164821119649 0.50717677693105 0.74899427196183 121.760 > 127 130 Sb 0.88164821119649 0.50717677693105 0.74899427196183 121.760 > 127 131 Sb 0.38164821119649 0.84051011026439 0.74899427196183 121.760 > 127 132 Sb 0.88164821119649 0.84051011026439 0.74899427196183 121.760 > 127 133 Sb 0.38164821119649 0.32615655640228 0.24899427196183 121.760 > 133 134 Sb 0.88164821119649 0.32615655640228 0.24899427196183 121.760 > 133 135 Sb 0.38164821119649 0.65948988973561 0.24899427196183 121.760 > 133 136 Sb 0.88164821119649 0.65948988973561 0.24899427196183 121.760 > 133 137 Sb 0.38164821119649 0.99282322306895 0.24899427196183 121.760 > 133 138 Sb 0.88164821119649 0.99282322306895 0.24899427196183 121.760 > 133 139 Sb 0.11835178880351 0.15948988973561 0.25100572803817 121.760 > 139 140 Sb 0.61835178880351 0.15948988973561 0.25100572803817 121.760 > 139 141 Sb 0.11835178880351 0.49282322306895 0.25100572803817 121.760 > 139 142 Sb 0.61835178880351 0.49282322306895 0.25100572803817 121.760 > 139 143 Sb 0.11835178880351 0.82615655640228 0.25100572803817 121.760 > 139 144 Sb 0.61835178880351 0.82615655640228 0.25100572803817 121.760 > 139 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.4506372 0.0000000 -0.0954582 0.0000000 4.3976362 0.0000000 -0.0954587 0.0000000 4.5418063 -------------------------- Born effective charges -------------------------- 1 Li 1.2283165 0.1086725 -0.0442969 0.1479634 1.2157724 0.1793820 -0.0594680 0.0981400 1.2830340 2 Li 1.2283165 -0.1086725 -0.0442969 -0.1479634 1.2157724 -0.1793820 -0.0594680 -0.0981400 1.2830340 3 O -1.7517760 0.1416333 0.5301756 0.1075162 -1.4645035 0.1149421 0.4030298 0.1491676 -2.1448317 4 O -1.7517760 -0.1416333 0.5301756 -0.1075162 -1.4645035 -0.1149421 0.4030298 -0.1491676 -2.1448317 5 O -1.7517760 0.1416333 0.5301756 0.1075162 -1.4645035 0.1149421 0.4030298 0.1491676 -2.1448317 6 O -1.7517760 -0.1416333 0.5301756 -0.1075162 -1.4645035 -0.1149421 0.4030298 -0.1491676 -2.1448317 7 O -2.0753339 -0.6214092 0.1458230 -0.6254900 -2.1142487 -0.6446681 0.2015235 -0.4350754 -2.2643866 8 O -2.0753339 0.6214092 0.1458230 0.6254900 -2.1142487 0.6446681 0.2015235 0.4350754 -2.2643866 9 O -2.0753339 -0.6214092 0.1458230 -0.6254900 -2.1142487 -0.6446681 0.2015235 -0.4350754 -2.2643866 10 O -2.0753339 0.6214092 0.1458230 0.6254900 -2.1142487 0.6446681 0.2015235 0.4350754 -2.2643866 11 O -1.6510884 0.5302165 -0.4071956 0.5575222 -1.9962113 0.6095871 -0.2499771 0.7082058 -2.1879081 12 O -1.6510884 -0.5302165 -0.4071956 -0.5575222 -1.9962113 -0.6095871 -0.2499771 -0.7082058 -2.1879081 13 O -1.6510884 0.5302165 -0.4071956 0.5575222 -1.9962113 0.6095871 -0.2499771 0.7082058 -2.1879081 14 O -1.6510884 -0.5302165 -0.4071956 -0.5575222 -1.9962113 -0.6095871 -0.2499771 -0.7082058 -2.1879081 15 O -2.4341847 -0.8802512 -0.0175799 -0.8467012 -2.1044627 -0.0828864 -0.0904498 -0.2027457 -1.4812826 16 O -2.4341847 0.8802512 -0.0175799 0.8467012 -2.1044627 0.0828864 -0.0904498 0.2027457 -1.4812826 17 O -2.4341847 -0.8802512 -0.0175799 -0.8467012 -2.1044627 -0.0828864 -0.0904498 -0.2027457 -1.4812826 18 O -2.4341847 0.8802512 -0.0175799 0.8467012 -2.1044627 0.0828864 -0.0904498 0.2027457 -1.4812826 19 Sb 4.0213145 0.3411024 -0.2056543 1.3009621 4.4226308 -0.6743487 -0.2230519 0.8204688 5.9833835 20 Sb 4.0213145 -0.3411024 -0.2056543 -1.3009621 4.4226308 0.6743487 -0.2230519 -0.8204688 5.9833835 21 Sb 5.2875675 -0.4762388 -0.1262474 -0.1220238 4.8602248 -0.6312617 -0.1228665 0.0448988 4.4452003 22 Sb 5.2875675 0.4762388 -0.1262474 0.1220238 4.8602248 0.6312617 -0.1228665 -0.0448988 4.4452003 23 Sb 5.2875675 -0.4762388 -0.1262474 -0.1220238 4.8602248 -0.6312617 -0.1228665 0.0448988 4.4452003 24 Sb 5.2875675 0.4762388 -0.1262474 0.1220238 4.8602248 0.6312617 -0.1228665 -0.0448988 4.4452003 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (zzz) -0.00000000 (zzz) -0.00000000 (zzz) Max drift of fc2: 0.00000000 (xx) 0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 9 11 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: 0.64, Number of G-points: 295, Lambda: 0.14 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/138) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.858 ( 0.000 0.000 0.000) 0.000 2.951 ( 0.000 0.000 0.000) 0.000 3.106 ( 0.000 0.000 0.000) 0.000 3.219 ( 0.000 0.000 0.000) 0.000 3.673 ( 0.000 0.000 0.000) 0.000 4.202 ( 0.000 0.000 0.000) 0.000 4.732 ( 0.000 0.000 0.000) 0.000 4.982 ( 0.000 0.000 0.000) 0.000 5.225 ( 0.000 0.000 0.000) 0.000 5.415 ( 0.000 0.000 0.000) 0.000 5.438 ( 0.000 0.000 0.000) 0.000 5.455 ( 0.000 0.000 0.000) 0.000 5.859 ( 0.000 0.000 0.000) 0.000 5.909 ( 0.000 0.000 0.000) 0.000 6.398 ( 0.000 0.000 0.000) 0.000 6.507 ( 0.000 0.000 0.000) 0.000 6.914 ( 0.000 0.000 0.000) 0.000 7.172 ( 0.000 0.000 0.000) 0.000 7.310 ( 0.000 0.000 0.000) 0.000 7.314 ( 0.000 0.000 0.000) 0.000 7.592 ( 0.000 0.000 0.000) 0.000 7.604 ( 0.000 0.000 0.000) 0.000 7.766 ( 0.000 0.000 0.000) 0.000 7.918 ( 0.000 0.000 0.000) 0.000 8.007 ( 0.000 0.000 0.000) 0.000 8.034 ( 0.000 0.000 0.000) 0.000 8.241 ( 0.000 0.000 0.000) 0.000 8.531 ( 0.000 0.000 0.000) 0.000 8.978 ( 0.000 0.000 0.000) 0.000 9.060 ( 0.000 0.000 0.000) 0.000 9.624 ( 0.000 0.000 0.000) 0.000 9.880 ( 0.000 0.000 0.000) 0.000 10.067 ( 0.000 0.000 0.000) 0.000 10.273 ( 0.000 0.000 0.000) 0.000 10.786 ( 0.000 0.000 0.000) 0.000 12.616 ( 0.000 0.000 0.000) 0.000 12.751 ( 0.000 0.000 0.000) 0.000 13.104 ( 0.000 0.000 0.000) 0.000 13.213 ( 0.000 0.000 0.000) 0.000 13.805 ( 0.000 0.000 0.000) 0.000 14.189 ( 0.000 0.000 0.000) 0.000 14.525 ( 0.000 0.000 0.000) 0.000 14.622 ( 0.000 0.000 0.000) 0.000 14.658 ( 0.000 0.000 0.000) 0.000 14.722 ( 0.000 0.000 0.000) 0.000 14.908 ( 0.000 0.000 0.000) 0.000 15.193 ( 0.000 0.000 0.000) 0.000 15.293 ( 0.000 0.000 0.000) 0.000 15.901 ( 0.000 0.000 0.000) 0.000 16.410 ( 0.000 0.000 0.000) 0.000 16.742 ( 0.000 0.000 0.000) 0.000 16.881 ( 0.000 0.000 0.000) 0.000 17.384 ( 0.000 0.000 0.000) 0.000 17.705 ( 0.000 0.000 0.000) 0.000 18.089 ( 0.000 0.000 0.000) 0.000 18.891 ( 0.000 0.000 0.000) 0.000 18.904 ( 0.000 0.000 0.000) 0.000 19.093 ( 0.000 0.000 0.000) 0.000 19.989 ( 0.000 0.000 0.000) 0.000 19.998 ( 0.000 0.000 0.000) 0.000 20.141 ( 0.000 0.000 0.000) 0.000 21.100 ( 0.000 0.000 0.000) 0.000 21.181 ( 0.000 0.000 0.000) 0.000 21.396 ( 0.000 0.000 0.000) 0.000 22.415 ( 0.000 0.000 0.000) 0.000 22.856 ( 0.000 0.000 0.000) 0.000 23.328 ( 0.000 0.000 0.000) 0.000 24.023 ( 0.000 0.000 0.000) 0.000 24.109 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/138) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.672 ( 34.414 0.000 -1.780) 34.460 0.948 ( 45.893 0.000 11.468) 47.304 1.235 ( 61.695 0.000 -1.819) 61.722 2.975 ( 4.816 0.000 -18.697) 19.307 3.024 ( 15.570 0.000 2.572) 15.781 3.224 ( 2.431 0.000 -16.628) 16.805 3.247 ( 10.339 0.000 19.725) 22.270 3.777 ( 6.519 0.000 12.946) 14.494 4.226 ( 2.401 0.000 -1.934) 3.083 4.789 ( 6.310 0.000 -2.411) 6.755 5.095 ( 2.985 0.000 -9.395) 9.858 5.158 ( -5.750 0.000 13.798) 14.948 5.385 ( -4.702 0.000 3.289) 5.738 5.426 ( 1.197 0.000 -5.167) 5.303 5.594 ( 13.958 0.000 -19.603) 24.065 5.864 ( -0.283 0.000 2.889) 2.903 5.976 ( 6.438 0.000 2.235) 6.815 6.389 ( -1.141 0.000 1.732) 2.075 6.656 ( -0.621 0.000 5.626) 5.660 6.784 ( -10.984 0.000 1.727) 11.119 7.165 ( -0.348 0.000 -4.267) 4.281 7.296 ( -2.039 0.000 3.834) 4.342 7.306 ( -1.566 0.000 -3.228) 3.588 7.572 ( -3.078 0.000 3.519) 4.675 7.777 ( 1.391 0.000 -3.976) 4.212 7.835 ( -1.549 0.000 2.599) 3.025 7.900 ( -5.287 0.000 4.925) 7.225 7.983 ( -0.822 0.000 -0.038) 0.823 8.258 ( 4.076 0.000 -3.534) 5.394 8.798 ( 22.092 0.000 -2.943) 22.287 8.999 ( 2.881 0.000 5.616) 6.312 9.007 ( -4.501 0.000 0.862) 4.583 9.570 ( -4.522 0.000 0.033) 4.522 9.662 ( -9.888 0.000 90.168) 90.709 9.861 ( -3.342 0.000 7.179) 7.919 9.969 ( -8.986 0.000 -2.120) 9.233 10.424 ( -2.094 0.000 -1.290) 2.459 10.799 ( 0.577 0.000 1.956) 2.040 12.635 ( 1.905 0.000 0.834) 2.079 12.788 ( 3.567 0.000 0.667) 3.629 13.188 ( -2.666 0.000 0.782) 2.779 13.620 ( -2.151 0.000 -10.847) 11.058 13.757 ( -4.723 0.000 0.532) 4.753 14.112 ( -6.805 0.000 -1.144) 6.901 14.515 ( -1.108 0.000 0.844) 1.393 14.694 ( -2.188 0.000 -2.667) 3.450 14.711 ( 4.656 0.000 -2.150) 5.129 14.910 ( 0.040 0.000 2.478) 2.478 15.005 ( 10.746 0.000 -90.990) 91.622 15.214 ( 2.055 0.000 -12.486) 12.654 15.300 ( -0.197 0.000 0.351) 0.402 15.897 ( 0.122 0.000 4.494) 4.495 16.399 ( -0.962 0.000 -0.870) 1.297 16.712 ( -3.315 0.000 4.124) 5.291 17.155 ( 0.141 0.000 13.880) 13.881 17.515 ( 11.227 0.000 4.268) 12.010 17.714 ( 1.772 0.000 -4.633) 4.961 18.152 ( 5.696 0.000 4.079) 7.006 18.948 ( 5.611 0.000 0.500) 5.633 19.101 ( 0.938 0.000 -1.594) 1.850 19.496 ( 3.000 0.000 -34.042) 34.174 19.944 ( -4.062 0.000 2.882) 4.980 20.200 ( 5.124 0.000 0.869) 5.198 20.508 ( 0.810 0.000 -22.202) 22.216 21.186 ( 0.669 0.000 -1.094) 1.282 21.367 ( -3.025 0.000 1.122) 3.227 22.271 ( -12.396 0.000 -5.431) 13.533 22.775 ( -8.343 0.000 30.684) 31.798 22.954 ( -1.808 0.000 49.583) 49.616 23.362 ( 3.164 0.000 -6.923) 7.612 24.163 ( 4.619 0.000 4.754) 6.628 24.539 ( 2.729 0.000 -14.016) 14.279 ======================= Grid point 2 (3/138) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.345 ( 33.945 0.000 -0.185) 33.945 1.841 ( 41.596 0.000 11.308) 43.106 2.392 ( 54.996 0.000 -1.926) 55.030 3.035 ( 4.444 0.000 -15.245) 15.880 3.240 ( 4.066 0.000 -20.314) 20.717 3.422 ( 21.870 0.000 3.413) 22.135 3.526 ( 11.901 0.000 16.744) 20.543 3.987 ( 10.644 0.000 15.656) 18.931 4.282 ( 3.820 0.000 -4.311) 5.760 4.969 ( 11.737 0.000 -1.712) 11.861 5.020 ( -9.091 0.000 -14.699) 17.283 5.090 ( -4.148 0.000 12.276) 12.958 5.369 ( 2.680 0.000 10.158) 10.506 5.447 ( 3.467 0.000 -11.143) 11.670 5.843 ( -2.906 0.000 2.636) 3.924 5.867 ( 17.764 0.000 -19.853) 26.641 6.156 ( 10.581 0.000 2.517) 10.876 6.355 ( -3.445 0.000 4.778) 5.890 6.570 ( -10.269 0.000 2.100) 10.482 6.666 ( 0.706 0.000 3.821) 3.886 7.132 ( -2.980 0.000 0.749) 3.073 7.256 ( -2.179 0.000 3.235) 3.900 7.262 ( -1.975 0.000 -5.118) 5.485 7.523 ( -1.884 0.000 0.486) 1.946 7.722 ( -12.436 0.000 9.096) 15.408 7.794 ( 1.122 0.000 -4.192) 4.339 7.826 ( -0.130 0.000 2.826) 2.829 7.987 ( 0.645 0.000 1.602) 1.727 8.399 ( 10.476 0.000 -8.165) 13.282 8.814 ( -11.492 0.000 1.907) 11.649 9.076 ( 3.524 0.000 2.239) 4.175 9.325 ( 25.874 0.000 -5.479) 26.448 9.456 ( -5.916 0.000 -7.651) 9.672 9.658 ( -5.855 0.000 40.945) 41.361 9.741 ( -12.056 0.000 -3.657) 12.599 9.806 ( -3.644 0.000 11.032) 11.618 10.359 ( -3.698 0.000 -4.699) 5.980 10.795 ( -1.996 0.000 3.310) 3.865 12.697 ( 4.144 0.000 1.029) 4.270 12.887 ( 6.011 0.000 0.703) 6.052 13.117 ( -4.461 0.000 1.111) 4.597 13.525 ( -5.346 0.000 -4.977) 7.304 13.632 ( -8.004 0.000 1.505) 8.144 13.950 ( -8.794 0.000 -0.746) 8.826 14.488 ( -1.623 0.000 0.867) 1.840 14.647 ( -1.183 0.000 -4.461) 4.615 14.796 ( 4.273 0.000 -5.126) 6.673 14.917 ( -0.501 0.000 4.212) 4.241 15.016 ( 4.538 0.000 -32.723) 33.036 15.238 ( 2.856 0.000 -8.932) 9.377 15.266 ( -2.936 0.000 0.058) 2.936 15.953 ( 3.878 0.000 7.524) 8.465 16.375 ( -1.077 0.000 -0.927) 1.421 16.637 ( -5.315 0.000 6.684) 8.540 17.195 ( 1.776 0.000 3.365) 3.805 17.727 ( 6.710 0.000 -12.878) 14.521 17.813 ( 10.860 0.000 10.069) 14.810 18.320 ( 9.699 0.000 6.373) 11.605 19.103 ( 9.252 0.000 1.263) 9.338 19.123 ( 1.692 0.000 -2.215) 2.788 19.466 ( -0.387 0.000 -16.179) 16.184 19.861 ( -4.796 0.000 3.295) 5.819 20.331 ( 7.504 0.000 4.493) 8.746 20.460 ( -1.851 0.000 -9.608) 9.784 21.201 ( 1.074 0.000 -1.676) 1.990 21.287 ( -5.339 0.000 1.777) 5.627 21.970 ( -14.970 0.000 -10.768) 18.441 22.680 ( -6.237 0.000 13.499) 14.870 23.024 ( 0.742 0.000 21.409) 21.422 23.391 ( 1.270 0.000 -7.340) 7.449 24.286 ( 6.054 0.000 4.894) 7.784 24.567 ( 2.241 0.000 -5.369) 5.817 ======================= Grid point 3 (4/138) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.991 ( 30.557 0.000 1.344) 30.587 2.608 ( 32.476 0.000 10.555) 34.148 3.070 ( 2.235 0.000 -8.930) 9.205 3.175 ( 11.539 0.000 -8.721) 14.464 3.453 ( 32.494 0.000 -6.081) 33.059 3.749 ( 7.977 0.000 8.300) 11.511 3.808 ( 13.332 0.000 1.093) 13.376 4.242 ( 12.611 0.000 9.475) 15.774 4.319 ( -0.810 0.000 -5.426) 5.486 4.775 ( -9.342 0.000 -10.296) 13.902 4.988 ( -5.719 0.000 9.516) 11.102 5.280 ( 17.123 0.000 0.337) 17.127 5.472 ( 5.004 0.000 6.275) 8.026 5.532 ( 7.745 0.000 -13.536) 15.595 5.755 ( -6.062 0.000 0.711) 6.103 6.137 ( 7.896 0.000 -12.547) 14.825 6.248 ( -9.828 0.000 9.305) 13.534 6.365 ( 9.032 0.000 1.763) 9.203 6.430 ( -0.501 0.000 0.704) 0.865 6.694 ( 0.926 0.000 2.050) 2.250 7.051 ( -5.219 0.000 4.742) 7.052 7.185 ( -4.869 0.000 -4.350) 6.529 7.250 ( 1.139 0.000 3.179) 3.376 7.500 ( -0.539 0.000 -4.598) 4.630 7.541 ( -5.868 0.000 5.316) 7.918 7.805 ( 1.026 0.000 -3.267) 3.425 7.838 ( 0.647 0.000 2.238) 2.330 8.005 ( 0.379 0.000 3.135) 3.158 8.556 ( -14.137 0.000 2.794) 14.411 8.596 ( 10.599 0.000 -8.007) 13.284 9.132 ( 0.566 0.000 8.800) 8.818 9.314 ( -5.847 0.000 -11.350) 12.768 9.437 ( -11.627 0.000 -2.283) 11.849 9.620 ( -2.898 0.000 7.066) 7.637 9.785 ( -2.441 0.000 22.833) 22.963 9.843 ( 21.860 0.000 -7.950) 23.261 10.266 ( -4.131 0.000 -6.413) 7.628 10.727 ( -5.857 0.000 4.439) 7.349 12.793 ( 4.770 0.000 0.833) 4.842 13.013 ( 6.166 0.000 0.061) 6.166 13.040 ( -2.567 0.000 0.215) 2.576 13.406 ( -5.210 0.000 -2.363) 5.721 13.458 ( -9.779 0.000 2.441) 10.079 13.779 ( -8.218 0.000 -0.153) 8.219 14.460 ( -1.237 0.000 0.452) 1.317 14.644 ( 2.155 0.000 -5.486) 5.894 14.851 ( 2.532 0.000 -5.067) 5.665 14.898 ( -2.667 0.000 5.183) 5.829 15.031 ( 1.992 0.000 -12.306) 12.466 15.209 ( -2.473 0.000 0.283) 2.489 15.282 ( 2.998 0.000 -5.720) 6.458 16.055 ( 4.239 0.000 6.214) 7.522 16.356 ( -0.678 0.000 -0.480) 0.830 16.544 ( -5.199 0.000 5.788) 7.780 17.233 ( 1.539 0.000 0.254) 1.559 17.809 ( 4.903 0.000 -8.839) 10.108 18.055 ( 10.250 0.000 4.948) 11.382 18.538 ( 10.278 0.000 6.189) 11.998 19.154 ( 1.785 0.000 -1.323) 2.221 19.273 ( 6.361 0.000 0.967) 6.434 19.407 ( -2.506 0.000 -9.965) 10.275 19.790 ( -2.431 0.000 3.201) 4.019 20.399 ( -2.419 0.000 -4.768) 5.346 20.518 ( 9.946 0.000 8.777) 13.265 21.170 ( -6.780 0.000 0.325) 6.788 21.218 ( 1.001 0.000 -1.486) 1.792 21.667 ( -12.464 0.000 -12.367) 17.558 22.597 ( -4.298 0.000 6.476) 7.772 23.077 ( 0.949 0.000 10.549) 10.592 23.386 ( -0.190 0.000 -4.723) 4.727 24.402 ( 4.382 0.000 2.908) 5.259 24.597 ( 1.602 0.000 -2.236) 2.751 ======================= Grid point 4 (5/138) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.483 ( 15.790 0.000 1.230) 15.838 3.012 ( 3.625 0.000 0.224) 3.632 3.182 ( 11.226 0.000 2.908) 11.596 3.251 ( 2.730 0.000 -5.438) 6.085 3.777 ( -5.064 0.000 5.892) 7.769 3.920 ( 9.690 0.000 1.254) 9.771 4.032 ( 12.902 0.000 -5.502) 14.026 4.180 ( -11.275 0.000 -3.095) 11.692 4.538 ( 13.746 0.000 -3.836) 14.271 4.684 ( -1.102 0.000 2.625) 2.847 4.927 ( -1.691 0.000 3.183) 3.604 5.582 ( 2.866 0.000 -4.692) 5.498 5.613 ( 9.440 0.000 8.241) 12.532 5.665 ( 1.191 0.000 4.264) 4.428 5.668 ( 12.629 0.000 -14.280) 19.063 6.004 ( -14.826 0.000 7.926) 16.812 6.009 ( -13.286 0.000 -0.659) 13.302 6.482 ( 2.434 0.000 2.134) 3.237 6.586 ( 8.502 0.000 -4.506) 9.622 6.699 ( -0.318 0.000 -0.143) 0.349 6.978 ( -2.441 0.000 2.535) 3.519 7.101 ( -1.962 0.000 -1.184) 2.292 7.315 ( 3.894 0.000 3.792) 5.435 7.460 ( -2.385 0.000 -4.955) 5.499 7.502 ( -0.297 0.000 1.122) 1.161 7.821 ( 0.888 0.000 -1.661) 1.883 7.854 ( 0.441 0.000 0.901) 1.003 8.003 ( -1.147 0.000 2.001) 2.306 8.337 ( -6.564 0.000 1.765) 6.797 8.753 ( 5.818 0.000 -4.403) 7.296 9.114 ( -4.139 0.000 10.237) 11.042 9.221 ( -0.300 0.000 -9.497) 9.501 9.246 ( -5.688 0.000 -1.133) 5.799 9.593 ( -0.486 0.000 -1.106) 1.209 9.797 ( -0.787 0.000 11.947) 11.973 10.188 ( -1.978 0.000 -3.817) 4.299 10.190 ( 12.944 0.000 -5.424) 14.035 10.596 ( -7.120 0.000 4.075) 8.204 12.849 ( 0.543 0.000 0.712) 0.896 13.060 ( 4.381 0.000 -1.496) 4.629 13.102 ( 2.248 0.000 -0.414) 2.286 13.277 ( -8.029 0.000 2.218) 8.330 13.340 ( -0.855 0.000 -0.372) 0.933 13.646 ( -4.379 0.000 0.033) 4.379 14.444 ( -0.425 0.000 0.106) 0.438 14.696 ( 3.492 0.000 -4.405) 5.621 14.840 ( -3.530 0.000 4.291) 5.556 14.876 ( 0.838 0.000 -1.859) 2.039 15.038 ( 0.557 0.000 -3.379) 3.425 15.177 ( -0.778 0.000 0.150) 0.792 15.317 ( 1.250 0.000 -1.877) 2.255 16.128 ( 1.862 0.000 2.272) 2.937 16.346 ( -0.215 0.000 -0.114) 0.243 16.475 ( -2.323 0.000 2.253) 3.236 17.254 ( 0.575 0.000 -0.183) 0.604 17.868 ( 2.038 0.000 -2.838) 3.494 18.212 ( 4.299 0.000 1.017) 4.418 18.713 ( 5.121 0.000 2.933) 5.902 19.180 ( 0.815 0.000 0.172) 0.833 19.336 ( 0.631 0.000 0.159) 0.650 19.337 ( -2.065 0.000 -4.541) 4.988 19.783 ( 0.400 0.000 1.483) 1.536 20.355 ( -1.120 0.000 -1.503) 1.875 20.754 ( 10.989 0.000 10.279) 15.047 21.011 ( -8.900 0.000 -5.506) 10.466 21.231 ( 0.412 0.000 -0.594) 0.723 21.460 ( -5.258 0.000 -5.776) 7.811 22.548 ( -1.576 0.000 1.981) 2.532 23.107 ( 0.396 0.000 3.254) 3.278 23.372 ( -0.253 0.000 -1.587) 1.607 24.465 ( 1.530 0.000 0.913) 1.782 24.616 ( 0.582 0.000 -0.614) 0.846 ======================= Grid point 9 (6/138) ======================= q-point: ( 0.00 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.715 ( 0.000 36.742 0.000) 36.742 0.964 ( 0.000 49.121 0.000) 49.121 1.065 ( 0.000 54.688 0.000) 54.688 2.974 ( 0.000 1.786 0.000) 1.786 2.994 ( 0.000 -5.539 0.000) 5.539 3.010 ( 0.000 14.592 0.000) 14.592 3.392 ( 0.000 12.200 0.000) 12.200 3.678 ( 0.000 1.489 0.000) 1.489 4.209 ( 0.000 -0.229 0.000) 0.229 4.757 ( 0.000 -3.005 0.000) 3.005 4.844 ( 0.000 -12.278 0.000) 12.278 5.140 ( 0.000 -5.179 0.000) 5.179 5.397 ( 0.000 -1.535 0.000) 1.535 5.482 ( 0.000 2.071 0.000) 2.071 5.489 ( 0.000 3.891 0.000) 3.891 5.957 ( 0.000 3.970 0.000) 3.970 6.010 ( 0.000 12.614 0.000) 12.614 6.479 ( 0.000 -3.569 0.000) 3.569 6.492 ( 0.000 8.617 0.000) 8.617 6.965 ( 0.000 1.095 0.000) 1.095 7.021 ( 0.000 -9.332 0.000) 9.332 7.387 ( 0.000 1.674 0.000) 1.674 7.538 ( 0.000 -3.629 0.000) 3.629 7.596 ( 0.000 0.438 0.000) 0.438 7.773 ( 0.000 0.526 0.000) 0.526 7.881 ( 0.000 -3.613 0.000) 3.613 7.934 ( 0.000 -3.122 0.000) 3.122 8.153 ( 0.000 8.320 0.000) 8.320 8.242 ( 0.000 0.310 0.000) 0.310 8.359 ( 0.000 6.093 0.000) 6.093 8.979 ( 0.000 -0.137 0.000) 0.137 8.985 ( 0.000 -6.002 0.000) 6.002 9.515 ( 0.000 -8.497 0.000) 8.497 9.804 ( 0.000 -7.665 0.000) 7.665 9.912 ( 0.000 5.339 0.000) 5.339 10.230 ( 0.000 -4.092 0.000) 4.092 10.647 ( 0.000 -2.214 0.000) 2.214 10.814 ( 0.000 2.435 0.000) 2.435 12.638 ( 0.000 2.288 0.000) 2.288 12.764 ( 0.000 1.309 0.000) 1.309 13.089 ( 0.000 -1.524 0.000) 1.524 13.312 ( 0.000 0.924 0.000) 0.924 14.015 ( 0.000 -3.755 0.000) 3.755 14.193 ( 0.000 0.264 0.000) 0.264 14.534 ( 0.000 0.857 0.000) 0.857 14.593 ( 0.000 -2.282 0.000) 2.282 14.650 ( 0.000 -0.843 0.000) 0.843 14.728 ( 0.000 -0.051 0.000) 0.051 14.920 ( 0.000 1.113 0.000) 1.113 15.189 ( 0.000 -0.464 0.000) 0.464 15.323 ( 0.000 -0.596 0.000) 0.596 15.795 ( 0.000 -10.419 0.000) 10.419 16.457 ( 0.000 3.970 0.000) 3.970 16.725 ( 0.000 -11.991 0.000) 11.991 17.491 ( 0.000 5.542 0.000) 5.542 17.634 ( 0.000 -2.564 0.000) 2.564 17.703 ( 0.000 1.710 0.000) 1.710 18.106 ( 0.000 1.622 0.000) 1.622 18.902 ( 0.000 -0.261 0.000) 0.261 18.947 ( 0.000 -2.428 0.000) 2.428 19.184 ( 0.000 7.274 0.000) 7.274 19.964 ( 0.000 -1.614 0.000) 1.614 20.017 ( 0.000 1.013 0.000) 1.013 20.297 ( 0.000 -6.346 0.000) 6.346 21.075 ( 0.000 -2.403 0.000) 2.403 21.125 ( 0.000 -5.117 0.000) 5.117 22.400 ( 0.000 -1.558 0.000) 1.558 22.802 ( 0.000 -4.312 0.000) 4.312 23.057 ( 0.000 7.431 0.000) 7.431 23.997 ( 0.000 -1.958 0.000) 1.958 24.133 ( 0.000 1.797 0.000) 1.797 24.188 ( 0.000 1.965 0.000) 1.965 ======================= Grid point 10 (7/138) ======================= q-point: ( 0.11 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.721 ( 20.002 18.994 -11.741) 29.978 1.047 ( 29.257 24.900 -6.671) 38.993 1.921 ( 47.148 44.072 10.159) 65.334 2.974 ( 4.172 -0.246 -17.069) 17.573 3.111 ( 8.733 -2.576 9.885) 13.440 3.176 ( 13.830 11.955 6.120) 19.278 3.390 ( 2.148 8.354 -11.291) 14.209 3.803 ( 8.880 4.014 14.850) 17.762 4.220 ( 1.896 -0.888 -2.361) 3.155 4.783 ( 4.050 -2.681 -3.001) 5.709 4.905 ( 3.600 -11.455 -1.984) 12.170 5.197 ( 4.914 -0.902 5.272) 7.263 5.332 ( -7.667 -3.180 4.536) 9.459 5.470 ( 0.713 1.764 -2.745) 3.339 5.530 ( 5.356 -1.483 -12.088) 13.304 5.995 ( 3.668 5.276 -3.674) 7.402 6.040 ( 2.904 10.311 2.503) 11.001 6.469 ( 0.544 4.368 -4.545) 6.327 6.526 ( -0.079 -3.044 11.555) 11.950 6.813 ( -11.929 -0.558 2.257) 12.153 7.056 ( 1.275 -6.498 -3.003) 7.271 7.352 ( -3.307 3.318 -1.536) 4.930 7.467 ( -5.004 6.275 -1.921) 8.253 7.543 ( -4.461 -1.531 0.026) 4.716 7.737 ( -0.764 -3.894 0.836) 4.055 7.804 ( -0.740 -1.958 0.806) 2.243 7.902 ( -2.750 -0.472 4.125) 4.981 8.066 ( -5.462 6.387 1.624) 8.559 8.257 ( 2.842 -0.320 -3.509) 4.527 8.772 ( 25.460 0.614 -2.854) 25.627 8.935 ( -2.795 -4.713 1.663) 5.727 9.021 ( 3.682 0.300 -3.273) 4.936 9.501 ( -2.338 -7.872 0.852) 8.256 9.744 ( -4.603 -4.063 -0.697) 6.179 9.850 ( -8.041 5.162 25.720) 27.438 10.069 ( -14.816 4.139 20.394) 25.546 10.437 ( -7.479 2.031 9.405) 12.186 10.860 ( 1.464 4.370 0.963) 4.708 12.654 ( 1.640 1.908 0.605) 2.588 12.803 ( 3.633 1.488 0.802) 4.007 13.209 ( -0.097 1.433 0.005) 1.437 13.367 ( 6.760 -12.214 -12.619) 18.818 13.868 ( -10.228 1.907 2.802) 10.775 14.113 ( -6.936 0.081 -1.472) 7.091 14.517 ( -1.396 0.287 1.314) 1.938 14.652 ( 0.246 -3.921 -9.907) 10.657 14.710 ( 4.280 -0.633 0.423) 4.347 14.819 ( 10.996 -6.721 -30.467) 33.080 14.941 ( 3.105 0.366 -8.455) 9.015 15.185 ( -0.304 -1.061 -0.150) 1.114 15.322 ( -0.606 0.070 -1.310) 1.446 15.806 ( 1.376 -9.074 4.442) 10.196 16.427 ( -1.828 2.567 -0.829) 3.258 16.829 ( 6.451 -7.137 3.457) 10.223 17.090 ( -18.432 10.159 0.905) 21.065 17.588 ( 6.231 -0.515 -4.687) 7.814 17.837 ( 1.755 8.312 1.311) 8.595 18.169 ( 5.053 2.428 8.294) 10.011 18.948 ( 6.061 0.007 1.715) 6.299 19.120 ( 4.522 -1.176 -11.888) 12.774 19.296 ( 7.564 -10.322 -12.904) 18.173 19.944 ( -3.872 -0.583 3.535) 5.276 20.114 ( 7.798 -5.039 3.120) 9.795 20.375 ( 4.541 -8.657 -7.125) 12.097 21.108 ( 0.219 -6.460 1.375) 6.608 21.227 ( 7.165 -6.742 5.191) 11.124 22.235 ( -13.406 -0.722 -2.675) 13.689 22.754 ( -5.253 -2.930 6.895) 9.150 23.049 ( -1.488 7.346 13.713) 15.627 23.682 ( -13.278 18.246 6.502) 23.484 24.110 ( 4.580 -4.611 1.064) 6.586 24.460 ( 8.293 -4.630 -7.704) 12.230 ======================= Grid point 11 (8/138) ======================= q-point: ( 0.22 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.340 ( 35.361 -3.268 -0.641) 35.518 1.735 ( 39.528 6.220 -2.590) 40.098 2.835 ( 40.693 31.617 5.310) 51.805 3.043 ( 6.901 1.510 -11.726) 13.690 3.285 ( 6.597 3.523 -15.329) 17.056 3.482 ( 8.917 -3.530 10.998) 14.592 3.538 ( 20.327 11.886 4.020) 23.888 4.027 ( 8.864 3.748 16.032) 18.699 4.279 ( 5.147 -0.477 -6.168) 8.048 4.857 ( 1.089 -8.788 -8.390) 12.199 4.991 ( 7.004 -1.971 -4.347) 8.476 5.104 ( -10.825 -0.796 10.180) 14.881 5.370 ( 6.916 0.137 7.461) 10.175 5.489 ( 2.392 2.487 -7.735) 8.470 5.638 ( 6.627 -9.157 -8.504) 14.145 6.062 ( 4.669 7.984 -6.976) 11.584 6.141 ( 6.349 0.421 2.139) 6.713 6.450 ( -3.869 8.086 6.539) 11.095 6.535 ( -4.265 -4.158 3.593) 6.956 6.601 ( -4.417 -3.927 0.548) 5.935 7.038 ( -2.450 -6.780 -1.270) 7.321 7.278 ( -3.234 4.102 -0.457) 5.244 7.397 ( -2.217 6.913 -1.392) 7.392 7.466 ( -4.132 -4.267 2.207) 6.337 7.740 ( -6.440 0.975 6.488) 9.194 7.747 ( 0.461 -3.446 -1.370) 3.737 7.863 ( -0.005 1.398 2.915) 3.233 8.006 ( -1.325 2.945 0.674) 3.299 8.371 ( 9.190 -2.702 -7.269) 12.025 8.759 ( -10.378 -5.157 0.913) 11.624 9.095 ( 4.066 0.566 -2.024) 4.577 9.304 ( 19.525 -0.705 -6.165) 20.488 9.433 ( -0.256 -4.943 -3.381) 5.994 9.614 ( -10.014 -6.381 -0.852) 11.905 9.742 ( -7.150 5.608 18.759) 20.844 9.889 ( -6.079 4.779 18.212) 19.786 10.354 ( -3.509 0.509 0.227) 3.553 10.868 ( -1.363 6.031 2.288) 6.593 12.711 ( 4.026 1.376 0.719) 4.315 12.900 ( 5.689 1.334 0.823) 5.901 13.147 ( -4.632 2.919 1.156) 5.595 13.409 ( -0.256 -8.498 -5.937) 10.370 13.669 ( -10.571 0.921 1.552) 10.724 13.948 ( -8.842 -0.126 -1.352) 8.945 14.487 ( -1.824 -0.117 0.935) 2.053 14.624 ( -0.321 -1.921 -4.721) 5.106 14.790 ( 3.701 -0.712 -3.193) 4.939 14.910 ( 2.204 -1.416 0.134) 2.623 14.992 ( 5.432 -1.218 -25.795) 26.388 15.180 ( -0.007 -3.204 -0.942) 3.339 15.290 ( -1.764 0.649 -0.494) 1.943 15.882 ( 4.513 -7.274 6.558) 10.783 16.398 ( -0.982 2.232 0.152) 2.443 16.768 ( -9.330 11.319 3.322) 15.040 17.043 ( 5.974 -11.938 4.757) 14.172 17.720 ( 7.577 -0.891 -11.315) 13.646 17.896 ( 4.984 4.829 4.748) 8.409 18.323 ( 8.320 0.491 7.560) 11.252 19.104 ( 7.776 0.099 1.225) 7.872 19.165 ( 2.816 3.187 -5.298) 6.794 19.339 ( 1.412 -10.395 -9.335) 14.042 19.866 ( -4.360 -0.202 2.650) 5.106 20.278 ( 7.869 -4.721 4.105) 10.053 20.401 ( 0.690 -5.077 -5.648) 7.626 21.111 ( 0.147 -7.248 -1.230) 7.353 21.293 ( -1.164 -0.602 1.138) 1.736 21.955 ( -12.823 -0.195 -6.513) 14.383 22.651 ( -6.398 -2.859 8.120) 10.726 23.069 ( 0.342 4.812 11.161) 12.159 23.537 ( -4.163 11.725 -1.761) 12.566 24.224 ( 5.745 -5.648 2.761) 8.516 24.551 ( 3.533 -1.597 -3.606) 5.295 ======================= Grid point 12 (9/138) ======================= q-point: ( 0.33 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.005 ( 31.304 -0.570 1.674) 31.354 2.500 ( 35.615 -4.010 3.461) 36.007 3.088 ( 3.643 2.594 -4.696) 6.485 3.282 ( 1.648 7.598 -15.043) 16.933 3.552 ( 17.118 4.089 2.017) 17.714 3.778 ( 20.413 4.697 3.652) 21.263 3.896 ( 10.901 9.985 2.598) 15.010 4.201 ( 7.230 -1.944 8.663) 11.450 4.383 ( 6.768 4.625 -4.469) 9.336 4.742 ( -5.868 -3.061 -7.521) 10.018 4.961 ( -4.502 -2.564 7.875) 9.427 5.198 ( 9.955 -5.815 2.695) 11.840 5.529 ( 8.215 1.678 -2.562) 8.767 5.555 ( 6.633 3.500 -3.739) 8.380 5.672 ( -2.403 -7.028 -2.885) 7.968 6.124 ( -1.973 -2.177 -7.010) 7.601 6.223 ( -5.039 -3.176 5.497) 8.105 6.352 ( 0.206 -2.223 5.311) 5.761 6.430 ( -0.735 1.043 3.139) 3.388 6.664 ( 5.803 -2.310 -2.312) 6.660 6.979 ( -2.686 -4.765 0.966) 5.555 7.231 ( -1.911 3.537 0.896) 4.119 7.315 ( -6.076 4.329 0.914) 7.516 7.416 ( -0.575 -2.146 0.379) 2.254 7.650 ( -2.277 5.027 -0.262) 5.525 7.773 ( 1.919 -1.544 -0.490) 2.511 7.883 ( 0.879 1.959 1.874) 2.850 8.001 ( 0.357 0.746 1.934) 2.103 8.504 ( -6.853 -4.383 -0.050) 8.135 8.561 ( 2.676 -3.770 -5.134) 6.909 9.140 ( -1.487 -1.282 7.255) 7.516 9.285 ( -3.226 -1.644 -12.851) 13.352 9.378 ( -9.602 -7.081 -3.235) 12.362 9.637 ( -5.387 0.263 3.691) 6.536 9.697 ( 7.356 -1.253 14.266) 16.099 9.936 ( 7.239 4.061 0.624) 8.324 10.310 ( 0.867 5.082 -0.884) 5.231 10.808 ( -5.410 7.297 3.097) 9.597 12.810 ( 5.378 1.478 0.621) 5.612 13.008 ( 3.943 -0.038 0.092) 3.944 13.074 ( -1.345 3.152 0.091) 3.429 13.360 ( -2.840 -3.707 -2.278) 5.196 13.460 ( -10.918 -0.607 2.209) 11.156 13.777 ( -7.919 -0.025 -0.704) 7.950 14.454 ( -1.531 -0.531 0.699) 1.765 14.637 ( 2.795 -0.505 -4.582) 5.391 14.834 ( 1.193 -1.650 -1.773) 2.700 14.921 ( -1.232 2.165 3.850) 4.586 15.019 ( 1.750 -1.139 -13.627) 13.786 15.187 ( 1.223 -2.447 -3.395) 4.359 15.273 ( 0.176 -0.211 0.092) 0.290 15.986 ( 4.212 -7.009 4.949) 9.558 16.389 ( 0.048 3.279 0.782) 3.371 16.614 ( -7.107 6.648 4.008) 10.524 17.154 ( 4.110 -7.215 1.091) 8.375 17.807 ( 3.661 -0.889 -6.597) 7.597 18.057 ( 9.188 -0.147 2.129) 9.433 18.515 ( 9.064 -2.071 5.572) 10.840 19.167 ( -2.108 -9.927 -3.276) 10.664 19.202 ( 2.336 4.451 -3.367) 6.050 19.391 ( 4.687 -1.735 -1.441) 5.202 19.803 ( -2.101 0.661 2.266) 3.160 20.342 ( -1.146 -5.349 -2.933) 6.208 20.509 ( 10.168 -1.025 7.725) 12.811 21.105 ( -0.444 -8.353 -2.851) 8.837 21.213 ( -6.297 3.555 -0.667) 7.262 21.722 ( -8.741 3.822 -8.540) 12.805 22.554 ( -4.754 -4.259 5.505) 8.429 23.102 ( 0.796 2.914 6.429) 7.104 23.472 ( -2.239 7.739 -2.125) 8.332 24.329 ( 4.077 -6.464 1.822) 7.857 24.600 ( 2.054 -0.450 -1.541) 2.607 ======================= Grid point 13 (10/138) ======================= q-point: ( 0.44 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.520 ( 17.299 3.001 1.159) 17.596 3.024 ( 11.392 -1.435 4.557) 12.354 3.159 ( 5.428 1.706 2.526) 6.226 3.266 ( 0.475 1.596 -8.601) 8.761 3.713 ( 3.618 -11.947 -3.463) 12.954 3.834 ( -6.309 -0.177 -4.352) 7.666 4.073 ( 0.924 8.244 5.078) 9.726 4.359 ( 5.531 9.974 1.410) 11.492 4.592 ( 11.792 4.629 -4.346) 13.392 4.703 ( 0.188 2.000 3.192) 3.772 4.927 ( 0.611 0.683 1.959) 2.163 5.396 ( 9.974 -12.789 0.622) 16.231 5.568 ( -3.780 -4.605 -1.044) 6.049 5.641 ( 3.013 -2.321 -3.515) 5.179 5.738 ( 5.818 -0.934 1.377) 6.051 5.871 ( -12.077 -5.893 -1.876) 13.569 6.073 ( -9.347 2.979 4.651) 10.857 6.431 ( 2.613 -5.880 1.719) 6.660 6.504 ( 4.096 -4.955 -0.705) 6.467 6.767 ( 3.951 1.027 -1.931) 4.516 6.950 ( -0.738 -1.063 1.544) 2.015 7.173 ( -2.791 5.455 -0.054) 6.128 7.257 ( -0.303 -0.438 0.509) 0.736 7.417 ( 0.183 -1.696 -0.282) 1.729 7.629 ( -0.203 6.787 -0.792) 6.836 7.808 ( 1.214 -0.959 -0.763) 1.725 7.894 ( -0.120 2.284 0.740) 2.404 8.019 ( 0.579 1.682 1.398) 2.263 8.311 ( -6.423 -1.583 1.144) 6.713 8.661 ( 3.383 -8.577 -3.274) 9.785 9.056 ( -4.978 -6.435 4.730) 9.411 9.248 ( -0.416 1.567 -4.630) 4.906 9.259 ( -1.486 1.490 -3.188) 3.819 9.562 ( -2.212 -3.223 1.043) 4.046 9.792 ( 0.961 0.076 11.059) 11.101 10.010 ( 0.727 -5.337 -6.564) 8.491 10.444 ( 11.056 12.292 -1.965) 16.649 10.668 ( -9.270 7.644 3.265) 12.450 12.886 ( 1.375 3.592 0.730) 3.915 13.059 ( 4.471 -0.822 -1.823) 4.898 13.106 ( 1.355 1.189 -0.205) 1.814 13.263 ( -8.610 -1.453 2.046) 8.968 13.324 ( -0.215 -1.357 -0.191) 1.387 13.652 ( -3.992 0.600 -0.202) 4.042 14.434 ( -0.576 -0.950 0.221) 1.133 14.701 ( 3.823 0.278 -3.726) 5.346 14.822 ( -2.315 -1.582 2.732) 3.914 14.903 ( -0.464 2.809 -0.154) 2.851 15.013 ( 0.009 -2.110 -3.221) 3.851 15.202 ( 0.684 1.857 -1.793) 2.671 15.285 ( 0.554 -2.951 -0.032) 3.003 16.054 ( 1.664 -7.349 1.689) 7.722 16.402 ( 0.886 5.315 0.438) 5.407 16.512 ( -3.486 3.747 1.660) 5.380 17.208 ( 1.347 -4.515 0.012) 4.711 17.845 ( 1.190 -2.963 -1.666) 3.602 18.210 ( 4.763 -0.027 0.065) 4.763 18.672 ( 4.790 -3.843 2.728) 6.720 19.089 ( -3.222 -14.190 -1.623) 14.642 19.233 ( 1.180 5.122 -1.950) 5.606 19.442 ( 0.639 -0.082 -0.204) 0.675 19.797 ( 0.455 1.441 1.178) 1.916 20.312 ( -0.893 -4.258 -1.203) 4.514 20.750 ( 11.037 -1.490 10.044) 14.998 21.018 ( -8.399 -2.056 -8.329) 12.006 21.119 ( -1.227 -1.953 0.617) 2.388 21.588 ( -3.079 7.681 -3.731) 9.078 22.496 ( -1.743 -5.160 1.905) 5.770 23.124 ( 0.355 2.046 2.054) 2.921 23.438 ( -0.804 6.222 -0.775) 6.321 24.386 ( 1.413 -6.851 0.591) 7.021 24.625 ( 0.713 -0.119 -0.423) 0.837 ======================= Grid point 18 (11/138) ======================= q-point: ( 0.00 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.405 ( 0.000 34.719 0.000) 34.719 1.870 ( 0.000 44.596 0.000) 44.596 2.087 ( 0.000 51.030 0.000) 51.030 2.941 ( 0.000 0.508 0.000) 0.508 2.987 ( 0.000 -0.646 0.000) 0.646 3.351 ( 0.000 18.327 0.000) 18.327 3.654 ( 0.000 15.315 0.000) 15.315 3.774 ( 0.000 8.622 0.000) 8.622 4.180 ( 0.000 -3.563 0.000) 3.563 4.591 ( 0.000 -12.284 0.000) 12.284 4.663 ( 0.000 -5.348 0.000) 5.348 5.092 ( 0.000 -0.455 0.000) 0.455 5.363 ( 0.000 -1.971 0.000) 1.971 5.510 ( 0.000 2.124 0.000) 2.124 5.585 ( 0.000 4.966 0.000) 4.966 6.059 ( 0.000 6.091 0.000) 6.091 6.239 ( 0.000 6.811 0.000) 6.811 6.365 ( 0.000 -4.338 0.000) 4.338 6.673 ( 0.000 8.885 0.000) 8.885 6.902 ( 0.000 -2.765 0.000) 2.765 7.002 ( 0.000 2.505 0.000) 2.505 7.345 ( 0.000 -5.330 0.000) 5.330 7.444 ( 0.000 -5.806 0.000) 5.806 7.570 ( 0.000 -3.985 0.000) 3.985 7.780 ( 0.000 0.416 0.000) 0.416 7.791 ( 0.000 -5.263 0.000) 5.263 7.916 ( 0.000 0.901 0.000) 0.901 8.247 ( 0.000 0.014 0.000) 0.014 8.341 ( 0.000 10.815 0.000) 10.815 8.506 ( 0.000 7.383 0.000) 7.383 8.845 ( 0.000 -6.402 0.000) 6.402 8.959 ( 0.000 -2.387 0.000) 2.387 9.340 ( 0.000 -9.624 0.000) 9.624 9.604 ( 0.000 -12.288 0.000) 12.288 9.984 ( 0.000 1.596 0.000) 1.596 10.135 ( 0.000 -5.446 0.000) 5.446 10.597 ( 0.000 -2.608 0.000) 2.608 10.860 ( 0.000 2.003 0.000) 2.003 12.703 ( 0.000 4.490 0.000) 4.490 12.799 ( 0.000 2.185 0.000) 2.185 13.049 ( 0.000 -2.524 0.000) 2.524 13.342 ( 0.000 2.183 0.000) 2.183 13.917 ( 0.000 -6.234 0.000) 6.234 14.186 ( 0.000 -1.459 0.000) 1.459 14.554 ( 0.000 1.178 0.000) 1.178 14.562 ( 0.000 -0.362 0.000) 0.362 14.628 ( 0.000 -1.344 0.000) 1.344 14.704 ( 0.000 -2.556 0.000) 2.556 14.943 ( 0.000 1.013 0.000) 1.013 15.169 ( 0.000 -1.843 0.000) 1.843 15.304 ( 0.000 -1.441 0.000) 1.441 15.553 ( 0.000 -13.872 0.000) 13.872 16.529 ( 0.000 -6.847 0.000) 6.847 16.537 ( 0.000 4.074 0.000) 4.074 17.469 ( 0.000 -6.069 0.000) 6.069 17.567 ( 0.000 -4.249 0.000) 4.249 17.825 ( 0.000 8.687 0.000) 8.687 18.144 ( 0.000 2.158 0.000) 2.158 18.891 ( 0.000 -0.987 0.000) 0.987 18.911 ( 0.000 -1.523 0.000) 1.523 19.339 ( 0.000 8.420 0.000) 8.420 19.928 ( 0.000 -2.226 0.000) 2.226 20.030 ( 0.000 0.267 0.000) 0.267 20.129 ( 0.000 -10.403 0.000) 10.403 21.016 ( 0.000 -3.461 0.000) 3.461 21.016 ( 0.000 -5.481 0.000) 5.481 22.357 ( 0.000 -2.725 0.000) 2.725 22.704 ( 0.000 -5.748 0.000) 5.748 23.223 ( 0.000 9.379 0.000) 9.379 23.964 ( 0.000 -1.439 0.000) 1.439 24.163 ( 0.000 1.266 0.000) 1.266 24.233 ( 0.000 2.475 0.000) 2.475 ======================= Grid point 19 (12/138) ======================= q-point: ( 0.11 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.398 ( -11.190 42.084 -8.744) 44.416 1.617 ( 16.280 32.557 -14.741) 39.272 2.749 ( 37.807 40.635 10.416) 56.472 2.975 ( 3.974 1.587 -6.494) 7.777 3.053 ( 5.373 -3.265 14.162) 15.495 3.447 ( 7.408 12.260 -4.011) 14.876 3.619 ( 3.571 17.253 -9.037) 19.801 3.938 ( 9.127 8.756 14.497) 19.239 4.171 ( 1.267 -4.616 -5.223) 7.084 4.651 ( 4.119 -7.549 -4.964) 9.930 4.751 ( 9.349 -6.408 0.509) 11.345 5.145 ( 3.936 -3.473 2.704) 5.904 5.305 ( -6.680 0.570 2.314) 7.092 5.470 ( -1.092 -0.084 -2.028) 2.305 5.575 ( 0.099 4.319 -5.155) 6.726 6.084 ( 2.054 4.624 0.209) 5.064 6.258 ( -0.128 10.183 0.683) 10.206 6.363 ( 1.393 -8.302 0.073) 8.419 6.665 ( -1.717 8.284 6.806) 10.858 6.771 ( -11.367 -2.638 1.173) 11.728 7.010 ( -0.763 0.860 -2.741) 2.972 7.324 ( -1.661 -5.650 -1.541) 6.087 7.449 ( 0.147 -3.323 3.108) 4.552 7.613 ( -4.036 3.488 -5.529) 7.683 7.630 ( -2.078 -6.090 1.079) 6.524 7.787 ( -1.414 -0.221 3.397) 3.686 7.894 ( -1.774 0.539 1.357) 2.298 8.197 ( -5.942 6.776 6.250) 10.967 8.249 ( -0.678 0.476 -2.616) 2.745 8.717 ( 2.344 -8.762 -1.937) 9.274 8.924 ( 15.465 4.450 -8.765) 18.324 9.006 ( 5.745 -2.126 -4.925) 7.861 9.336 ( -0.695 -8.724 -0.720) 8.781 9.576 ( -2.607 -10.274 1.480) 10.703 9.923 ( -6.214 0.497 3.387) 7.094 10.074 ( -6.388 -1.875 7.351) 9.917 10.489 ( -8.286 2.775 16.439) 18.617 10.923 ( 3.961 2.044 -0.568) 4.493 12.706 ( 0.789 3.475 -0.230) 3.571 12.843 ( 3.830 2.664 1.440) 4.882 13.148 ( 8.289 -6.365 -8.446) 13.437 13.300 ( -3.854 2.870 0.558) 4.838 13.834 ( -7.874 -4.431 1.757) 9.204 14.109 ( -6.749 -0.892 -1.913) 7.071 14.526 ( -2.047 0.681 1.557) 2.661 14.590 ( 1.429 -1.571 -6.642) 6.973 14.686 ( 5.193 -1.767 -0.057) 5.486 14.739 ( 4.844 -3.238 -9.612) 11.240 14.960 ( 1.912 1.147 -1.667) 2.784 15.160 ( -0.911 -1.862 -0.599) 2.158 15.309 ( -0.338 -1.245 0.220) 1.309 15.587 ( 3.402 -12.973 3.988) 13.992 16.464 ( -2.220 0.815 2.090) 3.156 16.669 ( 8.035 -4.566 2.733) 9.637 17.283 ( -17.248 5.274 -0.458) 18.042 17.546 ( 6.608 -2.462 -8.123) 10.757 17.891 ( 2.133 -0.813 -1.482) 2.721 18.235 ( 4.473 3.261 10.619) 11.975 18.934 ( 7.413 -2.390 0.530) 7.807 19.000 ( 5.617 -5.212 -10.146) 12.715 19.319 ( -1.557 6.588 -0.625) 6.798 19.910 ( -3.780 -2.835 3.711) 6.008 20.050 ( 5.188 -2.546 2.546) 6.315 20.214 ( 5.537 -7.744 -3.590) 10.175 20.993 ( -0.558 -5.097 0.053) 5.128 21.115 ( 6.835 -5.343 2.620) 9.062 22.229 ( -11.276 -0.391 -1.673) 11.406 22.673 ( -3.617 -5.341 1.965) 6.743 23.212 ( -1.378 9.234 4.206) 10.240 23.925 ( -9.599 7.901 2.187) 12.623 24.028 ( 1.921 -3.095 -2.065) 4.187 24.399 ( 7.608 -2.161 -1.812) 8.114 ======================= Grid point 20 (13/138) ======================= q-point: ( 0.22 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.447 ( 18.992 18.440 -10.725) 28.561 2.053 ( 27.596 22.206 -8.305) 36.382 3.056 ( 5.269 2.841 -4.136) 7.276 3.262 ( 11.764 -6.681 14.122) 19.557 3.450 ( 23.522 25.209 0.549) 34.483 3.511 ( 8.228 9.661 -11.092) 16.854 3.844 ( 16.525 18.034 4.326) 24.840 4.080 ( 2.659 0.408 12.445) 12.733 4.277 ( 10.386 1.340 -8.318) 13.373 4.709 ( 2.181 -5.964 -9.641) 11.544 4.938 ( 5.759 -3.152 -0.436) 6.580 5.063 ( -7.718 -3.065 12.727) 15.197 5.363 ( 9.968 -0.265 2.007) 10.171 5.461 ( 1.013 -3.891 -6.183) 7.376 5.593 ( 2.580 3.274 -4.645) 6.241 6.125 ( 1.990 1.361 1.101) 2.650 6.206 ( -4.801 2.671 0.333) 5.504 6.424 ( 1.195 -6.211 -0.401) 6.337 6.507 ( -11.435 -2.895 3.281) 12.244 6.641 ( -3.895 7.033 7.091) 10.720 6.942 ( -3.879 -2.953 -2.826) 5.635 7.292 ( -1.061 -3.225 -0.939) 3.522 7.435 ( -2.754 1.046 3.515) 4.587 7.495 ( -2.221 2.584 -1.640) 3.782 7.683 ( 1.683 -2.178 -1.040) 2.943 7.750 ( -2.223 0.470 4.865) 5.370 7.865 ( -0.854 -0.266 1.891) 2.092 8.107 ( -3.463 6.992 2.076) 8.074 8.308 ( 6.346 -3.546 -5.656) 9.211 8.632 ( -7.263 -7.778 -1.153) 10.704 9.059 ( 3.105 -4.614 -4.930) 7.432 9.223 ( 4.866 -10.265 -7.254) 13.478 9.301 ( -1.758 -6.151 -4.890) 8.052 9.578 ( 5.714 2.878 2.864) 7.010 9.777 ( -8.688 -2.370 6.042) 10.844 9.986 ( -2.665 4.622 7.414) 9.134 10.413 ( -2.508 5.858 11.004) 12.716 10.974 ( 0.904 4.415 1.191) 4.661 12.745 ( 3.316 2.104 -0.082) 3.928 12.938 ( 5.027 2.620 1.144) 5.783 13.206 ( -3.603 0.087 -1.933) 4.090 13.266 ( 3.076 -2.979 -3.598) 5.593 13.647 ( -10.846 -2.800 2.182) 11.412 13.946 ( -8.597 -0.217 -2.366) 8.919 14.487 ( -2.190 0.308 1.372) 2.603 14.595 ( 0.935 -0.669 -2.363) 2.628 14.765 ( 2.634 -1.830 -1.775) 3.666 14.848 ( 7.151 -4.381 -8.149) 11.693 15.003 ( 3.207 1.691 -7.819) 8.619 15.129 ( -1.806 -2.127 0.005) 2.790 15.292 ( -1.061 -0.425 1.191) 1.651 15.693 ( 5.654 -11.633 4.513) 13.699 16.447 ( -0.260 2.695 3.438) 4.376 16.843 ( 7.999 -7.571 2.763) 11.355 16.984 ( -12.388 9.485 0.985) 15.633 17.681 ( 7.482 -3.449 -8.375) 11.748 17.918 ( 2.374 -2.365 -0.567) 3.398 18.342 ( 5.237 1.411 7.568) 9.311 19.035 ( -0.710 -9.004 -6.865) 11.345 19.122 ( 9.088 -5.304 -1.090) 10.579 19.307 ( 1.433 6.504 1.149) 6.759 19.841 ( -3.074 -1.820 1.716) 3.963 20.187 ( 5.949 -4.203 1.229) 7.387 20.302 ( 5.338 -4.724 -0.211) 7.132 20.985 ( -0.089 -5.109 -1.821) 5.425 21.245 ( 4.442 -4.174 1.669) 6.320 21.979 ( -11.983 2.202 -3.042) 12.558 22.573 ( -6.697 -5.225 3.134) 9.053 23.197 ( -0.993 8.071 4.393) 9.242 23.749 ( -7.282 9.520 -0.388) 11.992 24.107 ( 4.643 -5.842 0.199) 7.465 24.507 ( 4.135 -2.986 -1.529) 5.324 ======================= Grid point 21 (14/138) ======================= q-point: ( 0.33 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.960 ( 30.862 -0.485 -2.290) 30.951 2.600 ( 27.566 12.671 -4.508) 30.672 3.155 ( 5.137 4.377 -0.194) 6.752 3.449 ( -2.816 7.063 -10.713) 13.137 3.510 ( 8.524 -3.460 1.314) 9.293 3.814 ( 3.067 -4.940 -4.754) 7.511 4.181 ( 14.168 16.404 5.371) 22.331 4.242 ( 11.611 6.458 10.638) 17.020 4.470 ( 10.895 4.116 -5.711) 12.971 4.680 ( -0.193 -1.922 0.461) 1.986 4.920 ( -1.136 -0.486 1.072) 1.636 5.115 ( 3.733 -2.311 7.238) 8.465 5.463 ( 1.896 -8.059 -7.386) 11.095 5.561 ( 3.010 -3.531 2.209) 5.139 5.639 ( 5.199 2.990 -3.126) 6.763 6.023 ( -14.149 -6.646 -2.226) 15.790 6.169 ( 1.001 -2.003 3.800) 4.410 6.279 ( -4.478 -4.382 1.286) 6.396 6.473 ( -4.341 2.752 10.427) 11.625 6.601 ( 2.823 -4.422 -5.499) 7.600 6.912 ( 0.938 -2.386 0.930) 2.727 7.283 ( 0.358 0.056 -0.914) 0.983 7.372 ( -4.353 2.708 2.781) 5.833 7.457 ( -1.538 5.182 -1.836) 5.709 7.685 ( -0.219 -1.242 0.389) 1.320 7.769 ( 2.263 1.082 0.240) 2.520 7.873 ( 1.054 -2.071 2.363) 3.314 8.068 ( -1.298 5.354 1.126) 5.623 8.410 ( 2.291 -5.284 -2.653) 6.341 8.477 ( -5.577 -3.732 -2.778) 7.263 9.016 ( -7.709 -10.926 1.979) 13.518 9.201 ( 0.602 -9.057 -7.504) 11.778 9.272 ( 0.727 -1.910 -7.411) 7.688 9.609 ( -7.972 -3.115 7.147) 11.151 9.745 ( 4.398 4.440 10.368) 12.106 9.996 ( 1.616 2.944 -7.239) 7.980 10.461 ( 6.082 10.023 6.532) 13.421 10.956 ( -3.134 7.181 1.697) 8.016 12.835 ( 5.706 0.879 -0.121) 5.775 13.022 ( 2.486 1.594 0.355) 2.974 13.151 ( -0.739 4.265 -0.895) 4.420 13.281 ( -0.731 -4.008 -2.328) 4.692 13.438 ( -10.396 -1.131 3.134) 10.917 13.780 ( -7.323 0.304 -1.810) 7.550 14.447 ( -2.078 0.006 1.208) 2.403 14.633 ( 3.331 0.151 -2.051) 3.915 14.793 ( 0.573 -2.495 -0.768) 2.673 14.938 ( 2.486 -1.742 0.996) 3.195 15.024 ( 0.458 2.977 -11.035) 11.439 15.127 ( 2.598 -3.316 -2.043) 4.682 15.277 ( -0.987 0.264 2.290) 2.507 15.805 ( 4.403 -11.193 2.901) 12.373 16.466 ( 1.341 4.281 3.386) 5.621 16.761 ( -9.091 7.307 0.881) 11.697 17.009 ( 6.364 -6.375 1.621) 9.153 17.746 ( 0.810 -5.774 -3.367) 6.733 18.032 ( 8.834 -2.880 -1.664) 9.440 18.481 ( 6.938 -0.959 4.185) 8.160 18.946 ( -6.325 -11.904 -2.119) 13.645 19.240 ( 4.778 -5.701 -7.402) 10.493 19.372 ( 2.288 3.968 5.168) 6.906 19.815 ( 0.311 1.322 1.411) 1.958 20.231 ( -0.015 -5.258 -2.742) 5.930 20.476 ( 10.231 -2.430 6.854) 12.552 20.980 ( 0.154 -4.017 -3.063) 5.054 21.267 ( -2.425 1.148 -0.197) 2.690 21.783 ( -6.579 2.725 -4.444) 8.394 22.446 ( -6.319 -6.684 3.268) 9.761 23.193 ( -0.345 6.346 2.661) 6.890 23.636 ( -4.145 8.624 -0.442) 9.578 24.190 ( 3.416 -7.393 0.509) 8.160 24.565 ( 2.227 -3.164 -0.966) 3.988 ======================= Grid point 22 (15/138) ======================= q-point: ( 0.44 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.537 ( 24.182 -2.382 1.538) 24.348 2.986 ( 5.783 0.205 3.700) 6.868 3.250 ( 3.965 3.943 1.318) 5.745 3.337 ( -4.272 6.214 -8.105) 11.070 3.511 ( -3.271 -5.582 -11.668) 13.341 3.817 ( 0.735 -2.147 2.024) 3.041 4.292 ( -1.779 12.470 5.102) 13.590 4.481 ( 7.402 0.792 3.559) 8.251 4.650 ( 7.389 1.489 -1.448) 7.675 4.764 ( 2.646 4.284 4.530) 6.773 4.978 ( 8.399 3.991 -2.771) 9.703 5.181 ( 1.294 -7.893 1.146) 8.080 5.422 ( -6.981 -15.650 0.618) 17.148 5.481 ( -5.097 -3.935 -1.151) 6.542 5.761 ( 3.554 -2.005 2.800) 4.948 5.794 ( -4.142 0.442 -6.773) 7.951 6.128 ( -4.144 2.195 4.038) 6.189 6.274 ( 1.231 -8.960 1.420) 9.155 6.441 ( 0.081 -0.898 1.504) 1.754 6.668 ( 2.995 -9.177 -2.250) 9.912 6.942 ( 0.909 -0.765 1.661) 2.042 7.259 ( -2.565 2.028 0.103) 3.272 7.351 ( 2.880 4.039 -0.530) 4.989 7.416 ( -2.752 5.840 -0.645) 6.488 7.687 ( 0.157 -1.312 0.420) 1.386 7.803 ( 1.109 0.735 -0.767) 1.535 7.903 ( 0.882 -1.548 1.107) 2.098 8.049 ( -0.760 1.931 0.837) 2.237 8.333 ( -3.298 3.973 -0.131) 5.165 8.474 ( 0.547 -9.530 -1.847) 9.723 8.879 ( -4.375 -11.215 1.412) 12.120 9.215 ( 1.353 -3.936 -3.857) 5.675 9.297 ( 2.480 -0.271 -5.425) 5.971 9.480 ( -5.467 -5.101 5.864) 9.503 9.830 ( 1.933 4.355 9.775) 10.874 9.972 ( -1.308 0.724 -8.728) 8.855 10.642 ( 8.977 8.980 1.274) 12.761 10.863 ( -6.092 10.878 1.117) 12.518 12.955 ( 5.415 1.676 0.160) 5.670 13.039 ( 0.199 0.078 -0.639) 0.674 13.151 ( -0.044 3.483 -0.925) 3.604 13.216 ( -5.577 -3.177 0.084) 6.419 13.317 ( -1.124 1.169 1.789) 2.415 13.667 ( -3.310 0.964 -0.754) 3.529 14.418 ( -0.859 -0.302 0.405) 0.997 14.699 ( 2.948 -0.708 -1.653) 3.454 14.788 ( -0.828 -1.847 0.889) 2.211 14.966 ( 0.298 0.170 5.117) 5.129 14.994 ( -0.783 3.968 -7.395) 8.429 15.189 ( 3.378 -3.928 -4.273) 6.716 15.256 ( -1.728 0.683 3.029) 3.553 15.870 ( 1.635 -11.090 0.947) 11.249 16.517 ( 3.338 5.760 2.112) 6.985 16.613 ( -6.039 6.376 -0.327) 8.788 17.101 ( 2.423 -5.971 0.324) 6.452 17.740 ( -0.375 -7.853 -0.511) 7.878 18.190 ( 5.660 -3.214 -1.010) 6.587 18.600 ( 3.460 -2.526 1.692) 4.606 18.822 ( -4.531 -13.209 -0.505) 13.973 19.305 ( 3.429 -8.239 -6.583) 11.089 19.380 ( -1.987 4.455 5.024) 7.003 19.843 ( 1.259 3.477 0.812) 3.786 20.215 ( -0.590 -5.011 -1.274) 5.204 20.674 ( 6.529 -5.597 5.416) 10.162 20.976 ( 0.135 -0.008 -2.907) 2.910 21.183 ( -4.113 4.690 -0.585) 6.266 21.697 ( -1.739 3.681 -2.405) 4.728 22.361 ( -2.523 -8.558 1.496) 9.047 23.193 ( -0.067 5.200 0.825) 5.265 23.582 ( -1.374 8.060 -0.124) 8.177 24.237 ( 1.214 -8.132 0.229) 8.225 24.593 ( 0.727 -3.300 -0.332) 3.396 ======================= Grid point 27 (16/138) ======================= q-point: ( 0.00 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.042 ( 0.000 31.221 0.000) 31.221 2.660 ( 0.000 36.818 0.000) 36.818 2.914 ( 0.000 19.626 0.000) 19.626 2.980 ( 0.000 1.355 0.000) 1.355 3.095 ( 0.000 29.063 0.000) 29.063 3.634 ( 0.000 10.308 0.000) 10.308 3.927 ( 0.000 3.135 0.000) 3.135 3.966 ( 0.000 13.780 0.000) 13.780 4.069 ( 0.000 -5.149 0.000) 5.149 4.460 ( 0.000 1.723 0.000) 1.723 4.595 ( 0.000 -1.899 0.000) 1.899 5.090 ( 0.000 0.412 0.000) 0.412 5.319 ( 0.000 -2.843 0.000) 2.843 5.615 ( 0.000 -3.552 0.000) 3.552 5.618 ( 0.000 9.914 0.000) 9.914 6.165 ( 0.000 -3.536 0.000) 3.536 6.182 ( 0.000 6.590 0.000) 6.590 6.485 ( 0.000 8.384 0.000) 8.384 6.786 ( 0.000 1.550 0.000) 1.550 6.874 ( 0.000 -1.510 0.000) 1.510 7.045 ( 0.000 1.537 0.000) 1.537 7.195 ( 0.000 -10.126 0.000) 10.126 7.341 ( 0.000 -3.734 0.000) 3.734 7.472 ( 0.000 -4.907 0.000) 4.907 7.698 ( 0.000 -4.246 0.000) 4.246 7.790 ( 0.000 0.308 0.000) 0.308 7.936 ( 0.000 0.620 0.000) 0.620 8.236 ( 0.000 -1.427 0.000) 1.427 8.494 ( 0.000 -7.529 0.000) 7.529 8.541 ( 0.000 8.942 0.000) 8.942 8.876 ( 0.000 -6.262 0.000) 6.262 8.896 ( 0.000 10.541 0.000) 10.541 9.149 ( 0.000 -9.582 0.000) 9.582 9.375 ( 0.000 -9.971 0.000) 9.971 9.963 ( 0.000 -3.760 0.000) 3.760 10.025 ( 0.000 -6.009 0.000) 6.009 10.566 ( 0.000 -0.211 0.000) 0.211 10.881 ( 0.000 -0.007 0.000) 0.007 12.808 ( 0.000 6.193 0.000) 6.193 12.842 ( 0.000 2.057 0.000) 2.057 13.000 ( 0.000 -2.202 0.000) 2.202 13.397 ( 0.000 3.428 0.000) 3.428 13.784 ( 0.000 -7.402 0.000) 7.402 14.120 ( 0.000 -5.506 0.000) 5.506 14.579 ( 0.000 1.256 0.000) 1.256 14.589 ( 0.000 2.817 0.000) 2.817 14.603 ( 0.000 -0.964 0.000) 0.964 14.638 ( 0.000 -3.796 0.000) 3.796 14.956 ( 0.000 0.502 0.000) 0.502 15.116 ( 0.000 -3.553 0.000) 3.553 15.261 ( 0.000 -4.669 0.000) 4.669 15.294 ( 0.000 -10.916 0.000) 10.916 16.491 ( 0.000 2.913 0.000) 2.913 16.614 ( 0.000 4.082 0.000) 4.082 17.319 ( 0.000 -8.814 0.000) 8.814 17.470 ( 0.000 -5.942 0.000) 5.942 17.980 ( 0.000 7.097 0.000) 7.097 18.186 ( 0.000 2.152 0.000) 2.152 18.859 ( 0.000 -2.390 0.000) 2.390 18.873 ( 0.000 -2.796 0.000) 2.796 19.494 ( 0.000 7.317 0.000) 7.317 19.877 ( 0.000 -3.128 0.000) 3.128 19.935 ( 0.000 -8.571 0.000) 8.571 20.025 ( 0.000 -0.837 0.000) 0.837 20.929 ( 0.000 -3.459 0.000) 3.459 20.951 ( 0.000 -3.077 0.000) 3.077 22.304 ( 0.000 -2.512 0.000) 2.512 22.585 ( 0.000 -6.481 0.000) 6.481 23.404 ( 0.000 9.200 0.000) 9.200 23.939 ( 0.000 -1.402 0.000) 1.402 24.183 ( 0.000 1.008 0.000) 1.008 24.274 ( 0.000 1.558 0.000) 1.558 ======================= Grid point 28 (17/138) ======================= q-point: ( 0.11 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.125 ( 3.018 31.675 2.253) 31.898 2.314 ( -9.774 39.219 -21.853) 45.947 3.000 ( 1.488 -1.044 12.115) 12.251 3.041 ( 5.116 6.151 -1.852) 8.213 3.466 ( 25.619 31.129 7.053) 40.927 3.640 ( 1.250 7.846 -6.157) 10.052 3.946 ( 3.751 10.231 2.960) 11.292 4.022 ( 0.813 -1.560 2.878) 3.373 4.119 ( 9.654 3.652 -7.197) 12.583 4.575 ( 6.689 0.720 -2.835) 7.300 4.653 ( 8.061 -2.883 3.298) 9.175 5.092 ( -1.231 -0.967 1.176) 1.958 5.308 ( -0.427 -1.816 -1.166) 2.200 5.528 ( -3.382 5.807 1.710) 6.934 5.653 ( 0.156 3.792 -4.570) 5.941 6.153 ( -0.856 1.452 4.987) 5.264 6.232 ( 3.149 -1.768 -1.590) 3.946 6.421 ( -5.957 6.219 4.022) 9.505 6.712 ( -11.583 -3.453 0.311) 12.091 6.778 ( -3.726 2.436 4.692) 6.467 7.021 ( -3.859 -1.651 -2.271) 4.772 7.189 ( 0.554 -7.332 0.981) 7.418 7.386 ( 2.998 -2.713 2.646) 4.832 7.532 ( 0.970 -3.299 1.087) 3.606 7.602 ( -2.549 -3.821 -3.142) 5.566 7.804 ( -0.017 1.400 1.766) 2.254 7.926 ( -1.114 2.003 -2.094) 3.105 8.220 ( -0.255 -0.976 -1.936) 2.183 8.394 ( -8.633 10.494 9.581) 16.627 8.519 ( -1.416 -9.918 -1.758) 10.171 8.896 ( 3.106 -7.062 -8.697) 11.625 9.004 ( 6.041 -0.194 -8.657) 10.559 9.160 ( 0.277 -10.174 -0.581) 10.194 9.445 ( 8.370 -0.953 0.135) 8.426 9.862 ( -9.586 -6.072 10.163) 15.233 10.035 ( 1.403 -2.337 -9.065) 9.465 10.546 ( -2.481 3.498 13.244) 13.921 10.943 ( 4.979 0.032 -0.223) 4.984 12.782 ( -0.637 4.145 -1.808) 4.567 12.904 ( 4.336 3.651 2.630) 6.249 13.045 ( 4.282 -4.128 -5.438) 8.060 13.374 ( -2.002 4.460 0.622) 4.928 13.722 ( -6.081 -6.697 1.796) 9.222 14.065 ( -5.071 -3.912 -1.755) 6.641 14.542 ( -2.318 0.791 0.753) 2.562 14.590 ( -0.250 0.766 0.870) 1.186 14.651 ( 5.449 -0.946 -4.763) 7.299 14.679 ( 3.002 -2.798 -2.902) 5.026 14.979 ( 2.217 0.951 -0.202) 2.421 15.113 ( -0.231 -2.919 -0.789) 3.033 15.273 ( -0.510 -3.092 0.894) 3.259 15.334 ( 5.048 -12.222 2.089) 13.387 16.491 ( -0.301 3.543 5.078) 6.199 16.661 ( 4.534 2.352 -1.505) 5.325 17.263 ( -6.857 -5.734 3.542) 9.614 17.495 ( 4.302 -4.498 -7.996) 10.133 17.895 ( -4.022 2.635 -3.222) 5.788 18.282 ( 4.591 1.811 6.494) 8.156 18.866 ( 2.539 -3.692 -3.392) 5.620 18.919 ( 2.177 -5.249 2.374) 6.159 19.458 ( -1.833 7.308 -3.035) 8.123 19.854 ( -2.572 -2.315 1.843) 3.920 19.986 ( 6.179 -4.225 3.023) 8.073 20.102 ( 5.523 -3.858 -2.376) 7.144 20.917 ( -0.236 -2.796 -0.805) 2.920 21.020 ( 5.553 -4.413 1.570) 7.265 22.218 ( -8.059 -0.609 -0.209) 8.085 22.554 ( -3.370 -6.746 0.516) 7.558 23.392 ( -1.413 9.212 2.230) 9.583 23.957 ( 1.740 -2.233 -0.942) 2.983 24.060 ( -7.787 4.450 -1.347) 9.069 24.363 ( 4.851 -1.808 0.032) 5.178 ======================= Grid point 29 (18/138) ======================= q-point: ( 0.22 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.984 ( -2.553 33.973 -12.424) 36.263 2.504 ( 19.926 23.542 -11.081) 32.773 3.118 ( 7.464 -6.424 16.665) 19.357 3.148 ( 5.826 6.658 -0.075) 8.848 3.654 ( 2.022 6.537 -10.904) 12.873 3.773 ( -0.138 1.471 -3.178) 3.505 4.092 ( 13.141 7.135 4.608) 15.647 4.184 ( 12.421 9.293 2.514) 15.715 4.326 ( 12.404 4.354 -4.319) 13.837 4.653 ( 4.150 2.791 -2.297) 5.504 4.883 ( 9.642 -2.512 6.554) 11.926 5.038 ( -2.344 2.016 5.654) 6.444 5.328 ( 1.164 -5.582 -3.476) 6.678 5.460 ( -2.654 5.420 -1.052) 6.126 5.667 ( 2.181 3.134 -5.484) 6.682 6.145 ( -1.385 1.070 6.179) 6.422 6.193 ( -9.747 -2.656 4.773) 11.174 6.336 ( -3.334 -2.437 -4.794) 6.327 6.476 ( -7.146 -0.242 2.494) 7.573 6.711 ( -6.817 -0.023 11.479) 13.350 6.894 ( -5.649 -3.182 -3.139) 7.203 7.216 ( 1.261 -4.842 0.721) 5.055 7.424 ( -0.437 -2.353 3.273) 4.055 7.472 ( -1.168 -3.604 -0.688) 3.850 7.665 ( 3.766 -1.272 -2.189) 4.538 7.793 ( -0.959 3.121 1.697) 3.680 7.889 ( -1.841 3.984 -1.461) 4.626 8.245 ( 0.805 -0.671 -2.977) 3.156 8.271 ( -2.882 7.789 4.443) 9.419 8.479 ( -1.928 -7.279 -2.505) 7.936 8.919 ( -1.933 -9.681 -4.583) 10.884 9.006 ( -0.845 -10.158 -6.844) 12.278 9.165 ( 1.141 -8.193 -3.390) 8.940 9.665 ( 6.529 0.000 2.166) 6.879 9.685 ( -5.198 -1.753 6.331) 8.377 10.046 ( 1.934 1.590 -8.879) 9.225 10.560 ( 1.304 8.774 14.077) 16.638 11.032 ( 3.374 1.604 0.805) 3.821 12.789 ( 1.713 2.392 -1.210) 3.181 13.002 ( 4.604 4.136 1.644) 6.404 13.107 ( 2.838 -5.876 -5.462) 8.509 13.337 ( -1.722 5.707 0.319) 5.970 13.575 ( -8.704 -4.411 3.241) 10.282 13.932 ( -7.347 -1.556 -2.733) 7.992 14.503 ( -2.162 1.361 1.951) 3.215 14.595 ( 0.953 0.007 0.367) 1.021 14.720 ( 1.764 -3.074 -2.557) 4.370 14.775 ( 7.746 -1.818 -6.115) 10.035 15.028 ( 2.422 0.438 -0.794) 2.587 15.105 ( -0.139 -0.206 -1.892) 1.909 15.267 ( -0.162 -2.631 2.005) 3.312 15.461 ( 6.579 -11.605 1.956) 13.483 16.508 ( 0.697 4.068 6.443) 7.652 16.767 ( 5.944 -0.674 -1.641) 6.203 17.096 ( -9.401 1.647 1.899) 9.731 17.576 ( 3.879 -8.005 -6.201) 10.844 17.861 ( 1.713 -1.575 -2.372) 3.323 18.368 ( 3.760 0.892 4.863) 6.211 18.858 ( -3.801 -8.546 -2.290) 9.630 18.987 ( 3.751 -8.647 1.515) 9.547 19.455 ( 2.190 8.231 -2.131) 8.780 19.829 ( 0.163 0.938 0.976) 1.364 20.118 ( 4.503 -3.233 -0.196) 5.547 20.220 ( 8.011 -3.947 1.908) 9.132 20.919 ( 0.798 -1.863 -1.617) 2.593 21.150 ( 6.403 -5.263 1.475) 8.419 22.023 ( -10.522 2.226 -0.938) 10.795 22.453 ( -6.917 -7.025 1.155) 9.926 23.364 ( -1.821 8.928 2.455) 9.437 23.903 ( -6.533 6.737 -1.206) 9.462 24.008 ( 2.484 -4.491 -0.613) 5.168 24.439 ( 2.990 -4.059 -0.585) 5.076 ======================= Grid point 30 (19/138) ======================= q-point: ( 0.33 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.093 ( 15.444 14.882 -9.581) 23.490 2.893 ( 19.190 15.795 -6.532) 25.698 3.254 ( 4.276 3.767 -2.842) 6.368 3.331 ( 7.104 -7.133 14.128) 17.348 3.635 ( -4.608 -9.799 -2.757) 11.174 3.676 ( 0.764 9.601 -15.066) 17.881 4.248 ( 1.968 -7.091 5.188) 9.004 4.456 ( 13.494 6.188 3.470) 15.245 4.539 ( 6.717 8.087 -3.167) 10.979 4.782 ( 6.551 10.611 5.954) 13.819 4.956 ( 1.607 3.954 1.253) 4.448 5.100 ( 3.005 0.232 6.555) 7.215 5.269 ( -4.678 -11.516 -4.371) 13.176 5.504 ( 5.229 -2.793 1.229) 6.054 5.617 ( -7.335 -4.392 -9.142) 12.517 5.973 ( -8.043 2.409 3.297) 9.021 6.152 ( -0.695 0.632 8.791) 8.841 6.223 ( -4.593 -0.548 -3.210) 5.630 6.464 ( 1.032 -6.039 -2.701) 6.696 6.555 ( -8.143 1.860 9.745) 12.835 6.861 ( 1.489 -3.506 0.313) 3.822 7.231 ( 0.162 -5.029 -0.515) 5.058 7.387 ( -2.957 -1.493 1.494) 3.633 7.496 ( 2.577 -3.915 0.328) 4.699 7.697 ( 0.291 2.211 -3.781) 4.390 7.803 ( 1.595 2.105 2.989) 3.989 7.850 ( -1.634 3.017 -1.259) 3.654 8.178 ( -3.566 5.422 3.067) 7.178 8.319 ( 2.408 -3.132 -2.959) 4.936 8.441 ( -1.317 -0.178 -1.874) 2.297 8.778 ( -8.461 -12.452 0.384) 15.060 9.038 ( 4.318 -7.740 -8.310) 12.150 9.186 ( 2.095 -6.950 -5.583) 9.158 9.509 ( -9.390 -7.253 10.560) 15.884 9.842 ( 5.658 5.284 4.920) 9.173 10.059 ( 1.053 3.310 -11.812) 12.312 10.668 ( 6.515 10.837 8.360) 15.158 11.067 ( -0.083 4.159 1.039) 4.288 12.843 ( 3.917 0.154 -1.030) 4.053 13.063 ( 0.827 1.632 0.277) 1.851 13.149 ( 2.783 -3.272 -3.401) 5.479 13.300 ( -2.286 5.949 0.155) 6.375 13.425 ( -6.607 -0.467 4.085) 7.782 13.785 ( -6.414 0.049 -2.551) 6.903 14.464 ( -2.043 1.963 1.534) 3.223 14.631 ( 2.295 -0.963 -0.173) 2.495 14.739 ( 0.654 -3.161 -1.192) 3.441 14.904 ( 5.987 -0.257 -3.422) 6.901 15.067 ( 1.969 -1.845 -0.711) 2.790 15.103 ( 0.336 3.404 -2.646) 4.325 15.270 ( -0.304 -1.407 1.538) 2.106 15.581 ( 4.963 -11.315 1.212) 12.415 16.548 ( 1.947 4.266 5.616) 7.316 16.836 ( -1.563 0.342 -3.302) 3.669 16.965 ( -1.260 1.618 2.578) 3.294 17.587 ( -1.081 -10.559 -2.763) 10.968 17.952 ( 6.947 -4.545 -2.082) 8.559 18.468 ( 5.279 -1.669 1.926) 5.862 18.737 ( -7.453 -9.113 1.937) 11.931 19.042 ( 1.966 -11.648 -2.768) 12.132 19.501 ( 1.906 7.656 -0.365) 7.898 19.868 ( 3.169 3.902 1.531) 5.254 20.150 ( 0.069 -3.443 -3.342) 4.799 20.415 ( 9.354 -3.895 5.074) 11.332 20.945 ( 2.355 -0.014 -1.531) 2.809 21.246 ( 2.490 -2.980 0.281) 3.893 21.836 ( -7.321 2.835 -1.859) 8.068 22.305 ( -7.790 -7.750 1.571) 11.101 23.336 ( -1.361 8.254 1.492) 8.497 23.793 ( -4.260 7.666 -0.604) 8.791 24.055 ( 2.101 -6.635 -0.150) 6.961 24.482 ( 1.627 -5.373 -0.658) 5.653 ======================= Grid point 31 (20/138) ======================= q-point: ( 0.44 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.480 ( 22.499 -1.094 -2.476) 22.662 2.958 ( -15.834 -5.642 -0.985) 16.838 3.331 ( 7.928 7.227 -7.710) 13.211 3.432 ( 5.077 5.036 8.959) 11.463 3.563 ( -4.053 4.030 -8.832) 10.520 3.790 ( 7.612 2.415 0.276) 7.991 4.296 ( 3.246 -14.659 5.618) 16.031 4.518 ( -6.769 5.490 0.723) 8.745 4.707 ( 10.881 3.277 3.194) 11.804 4.845 ( 1.338 3.993 1.132) 4.361 4.997 ( -5.637 -4.322 -5.343) 8.889 5.120 ( 0.780 -1.300 0.358) 1.558 5.176 ( -0.981 -4.756 2.682) 5.547 5.442 ( -4.370 -0.031 -2.742) 5.159 5.614 ( 3.068 -8.783 1.085) 9.367 5.899 ( -1.234 6.981 -1.017) 7.162 6.144 ( -1.199 -2.096 6.241) 6.692 6.174 ( -0.648 2.217 -1.334) 2.668 6.392 ( -3.307 -8.902 -2.226) 9.754 6.556 ( 2.037 2.035 2.460) 3.787 6.897 ( 1.185 -4.145 0.698) 4.367 7.214 ( -1.264 -5.639 -0.503) 5.801 7.354 ( -0.441 -1.743 0.640) 1.908 7.539 ( 1.243 -3.344 -0.199) 3.573 7.681 ( -0.753 5.100 -1.282) 5.313 7.825 ( -0.280 4.024 -0.296) 4.045 7.849 ( 1.345 -3.073 0.774) 3.443 8.133 ( -1.292 6.442 0.999) 6.646 8.329 ( -0.285 -4.987 -0.865) 5.069 8.418 ( -0.742 3.313 -0.376) 3.416 8.657 ( -3.266 -10.660 0.350) 11.155 9.111 ( 3.588 -6.451 -4.507) 8.649 9.223 ( 3.030 -6.999 -6.720) 10.165 9.362 ( -7.151 -7.391 9.474) 13.983 9.943 ( 3.247 6.253 9.863) 12.121 10.023 ( -1.693 4.400 -11.914) 12.813 10.809 ( 4.960 8.428 2.458) 10.083 11.042 ( -1.907 7.274 0.380) 7.529 12.932 ( 4.958 -2.425 -0.789) 5.576 13.036 ( -3.513 -2.487 0.045) 4.304 13.182 ( 1.188 0.891 -0.772) 1.674 13.257 ( -1.787 7.252 -0.576) 7.491 13.357 ( -1.202 2.290 2.550) 3.632 13.687 ( -2.722 0.963 -1.199) 3.127 14.436 ( -0.838 2.469 0.523) 2.659 14.667 ( 1.119 -2.621 -0.342) 2.870 14.744 ( 0.110 -2.893 -0.188) 2.901 14.984 ( 2.278 3.226 0.230) 3.955 15.097 ( 0.098 3.836 -2.592) 4.631 15.109 ( 1.526 -2.714 -0.191) 3.120 15.258 ( -0.817 -0.873 0.752) 1.412 15.652 ( 1.836 -11.018 0.387) 11.176 16.609 ( 3.012 3.830 3.516) 6.009 16.733 ( -4.975 5.513 -2.275) 7.766 17.007 ( 1.992 -3.168 0.524) 3.779 17.555 ( -1.079 -11.092 -0.677) 11.164 18.074 ( 4.375 -7.804 -0.816) 8.984 18.547 ( 1.413 -9.650 -2.136) 9.984 18.621 ( -3.166 -1.904 3.871) 5.351 19.058 ( 0.453 -13.226 -1.662) 13.337 19.521 ( 0.347 7.729 0.032) 7.737 19.934 ( 2.286 5.797 1.160) 6.339 20.130 ( -0.846 -3.927 -1.934) 4.459 20.563 ( 3.886 -5.792 2.398) 7.376 21.002 ( 2.898 2.206 -0.362) 3.660 21.244 ( -1.772 1.195 -0.236) 2.150 21.746 ( -1.689 1.849 -1.357) 2.848 22.185 ( -3.729 -9.184 0.949) 9.958 23.320 ( -0.496 7.707 0.455) 7.736 23.736 ( -1.452 7.874 -0.158) 8.009 24.084 ( 0.779 -7.741 0.012) 7.780 24.502 ( 0.526 -6.011 -0.275) 6.040 ======================= Grid point 36 (21/138) ======================= q-point: ( 0.00 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.588 ( 0.000 24.816 0.000) 24.816 3.031 ( 0.000 7.821 0.000) 7.821 3.075 ( 0.000 5.368 0.000) 5.368 3.316 ( 0.000 27.703 0.000) 27.703 3.606 ( 0.000 2.668 0.000) 2.668 3.767 ( 0.000 8.711 0.000) 8.711 3.868 ( 0.000 -5.933 0.000) 5.933 4.020 ( 0.000 5.799 0.000) 5.799 4.219 ( 0.000 10.709 0.000) 10.709 4.614 ( 0.000 6.490 0.000) 6.490 4.625 ( 0.000 10.136 0.000) 10.136 5.132 ( 0.000 3.710 0.000) 3.710 5.235 ( 0.000 -5.802 0.000) 5.802 5.476 ( 0.000 -8.755 0.000) 8.755 5.885 ( 0.000 16.922 0.000) 16.922 6.181 ( 0.000 3.505 0.000) 3.505 6.301 ( 0.000 5.176 0.000) 5.176 6.607 ( 0.000 3.187 0.000) 3.187 6.731 ( 0.000 -5.475 0.000) 5.475 6.811 ( 0.000 -5.140 0.000) 5.140 6.985 ( 0.000 -10.002 0.000) 10.002 7.024 ( 0.000 -3.862 0.000) 3.862 7.351 ( 0.000 4.454 0.000) 4.454 7.408 ( 0.000 -1.591 0.000) 1.591 7.622 ( 0.000 -3.837 0.000) 3.837 7.773 ( 0.000 -2.666 0.000) 2.666 7.939 ( 0.000 0.268 0.000) 0.268 8.174 ( 0.000 -5.368 0.000) 5.368 8.383 ( 0.000 -1.798 0.000) 1.798 8.632 ( 0.000 -0.608 0.000) 0.608 8.739 ( 0.000 -6.644 0.000) 6.644 8.902 ( 0.000 -9.726 0.000) 9.726 9.191 ( 0.000 12.564 0.000) 12.564 9.284 ( 0.000 1.296 0.000) 1.296 9.851 ( 0.000 -7.289 0.000) 7.289 9.900 ( 0.000 -7.099 0.000) 7.099 10.595 ( 0.000 3.166 0.000) 3.166 10.856 ( 0.000 -2.633 0.000) 2.633 12.872 ( 0.000 1.082 0.000) 1.082 12.901 ( 0.000 1.254 0.000) 1.254 13.010 ( 0.000 5.484 0.000) 5.484 13.451 ( 0.000 0.513 0.000) 0.513 13.656 ( 0.000 -4.198 0.000) 4.198 13.984 ( 0.000 -8.230 0.000) 8.230 14.577 ( 0.000 -1.862 0.000) 1.862 14.579 ( 0.000 -0.405 0.000) 0.405 14.619 ( 0.000 1.883 0.000) 1.883 14.647 ( 0.000 2.337 0.000) 2.337 14.972 ( 0.000 1.308 0.000) 1.308 15.042 ( 0.000 -3.679 0.000) 3.679 15.067 ( 0.000 -9.168 0.000) 9.168 15.209 ( 0.000 -3.780 0.000) 3.780 16.622 ( 0.000 9.818 0.000) 9.818 16.699 ( 0.000 4.805 0.000) 4.805 17.147 ( 0.000 -8.600 0.000) 8.600 17.333 ( 0.000 -8.542 0.000) 8.542 18.099 ( 0.000 5.397 0.000) 5.397 18.224 ( 0.000 1.626 0.000) 1.626 18.799 ( 0.000 -4.615 0.000) 4.615 18.800 ( 0.000 -3.593 0.000) 3.593 19.605 ( 0.000 4.063 0.000) 4.063 19.809 ( 0.000 -3.859 0.000) 3.859 19.840 ( 0.000 -0.896 0.000) 0.896 19.997 ( 0.000 -2.076 0.000) 2.076 20.883 ( 0.000 -1.508 0.000) 1.508 20.902 ( 0.000 -1.996 0.000) 1.996 22.272 ( 0.000 -0.589 0.000) 0.589 22.462 ( 0.000 -6.190 0.000) 6.190 23.572 ( 0.000 8.120 0.000) 8.120 23.900 ( 0.000 -2.842 0.000) 2.842 24.208 ( 0.000 1.584 0.000) 1.584 24.289 ( 0.000 0.028 0.000) 0.028 ======================= Grid point 37 (22/138) ======================= q-point: ( 0.11 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.659 ( 6.476 23.905 -0.972) 24.786 2.932 ( -9.489 17.000 0.181) 19.469 3.075 ( -1.590 10.496 -1.226) 10.686 3.228 ( 0.328 17.368 -3.456) 17.711 3.663 ( 1.039 -4.292 -0.600) 4.456 3.822 ( 2.860 4.259 -2.059) 5.528 3.920 ( 4.485 -7.012 3.726) 9.119 4.079 ( 5.139 1.492 -1.036) 5.451 4.284 ( 8.699 14.302 -4.779) 17.408 4.664 ( 5.716 9.642 0.478) 11.219 4.709 ( 7.242 6.887 3.232) 10.504 5.116 ( -1.178 2.395 1.276) 2.959 5.234 ( -0.262 -4.989 -1.066) 5.108 5.526 ( 4.354 -5.942 -5.164) 8.996 5.839 ( -4.541 14.926 -0.991) 15.633 6.187 ( -0.277 3.470 6.304) 7.202 6.274 ( -2.488 3.311 1.462) 4.392 6.494 ( -10.688 0.900 5.171) 11.907 6.625 ( -8.707 -4.189 0.303) 9.667 6.777 ( -4.046 -2.468 5.334) 7.135 6.925 ( -5.247 -7.004 -2.546) 9.115 7.037 ( 0.426 -8.349 5.039) 9.761 7.364 ( 1.811 -0.449 -0.577) 1.953 7.509 ( -2.435 -5.384 -2.789) 6.534 7.527 ( 2.794 3.127 1.296) 4.390 7.811 ( 1.668 -1.289 0.920) 2.300 7.955 ( 1.931 1.340 -2.721) 3.596 8.182 ( 1.502 -3.634 -3.571) 5.312 8.371 ( -0.892 -2.895 -2.724) 4.074 8.576 ( -6.142 4.251 8.092) 11.012 8.744 ( 2.049 -7.313 -9.127) 11.873 8.945 ( 3.164 -9.658 0.091) 10.163 9.006 ( -9.631 2.533 1.168) 10.027 9.503 ( 11.640 3.337 -3.351) 12.564 9.727 ( -8.137 -6.178 9.070) 13.661 9.971 ( 5.386 -4.498 -13.527) 15.239 10.631 ( 2.611 5.297 8.765) 10.569 10.921 ( 5.542 -2.342 1.065) 6.110 12.849 ( -0.973 2.494 -3.086) 4.085 12.945 ( 3.549 -1.397 -1.256) 4.016 13.038 ( 2.349 5.427 1.102) 6.015 13.449 ( -0.197 1.347 -0.076) 1.363 13.604 ( -5.038 -3.571 2.388) 6.621 13.956 ( -2.743 -7.216 -1.129) 7.802 14.543 ( -1.081 -0.428 0.697) 1.355 14.606 ( -1.104 1.546 -0.009) 1.900 14.632 ( 2.117 -2.021 -0.945) 3.076 14.679 ( 4.190 2.439 -2.694) 5.546 15.004 ( 2.216 1.863 0.268) 2.907 15.049 ( 1.456 -3.854 0.046) 4.120 15.104 ( 2.932 -8.904 1.187) 9.449 15.226 ( 2.060 -3.567 0.116) 4.121 16.615 ( -0.894 8.869 4.788) 10.118 16.730 ( 3.147 4.542 -3.295) 6.433 17.125 ( -2.729 -7.666 3.809) 8.985 17.352 ( 2.171 -9.761 -4.926) 11.147 17.987 ( -6.420 6.198 -3.450) 9.568 18.301 ( 3.507 -0.311 2.766) 4.477 18.783 ( -2.235 -5.860 0.066) 6.272 18.807 ( 0.951 -4.371 2.127) 4.953 19.589 ( 0.151 6.155 -3.468) 7.066 19.838 ( 0.304 0.165 -0.193) 0.396 19.904 ( 7.593 -3.581 3.594) 9.132 20.041 ( 3.869 -3.067 -1.091) 5.056 20.883 ( 0.574 -0.839 -0.689) 1.228 20.948 ( 4.063 -3.044 0.901) 5.156 22.214 ( -5.731 0.448 0.558) 5.775 22.425 ( -3.759 -6.486 0.064) 7.497 23.560 ( -1.253 8.209 1.398) 8.421 23.903 ( 0.444 -3.428 -0.793) 3.546 24.138 ( -5.077 3.837 -1.397) 6.515 24.324 ( 1.977 -2.277 0.171) 3.020 ======================= Grid point 38 (23/138) ======================= q-point: ( 0.22 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.632 ( -9.504 29.573 -5.049) 31.470 2.918 ( 11.030 17.878 -5.781) 21.788 3.072 ( 1.902 3.793 6.069) 7.405 3.292 ( 4.744 7.723 -4.252) 10.012 3.646 ( -4.200 -3.109 2.306) 5.712 3.792 ( -1.199 -0.267 -6.075) 6.198 4.035 ( 4.493 -9.119 0.090) 10.166 4.205 ( 8.578 -5.159 -0.304) 10.015 4.511 ( 13.001 10.163 -3.613) 16.893 4.835 ( 8.749 8.923 5.510) 13.657 4.892 ( 10.289 6.959 3.249) 12.839 5.100 ( -0.907 2.616 1.323) 3.068 5.198 ( -3.476 -6.206 -1.226) 7.218 5.525 ( -4.814 -3.582 -9.719) 11.422 5.749 ( -3.091 9.241 -3.879) 10.488 6.178 ( -7.566 1.748 13.147) 15.269 6.195 ( -3.398 4.009 9.197) 10.593 6.303 ( -4.925 -2.129 -6.357) 8.319 6.481 ( -6.026 0.765 3.550) 7.036 6.673 ( -8.032 -2.698 12.265) 14.907 6.805 ( -4.454 -5.792 -3.030) 7.909 7.070 ( 1.769 -10.009 2.725) 10.523 7.372 ( -1.471 -3.534 1.282) 4.037 7.399 ( -3.051 -3.438 -1.976) 5.003 7.654 ( 5.109 1.310 -1.420) 5.462 7.817 ( -1.086 -0.225 0.218) 1.130 7.996 ( 2.649 5.328 -3.902) 7.115 8.224 ( 3.302 -0.704 -5.961) 6.850 8.324 ( -3.358 -3.960 -0.986) 5.285 8.496 ( -2.175 8.231 7.426) 11.297 8.720 ( -5.606 -9.121 -4.006) 11.431 8.881 ( -0.334 -1.965 -5.664) 6.004 8.998 ( 2.010 -8.417 -1.763) 8.831 9.496 ( -9.453 -10.897 11.935) 18.723 9.785 ( 9.828 5.719 -5.667) 12.705 10.047 ( 5.209 -1.523 -12.253) 13.401 10.731 ( 5.083 8.625 10.511) 14.516 11.037 ( 5.144 -1.093 1.603) 5.497 12.834 ( 0.263 2.257 -2.392) 3.299 13.005 ( 2.420 -4.590 -4.273) 6.722 13.100 ( 3.601 5.947 2.287) 7.319 13.442 ( -0.588 1.865 -0.717) 2.083 13.497 ( -5.766 -0.447 4.266) 7.186 13.874 ( -4.851 -4.619 -2.258) 7.069 14.532 ( -0.642 0.980 2.531) 2.789 14.588 ( -0.022 0.450 -2.485) 2.526 14.660 ( 1.151 -2.514 -0.256) 2.777 14.790 ( 7.160 1.978 -2.826) 7.947 15.026 ( 0.507 -0.292 1.108) 1.253 15.113 ( 3.824 0.621 -2.073) 4.394 15.160 ( 2.195 -7.640 3.308) 8.610 15.301 ( 5.257 -4.927 -0.584) 7.228 16.616 ( -0.196 7.150 5.946) 9.302 16.794 ( 3.949 3.051 -4.197) 6.520 17.060 ( -4.491 -4.348 3.683) 7.255 17.374 ( 0.727 -12.240 -4.860) 13.189 17.894 ( -1.784 4.690 -2.828) 5.760 18.348 ( 0.974 -4.164 1.665) 4.589 18.713 ( -4.585 -5.336 2.735) 7.548 18.838 ( 1.436 -6.158 0.171) 6.326 19.613 ( 2.518 8.023 -3.126) 8.971 19.865 ( 2.609 2.052 0.681) 3.388 20.054 ( 4.906 -3.267 0.046) 5.894 20.146 ( 8.074 -3.805 1.468) 9.046 20.907 ( 2.126 0.409 -0.851) 2.326 21.054 ( 6.057 -4.509 0.953) 7.610 22.065 ( -8.874 2.274 0.244) 9.164 22.316 ( -7.131 -6.853 0.512) 9.903 23.532 ( -1.877 8.386 1.721) 8.765 23.913 ( 0.679 -4.723 -1.242) 4.931 24.032 ( -5.099 5.920 -0.861) 7.861 24.352 ( 0.971 -4.861 -0.446) 4.977 ======================= Grid point 39 (24/138) ======================= q-point: ( 0.33 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.489 ( -1.359 23.873 -10.611) 26.160 3.089 ( -4.488 -1.636 -0.698) 4.828 3.140 ( 7.853 -4.159 8.933) 12.600 3.399 ( 11.017 8.633 -11.598) 18.177 3.578 ( -0.096 6.526 8.733) 10.903 3.803 ( 2.552 0.812 -7.944) 8.383 4.078 ( -0.201 -7.525 1.354) 7.649 4.387 ( 8.508 -10.302 -1.462) 13.441 4.732 ( 8.797 5.290 0.428) 10.274 4.876 ( -6.407 -1.574 3.425) 7.433 5.080 ( 4.219 5.413 0.616) 6.890 5.094 ( -6.925 -2.920 -1.744) 7.715 5.138 ( 6.141 5.105 3.826) 8.855 5.377 ( -4.480 -8.221 -7.113) 11.758 5.644 ( -5.433 7.136 -3.002) 9.458 6.065 ( -3.496 5.852 8.178) 10.646 6.195 ( -2.214 2.441 11.065) 11.546 6.239 ( -0.531 -1.392 -6.680) 6.844 6.337 ( -8.784 -2.630 1.391) 9.274 6.608 ( -0.260 3.572 9.721) 10.360 6.765 ( 0.401 -6.477 -1.154) 6.591 7.099 ( 0.360 -8.483 -0.271) 8.495 7.327 ( -2.681 -3.976 1.508) 5.027 7.382 ( 0.742 -6.243 0.259) 6.292 7.704 ( 0.779 -0.180 -3.798) 3.881 7.790 ( -0.825 -1.374 -0.008) 1.603 8.035 ( 2.057 11.036 -3.353) 11.716 8.219 ( -2.186 -0.155 1.241) 2.519 8.304 ( 0.795 -1.585 -2.118) 2.762 8.495 ( -2.119 7.273 4.091) 8.609 8.575 ( -4.555 -7.991 -0.912) 9.243 8.915 ( 4.039 -4.404 -8.985) 10.791 9.026 ( 1.742 -8.989 -3.816) 9.920 9.335 ( -9.230 -10.567 11.357) 18.051 9.943 ( 6.714 5.187 -0.253) 8.488 10.106 ( 3.138 1.263 -10.929) 11.440 10.862 ( 5.668 9.099 7.056) 12.834 11.115 ( 2.286 0.796 1.312) 2.753 12.850 ( 1.758 0.707 -1.692) 2.540 13.010 ( -0.962 -4.899 -2.738) 5.694 13.178 ( 3.498 4.482 0.913) 5.758 13.406 ( -2.774 -1.720 3.905) 5.089 13.434 ( -1.359 7.458 -0.423) 7.592 13.771 ( -4.699 -1.942 -2.486) 5.660 14.522 ( -0.908 3.382 2.603) 4.363 14.596 ( 1.033 -1.842 -2.735) 3.456 14.679 ( 0.849 -2.194 -0.155) 2.358 14.932 ( 7.302 1.312 -1.960) 7.673 15.044 ( 1.057 0.076 2.686) 2.887 15.155 ( 1.130 1.722 -1.428) 2.506 15.210 ( 1.789 -4.597 0.785) 4.995 15.405 ( 4.859 -6.272 -0.469) 7.948 16.636 ( 0.989 5.221 5.368) 7.553 16.844 ( 1.227 1.111 -5.125) 5.386 16.986 ( -2.786 -0.275 3.224) 4.270 17.356 ( -1.380 -12.852 -2.907) 13.249 17.900 ( 2.298 -0.074 -1.694) 2.856 18.346 ( -1.579 -10.840 -0.052) 10.955 18.649 ( -2.003 -0.114 3.881) 4.369 18.855 ( 0.403 -7.412 -0.975) 7.487 19.650 ( 1.591 7.775 -1.760) 8.129 19.940 ( 4.317 2.375 1.662) 5.200 20.098 ( 0.855 -1.262 -3.198) 3.542 20.329 ( 8.292 -4.903 3.047) 10.103 20.967 ( 4.122 2.012 -0.384) 4.603 21.171 ( 5.019 -4.443 0.351) 6.712 21.892 ( -7.968 2.978 -0.382) 8.515 22.159 ( -8.384 -7.073 0.809) 10.999 23.500 ( -1.601 8.511 1.187) 8.742 23.917 ( -0.335 -1.581 -2.987) 3.396 23.949 ( -2.627 2.502 1.759) 4.032 24.364 ( 0.396 -6.764 -0.591) 6.801 ======================= Grid point 40 (25/138) ======================= q-point: ( 0.44 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.552 ( 9.241 8.746 -8.045) 15.054 2.836 ( -15.068 -4.719 2.269) 15.952 3.373 ( 10.535 -7.988 7.091) 15.002 3.551 ( 1.774 7.886 -3.501) 8.808 3.652 ( 2.200 9.178 1.278) 9.524 3.874 ( 8.578 -4.171 -3.600) 10.195 4.035 ( -4.192 -2.850 -1.844) 5.394 4.436 ( -4.859 -12.656 1.965) 13.699 4.731 ( -0.157 -1.225 1.598) 2.020 4.892 ( -0.560 -3.868 -5.979) 7.143 4.949 ( 0.001 5.739 0.977) 5.822 5.071 ( -4.022 -1.630 2.129) 4.834 5.230 ( 1.748 4.702 0.779) 5.077 5.365 ( 1.580 -6.784 0.204) 6.969 5.598 ( 0.334 6.904 -0.189) 6.914 6.037 ( -0.725 6.848 0.765) 6.928 6.148 ( -2.421 1.646 2.798) 4.049 6.176 ( -3.905 -11.154 -0.031) 11.817 6.273 ( 0.591 7.107 0.141) 7.133 6.655 ( 1.925 6.496 3.612) 7.678 6.782 ( 0.771 -7.637 -0.384) 7.686 7.084 ( -1.039 -7.308 -0.825) 7.427 7.293 ( -0.914 -3.956 0.783) 4.135 7.396 ( 0.232 -8.384 0.556) 8.406 7.696 ( -0.288 -1.515 -1.828) 2.392 7.797 ( 0.977 -2.456 -0.400) 2.673 8.049 ( -0.021 15.034 -0.962) 15.065 8.221 ( 2.145 -0.124 0.668) 2.250 8.280 ( -2.701 -1.394 -0.270) 3.052 8.411 ( -3.463 -0.928 1.363) 3.835 8.571 ( 0.876 2.423 -0.208) 2.585 8.982 ( 3.655 -6.418 -5.087) 8.968 9.054 ( 2.201 -9.856 -5.535) 11.516 9.193 ( -6.872 -10.040 9.363) 15.352 10.048 ( 3.355 4.844 4.107) 7.183 10.115 ( -0.032 4.074 -7.748) 8.753 10.963 ( 2.796 7.387 2.400) 8.255 11.137 ( 0.148 2.690 0.420) 2.727 12.892 ( 2.491 -1.476 -0.791) 3.001 12.966 ( -2.577 -3.784 -0.646) 4.623 13.231 ( 1.526 3.475 0.281) 3.806 13.381 ( -0.733 0.661 1.454) 1.758 13.413 ( -0.501 7.738 -0.008) 7.754 13.696 ( -2.045 -0.342 -1.229) 2.411 14.513 ( -0.349 4.803 0.961) 4.910 14.607 ( 0.418 -3.228 -1.027) 3.413 14.691 ( 0.358 -1.517 -0.087) 1.561 15.035 ( 2.535 -2.632 -2.285) 4.310 15.088 ( 2.759 4.990 4.858) 7.491 15.158 ( -0.513 1.217 -1.996) 2.393 15.221 ( -0.305 -2.703 -0.470) 2.760 15.473 ( 1.888 -6.818 -0.145) 7.076 16.674 ( 1.415 3.324 2.999) 4.695 16.811 ( -2.136 2.416 -2.706) 4.210 16.981 ( 0.628 0.074 0.865) 1.071 17.324 ( -0.953 -12.396 -0.920) 12.466 17.947 ( 1.915 -4.178 -0.530) 4.626 18.300 ( -1.987 -13.508 -0.270) 13.656 18.647 ( 0.319 2.089 1.848) 2.807 18.854 ( -0.108 -7.761 -0.628) 7.787 19.667 ( 0.423 7.473 -0.541) 7.505 20.021 ( 2.941 -1.223 2.189) 3.865 20.088 ( -0.869 3.610 -2.911) 4.718 20.451 ( 3.080 -5.945 1.195) 6.801 21.052 ( 3.502 2.889 0.125) 4.542 21.231 ( 0.948 -2.143 -0.024) 2.343 21.780 ( -2.728 1.969 -0.523) 3.405 22.023 ( -4.528 -7.484 0.553) 8.764 23.479 ( -0.620 8.560 0.401) 8.592 23.886 ( -1.055 7.715 -0.962) 7.846 23.939 ( 0.028 -7.216 0.590) 7.240 24.368 ( 0.110 -7.774 -0.258) 7.779 ======================= Grid point 45 (26/138) ======================= q-point: ( 0.00 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.957 ( 0.000 13.304 0.000) 13.304 3.113 ( 0.000 -2.676 0.000) 2.676 3.250 ( 0.000 13.618 0.000) 13.618 3.470 ( 0.000 -9.523 0.000) 9.523 3.722 ( 0.000 10.732 0.000) 10.732 3.812 ( 0.000 4.718 0.000) 4.718 3.830 ( 0.000 -3.587 0.000) 3.587 3.968 ( 0.000 -7.076 0.000) 7.076 4.507 ( 0.000 12.510 0.000) 12.510 4.682 ( 0.000 -5.136 0.000) 5.136 4.895 ( 0.000 20.647 0.000) 20.647 5.167 ( 0.000 -1.368 0.000) 1.368 5.194 ( 0.000 1.805 0.000) 1.805 5.277 ( 0.000 -12.461 0.000) 12.461 6.218 ( 0.000 15.667 0.000) 15.667 6.257 ( 0.000 4.031 0.000) 4.031 6.346 ( 0.000 -0.431 0.000) 0.431 6.523 ( 0.000 -11.655 0.000) 11.655 6.667 ( 0.000 0.564 0.000) 0.564 6.725 ( 0.000 -3.745 0.000) 3.745 6.883 ( 0.000 0.014 0.000) 0.014 6.937 ( 0.000 -4.370 0.000) 4.370 7.407 ( 0.000 1.255 0.000) 1.255 7.428 ( 0.000 1.008 0.000) 1.008 7.581 ( 0.000 1.787 0.000) 1.787 7.680 ( 0.000 -6.342 0.000) 6.342 7.971 ( 0.000 3.223 0.000) 3.223 8.059 ( 0.000 -5.706 0.000) 5.706 8.422 ( 0.000 4.912 0.000) 4.912 8.542 ( 0.000 -6.729 0.000) 6.729 8.670 ( 0.000 -0.278 0.000) 0.278 8.733 ( 0.000 -6.683 0.000) 6.683 9.381 ( 0.000 6.387 0.000) 6.387 9.400 ( 0.000 6.836 0.000) 6.836 9.719 ( 0.000 -4.570 0.000) 4.570 9.758 ( 0.000 -6.923 0.000) 6.923 10.679 ( 0.000 5.290 0.000) 5.290 10.782 ( 0.000 -4.914 0.000) 4.914 12.885 ( 0.000 0.374 0.000) 0.374 12.894 ( 0.000 -0.652 0.000) 0.652 13.171 ( 0.000 9.726 0.000) 9.726 13.356 ( 0.000 -8.813 0.000) 8.813 13.684 ( 0.000 5.648 0.000) 5.648 13.822 ( 0.000 -8.171 0.000) 8.171 14.568 ( 0.000 0.523 0.000) 0.523 14.577 ( 0.000 -0.119 0.000) 0.119 14.650 ( 0.000 1.151 0.000) 1.151 14.665 ( 0.000 -0.292 0.000) 0.292 14.950 ( 0.000 -2.563 0.000) 2.563 14.959 ( 0.000 -2.462 0.000) 2.462 15.042 ( 0.000 3.773 0.000) 3.773 15.127 ( 0.000 -4.579 0.000) 4.579 16.798 ( 0.000 5.197 0.000) 5.197 16.817 ( 0.000 7.434 0.000) 7.434 17.019 ( 0.000 -2.358 0.000) 2.358 17.144 ( 0.000 -10.650 0.000) 10.650 18.189 ( 0.000 3.835 0.000) 3.835 18.236 ( 0.000 -0.821 0.000) 0.821 18.727 ( 0.000 -1.956 0.000) 1.956 18.736 ( 0.000 -2.519 0.000) 2.519 19.666 ( 0.000 3.017 0.000) 3.017 19.733 ( 0.000 -3.852 0.000) 3.852 19.877 ( 0.000 3.530 0.000) 3.530 19.945 ( 0.000 -3.268 0.000) 3.268 20.867 ( 0.000 -0.154 0.000) 0.154 20.875 ( 0.000 -0.888 0.000) 0.888 22.287 ( 0.000 2.206 0.000) 2.206 22.355 ( 0.000 -4.710 0.000) 4.710 23.714 ( 0.000 6.656 0.000) 6.656 23.826 ( 0.000 -4.871 0.000) 4.871 24.243 ( 0.000 1.947 0.000) 1.947 24.276 ( 0.000 -1.336 0.000) 1.336 ======================= Grid point 46 (27/138) ======================= q-point: ( 0.11 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.995 ( 2.418 10.833 1.874) 11.256 3.117 ( -0.183 0.183 0.556) 0.613 3.246 ( 0.451 14.171 -3.553) 14.617 3.509 ( 3.254 -8.030 0.568) 8.683 3.666 ( -3.481 13.779 -5.718) 15.319 3.766 ( -4.279 -4.489 -2.057) 6.534 3.831 ( -0.046 0.075 9.363) 9.363 3.992 ( 2.009 -8.003 0.223) 8.254 4.564 ( 5.898 12.112 -6.315) 14.878 4.742 ( 5.417 -4.987 -2.039) 7.640 4.949 ( 4.980 16.019 2.551) 16.968 5.142 ( -2.281 -3.234 2.932) 4.925 5.184 ( 0.900 3.939 -3.255) 5.189 5.358 ( 5.620 -11.009 -9.963) 15.876 6.136 ( -6.658 13.927 -1.159) 15.480 6.267 ( -1.627 3.574 10.382) 11.100 6.300 ( -4.079 -0.393 3.590) 5.448 6.427 ( -9.079 -7.640 2.051) 12.042 6.613 ( -5.372 2.659 4.382) 7.425 6.694 ( -2.947 -5.259 3.667) 7.056 6.827 ( -4.679 -0.878 0.424) 4.780 6.894 ( -4.088 -6.283 4.057) 8.524 7.360 ( -2.029 0.769 -2.380) 3.221 7.410 ( -3.403 -4.323 -3.158) 6.344 7.628 ( 4.951 6.328 1.572) 8.187 7.744 ( 4.112 -5.260 1.077) 6.762 8.002 ( 3.439 3.767 -2.427) 5.649 8.091 ( 3.262 -5.096 -2.953) 6.733 8.397 ( -1.974 4.623 -4.410) 6.687 8.519 ( -1.954 -7.165 -2.396) 7.804 8.685 ( 1.843 1.401 -3.348) 4.071 8.773 ( 3.090 -7.280 -0.925) 7.962 9.179 ( -11.894 12.633 10.599) 20.332 9.418 ( -7.622 -10.900 10.966) 17.238 9.739 ( 7.581 5.905 -9.059) 13.206 9.865 ( 7.829 -6.362 -13.038) 16.485 10.743 ( 5.327 6.097 5.268) 9.659 10.851 ( 5.934 -4.836 2.819) 8.158 12.883 ( 0.143 1.311 -2.909) 3.194 12.909 ( 1.537 -1.632 -2.443) 3.316 13.186 ( 1.233 8.859 2.250) 9.223 13.357 ( -0.155 -8.369 1.505) 8.504 13.657 ( -2.423 6.615 0.720) 7.081 13.804 ( -1.744 -8.180 -0.325) 8.370 14.551 ( -0.658 1.418 -0.411) 1.617 14.588 ( 0.255 -2.147 -2.276) 3.139 14.653 ( 0.602 2.703 1.559) 3.178 14.697 ( 3.101 -1.090 -0.114) 3.289 14.976 ( 2.488 -1.638 1.112) 3.180 14.998 ( 2.687 -2.992 -0.222) 4.028 15.064 ( 2.760 3.893 -0.186) 4.776 15.148 ( 2.213 -4.462 0.112) 4.982 16.787 ( -1.378 7.130 4.221) 8.399 16.833 ( 1.751 4.753 -4.124) 6.532 17.007 ( -1.275 -1.885 2.674) 3.511 17.142 ( 0.139 -11.364 -2.909) 11.731 18.118 ( -4.800 7.201 -1.789) 8.837 18.247 ( -0.683 -5.420 0.140) 5.464 18.709 ( -1.640 -0.806 1.897) 2.634 18.738 ( 0.020 -3.031 1.137) 3.237 19.696 ( 3.129 5.129 -2.052) 6.349 19.790 ( 4.511 -4.526 -0.748) 6.434 19.909 ( 3.603 3.116 1.689) 5.054 19.977 ( 3.139 -3.561 -0.043) 4.747 20.881 ( 1.546 0.555 -0.170) 1.652 20.903 ( 2.694 -1.725 0.380) 3.221 22.242 ( -4.572 2.569 0.556) 5.274 22.314 ( -4.123 -4.867 0.206) 6.382 23.705 ( -0.939 6.814 0.659) 6.909 23.821 ( -0.431 -5.167 -0.120) 5.186 24.210 ( -2.734 3.560 -0.960) 4.591 24.273 ( -0.530 -3.004 -0.333) 3.069 ======================= Grid point 47 (28/138) ======================= q-point: ( 0.22 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.963 ( -6.442 8.583 5.493) 12.056 3.104 ( -3.485 -4.623 0.355) 5.800 3.274 ( 2.667 18.852 -3.677) 19.392 3.531 ( -0.407 8.972 -8.676) 12.487 3.635 ( 3.056 -0.671 -4.979) 5.880 3.706 ( -0.509 1.126 4.637) 4.799 3.898 ( 4.617 -4.226 7.513) 9.778 4.029 ( 2.056 -13.262 -1.685) 13.526 4.676 ( 6.246 8.657 -8.834) 13.857 4.836 ( 3.410 -5.777 -3.726) 7.673 5.075 ( 5.279 3.903 5.072) 8.296 5.127 ( -0.326 -2.177 2.587) 3.397 5.183 ( 1.000 9.783 -4.567) 10.842 5.377 ( -1.992 -9.414 -11.158) 14.734 5.986 ( -7.644 13.177 -2.713) 15.474 6.200 ( -7.069 -7.555 -0.416) 10.355 6.235 ( -5.545 2.734 14.858) 16.093 6.264 ( -4.926 0.646 13.540) 14.423 6.523 ( -5.458 3.905 3.660) 7.644 6.621 ( -4.232 -4.712 7.829) 10.070 6.732 ( -3.022 2.084 -1.367) 3.917 6.870 ( 1.280 -9.923 1.164) 10.072 7.316 ( -2.237 -1.237 -0.743) 2.662 7.335 ( -3.035 -2.832 -1.590) 4.445 7.716 ( 2.550 4.244 -0.699) 5.000 7.788 ( -0.236 -2.814 0.011) 2.824 8.082 ( 4.978 4.062 -4.307) 7.735 8.166 ( 5.063 -4.661 -4.929) 8.465 8.336 ( -2.966 4.922 -3.161) 6.559 8.469 ( -2.247 -8.014 -1.297) 8.424 8.702 ( -0.033 4.645 -2.809) 5.428 8.816 ( 1.810 -7.006 -4.008) 8.272 9.012 ( -6.794 11.219 7.594) 15.155 9.262 ( -9.390 -13.236 11.755) 20.039 9.894 ( 9.015 5.522 -8.816) 13.765 9.990 ( 7.566 -4.211 -11.185) 14.145 10.882 ( 6.597 6.836 6.550) 11.539 10.988 ( 6.320 -4.077 3.553) 8.318 12.877 ( 0.078 2.354 -3.165) 3.945 12.930 ( 0.979 -3.225 -3.625) 4.950 13.225 ( 2.019 6.842 2.864) 7.687 13.354 ( -0.549 -6.375 2.961) 7.050 13.611 ( -2.041 7.627 -0.115) 7.896 13.757 ( -2.599 -7.241 -1.308) 7.804 14.544 ( -0.078 1.112 -0.090) 1.118 14.580 ( -0.361 -2.191 -1.976) 2.972 14.682 ( 1.865 4.811 1.157) 5.288 14.780 ( 4.978 -3.916 0.049) 6.334 15.024 ( 1.744 0.511 1.627) 2.440 15.054 ( 3.072 -2.656 1.959) 4.509 15.145 ( 4.776 2.901 -1.562) 5.802 15.219 ( 4.896 -4.180 -0.901) 6.500 16.767 ( -1.484 7.618 3.863) 8.669 16.855 ( 0.969 0.750 -3.370) 3.586 16.989 ( -0.925 0.371 2.706) 2.883 17.135 ( -0.063 -11.720 -3.472) 12.224 18.023 ( -4.049 8.365 -1.914) 9.489 18.202 ( -3.474 -9.636 -0.533) 10.257 18.685 ( -1.126 1.613 2.982) 3.573 18.743 ( 0.112 -4.013 1.497) 4.285 19.758 ( 3.045 6.919 -2.597) 7.993 19.864 ( 3.196 -3.256 -1.040) 4.679 20.024 ( 6.204 1.021 0.881) 6.349 20.075 ( 7.114 -3.518 1.060) 8.006 20.930 ( 3.510 1.931 -0.091) 4.007 20.980 ( 4.876 -3.220 0.465) 5.862 22.118 ( -7.825 3.347 0.578) 8.530 22.199 ( -7.363 -5.191 0.481) 9.021 23.683 ( -1.423 7.257 0.894) 7.449 23.810 ( -0.581 -5.958 -0.177) 5.989 24.145 ( -3.356 5.784 -1.048) 6.769 24.253 ( -1.269 -5.437 -0.741) 5.632 ======================= Grid point 48 (29/138) ======================= q-point: ( 0.33 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.842 ( -5.893 8.598 3.282) 10.928 2.958 ( -9.700 -6.681 3.573) 12.308 3.240 ( -3.810 16.610 -1.650) 17.121 3.570 ( 0.089 -6.741 -6.391) 9.289 3.699 ( 7.953 6.245 -9.140) 13.630 3.768 ( 4.993 6.387 3.275) 8.743 3.997 ( 3.870 -2.944 3.183) 5.812 4.102 ( 5.348 -15.990 -1.075) 16.895 4.745 ( 2.904 0.740 -6.748) 7.384 4.812 ( -4.476 -4.755 -3.632) 7.472 5.112 ( -3.411 1.742 2.019) 4.329 5.126 ( -0.361 0.894 4.545) 4.646 5.249 ( 4.248 3.645 -0.570) 5.627 5.285 ( -2.440 -1.446 -4.340) 5.185 5.833 ( -6.060 11.604 -2.873) 13.403 6.061 ( -5.953 -11.267 -5.204) 13.764 6.175 ( -3.471 4.343 12.130) 13.343 6.227 ( -3.912 -0.626 15.859) 16.346 6.433 ( -2.077 8.044 -0.197) 8.310 6.597 ( -0.245 -8.270 4.007) 9.193 6.736 ( 2.774 7.714 0.399) 8.207 6.917 ( 2.461 -10.022 -0.354) 10.326 7.268 ( -2.453 -1.372 1.209) 3.059 7.288 ( -1.703 -3.231 0.367) 3.670 7.716 ( -1.285 1.594 -3.194) 3.794 7.757 ( -1.625 -2.187 -1.694) 3.208 8.171 ( 4.011 2.659 -2.311) 5.338 8.227 ( 0.576 -3.429 0.194) 3.483 8.290 ( -0.164 7.132 -4.140) 8.248 8.437 ( -0.075 -7.048 -2.763) 7.571 8.682 ( -1.239 9.428 3.270) 10.056 8.840 ( 1.800 -7.324 -5.482) 9.324 8.933 ( -2.686 4.514 0.760) 5.308 9.114 ( -8.037 -11.848 9.106) 16.967 10.037 ( 6.717 4.332 -4.438) 9.142 10.100 ( 5.408 -1.961 -7.961) 9.822 11.010 ( 4.809 6.187 4.790) 9.185 11.097 ( 3.798 -2.720 2.666) 5.379 12.874 ( 0.290 1.932 -2.130) 2.891 12.927 ( -0.514 -3.559 -2.488) 4.373 13.271 ( 1.848 4.810 2.148) 5.583 13.354 ( -0.118 -3.648 3.234) 4.877 13.578 ( -1.197 7.289 -1.245) 7.491 13.702 ( -2.483 -5.232 -1.940) 6.108 14.546 ( 0.188 0.351 0.897) 0.982 14.570 ( -0.233 -1.770 -1.684) 2.454 14.726 ( 2.186 7.037 0.357) 7.377 14.877 ( 4.329 -6.970 0.154) 8.207 15.067 ( 2.239 1.774 2.525) 3.813 15.113 ( 2.279 -3.230 2.404) 4.626 15.225 ( 3.516 4.562 -2.375) 6.230 15.316 ( 4.567 -4.288 -1.364) 6.411 16.751 ( -0.803 6.329 3.002) 7.050 16.847 ( -1.109 -2.462 -1.789) 3.239 16.991 ( 0.585 2.921 0.828) 3.092 17.124 ( -0.412 -10.338 -2.356) 10.611 17.959 ( -1.953 6.141 -1.360) 6.586 18.125 ( -3.726 -10.745 -0.707) 11.394 18.681 ( -0.023 2.708 2.743) 3.855 18.747 ( -0.030 -4.264 1.108) 4.406 19.795 ( 1.320 7.080 -1.844) 7.434 19.913 ( 1.871 -4.683 -0.860) 5.116 20.135 ( 5.023 4.371 -0.232) 6.662 20.231 ( 7.118 -5.247 1.447) 8.961 21.017 ( 5.145 3.167 0.103) 6.043 21.087 ( 5.558 -4.070 0.271) 6.894 21.954 ( -8.223 3.702 0.284) 9.022 22.040 ( -8.393 -5.296 0.540) 9.939 23.658 ( -1.226 7.823 0.696) 7.949 23.799 ( -0.417 -6.937 -0.172) 6.952 24.082 ( -2.619 7.479 -0.683) 7.954 24.226 ( -1.140 -7.432 -0.704) 7.551 ======================= Grid point 49 (30/138) ======================= q-point: ( 0.44 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.756 ( -2.577 8.765 -2.349) 9.433 2.814 ( -4.609 1.480 4.893) 6.883 3.229 ( 3.101 -1.150 3.980) 5.174 3.432 ( -8.526 -16.933 -6.368) 19.999 3.865 ( 3.309 11.178 1.679) 11.777 3.893 ( 9.418 9.404 -8.970) 16.050 4.061 ( 0.737 -2.027 3.343) 3.978 4.164 ( 0.557 -13.469 0.387) 13.486 4.718 ( -2.748 1.835 -1.143) 3.496 4.803 ( 4.022 -5.570 -3.818) 7.860 5.019 ( -3.895 2.381 1.608) 4.840 5.058 ( -5.879 -1.208 3.905) 7.161 5.295 ( 1.533 1.714 0.211) 2.310 5.306 ( 1.810 0.179 -0.983) 2.067 5.764 ( -0.985 9.445 -1.201) 9.572 5.956 ( -3.014 -10.604 -2.365) 11.275 6.151 ( -0.816 4.098 3.026) 5.159 6.184 ( -2.268 0.601 6.091) 6.527 6.431 ( 0.621 8.983 0.136) 9.006 6.611 ( 0.546 -9.462 1.291) 9.566 6.795 ( 2.043 7.601 0.582) 7.892 6.942 ( 0.247 -7.512 -0.730) 7.551 7.236 ( -0.937 -1.179 0.839) 1.725 7.266 ( -0.617 -4.443 0.727) 4.544 7.688 ( -0.620 1.222 -1.599) 2.105 7.739 ( 0.048 -3.485 -1.225) 3.695 8.187 ( -0.259 -0.712 0.646) 0.996 8.210 ( -2.282 -3.088 0.930) 3.951 8.323 ( 3.428 11.127 -3.460) 12.146 8.443 ( 0.058 -0.570 -1.254) 1.379 8.680 ( 0.087 8.377 2.857) 8.852 8.857 ( 1.001 -9.201 -4.141) 10.139 8.906 ( 0.007 -1.192 -1.034) 1.578 8.995 ( -4.904 -9.293 5.117) 11.688 10.127 ( 2.724 3.106 -0.471) 4.158 10.157 ( 1.693 0.225 -3.661) 4.040 11.084 ( 1.772 5.018 1.725) 5.594 11.148 ( 1.110 -1.491 0.943) 2.084 12.881 ( 0.611 0.375 -0.770) 1.052 12.906 ( -0.912 -2.276 -0.734) 2.559 13.302 ( 0.788 3.641 0.861) 3.823 13.361 ( 0.146 -2.313 1.431) 2.723 13.558 ( -0.470 6.761 -0.762) 6.820 13.660 ( -1.121 -3.584 -1.026) 3.893 14.553 ( 0.235 -0.330 1.333) 1.393 14.562 ( -0.213 -1.305 -1.483) 1.987 14.759 ( 0.975 8.436 0.031) 8.492 14.936 ( 1.555 -8.228 0.016) 8.374 15.115 ( 1.542 0.372 1.598) 2.252 15.149 ( 0.831 -2.719 1.046) 3.029 15.266 ( 1.091 6.739 -1.432) 6.975 15.377 ( 1.724 -4.582 -0.614) 4.934 16.749 ( 0.001 4.420 1.406) 4.638 16.818 ( -1.002 -1.875 -0.804) 2.273 17.005 ( 0.515 2.789 0.046) 2.836 17.112 ( -0.324 -8.719 -0.794) 8.761 17.937 ( -0.319 3.262 -0.468) 3.311 18.067 ( -1.698 -9.960 -0.325) 10.109 18.689 ( 0.221 2.401 1.145) 2.670 18.747 ( -0.081 -3.896 0.366) 3.914 19.807 ( 0.338 7.068 -0.649) 7.105 19.934 ( 0.520 -5.926 -0.382) 5.961 20.208 ( 2.086 6.708 -0.105) 7.025 20.333 ( 2.686 -6.288 0.535) 6.859 21.112 ( 3.395 3.262 0.120) 4.710 21.176 ( 2.656 -3.307 0.047) 4.242 21.827 ( -3.825 3.022 -0.003) 4.875 21.903 ( -4.511 -4.992 0.295) 6.734 23.641 ( -0.477 8.223 0.257) 8.240 23.794 ( -0.134 -7.650 -0.079) 7.652 24.044 ( -0.985 8.428 -0.217) 8.488 24.209 ( -0.437 -8.555 -0.283) 8.571 ======================= Grid point 99 (31/138) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.684 ( 5.193 0.000 34.833) 35.218 0.817 ( 7.950 0.000 41.014) 41.777 1.353 ( -15.315 0.000 68.328) 70.024 2.561 ( -3.280 0.000 -25.638) 25.847 2.895 ( -5.364 0.000 -20.160) 20.861 2.975 ( -0.559 0.000 5.610) 5.638 3.370 ( 5.238 0.000 11.840) 12.947 3.875 ( 3.169 0.000 13.390) 13.760 4.145 ( -0.341 0.000 -4.564) 4.576 4.662 ( 1.649 0.000 -15.222) 15.311 4.852 ( 7.149 0.000 -23.628) 24.685 4.930 ( -2.647 0.000 -6.426) 6.950 5.382 ( -7.083 0.000 -2.658) 7.565 5.408 ( 0.962 0.000 -2.296) 2.489 5.594 ( -7.832 0.000 11.337) 13.779 5.916 ( 2.590 0.000 5.038) 5.664 6.028 ( -2.613 0.000 8.325) 8.725 6.281 ( 3.728 0.000 -8.942) 9.688 6.731 ( 9.599 0.000 7.567) 12.223 6.875 ( 3.470 0.000 -3.153) 4.689 7.109 ( -4.001 0.000 -4.379) 5.932 7.276 ( -1.412 0.000 -4.469) 4.687 7.367 ( 1.858 0.000 2.157) 2.847 7.462 ( 1.248 0.000 -2.940) 3.194 7.653 ( 15.289 0.000 -5.111) 16.120 7.807 ( 3.282 0.000 -11.166) 11.639 7.991 ( -3.829 0.000 5.130) 6.401 8.074 ( -1.432 0.000 13.991) 14.064 8.103 ( 18.683 0.000 -5.143) 19.378 8.405 ( 38.628 0.000 3.279) 38.767 8.552 ( -2.621 0.000 2.350) 3.521 9.184 ( -0.103 0.000 11.169) 11.169 9.235 ( 4.476 0.000 -5.763) 7.297 9.524 ( 0.816 0.000 -3.172) 3.275 10.015 ( 9.592 0.000 4.266) 10.498 10.073 ( -2.543 0.000 0.562) 2.605 10.516 ( -4.092 0.000 4.155) 5.831 10.765 ( 2.473 0.000 -2.094) 3.240 12.634 ( 0.753 0.000 1.828) 1.977 12.748 ( -1.348 0.000 -0.460) 1.424 13.234 ( 0.614 0.000 2.148) 2.234 13.330 ( -14.474 0.000 0.507) 14.483 13.782 ( 0.526 0.000 -2.008) 2.076 14.030 ( 0.507 0.000 -12.253) 12.264 14.639 ( -3.463 0.000 7.320) 8.098 14.689 ( 4.729 0.000 3.222) 5.722 14.744 ( -3.088 0.000 1.898) 3.625 14.894 ( 2.663 0.000 -1.534) 3.073 15.195 ( 0.396 0.000 0.392) 0.557 15.271 ( 0.910 0.000 -1.928) 2.132 15.907 ( 4.552 0.000 0.842) 4.629 16.151 ( -56.803 0.000 -5.630) 57.081 16.455 ( -9.196 0.000 3.694) 9.910 16.703 ( 4.100 0.000 -3.573) 5.438 17.452 ( 6.837 0.000 6.333) 9.319 17.731 ( -6.950 0.000 2.729) 7.467 17.832 ( -14.324 0.000 -4.090) 14.896 18.060 ( 13.991 0.000 -3.545) 14.433 18.881 ( 0.737 0.000 -1.075) 1.303 18.904 ( -29.354 0.000 -6.585) 30.084 19.345 ( -33.401 0.000 13.326) 35.962 19.934 ( 4.787 0.000 -5.260) 7.113 20.155 ( -0.625 0.000 1.046) 1.219 20.204 ( 5.982 0.000 -0.536) 6.006 21.202 ( -1.102 0.000 2.067) 2.343 21.375 ( 1.269 0.000 -2.075) 2.433 22.445 ( -5.233 0.000 2.978) 6.021 22.763 ( 28.912 0.000 -6.377) 29.607 23.034 ( 62.407 0.000 5.666) 62.664 23.302 ( -8.382 0.000 -2.582) 8.771 24.133 ( 5.370 0.000 2.321) 5.850 24.299 ( -24.231 0.000 -1.686) 24.290 ======================= Grid point 100 (32/138) ======================= q-point: ( 0.11 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.160 ( 20.883 0.000 33.072) 39.114 1.390 ( 34.702 0.000 29.292) 45.412 1.649 ( 33.680 0.000 42.531) 54.251 2.560 ( 7.777 0.000 -23.120) 24.393 2.792 ( 1.170 0.000 -25.185) 25.212 3.162 ( 15.344 0.000 10.698) 18.705 3.567 ( 11.455 0.000 10.637) 15.632 4.023 ( 8.306 0.000 9.873) 12.902 4.154 ( 1.339 0.000 -2.864) 3.162 4.673 ( 3.882 0.000 -10.363) 11.066 4.903 ( -2.538 0.000 -8.900) 9.255 5.005 ( 13.068 0.000 -36.234) 38.518 5.279 ( -0.668 0.000 0.874) 1.100 5.438 ( 2.822 0.000 2.319) 3.652 5.495 ( -5.446 0.000 9.374) 10.841 5.959 ( -0.087 0.000 6.501) 6.502 6.051 ( 3.469 0.000 3.324) 4.804 6.317 ( 2.626 0.000 -6.944) 7.424 6.779 ( -1.732 0.000 6.258) 6.493 6.796 ( -9.837 0.000 -0.366) 9.844 7.045 ( 0.603 0.000 -6.151) 6.180 7.224 ( -2.454 0.000 -5.042) 5.608 7.381 ( -0.944 0.000 2.711) 2.870 7.504 ( 2.593 0.000 -1.998) 3.273 7.802 ( 0.893 0.000 -6.681) 6.741 7.847 ( 5.850 0.000 -7.378) 9.416 7.897 ( -5.032 0.000 3.588) 6.180 8.066 ( -1.298 0.000 12.146) 12.216 8.181 ( 1.894 0.000 -6.052) 6.342 8.770 ( 19.067 0.000 0.148) 19.067 8.911 ( -0.153 0.000 -5.181) 5.184 9.150 ( -5.519 0.000 12.393) 13.566 9.396 ( -2.204 0.000 -10.117) 10.355 9.790 ( 14.112 0.000 -13.802) 19.739 9.936 ( -10.452 0.000 -1.409) 10.546 10.288 ( 3.183 0.000 3.511) 4.739 10.509 ( 9.085 0.000 -14.491) 17.103 10.818 ( 2.447 0.000 -0.046) 2.448 12.668 ( 2.114 0.000 2.501) 3.275 12.760 ( 5.474 0.000 -4.489) 7.079 13.128 ( -1.020 0.000 3.011) 3.179 13.228 ( -1.967 0.000 3.333) 3.871 13.745 ( -3.619 0.000 -1.568) 3.944 13.963 ( -4.469 0.000 -10.983) 11.858 14.557 ( -4.470 0.000 3.813) 5.875 14.660 ( -5.010 0.000 -1.100) 5.129 14.831 ( 6.455 0.000 6.115) 8.891 14.943 ( 2.323 0.000 0.894) 2.489 14.946 ( -37.631 0.000 33.907) 50.654 15.204 ( 0.574 0.000 0.814) 0.996 15.283 ( -0.012 0.000 -2.044) 2.044 15.991 ( 3.879 0.000 5.569) 6.787 16.395 ( -2.018 0.000 0.729) 2.146 16.765 ( 2.189 0.000 1.184) 2.489 17.332 ( -11.340 0.000 4.342) 12.142 17.528 ( -4.256 0.000 -2.262) 4.820 17.757 ( 11.611 0.000 8.241) 14.238 18.296 ( 7.832 0.000 6.853) 10.407 18.864 ( 7.758 0.000 -14.541) 16.481 18.956 ( 6.843 0.000 0.577) 6.868 19.281 ( 3.211 0.000 6.162) 6.948 19.966 ( -1.501 0.000 -0.334) 1.538 20.221 ( 7.783 0.000 1.148) 7.867 20.303 ( 3.698 0.000 -4.785) 6.047 21.186 ( -0.736 0.000 1.020) 1.258 21.371 ( -1.400 0.000 -0.824) 1.625 22.177 ( -19.617 0.000 -4.341) 20.091 22.772 ( -3.410 0.000 -4.245) 5.445 23.225 ( 0.836 0.000 -7.086) 7.135 23.741 ( -18.811 0.000 14.042) 23.474 24.132 ( 24.251 0.000 -17.559) 29.940 24.264 ( 6.329 0.000 5.417) 8.331 ======================= Grid point 101 (33/138) ======================= q-point: ( 0.22 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.657 ( 24.049 0.000 27.994) 36.906 2.168 ( 36.900 0.000 20.424) 42.175 2.564 ( 45.872 0.000 18.854) 49.595 2.705 ( 10.241 0.000 -17.685) 20.436 2.825 ( 7.432 0.000 -21.818) 23.049 3.550 ( 19.682 0.000 8.684) 21.512 3.805 ( 7.776 0.000 10.100) 12.746 4.162 ( 0.908 0.000 -5.989) 6.057 4.230 ( 10.244 0.000 8.280) 13.172 4.745 ( -10.099 0.000 -11.226) 15.100 4.818 ( 13.501 0.000 -12.993) 18.738 5.114 ( 7.113 0.000 -24.572) 25.581 5.321 ( -5.838 0.000 10.318) 11.855 5.524 ( 3.896 0.000 5.569) 6.796 5.531 ( 16.534 0.000 -10.670) 19.678 5.926 ( -4.897 0.000 5.918) 7.681 6.169 ( 7.719 0.000 -1.711) 7.907 6.360 ( 2.659 0.000 -2.946) 3.969 6.609 ( -8.048 0.000 2.076) 8.311 6.760 ( -1.225 0.000 4.660) 4.819 7.069 ( 2.397 0.000 -4.519) 5.115 7.175 ( -1.374 0.000 -3.486) 3.747 7.351 ( -2.515 0.000 4.822) 5.438 7.531 ( -0.021 0.000 0.823) 0.823 7.758 ( -4.419 0.000 -4.465) 6.282 7.826 ( -3.059 0.000 3.860) 4.925 7.900 ( -0.665 0.000 1.946) 2.056 8.084 ( 0.443 0.000 9.621) 9.631 8.237 ( 6.804 0.000 -8.247) 10.692 8.879 ( 1.162 0.000 -15.073) 15.118 8.939 ( -10.101 0.000 9.225) 13.680 9.268 ( 21.526 0.000 0.227) 21.527 9.288 ( -5.098 0.000 -8.712) 10.094 9.691 ( -13.153 0.000 -1.658) 13.257 9.821 ( -5.253 0.000 -3.641) 6.392 10.213 ( -6.327 0.000 11.656) 13.262 10.519 ( -5.931 0.000 7.345) 9.441 10.841 ( -0.479 0.000 1.339) 1.422 12.729 ( 3.594 0.000 2.389) 4.315 12.896 ( 7.144 0.000 -2.902) 7.711 13.173 ( -4.376 0.000 4.545) 6.309 13.207 ( 6.133 0.000 -14.631) 15.864 13.643 ( -6.428 0.000 -0.358) 6.438 13.827 ( -6.217 0.000 -9.809) 11.613 14.490 ( -2.816 0.000 1.983) 3.444 14.566 ( -3.355 0.000 -3.772) 5.049 14.672 ( -3.027 0.000 9.881) 10.335 14.948 ( 3.743 0.000 5.671) 6.795 14.981 ( 0.915 0.000 2.572) 2.729 15.235 ( 2.517 0.000 2.004) 3.217 15.256 ( -2.026 0.000 -1.447) 2.489 16.086 ( 3.812 0.000 6.461) 7.502 16.362 ( -1.344 0.000 -0.243) 1.365 16.755 ( -4.947 0.000 5.034) 7.058 17.253 ( -0.365 0.000 3.020) 3.042 17.484 ( 3.864 0.000 -11.861) 12.475 18.007 ( 9.786 0.000 9.403) 13.571 18.485 ( 9.611 0.000 8.448) 12.796 18.943 ( 4.156 0.000 -13.128) 13.770 19.129 ( 9.325 0.000 1.647) 9.470 19.349 ( 2.077 0.000 3.028) 3.672 19.904 ( -4.012 0.000 1.448) 4.266 20.334 ( 0.840 0.000 -4.359) 4.439 20.438 ( 12.605 0.000 6.755) 14.301 21.180 ( 0.083 0.000 -0.382) 0.391 21.314 ( -4.610 0.000 0.989) 4.715 21.756 ( -19.196 0.000 -11.385) 22.319 22.678 ( -4.831 0.000 -5.163) 7.071 23.250 ( 2.523 0.000 -7.064) 7.501 23.460 ( -12.083 0.000 15.499) 19.652 24.388 ( 4.815 0.000 5.365) 7.209 24.416 ( 9.741 0.000 -9.027) 13.281 ======================= Grid point 102 (34/138) ======================= q-point: ( 0.33 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.212 ( 25.379 0.000 19.909) 32.256 2.847 ( 8.808 0.000 -6.183) 10.762 2.889 ( 29.161 0.000 10.622) 31.035 2.951 ( 9.801 0.000 -13.206) 16.446 3.428 ( 34.478 0.000 1.556) 34.513 3.857 ( -2.520 0.000 2.772) 3.746 3.875 ( 9.351 0.000 6.286) 11.268 4.178 ( 0.714 0.000 -8.910) 8.938 4.415 ( 3.247 0.000 8.859) 9.435 4.586 ( 3.357 0.000 -8.352) 9.001 5.060 ( 12.859 0.000 -24.041) 27.264 5.159 ( -8.954 0.000 7.923) 11.956 5.320 ( 16.902 0.000 -3.658) 17.293 5.567 ( -1.714 0.000 2.481) 3.015 5.818 ( -5.839 0.000 6.185) 8.505 5.912 ( 19.825 0.000 -11.785) 23.064 6.294 ( 4.280 0.000 -6.956) 8.167 6.384 ( -1.821 0.000 4.236) 4.611 6.517 ( -0.535 0.000 5.912) 5.936 6.736 ( -2.651 0.000 2.389) 3.569 7.090 ( -0.513 0.000 -0.700) 0.868 7.142 ( -1.903 0.000 -0.304) 1.927 7.327 ( -0.619 0.000 4.317) 4.361 7.513 ( -1.731 0.000 5.008) 5.298 7.602 ( -8.686 0.000 0.038) 8.686 7.799 ( -0.386 0.000 2.480) 2.510 7.883 ( -0.854 0.000 2.470) 2.614 8.115 ( 0.176 0.000 8.522) 8.523 8.402 ( 10.891 0.000 -10.963) 15.453 8.687 ( -15.772 0.000 10.102) 18.730 8.881 ( 2.417 0.000 -22.865) 22.992 9.199 ( -1.032 0.000 -8.077) 8.143 9.420 ( -11.178 0.000 0.684) 11.199 9.648 ( -9.839 0.000 -2.743) 10.214 9.723 ( 21.230 0.000 -4.776) 21.761 10.110 ( -7.748 0.000 10.627) 13.152 10.424 ( -4.923 0.000 14.632) 15.438 10.799 ( -4.395 0.000 2.721) 5.169 12.816 ( 4.416 0.000 1.683) 4.726 13.014 ( 5.148 0.000 -1.090) 5.262 13.091 ( -4.322 0.000 4.833) 6.484 13.247 ( 1.547 0.000 -10.988) 11.097 13.494 ( -8.602 0.000 1.278) 8.696 13.692 ( -5.202 0.000 -8.182) 9.696 14.448 ( -1.764 0.000 -0.036) 1.765 14.529 ( 0.948 0.000 -5.907) 5.982 14.724 ( 5.311 0.000 0.753) 5.364 14.982 ( -1.677 0.000 3.604) 3.975 15.007 ( 1.480 0.000 3.788) 4.067 15.212 ( -1.963 0.000 -0.526) 2.032 15.311 ( 4.105 0.000 4.695) 6.237 16.153 ( 1.562 0.000 4.254) 4.532 16.341 ( -0.681 0.000 -0.910) 1.136 16.605 ( -9.523 0.000 -0.315) 9.529 17.280 ( 1.555 0.000 4.702) 4.952 17.620 ( 10.586 0.000 -9.080) 13.947 18.176 ( 5.957 0.000 6.292) 8.665 18.695 ( 8.963 0.000 8.756) 12.530 18.978 ( 2.325 0.000 -12.913) 13.121 19.276 ( 4.526 0.000 -0.634) 4.570 19.383 ( 1.031 0.000 4.603) 4.717 19.838 ( -2.711 0.000 1.687) 3.193 20.331 ( 0.065 0.000 -2.506) 2.507 20.723 ( 13.249 0.000 12.355) 18.116 21.151 ( -12.892 0.000 -3.322) 13.313 21.188 ( 0.943 0.000 -1.460) 1.738 21.461 ( -6.527 0.000 -7.601) 10.019 22.567 ( -4.863 0.000 -6.423) 8.056 23.283 ( 2.332 0.000 -5.639) 6.102 23.305 ( -7.263 0.000 9.877) 12.260 24.471 ( 2.440 0.000 3.973) 4.662 24.536 ( 4.668 0.000 -3.849) 6.051 ======================= Grid point 103 (35/138) ======================= q-point: ( 0.44 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.655 ( 11.363 0.000 15.362) 19.108 2.955 ( 4.924 0.000 -5.020) 7.032 3.138 ( 11.585 0.000 -5.635) 12.882 3.306 ( 4.119 0.000 8.892) 9.800 3.642 ( -4.820 0.000 -14.590) 15.366 3.863 ( 7.016 0.000 -6.800) 9.771 4.099 ( -5.290 0.000 -4.801) 7.144 4.115 ( 10.766 0.000 10.583) 15.097 4.477 ( 2.330 0.000 0.092) 2.332 4.812 ( 14.112 0.000 5.792) 15.254 5.006 ( -7.236 0.000 5.040) 8.818 5.231 ( 9.871 0.000 -25.854) 27.674 5.471 ( -4.672 0.000 -4.416) 6.429 5.702 ( 19.466 0.000 1.708) 19.541 5.769 ( -1.675 0.000 6.491) 6.703 6.004 ( -8.127 0.000 -4.396) 9.240 6.215 ( -17.559 0.000 11.862) 21.190 6.445 ( 11.651 0.000 -5.231) 12.772 6.594 ( 4.596 0.000 4.162) 6.200 6.693 ( -0.518 0.000 -0.057) 0.521 7.045 ( -3.458 0.000 3.480) 4.905 7.115 ( -0.209 0.000 2.093) 2.103 7.317 ( -1.925 0.000 -1.588) 2.496 7.490 ( -2.681 0.000 -2.559) 3.706 7.530 ( 2.486 0.000 9.800) 10.110 7.822 ( 2.087 0.000 2.058) 2.931 7.869 ( -1.255 0.000 0.590) 1.387 8.104 ( -3.644 0.000 8.225) 8.996 8.427 ( -10.809 0.000 7.853) 13.361 8.577 ( 8.796 0.000 -12.527) 15.306 8.853 ( 0.023 0.000 -21.224) 21.224 9.224 ( 4.772 0.000 -7.895) 9.225 9.260 ( -3.971 0.000 2.504) 4.694 9.473 ( -5.899 0.000 -5.607) 8.139 9.941 ( -11.132 0.000 7.697) 13.534 10.090 ( 16.318 0.000 -5.029) 17.076 10.404 ( -1.028 0.000 16.089) 16.122 10.681 ( -8.189 0.000 4.213) 9.209 12.878 ( 0.405 0.000 1.985) 2.026 13.070 ( 2.511 0.000 2.676) 3.670 13.085 ( 2.413 0.000 -1.871) 3.054 13.256 ( 1.698 0.000 -6.650) 6.864 13.321 ( -8.936 0.000 2.353) 9.241 13.596 ( -2.353 0.000 -5.238) 5.742 14.421 ( -0.829 0.000 -1.399) 1.626 14.573 ( 4.596 0.000 -7.081) 8.442 14.838 ( 5.332 0.000 0.615) 5.368 14.930 ( -4.323 0.000 4.182) 6.015 15.039 ( 1.441 0.000 2.200) 2.630 15.183 ( -0.843 0.000 -0.152) 0.857 15.410 ( 4.353 0.000 8.998) 9.995 16.156 ( -2.401 0.000 0.483) 2.449 16.331 ( -0.042 0.000 -1.309) 1.310 16.433 ( -5.848 0.000 -6.053) 8.417 17.317 ( 0.570 0.000 6.395) 6.420 17.791 ( 7.127 0.000 -5.111) 8.771 18.275 ( 2.376 0.000 5.292) 5.801 18.812 ( -1.558 0.000 6.275) 6.465 18.999 ( 4.662 0.000 -11.715) 12.609 19.308 ( 0.072 0.000 -2.953) 2.954 19.433 ( 2.893 0.000 7.979) 8.487 19.799 ( -2.037 0.000 0.013) 2.037 20.341 ( 1.589 0.000 0.098) 1.592 20.846 ( -14.472 0.000 -8.360) 16.714 20.970 ( 7.813 0.000 8.707) 11.698 21.208 ( 1.304 0.000 -1.642) 2.097 21.452 ( 5.201 0.000 5.052) 7.251 22.463 ( -3.930 0.000 -9.363) 10.154 23.198 ( -5.636 0.000 5.051) 7.568 23.322 ( 2.794 0.000 -3.465) 4.451 24.500 ( -0.300 0.000 2.514) 2.532 24.596 ( 2.132 0.000 -1.526) 2.622 ======================= Grid point 104 (36/138) ======================= q-point: (-0.44 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.591 ( -18.774 0.000 10.424) 21.474 2.967 ( -9.546 0.000 -2.938) 9.988 3.174 ( -7.504 0.000 0.941) 7.563 3.339 ( 6.640 0.000 3.830) 7.665 3.620 ( 5.432 0.000 -6.581) 8.533 3.807 ( -9.955 0.000 -10.187) 14.244 4.140 ( -9.372 0.000 4.589) 10.436 4.226 ( 13.474 0.000 2.125) 13.641 4.409 ( -9.719 0.000 -10.036) 13.970 4.882 ( -6.221 0.000 -1.384) 6.373 4.951 ( -4.731 0.000 21.895) 22.400 5.290 ( 0.237 0.000 -21.340) 21.341 5.531 ( 11.783 0.000 -9.883) 15.379 5.634 ( -14.069 0.000 1.817) 14.185 5.784 ( -9.268 0.000 -2.740) 9.664 5.989 ( -1.344 0.000 5.514) 5.676 6.059 ( 14.830 0.000 1.067) 14.868 6.500 ( -5.004 0.000 4.224) 6.549 6.668 ( -0.704 0.000 3.285) 3.359 6.694 ( -0.536 0.000 -0.398) 0.667 6.991 ( -3.042 0.000 4.313) 5.278 7.160 ( 4.353 0.000 4.342) 6.149 7.253 ( -3.012 0.000 -1.658) 3.438 7.447 ( -1.448 0.000 -4.675) 4.894 7.625 ( 3.170 0.000 10.666) 11.127 7.833 ( -2.153 0.000 -1.329) 2.530 7.882 ( 3.021 0.000 4.333) 5.282 8.025 ( -5.060 0.000 4.423) 6.721 8.360 ( 3.703 0.000 4.626) 5.926 8.671 ( 3.833 0.000 -17.693) 18.103 8.792 ( -2.392 0.000 -13.205) 13.420 9.298 ( 6.691 0.000 3.837) 7.713 9.314 ( 5.459 0.000 -9.952) 11.351 9.421 ( 2.355 0.000 -5.577) 6.054 9.729 ( -11.186 0.000 4.974) 12.242 10.284 ( -0.902 0.000 2.845) 2.985 10.441 ( 0.958 0.000 15.351) 15.380 10.543 ( -1.911 0.000 -0.417) 1.956 12.856 ( -2.349 0.000 1.406) 2.737 13.096 ( -1.720 0.000 -1.779) 2.474 13.125 ( -3.516 0.000 5.231) 6.303 13.235 ( 5.422 0.000 -2.099) 5.814 13.282 ( 3.092 0.000 -4.673) 5.603 13.602 ( 4.154 0.000 -4.247) 5.941 14.409 ( 0.078 0.000 -2.670) 2.672 14.657 ( 4.879 0.000 -6.747) 8.326 14.848 ( -4.266 0.000 3.656) 5.618 14.916 ( 1.791 0.000 3.684) 4.096 15.079 ( 2.325 0.000 0.257) 2.339 15.179 ( 0.556 0.000 -0.119) 0.568 15.533 ( 5.574 0.000 17.074) 17.961 16.051 ( -6.828 0.000 -6.557) 9.466 16.335 ( 0.736 0.000 -1.208) 1.414 16.377 ( 1.087 0.000 -5.939) 6.037 17.320 ( -1.907 0.000 6.222) 6.508 17.857 ( 0.796 0.000 -4.928) 4.992 18.269 ( -4.849 0.000 7.418) 8.862 18.679 ( -10.161 0.000 -2.066) 10.368 19.090 ( 4.512 0.000 -3.386) 5.641 19.298 ( -0.415 0.000 -3.814) 3.837 19.528 ( 4.327 0.000 10.295) 11.168 19.743 ( -2.963 0.000 -2.627) 3.960 20.403 ( 4.364 0.000 3.636) 5.681 20.570 ( -11.016 0.000 -8.363) 13.830 21.084 ( 3.554 0.000 2.565) 4.383 21.228 ( 0.957 0.000 -0.879) 1.299 21.652 ( 11.459 0.000 12.914) 17.265 22.366 ( -3.332 0.000 -15.596) 15.948 23.100 ( -5.220 0.000 2.119) 5.634 23.380 ( 3.644 0.000 -0.749) 3.720 24.468 ( -3.440 0.000 1.228) 3.653 24.619 ( 0.558 0.000 -0.409) 0.692 ======================= Grid point 105 (37/138) ======================= q-point: (-0.33 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.126 ( -28.442 0.000 12.471) 31.056 2.484 ( -32.540 0.000 -1.966) 32.600 3.176 ( 1.890 0.000 0.778) 2.044 3.334 ( -15.232 0.000 9.999) 18.221 3.565 ( -12.168 0.000 -8.923) 15.089 3.635 ( -4.241 0.000 9.674) 10.563 3.837 ( -19.626 0.000 4.410) 20.116 4.039 ( -21.941 0.000 -10.672) 24.398 4.390 ( 0.742 0.000 1.973) 2.108 4.765 ( -2.853 0.000 -14.074) 14.360 4.945 ( 4.445 0.000 6.285) 7.698 5.154 ( -8.300 0.000 -11.924) 14.528 5.394 ( -7.994 0.000 -0.118) 7.995 5.652 ( -4.423 0.000 -0.915) 4.517 5.743 ( 7.490 0.000 -2.102) 7.779 6.066 ( 6.674 0.000 -7.486) 10.029 6.267 ( 0.575 0.000 -1.775) 1.866 6.378 ( -1.229 0.000 2.308) 2.615 6.540 ( -12.725 0.000 14.612) 19.376 6.661 ( -1.993 0.000 -1.098) 2.276 6.974 ( 1.674 0.000 -1.094) 1.999 7.221 ( 0.058 0.000 0.497) 0.500 7.291 ( 5.806 0.000 5.555) 8.035 7.417 ( 1.255 0.000 -7.235) 7.343 7.650 ( -3.477 0.000 9.938) 10.529 7.788 ( -1.657 0.000 -3.035) 3.458 7.929 ( -0.465 0.000 8.101) 8.115 7.975 ( 1.018 0.000 0.873) 1.342 8.573 ( 14.552 0.000 3.978) 15.086 8.635 ( -2.921 0.000 -24.574) 24.747 8.691 ( -5.720 0.000 -7.724) 9.611 9.387 ( 4.896 0.000 -11.345) 12.356 9.465 ( -2.997 0.000 -0.680) 3.073 9.497 ( 10.871 0.000 3.482) 11.416 9.594 ( 1.565 0.000 1.589) 2.230 10.041 ( -20.337 0.000 12.270) 23.752 10.502 ( 1.583 0.000 13.742) 13.832 10.628 ( 6.550 0.000 -5.785) 8.739 12.785 ( -5.006 0.000 0.248) 5.012 13.006 ( -6.042 0.000 -1.284) 6.177 13.081 ( 0.051 0.000 4.209) 4.210 13.374 ( 6.343 0.000 -3.493) 7.241 13.405 ( 10.113 0.000 -2.759) 10.482 13.717 ( 7.992 0.000 -5.836) 9.896 14.415 ( 1.340 0.000 -3.101) 3.378 14.711 ( 1.364 0.000 -1.340) 1.912 14.806 ( 0.042 0.000 -1.311) 1.312 14.923 ( -2.047 0.000 5.306) 5.687 15.126 ( 2.238 0.000 -0.597) 2.316 15.207 ( 2.370 0.000 -0.216) 2.379 15.731 ( 10.046 0.000 29.728) 31.380 15.894 ( -6.403 0.000 -10.629) 12.409 16.355 ( 1.568 0.000 -0.569) 1.668 16.422 ( 4.343 0.000 -5.745) 7.202 17.262 ( -5.258 0.000 3.010) 6.058 17.801 ( -5.083 0.000 -8.335) 9.763 18.134 ( -9.804 0.000 11.575) 15.169 18.455 ( -11.071 0.000 -3.026) 11.476 19.141 ( 1.109 0.000 0.025) 1.109 19.232 ( -6.190 0.000 -3.539) 7.130 19.643 ( 4.886 0.000 11.255) 12.270 19.713 ( 1.548 0.000 -4.763) 5.008 20.380 ( -6.837 0.000 -5.376) 8.698 20.529 ( 7.104 0.000 8.893) 11.382 21.160 ( 4.270 0.000 -0.481) 4.297 21.239 ( 0.185 0.000 0.423) 0.462 21.918 ( 12.080 0.000 13.180) 17.878 22.236 ( -5.882 0.000 -27.297) 27.923 23.006 ( -4.514 0.000 1.697) 4.822 23.458 ( 3.856 0.000 2.538) 4.616 24.368 ( -6.824 0.000 -0.349) 6.833 24.620 ( -0.293 0.000 0.076) 0.303 ======================= Grid point 106 (38/138) ======================= q-point: (-0.22 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.576 ( -30.456 0.000 17.480) 35.116 1.774 ( -38.529 0.000 4.729) 38.818 2.685 ( -47.655 0.000 28.531) 55.543 3.120 ( -9.581 0.000 -17.229) 19.713 3.340 ( -6.892 0.000 8.476) 10.924 3.433 ( -21.269 0.000 5.245) 21.906 3.509 ( -14.887 0.000 -6.710) 16.329 3.757 ( -1.831 0.000 6.200) 6.464 4.308 ( -6.172 0.000 -1.674) 6.395 4.703 ( 0.059 0.000 -24.978) 24.978 4.971 ( -7.571 0.000 -4.882) 9.008 5.081 ( 6.161 0.000 -15.184) 16.386 5.297 ( -1.659 0.000 8.332) 8.495 5.577 ( -3.585 0.000 1.652) 3.947 5.826 ( 2.054 0.000 0.807) 2.207 6.065 ( -14.155 0.000 2.527) 14.378 6.168 ( 5.474 0.000 -12.582) 13.721 6.295 ( -12.713 0.000 14.037) 18.938 6.535 ( 9.539 0.000 0.909) 9.583 6.634 ( -0.668 0.000 0.032) 0.668 7.039 ( 5.030 0.000 -5.131) 7.185 7.251 ( 2.333 0.000 1.733) 2.907 7.323 ( -0.707 0.000 -1.632) 1.779 7.529 ( 8.768 0.000 -7.157) 11.318 7.566 ( -5.486 0.000 5.150) 7.524 7.760 ( -0.242 0.000 -4.708) 4.714 7.953 ( 1.555 0.000 4.196) 4.475 8.012 ( 0.557 0.000 9.945) 9.960 8.422 ( -12.661 0.000 -38.676) 40.696 8.527 ( -9.723 0.000 3.101) 10.206 8.865 ( 12.470 0.000 5.874) 13.784 9.358 ( -4.780 0.000 -1.215) 4.932 9.459 ( 4.237 0.000 -7.430) 8.553 9.467 ( -24.091 0.000 8.575) 25.571 9.718 ( 7.384 0.000 1.240) 7.488 9.843 ( 6.881 0.000 7.211) 9.967 10.554 ( 0.484 0.000 11.612) 11.622 10.713 ( 3.205 0.000 -5.174) 6.086 12.688 ( -4.193 0.000 0.174) 4.196 12.883 ( -5.773 0.000 -0.311) 5.781 13.130 ( 3.275 0.000 2.328) 4.018 13.478 ( 4.416 0.000 -4.925) 6.615 13.591 ( 8.896 0.000 -2.381) 9.209 13.870 ( 8.624 0.000 -8.176) 11.883 14.453 ( 3.244 0.000 -1.332) 3.507 14.735 ( 1.349 0.000 3.862) 4.091 14.818 ( 1.367 0.000 -5.144) 5.322 14.864 ( -5.008 0.000 5.646) 7.547 15.161 ( 1.449 0.000 -0.428) 1.511 15.262 ( 2.544 0.000 -0.410) 2.577 15.780 ( -1.773 0.000 -10.584) 10.731 16.106 ( 20.638 0.000 42.013) 46.808 16.398 ( 3.228 0.000 2.992) 4.401 16.511 ( 5.881 0.000 -5.897) 8.328 17.122 ( -8.883 0.000 -3.362) 9.498 17.622 ( -10.110 0.000 -9.291) 13.731 17.982 ( -8.125 0.000 13.128) 15.439 18.259 ( -7.968 0.000 -0.702) 7.999 19.068 ( -8.402 0.000 -2.698) 8.825 19.141 ( -0.970 0.000 1.335) 1.650 19.768 ( 4.515 0.000 -6.281) 7.736 19.776 ( 6.221 0.000 11.970) 13.490 20.264 ( -4.298 0.000 -2.272) 4.861 20.740 ( 12.217 0.000 18.415) 22.099 21.239 ( -0.395 0.000 1.913) 1.953 21.249 ( 4.864 0.000 -1.993) 5.257 21.949 ( -17.229 0.000 -45.935) 49.059 22.177 ( 11.238 0.000 10.440) 15.340 22.937 ( -2.964 0.000 2.767) 4.055 23.528 ( 1.407 0.000 6.393) 6.546 24.208 ( -8.368 0.000 -2.904) 8.857 24.610 ( -0.726 0.000 -0.513) 0.890 ======================= Grid point 107 (39/138) ======================= q-point: (-0.11 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.007 ( -31.207 0.000 21.036) 37.635 1.061 ( -33.438 0.000 20.974) 39.472 1.826 ( -43.980 0.000 52.367) 68.385 2.799 ( -13.881 0.000 -24.366) 28.043 3.071 ( -14.633 0.000 5.801) 15.741 3.179 ( -13.654 0.000 -18.055) 22.636 3.305 ( -0.904 0.000 13.032) 13.063 3.806 ( 1.977 0.000 14.876) 15.007 4.199 ( -3.880 0.000 -4.323) 5.809 4.662 ( 2.491 0.000 -28.132) 28.242 4.852 ( -2.989 0.000 -5.647) 6.389 5.057 ( -3.155 0.000 -14.643) 14.979 5.365 ( 4.179 0.000 1.042) 4.307 5.503 ( -4.626 0.000 0.632) 4.669 5.789 ( -13.805 0.000 6.632) 15.315 5.861 ( 1.779 0.000 2.356) 2.953 6.114 ( -8.404 0.000 12.898) 15.394 6.222 ( 3.134 0.000 -11.325) 11.751 6.611 ( -2.019 0.000 2.172) 2.966 6.734 ( 10.064 0.000 -2.568) 10.387 7.120 ( 3.531 0.000 -5.617) 6.635 7.309 ( -0.151 0.000 -4.639) 4.642 7.310 ( 2.950 0.000 2.528) 3.885 7.486 ( -2.973 0.000 0.244) 2.983 7.624 ( -0.788 0.000 -13.353) 13.376 7.759 ( 1.884 0.000 -10.258) 10.430 7.993 ( -16.022 0.000 -20.338) 25.891 7.998 ( 1.875 0.000 1.293) 2.277 8.040 ( -0.447 0.000 17.456) 17.462 8.352 ( -7.987 0.000 4.870) 9.354 8.884 ( -24.670 0.000 5.959) 25.380 9.110 ( 3.113 0.000 9.746) 10.231 9.276 ( -3.605 0.000 -1.104) 3.770 9.511 ( 2.175 0.000 -4.251) 4.775 9.861 ( 6.768 0.000 2.753) 7.307 10.022 ( 6.810 0.000 3.314) 7.574 10.564 ( -1.960 0.000 8.685) 8.903 10.740 ( 1.158 0.000 -4.137) 4.296 12.635 ( -1.310 0.000 0.787) 1.528 12.791 ( -3.362 0.000 0.247) 3.371 13.197 ( 2.668 0.000 1.640) 3.132 13.498 ( -1.907 0.000 -6.927) 7.185 13.729 ( 5.316 0.000 -2.040) 5.694 13.995 ( 5.680 0.000 -11.133) 12.498 14.541 ( 5.417 0.000 2.941) 6.164 14.762 ( -6.329 0.000 5.325) 8.271 14.766 ( 0.036 0.000 4.533) 4.533 14.844 ( 2.730 0.000 -4.278) 5.075 15.183 ( 0.855 0.000 -0.009) 0.855 15.277 ( -0.547 0.000 -1.717) 1.802 15.803 ( 5.421 0.000 -5.446) 7.685 16.386 ( 1.562 0.000 -1.292) 2.028 16.616 ( 5.744 0.000 -5.406) 7.888 16.864 ( -1.004 0.000 -1.990) 2.229 16.951 ( 33.913 0.000 38.178) 51.065 17.433 ( -5.485 0.000 -3.307) 6.405 17.861 ( -7.199 0.000 9.312) 11.771 18.144 ( -4.073 0.000 0.889) 4.169 18.927 ( -4.857 0.000 -1.896) 5.214 19.115 ( -1.996 0.000 0.145) 2.001 19.847 ( 5.025 0.000 -7.087) 8.687 19.948 ( 8.047 0.000 7.765) 11.182 20.193 ( -2.859 0.000 0.143) 2.863 20.989 ( -30.956 0.000 -37.873) 48.914 21.238 ( -8.012 0.000 -3.752) 8.847 21.331 ( 3.677 0.000 -2.486) 4.438 21.412 ( 20.919 0.000 18.328) 27.812 22.390 ( 7.576 0.000 6.760) 10.154 22.898 ( -1.746 0.000 2.807) 3.306 23.491 ( -7.751 0.000 6.235) 9.947 24.084 ( -1.651 0.000 -3.218) 3.617 24.570 ( -4.246 0.000 -4.662) 6.306 ======================= Grid point 108 (40/138) ======================= q-point: ( 0.00 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.831 ( -19.914 23.362 20.429) 36.874 1.176 ( 0.185 31.543 27.881) 42.100 1.823 ( 1.298 36.764 49.566) 61.726 2.559 ( 0.788 0.950 -22.943) 22.976 2.987 ( -6.690 9.319 -17.906) 21.266 3.132 ( -0.384 15.248 3.389) 15.625 3.349 ( 4.969 -2.495 11.695) 12.949 3.869 ( 3.438 0.027 9.558) 10.158 4.180 ( 0.328 2.723 -2.342) 3.607 4.619 ( 3.107 -4.455 -18.198) 18.992 4.728 ( -0.756 -8.826 -7.963) 11.911 5.015 ( 2.238 4.959 -10.204) 11.564 5.355 ( -2.074 0.540 -2.387) 3.208 5.445 ( -1.136 0.377 1.074) 1.608 5.648 ( -8.177 2.876 7.822) 11.675 5.939 ( 2.071 3.425 1.637) 4.325 6.069 ( -2.519 4.431 3.721) 6.310 6.289 ( 3.373 0.982 -9.425) 10.059 6.707 ( 4.708 1.952 11.032) 12.152 6.895 ( 4.723 -0.395 -3.883) 6.127 7.041 ( -5.680 -5.979 -0.714) 8.278 7.328 ( 0.846 1.135 -5.135) 5.327 7.459 ( 1.136 -1.203 -3.535) 3.903 7.518 ( -6.366 4.387 -6.598) 10.164 7.748 ( -0.003 -4.324 -9.814) 10.725 7.848 ( -0.950 9.536 -11.995) 15.353 7.927 ( 7.934 -1.505 6.402) 10.306 8.056 ( 1.845 0.170 2.479) 3.094 8.224 ( 1.905 4.897 2.617) 5.870 8.494 ( -2.524 7.961 9.021) 12.293 8.876 ( 15.616 17.323 -11.439) 25.977 9.088 ( -1.094 -7.507 6.783) 10.176 9.422 ( 18.333 13.864 -13.044) 26.428 9.467 ( -0.810 -2.348 -6.408) 6.872 9.960 ( 11.546 -4.697 1.469) 12.551 10.029 ( 1.541 -4.068 -4.542) 6.289 10.499 ( -2.150 -1.350 4.132) 4.850 10.806 ( 0.997 3.075 -2.501) 4.088 12.654 ( 0.668 2.068 1.628) 2.715 12.756 ( -1.086 0.981 -0.398) 1.517 13.207 ( -5.551 -2.474 4.900) 7.806 13.331 ( -4.868 0.485 1.185) 5.033 13.811 ( 1.011 1.619 -5.813) 6.118 14.034 ( 0.227 0.326 -12.354) 12.360 14.614 ( -3.135 -2.128 6.166) 7.237 14.663 ( 4.073 -2.234 2.417) 5.237 14.754 ( -2.855 0.525 3.329) 4.417 14.902 ( 2.777 0.498 -1.020) 3.000 15.184 ( 0.004 -1.323 -0.154) 1.332 15.245 ( -4.140 -4.560 1.994) 6.474 15.548 ( -34.106 -32.589 25.902) 53.816 15.801 ( 4.693 -10.191 0.686) 11.240 16.484 ( -3.390 3.374 2.666) 5.476 16.726 ( 6.026 -6.042 -1.554) 8.673 17.401 ( -10.190 0.343 0.098) 10.197 17.684 ( -5.184 -3.634 -0.743) 6.375 17.787 ( 3.143 -1.655 4.928) 6.074 18.087 ( 12.689 2.196 -2.674) 13.153 18.846 ( -2.195 0.249 -1.001) 2.426 19.011 ( -21.113 3.133 -3.618) 21.648 19.296 ( -7.311 0.040 14.358) 16.112 19.959 ( 3.945 1.498 -4.964) 6.515 20.039 ( 6.422 -4.653 4.327) 9.034 20.230 ( -3.068 -3.381 -4.336) 6.296 21.133 ( 2.194 -6.447 2.048) 7.112 21.174 ( 4.224 -9.191 4.170) 10.941 22.429 ( -4.583 -1.599 2.926) 5.667 22.744 ( 7.959 -2.957 -5.335) 10.027 23.113 ( 13.015 7.344 5.214) 15.828 23.649 ( 12.743 17.845 -18.074) 28.417 24.144 ( 6.376 1.094 1.626) 6.671 24.250 ( -17.383 -3.476 0.406) 17.732 ======================= Grid point 109 (41/138) ======================= q-point: ( 0.11 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.928 ( 26.257 -11.427 29.593) 41.180 1.361 ( 12.758 18.399 32.050) 39.096 2.318 ( 32.196 38.272 23.882) 55.423 2.628 ( 9.967 7.969 -14.653) 19.431 2.865 ( 0.012 7.852 -24.398) 25.630 3.300 ( 14.115 13.567 9.158) 21.614 3.537 ( 10.589 -3.208 12.551) 16.731 3.990 ( 7.001 -1.937 1.014) 7.335 4.209 ( 2.179 3.905 3.906) 5.937 4.612 ( 0.520 -7.072 -11.974) 13.916 4.763 ( 5.068 -6.689 -12.212) 14.818 5.114 ( 10.485 5.706 -20.236) 23.494 5.324 ( 0.219 3.049 -0.307) 3.072 5.436 ( -0.035 -0.114 1.282) 1.287 5.498 ( -8.145 0.219 8.552) 11.812 5.997 ( 2.569 3.139 3.670) 5.470 6.060 ( 0.896 3.080 -0.605) 3.264 6.348 ( 4.548 1.018 -6.678) 8.143 6.755 ( -2.567 2.368 10.179) 10.762 6.823 ( -11.298 -0.251 -0.748) 11.326 6.970 ( 1.571 -5.440 -5.041) 7.581 7.290 ( -2.658 4.178 -4.067) 6.408 7.418 ( -2.210 2.534 -2.872) 4.422 7.492 ( 2.110 -1.198 -1.065) 2.650 7.725 ( 0.502 -4.959 -3.541) 6.115 7.868 ( 2.968 0.749 -5.171) 6.009 7.979 ( -1.640 2.101 9.834) 10.189 8.050 ( -1.396 3.556 -2.808) 4.741 8.211 ( -1.126 2.261 -0.734) 2.631 8.738 ( 19.130 -1.307 0.602) 19.184 8.932 ( -1.740 0.357 -4.786) 5.105 9.062 ( -4.090 -6.885 10.418) 13.140 9.397 ( -4.419 -3.240 -6.669) 8.631 9.709 ( 3.538 -4.553 -3.693) 6.847 9.929 ( -5.960 -3.453 -4.021) 7.976 10.276 ( 1.265 -1.156 4.979) 5.265 10.542 ( 10.370 2.196 -16.348) 19.484 10.845 ( 2.946 2.484 -0.309) 3.866 12.677 ( 1.396 0.940 1.657) 2.362 12.786 ( 5.481 2.483 -3.252) 6.840 13.112 ( -0.751 -1.385 2.911) 3.310 13.270 ( -3.148 3.336 2.938) 5.447 13.767 ( -3.875 1.339 -5.102) 6.545 13.964 ( -4.451 0.112 -10.735) 11.622 14.536 ( -3.800 -1.710 2.449) 4.833 14.677 ( -4.843 1.200 -0.122) 4.991 14.793 ( 2.253 -4.298 11.469) 12.454 14.845 ( -18.433 -6.050 19.473) 27.488 14.951 ( 2.049 0.686 0.984) 2.374 15.189 ( 0.095 -1.382 0.501) 1.473 15.308 ( -1.208 0.817 -0.717) 1.625 15.895 ( 4.429 -9.558 4.756) 11.558 16.430 ( -2.204 3.286 1.062) 4.096 16.845 ( 4.655 2.316 -1.522) 5.417 17.203 ( -8.919 -4.604 8.443) 13.116 17.510 ( -4.529 -2.307 -2.976) 5.890 17.834 ( 6.001 3.655 0.358) 7.036 18.352 ( 7.094 3.056 5.190) 9.306 18.823 ( 5.669 -2.415 -9.810) 11.585 18.981 ( 7.754 2.451 2.082) 8.394 19.301 ( 1.246 2.192 6.646) 7.108 19.975 ( -2.561 0.437 -0.051) 2.598 20.160 ( 7.490 -5.393 0.687) 9.255 20.260 ( 4.403 -4.333 -3.863) 7.286 21.109 ( -1.850 -6.757 -0.159) 7.007 21.289 ( 3.416 -6.853 0.773) 7.696 22.192 ( -17.465 1.533 -1.455) 17.593 22.744 ( -3.031 -3.132 -3.934) 5.871 23.203 ( 0.232 1.493 0.623) 1.634 23.837 ( -14.365 6.469 4.452) 16.371 24.054 ( 14.431 -4.803 -6.560) 16.563 24.315 ( 8.777 2.447 -1.924) 9.313 ======================= Grid point 110 (42/138) ======================= q-point: ( 0.22 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.639 ( 30.776 -14.939 29.459) 45.146 1.859 ( 33.909 1.748 14.191) 36.800 2.779 ( 12.155 7.457 -14.725) 20.498 2.873 ( 5.667 5.877 -22.257) 23.708 3.076 ( 32.841 31.831 16.427) 48.596 3.659 ( 18.336 10.112 7.975) 22.407 3.763 ( 7.346 -3.442 12.662) 15.038 4.110 ( 5.593 -3.010 -8.904) 10.937 4.287 ( 5.043 2.959 8.957) 10.696 4.599 ( -0.575 -8.659 -13.420) 15.982 4.865 ( 9.130 1.114 -8.558) 12.563 5.222 ( 4.748 8.596 -22.888) 24.906 5.313 ( -7.407 -0.300 10.505) 12.857 5.451 ( 7.254 -4.464 -3.305) 9.136 5.517 ( 7.895 -2.661 4.007) 9.244 6.017 ( -1.132 7.156 0.905) 7.301 6.118 ( 5.460 -2.681 -3.479) 7.007 6.436 ( 5.181 3.393 -4.015) 7.381 6.583 ( -10.238 -3.090 0.289) 10.698 6.716 ( -4.541 -0.711 7.906) 9.145 6.985 ( 0.831 -5.643 -2.996) 6.443 7.249 ( -0.710 4.568 -1.883) 4.992 7.393 ( -0.327 2.874 0.934) 3.040 7.509 ( -0.881 -1.280 2.327) 2.798 7.730 ( -0.383 -1.826 -1.004) 2.119 7.852 ( -4.589 1.258 3.645) 5.994 7.965 ( -1.502 5.583 3.182) 6.599 8.051 ( 0.631 -2.387 5.032) 5.605 8.228 ( 5.144 -1.068 -6.006) 7.980 8.810 ( -5.587 -6.280 -4.227) 9.409 8.961 ( -2.941 0.899 -0.883) 3.199 9.172 ( 8.453 -4.981 -5.076) 11.046 9.323 ( 6.498 -2.123 -5.905) 9.034 9.613 ( -9.995 -4.055 0.503) 10.798 9.806 ( -5.729 -2.781 -3.700) 7.365 10.199 ( -6.487 -1.761 10.694) 12.631 10.570 ( -4.532 4.437 6.352) 8.976 10.892 ( 0.798 4.351 -0.112) 4.425 12.732 ( 3.724 0.297 1.383) 3.984 12.911 ( 6.436 1.513 -2.282) 6.994 13.160 ( 2.036 -2.620 -6.807) 7.572 13.213 ( -1.493 2.376 1.477) 3.171 13.649 ( -6.962 0.272 -2.274) 7.329 13.829 ( -6.297 0.249 -8.912) 10.915 14.483 ( -2.054 -0.436 1.086) 2.364 14.586 ( -3.657 1.536 -3.042) 4.999 14.663 ( -1.354 -0.657 7.231) 7.386 14.921 ( 3.970 -2.597 5.569) 7.316 14.984 ( 0.736 0.359 2.245) 2.390 15.196 ( 0.325 -2.338 1.324) 2.706 15.290 ( -0.175 1.550 -0.139) 1.566 15.993 ( 3.983 -9.126 5.098) 11.187 16.400 ( -1.074 3.541 0.026) 3.701 16.837 ( -6.609 7.520 2.938) 10.434 17.138 ( 1.194 -9.644 4.444) 10.686 17.517 ( 5.789 2.000 -8.826) 10.743 17.990 ( 7.860 -1.831 5.515) 9.775 18.482 ( 6.571 -0.701 6.282) 9.117 18.907 ( 4.660 -3.395 -12.347) 13.627 19.167 ( 7.585 2.847 3.191) 8.708 19.345 ( 2.450 0.422 4.993) 5.577 19.899 ( -4.254 -1.038 0.906) 4.472 20.278 ( 2.347 -6.166 -3.809) 7.618 20.405 ( 11.980 -2.400 5.419) 13.366 21.070 ( -1.912 -8.340 -2.812) 9.007 21.305 ( -1.804 -1.414 0.011) 2.292 21.831 ( -16.257 6.011 -5.605) 18.217 22.651 ( -5.083 -2.936 -4.409) 7.341 23.211 ( 0.447 -0.261 0.126) 0.532 23.589 ( -10.358 9.248 6.005) 15.129 24.273 ( 7.770 -7.551 1.254) 10.907 24.460 ( 6.396 0.858 -3.988) 7.586 ======================= Grid point 111 (43/138) ======================= q-point: ( 0.33 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.232 ( 25.332 -0.189 20.994) 32.901 2.643 ( 37.932 -14.185 10.742) 41.898 2.933 ( 6.978 7.467 -14.937) 18.099 2.989 ( 9.724 4.018 -9.892) 14.441 3.566 ( 6.912 5.194 -0.944) 8.698 3.847 ( 2.492 -0.536 2.288) 3.425 4.002 ( 13.620 13.297 8.294) 20.763 4.216 ( 7.353 4.448 -6.885) 11.012 4.411 ( 3.926 -0.287 7.993) 8.910 4.584 ( 6.201 0.440 -7.250) 9.550 5.054 ( 8.731 -4.095 -9.121) 13.274 5.143 ( -6.224 0.768 -1.495) 6.446 5.337 ( 7.972 3.585 -6.125) 10.674 5.589 ( 7.063 -4.245 2.642) 8.653 5.651 ( 1.036 -4.297 0.244) 4.427 6.016 ( 0.777 1.462 -5.668) 5.905 6.212 ( 3.782 -4.405 -4.688) 7.462 6.449 ( -0.256 -5.911 1.608) 6.131 6.484 ( -3.452 5.795 3.050) 7.403 6.669 ( 0.743 -5.290 2.849) 6.054 6.997 ( 0.829 -3.388 1.509) 3.800 7.239 ( -0.748 4.795 0.233) 4.859 7.374 ( -4.288 3.700 4.266) 7.091 7.486 ( -0.772 -1.258 5.870) 6.053 7.663 ( -5.320 4.538 0.600) 7.019 7.794 ( -0.832 -0.498 2.849) 3.010 7.940 ( -0.992 5.029 2.984) 5.931 8.081 ( 0.740 -3.067 6.667) 7.376 8.373 ( 9.749 -2.951 -9.886) 14.195 8.616 ( -13.047 -6.002 6.220) 15.651 8.929 ( 0.277 3.621 -19.008) 19.352 9.133 ( -0.891 -6.113 -7.351) 9.602 9.368 ( -9.758 -7.473 1.230) 12.352 9.565 ( -0.717 -2.507 -6.986) 7.457 9.775 ( 10.608 2.130 -1.546) 10.929 10.088 ( -7.833 -2.330 9.806) 12.765 10.505 ( -2.713 7.420 12.791) 15.035 10.864 ( -3.903 5.959 2.056) 7.414 12.823 ( 5.035 0.515 0.938) 5.148 13.009 ( 3.417 -0.134 -1.250) 3.641 13.115 ( -2.850 2.071 3.787) 5.173 13.230 ( 1.541 -1.306 -8.009) 8.260 13.491 ( -8.759 -0.312 1.012) 8.823 13.695 ( -5.161 0.358 -7.187) 8.855 14.445 ( -2.099 -0.337 -0.132) 2.130 14.548 ( 1.168 1.794 -5.607) 6.002 14.725 ( 5.411 0.204 -0.358) 5.427 14.959 ( -1.440 -2.317 4.338) 5.125 15.007 ( 1.333 0.198 2.790) 3.098 15.194 ( -0.720 -1.557 0.775) 1.882 15.322 ( 2.801 0.724 4.111) 5.027 16.061 ( 1.808 -8.777 3.004) 9.451 16.386 ( -0.251 4.051 -1.149) 4.218 16.659 ( -10.097 5.189 -0.008) 11.352 17.209 ( 3.557 -6.322 4.299) 8.433 17.652 ( 8.348 1.849 -7.593) 11.435 18.144 ( 6.523 -3.255 5.599) 9.192 18.652 ( 8.313 -3.712 7.557) 11.832 18.943 ( 1.614 -3.900 -12.452) 13.148 19.231 ( -0.151 -2.852 1.782) 3.366 19.434 ( 4.035 3.274 3.907) 6.501 19.834 ( -2.239 -0.559 0.899) 2.477 20.290 ( 0.359 -4.382 -2.248) 4.938 20.685 ( 13.344 -4.056 9.672) 16.972 21.003 ( -4.541 -7.958 -6.919) 11.482 21.221 ( -5.952 2.135 1.122) 6.422 21.594 ( -5.666 8.821 -4.049) 11.239 22.535 ( -5.255 -3.430 -5.412) 8.287 23.215 ( -0.510 -0.991 2.484) 2.723 23.448 ( -4.926 8.607 0.477) 9.928 24.386 ( 3.378 -6.849 3.536) 8.416 24.551 ( 3.822 -0.146 -3.099) 4.922 ======================= Grid point 112 (44/138) ======================= q-point: ( 0.44 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.685 ( 12.616 2.609 15.133) 19.874 3.001 ( 4.540 4.503 -7.444) 9.814 3.123 ( 3.418 -2.171 -4.078) 5.747 3.295 ( 14.744 -0.798 9.876) 17.764 3.516 ( 5.062 -11.198 -10.862) 16.402 3.819 ( -1.283 -0.519 -3.003) 3.307 4.087 ( -6.007 6.170 -2.735) 9.035 4.382 ( 5.977 14.738 0.741) 15.921 4.510 ( 2.659 3.327 -0.609) 4.302 4.775 ( 7.699 -3.102 3.627) 9.058 5.014 ( -0.041 0.222 4.430) 4.436 5.238 ( 8.845 -1.524 -20.948) 22.790 5.394 ( -1.044 -3.899 -4.927) 6.369 5.637 ( -1.557 -8.882 3.745) 9.764 5.777 ( 11.204 2.264 2.029) 11.609 5.883 ( -9.635 -10.714 -1.024) 14.445 6.220 ( -11.605 0.267 8.266) 14.250 6.366 ( 2.163 -6.951 -4.989) 8.825 6.567 ( 4.480 -2.421 3.534) 6.198 6.737 ( 4.349 0.028 -1.705) 4.672 7.024 ( 0.641 1.038 5.071) 5.216 7.201 ( -2.974 5.886 2.730) 7.137 7.284 ( -2.761 1.058 2.376) 3.793 7.488 ( -1.645 -1.527 6.735) 7.100 7.621 ( 1.253 7.446 -0.085) 7.552 7.806 ( 1.037 -1.270 1.011) 1.927 7.934 ( -0.375 5.142 2.394) 5.684 8.088 ( -2.178 -1.628 6.199) 6.769 8.390 ( -9.640 -3.041 7.387) 12.520 8.526 ( 7.714 -5.388 -10.010) 13.738 8.854 ( -2.522 -0.073 -19.334) 19.498 9.167 ( 4.931 -4.466 -8.312) 10.647 9.249 ( -0.924 -2.524 1.491) 3.074 9.451 ( -5.023 -1.383 -8.239) 9.748 9.922 ( -10.463 -2.016 7.614) 13.096 10.031 ( 11.115 -3.113 0.372) 11.549 10.542 ( 3.485 10.430 9.865) 14.773 10.747 ( -8.639 6.756 4.216) 11.750 12.906 ( 1.658 2.567 1.089) 3.244 13.042 ( 2.414 -1.752 -0.487) 3.022 13.112 ( 1.324 1.824 1.018) 2.473 13.233 ( -0.213 -2.310 -5.432) 5.906 13.329 ( -6.951 1.121 2.614) 7.510 13.607 ( -1.920 1.040 -4.582) 5.076 14.410 ( -1.121 -1.048 -1.501) 2.147 14.593 ( 4.365 1.831 -7.265) 8.671 14.837 ( 5.257 -0.026 0.340) 5.268 14.910 ( -4.209 -1.851 4.213) 6.236 15.036 ( 1.143 -0.168 2.075) 2.375 15.185 ( 0.014 0.030 -0.308) 0.309 15.400 ( 3.331 -0.954 9.385) 10.004 16.069 ( -1.538 -8.044 -0.278) 8.194 16.386 ( 0.650 5.132 -1.910) 5.515 16.481 ( -6.530 4.436 -4.360) 9.018 17.271 ( 1.155 -4.403 6.166) 7.664 17.768 ( 4.587 -2.781 -5.882) 7.960 18.268 ( 3.978 -0.747 5.436) 6.777 18.764 ( -1.619 -4.727 5.672) 7.559 18.950 ( 4.282 -6.034 -8.975) 11.632 19.231 ( 0.570 -3.041 -0.464) 3.129 19.493 ( 1.409 2.114 4.640) 5.290 19.804 ( -1.491 0.658 -0.587) 1.733 20.302 ( 1.395 -3.968 0.215) 4.212 20.787 ( -9.239 -6.133 -9.263) 14.449 20.980 ( 8.444 0.574 7.370) 11.222 21.138 ( -2.312 -1.294 1.294) 2.949 21.581 ( 3.664 8.349 3.317) 9.703 22.427 ( -4.053 -3.803 -8.054) 9.786 23.192 ( -2.733 0.568 4.103) 4.963 23.396 ( -0.018 6.403 -3.321) 7.213 24.428 ( 0.144 -6.261 3.346) 7.101 24.600 ( 1.829 -0.549 -2.092) 2.833 ======================= Grid point 113 (45/138) ======================= q-point: (-0.44 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.610 ( -20.872 0.789 8.066) 22.390 2.955 ( -12.168 -0.653 -1.074) 12.233 3.118 ( 0.663 -1.773 -0.939) 2.113 3.419 ( 4.301 5.382 5.300) 8.692 3.644 ( 2.309 1.896 -4.613) 5.496 3.899 ( -4.612 8.592 -11.690) 15.223 4.022 ( 8.119 -7.091 9.961) 14.678 4.346 ( -9.725 6.264 0.806) 11.596 4.438 ( -4.824 3.314 -13.649) 14.851 4.773 ( -5.254 -6.761 3.988) 9.446 5.025 ( -6.791 3.992 10.964) 13.500 5.267 ( -4.040 -3.429 -13.375) 14.386 5.475 ( 11.809 -6.105 -9.483) 16.330 5.537 ( -4.328 -5.455 -4.321) 8.195 5.789 ( -4.596 -2.523 2.241) 5.702 5.962 ( 0.312 -2.464 5.127) 5.697 6.050 ( 7.015 0.011 -0.129) 7.016 6.400 ( -0.874 -8.639 -0.445) 8.694 6.537 ( -7.038 -6.699 2.368) 10.001 6.790 ( 0.280 1.359 -0.756) 1.580 7.017 ( -2.905 1.487 8.053) 8.689 7.197 ( 1.818 3.460 1.806) 4.306 7.279 ( 0.815 5.303 3.515) 6.414 7.459 ( -2.048 0.632 2.138) 3.028 7.669 ( 2.373 3.752 4.158) 6.082 7.815 ( -0.819 -1.281 -0.144) 1.527 7.940 ( 0.099 3.624 4.909) 6.102 8.020 ( -4.797 0.136 1.939) 5.176 8.339 ( 4.172 -1.412 4.491) 6.290 8.632 ( 4.272 -6.495 -7.330) 10.684 8.775 ( -0.340 0.568 -19.364) 19.376 9.277 ( 7.889 -2.773 -6.176) 10.396 9.304 ( 3.945 -0.985 -1.118) 4.217 9.384 ( 1.399 -3.016 -7.756) 8.439 9.723 ( -10.559 -0.834 5.015) 11.719 10.190 ( 3.435 -4.414 6.821) 8.821 10.550 ( -11.610 5.477 5.570) 13.993 10.659 ( 5.904 11.752 4.052) 13.761 12.886 ( -3.036 2.769 0.668) 4.163 13.076 ( -1.872 -1.746 -1.380) 2.908 13.144 ( -1.368 1.703 4.242) 4.772 13.222 ( 5.861 -1.003 -1.890) 6.239 13.278 ( 1.277 -0.275 -3.433) 3.673 13.620 ( 4.185 1.777 -3.374) 5.662 14.395 ( 0.151 -1.233 -2.691) 2.964 14.667 ( 4.215 0.833 -7.141) 8.334 14.829 ( -4.166 -1.654 3.366) 5.606 14.915 ( 1.887 -0.092 3.788) 4.233 15.068 ( 1.932 -0.692 0.626) 2.146 15.194 ( 1.049 1.034 -1.180) 1.887 15.496 ( 3.539 -3.404 16.770) 17.474 15.992 ( -5.484 -6.012 -5.379) 9.754 16.369 ( -1.504 3.307 -2.658) 4.501 16.441 ( 3.261 6.196 -4.298) 8.216 17.268 ( -3.123 -4.984 5.825) 8.278 17.810 ( 1.276 -4.674 -5.479) 7.314 18.282 ( -4.591 0.818 7.282) 8.647 18.643 ( -8.897 -3.357 -1.561) 9.637 19.055 ( 6.012 -7.006 -1.534) 9.359 19.247 ( 0.709 -0.653 -2.529) 2.706 19.525 ( 0.363 -1.745 7.344) 7.557 19.761 ( -2.062 1.744 -2.554) 3.717 20.351 ( 2.976 -4.674 2.947) 6.276 20.558 ( -9.852 -1.407 -8.981) 13.405 21.113 ( 0.821 0.368 0.250) 0.934 21.145 ( 4.774 -3.491 3.844) 7.054 21.722 ( 8.094 4.975 9.831) 13.671 22.342 ( -2.053 -2.675 -13.101) 13.528 23.130 ( -4.061 3.083 2.360) 5.618 23.425 ( 3.309 4.538 -1.910) 5.932 24.407 ( -2.947 -5.577 2.492) 6.782 24.616 ( 0.240 -0.878 -1.339) 1.619 ======================= Grid point 114 (46/138) ======================= q-point: (-0.33 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.109 ( -29.549 -2.118 9.720) 31.179 2.526 ( -29.011 6.990 5.897) 30.418 3.137 ( 0.079 -2.302 -0.480) 2.352 3.393 ( -10.147 -0.213 -3.887) 10.868 3.624 ( -5.278 8.055 11.009) 14.627 3.751 ( -11.359 11.372 -0.689) 16.088 3.897 ( -17.084 4.856 1.526) 17.826 4.001 ( -20.390 -1.454 -8.776) 22.246 4.451 ( -0.853 5.213 2.076) 5.675 4.708 ( 3.087 -5.882 -10.768) 12.652 4.897 ( -4.070 -2.611 -0.448) 4.857 5.145 ( -4.547 -2.587 -0.626) 5.269 5.426 ( -6.938 3.150 -6.682) 10.135 5.604 ( -0.478 -5.451 -2.732) 6.116 5.731 ( 2.609 -0.196 1.426) 2.980 6.053 ( 7.614 -2.272 -8.716) 11.795 6.221 ( 2.251 -3.856 -0.278) 4.473 6.349 ( 1.194 -2.608 1.690) 3.329 6.386 ( -7.202 -10.071 3.209) 12.790 6.735 ( -6.057 2.320 3.706) 7.471 6.988 ( 0.044 0.291 3.880) 3.891 7.233 ( 1.232 3.650 1.684) 4.204 7.338 ( 4.184 1.131 2.528) 5.018 7.428 ( -0.934 3.924 0.505) 4.065 7.701 ( -1.294 2.724 4.844) 5.706 7.769 ( -3.108 -1.095 -1.252) 3.525 7.913 ( -1.756 -1.986 3.149) 4.116 8.001 ( 1.557 3.242 3.825) 5.250 8.533 ( 10.548 -3.481 2.726) 11.437 8.623 ( -1.846 -5.022 -0.223) 5.356 8.754 ( 1.607 8.729 -28.066) 29.436 9.345 ( 3.950 -4.084 -9.826) 11.350 9.420 ( 2.392 -4.502 -0.733) 5.150 9.492 ( 9.441 -1.477 0.943) 9.603 9.571 ( -2.842 -1.626 1.793) 3.733 10.083 ( -17.598 4.371 11.852) 21.663 10.437 ( 0.302 -2.337 6.225) 6.656 10.769 ( 4.348 9.799 0.093) 10.721 12.800 ( -5.305 1.325 -0.176) 5.471 13.005 ( -4.794 0.095 -0.903) 4.880 13.114 ( -0.338 3.241 4.110) 5.245 13.344 ( 4.955 -2.475 -2.258) 5.981 13.398 ( 10.651 -1.140 -3.733) 11.343 13.735 ( 7.798 1.782 -4.597) 9.226 14.405 ( 1.531 -0.933 -3.181) 3.652 14.701 ( 0.183 -1.014 -0.591) 1.188 14.794 ( 0.693 -1.110 -2.416) 2.748 14.923 ( -2.017 0.068 5.126) 5.509 15.114 ( 2.571 -0.957 0.022) 2.743 15.220 ( 1.846 0.977 -1.312) 2.466 15.624 ( 4.746 -8.983 25.918) 27.838 15.852 ( -6.345 -4.565 -9.117) 12.009 16.360 ( 0.923 0.606 -1.935) 2.228 16.540 ( 7.674 10.164 -2.664) 13.012 17.167 ( -8.081 -7.984 2.357) 11.602 17.807 ( -0.134 -0.782 -5.902) 5.956 18.140 ( -10.664 0.279 9.479) 14.270 18.440 ( -10.634 -1.165 -2.448) 10.974 19.154 ( 3.089 -4.306 -0.270) 5.306 19.208 ( -4.158 1.827 -3.781) 5.910 19.538 ( 0.103 -7.439 9.426) 12.008 19.751 ( 1.900 1.594 -2.621) 3.608 20.339 ( -6.259 -3.679 -4.235) 8.405 20.467 ( 3.118 -5.175 4.813) 7.724 21.117 ( -0.056 -4.962 -0.998) 5.062 21.240 ( 3.773 1.334 1.412) 4.244 21.897 ( 6.451 -1.273 7.697) 10.123 22.296 ( 1.521 3.725 -17.547) 18.003 23.054 ( -3.813 4.861 1.264) 6.306 23.506 ( 4.764 4.749 1.105) 6.817 24.322 ( -6.032 -4.324 1.109) 7.504 24.606 ( -0.956 -1.648 -0.874) 2.096 ======================= Grid point 115 (47/138) ======================= q-point: (-0.22 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.539 ( -30.022 0.840 16.166) 34.108 1.937 ( -31.267 16.428 14.565) 38.205 2.951 ( -37.966 22.045 18.528) 47.652 3.020 ( -13.117 -8.394 -18.162) 23.924 3.327 ( -9.112 -0.686 10.282) 13.755 3.529 ( -20.415 8.496 3.347) 22.364 3.603 ( -11.257 8.348 -12.692) 18.908 3.769 ( -0.891 2.562 9.276) 9.665 4.336 ( -7.510 2.478 -0.638) 7.933 4.707 ( -1.564 0.895 -20.621) 20.700 4.871 ( -0.811 -6.763 -9.975) 12.079 5.134 ( 2.327 1.023 -3.282) 4.151 5.281 ( -4.379 -0.563 4.378) 6.218 5.563 ( -2.747 -1.735 -0.581) 3.301 5.765 ( -0.689 -4.268 5.443) 6.951 6.079 ( -6.431 0.148 -1.880) 6.702 6.192 ( 4.020 2.275 -11.015) 11.944 6.267 ( -5.990 -3.370 6.422) 9.406 6.525 ( 11.509 -1.524 -1.866) 11.759 6.621 ( -4.814 0.680 4.769) 6.810 7.037 ( 3.490 -0.985 -0.069) 3.627 7.267 ( 2.206 2.352 -1.426) 3.525 7.419 ( 3.192 -4.734 -1.344) 5.866 7.437 ( 2.107 7.339 1.052) 7.707 7.656 ( -1.557 3.518 -0.116) 3.849 7.725 ( -0.882 -2.806 -3.324) 4.439 7.931 ( 1.726 -1.471 3.902) 4.513 8.042 ( 0.914 2.783 7.810) 8.341 8.476 ( -8.180 -3.912 2.313) 9.358 8.636 ( -4.652 17.792 -35.027) 39.561 8.824 ( 10.641 -3.899 4.557) 12.214 9.352 ( -6.447 0.105 0.823) 6.500 9.411 ( 3.849 -4.540 -5.542) 8.133 9.553 ( -14.244 4.417 3.516) 15.322 9.665 ( 5.539 -3.004 2.973) 6.967 9.801 ( 1.974 -3.243 4.877) 6.181 10.482 ( 1.360 -4.035 7.472) 8.600 10.823 ( 1.260 7.526 -1.677) 7.812 12.704 ( -3.917 1.531 0.008) 4.206 12.895 ( -5.597 1.190 -0.221) 5.727 13.158 ( 3.163 2.832 2.240) 4.800 13.421 ( 2.672 -4.836 -1.989) 5.873 13.596 ( 9.908 -0.365 -4.450) 10.868 13.887 ( 8.357 1.579 -7.064) 11.056 14.444 ( 3.156 -0.800 -1.677) 3.662 14.712 ( 1.023 -2.219 3.896) 4.599 14.811 ( 1.331 -0.797 -4.698) 4.948 14.866 ( -4.586 0.221 4.905) 6.719 15.159 ( 1.684 -0.389 -0.111) 1.732 15.260 ( 2.159 -0.164 -0.792) 2.306 15.719 ( -2.769 -6.307 -7.047) 9.854 15.806 ( 4.922 -20.529 29.540) 36.308 16.393 ( 2.752 -0.341 -0.373) 2.798 16.749 ( 14.137 14.916 2.433) 20.694 16.976 ( -10.317 -9.886 -1.363) 14.354 17.765 ( -3.349 8.957 -8.804) 12.998 17.944 ( -10.486 -3.030 11.224) 15.656 18.243 ( -8.240 -1.462 -0.794) 8.406 19.046 ( -8.133 -1.604 -4.181) 9.284 19.206 ( 0.374 5.205 1.937) 5.566 19.611 ( 4.753 -13.489 11.909) 18.612 19.797 ( 2.724 -0.342 -3.464) 4.420 20.205 ( -6.385 -4.945 -2.906) 8.583 20.552 ( 2.201 -13.360 9.247) 16.396 21.089 ( -2.950 -6.342 -4.781) 8.472 21.268 ( -2.106 -2.465 -0.865) 3.355 22.005 ( 6.574 2.620 -6.874) 9.866 22.350 ( 6.813 11.289 -9.910) 16.495 22.993 ( -2.546 6.165 1.704) 6.884 23.605 ( 4.122 7.158 4.084) 9.214 24.182 ( -7.581 -2.459 -1.317) 8.078 24.574 ( -2.204 -3.399 -1.063) 4.188 ======================= Grid point 116 (48/138) ======================= q-point: (-0.11 0.09 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.098 ( -16.509 16.192 26.199) 34.945 1.404 ( -25.726 28.706 16.079) 41.766 2.176 ( -40.534 30.392 38.644) 63.718 2.712 ( -10.496 -6.479 -24.140) 27.108 3.185 ( -13.463 10.616 1.851) 17.244 3.275 ( -3.973 0.737 11.662) 12.342 3.324 ( -9.745 9.308 -15.995) 20.915 3.806 ( 0.857 1.182 13.866) 13.943 4.216 ( -3.700 1.580 -3.130) 5.097 4.629 ( 0.101 -3.048 -23.726) 23.921 4.798 ( -3.738 -4.888 -5.536) 8.277 5.067 ( -4.308 2.377 -8.746) 10.036 5.339 ( 4.067 -1.925 2.589) 5.192 5.495 ( -3.718 -0.562 0.104) 3.762 5.745 ( -3.275 -2.937 10.182) 11.091 5.955 ( -4.182 5.768 -3.021) 7.738 6.145 ( -6.021 2.938 8.102) 10.513 6.255 ( 3.008 2.096 -12.871) 13.383 6.600 ( 1.894 0.840 6.187) 6.525 6.747 ( 10.633 -0.294 -2.822) 11.005 7.085 ( 0.633 -3.291 0.132) 3.354 7.303 ( 2.203 0.910 -5.468) 5.965 7.446 ( 1.368 -2.944 -3.511) 4.782 7.568 ( 9.152 10.151 2.735) 13.939 7.642 ( 1.573 -0.249 -6.917) 7.098 7.736 ( 3.535 -2.004 -6.782) 7.906 7.958 ( -0.850 -0.434 -2.861) 3.016 8.059 ( -1.934 1.800 10.410) 10.740 8.294 ( -9.514 3.789 -4.980) 11.387 8.479 ( 0.634 30.777 -20.223) 36.832 8.929 ( -11.184 0.685 6.803) 13.109 9.084 ( -7.714 0.120 7.710) 10.907 9.343 ( -2.492 7.240 -3.501) 8.419 9.466 ( 2.096 -4.104 -4.543) 6.471 9.792 ( 6.522 -6.691 2.099) 9.577 9.960 ( 7.190 -6.136 0.613) 9.472 10.510 ( -0.300 -3.368 7.433) 8.167 10.817 ( -0.804 5.270 -2.909) 6.073 12.655 ( -1.162 2.026 0.656) 2.426 12.802 ( -3.565 1.100 0.221) 3.737 13.219 ( 1.986 2.203 1.564) 3.353 13.423 ( -2.380 -6.170 -1.643) 6.815 13.749 ( 6.349 0.790 -5.107) 8.187 14.006 ( 5.244 1.033 -10.699) 11.960 14.525 ( 4.947 -1.386 2.325) 5.639 14.724 ( -3.094 -2.504 3.641) 5.395 14.782 ( -2.613 0.293 5.766) 6.337 14.846 ( 2.844 0.011 -3.575) 4.568 15.179 ( 0.554 -0.430 -0.361) 0.789 15.274 ( -0.681 -0.475 -1.195) 1.455 15.711 ( 3.817 -8.857 -5.430) 11.068 15.900 ( -5.937 -38.560 26.866) 47.370 16.470 ( 4.231 0.019 3.494) 5.487 16.747 ( -8.103 -8.099 -3.509) 11.982 17.211 ( 29.111 10.727 11.542) 33.101 17.611 ( -9.232 11.855 -4.974) 15.827 17.814 ( -5.105 -3.528 3.473) 7.112 18.121 ( -4.907 -2.304 1.021) 5.517 18.903 ( -4.874 -1.649 -2.845) 5.879 19.201 ( -1.169 7.505 1.140) 7.680 19.712 ( -7.342 -28.285 18.497) 34.585 19.838 ( 5.416 -0.966 -6.413) 8.450 20.044 ( -9.253 -4.486 -4.306) 11.148 20.453 ( -16.054 -16.278 -3.164) 23.081 21.011 ( 1.623 -2.230 -2.414) 3.665 21.197 ( -3.134 -4.663 1.533) 5.824 22.249 ( 20.089 11.445 -3.515) 23.386 22.482 ( 8.478 12.342 -6.367) 16.270 22.968 ( 0.158 8.597 2.372) 8.919 23.645 ( -1.820 13.324 1.244) 13.506 24.073 ( -1.067 -1.140 -2.127) 2.639 24.494 ( -6.624 -6.182 -2.511) 9.402 ======================= Grid point 117 (49/138) ======================= q-point: ( 0.00 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.446 ( -11.778 35.691 4.754) 37.883 1.870 ( -15.268 38.610 12.935) 43.488 2.476 ( 8.128 20.936 2.635) 22.613 2.710 ( 7.752 23.542 12.242) 27.644 3.216 ( -4.654 9.181 -3.768) 10.961 3.288 ( 1.353 1.073 -1.101) 2.048 3.500 ( 1.031 21.037 1.753) 21.135 3.885 ( 2.165 0.968 1.582) 2.851 4.218 ( 0.894 0.148 0.801) 1.209 4.542 ( -0.203 -3.123 -11.640) 12.054 4.567 ( -1.214 -4.971 0.638) 5.156 5.092 ( 1.311 2.419 -1.489) 3.129 5.404 ( 1.658 3.912 -2.973) 5.186 5.432 ( -1.870 -1.049 0.826) 2.298 5.669 ( -6.589 0.012 5.670) 8.693 6.035 ( 1.567 5.553 -1.293) 5.913 6.190 ( 0.672 6.733 -4.116) 7.920 6.271 ( 1.875 -2.536 -8.150) 8.739 6.763 ( 5.376 2.932 7.753) 9.880 6.866 ( 3.060 -1.619 -2.305) 4.159 6.991 ( -4.829 0.250 -1.345) 5.019 7.302 ( -0.011 -3.379 -2.667) 4.305 7.399 ( 2.414 -4.660 -4.810) 7.119 7.543 ( -0.560 -1.913 -2.694) 3.351 7.676 ( -2.252 -2.438 -6.870) 7.630 7.847 ( 1.893 -2.459 1.680) 3.529 7.982 ( -5.988 1.147 3.112) 6.845 8.110 ( 9.240 5.094 -8.715) 13.685 8.313 ( 6.068 5.107 3.908) 8.842 8.680 ( -13.411 8.157 11.521) 19.471 8.927 ( -3.484 -5.901 6.578) 9.499 9.009 ( -3.012 0.455 0.627) 3.110 9.316 ( -0.588 -8.442 -0.505) 8.478 9.579 ( 3.512 -5.648 -3.200) 7.381 9.869 ( 1.657 -6.628 -6.373) 9.343 10.036 ( 22.290 7.957 -18.599) 30.101 10.462 ( -0.662 -2.726 3.450) 4.447 10.852 ( 0.269 1.368 -2.793) 3.122 12.711 ( -0.463 3.745 0.992) 3.902 12.790 ( 0.462 2.512 -0.382) 2.582 13.154 ( -6.737 -2.922 7.367) 10.402 13.355 ( 0.416 2.044 1.140) 2.377 13.807 ( 1.643 -2.254 -6.459) 7.035 14.037 ( -0.256 -0.284 -11.926) 11.932 14.576 ( -2.987 -1.490 4.117) 5.300 14.618 ( 3.536 -2.224 0.822) 4.258 14.750 ( -2.498 -1.164 4.481) 5.261 14.879 ( -0.783 -5.081 6.596) 8.363 15.012 ( -13.414 -8.758 12.459) 20.294 15.159 ( -0.412 -2.197 -0.334) 2.260 15.299 ( -0.473 -3.125 0.810) 3.263 15.558 ( 4.090 -14.060 0.197) 14.644 16.558 ( -3.873 3.910 2.438) 6.019 16.587 ( 7.427 -5.413 4.504) 10.234 17.384 ( -2.343 -4.153 -3.881) 6.148 17.618 ( -12.214 -3.626 -0.944) 12.776 17.806 ( 3.900 4.170 1.262) 5.848 18.124 ( 11.007 1.518 -2.763) 11.450 18.862 ( 2.559 0.876 0.661) 2.785 19.003 ( -13.557 -2.698 2.994) 14.143 19.379 ( -1.304 6.836 6.137) 9.279 19.953 ( 8.639 -2.654 -0.052) 9.037 19.990 ( 2.224 -1.260 -2.485) 3.565 20.106 ( -6.319 -7.737 -1.802) 10.151 21.017 ( 2.777 -5.031 0.779) 5.799 21.040 ( 0.021 -5.680 1.255) 5.817 22.385 ( -2.287 -2.837 2.773) 4.579 22.663 ( 2.641 -5.125 -3.958) 6.994 23.282 ( 3.779 9.587 5.807) 11.829 23.861 ( 1.774 6.052 -9.761) 11.621 24.165 ( 1.924 0.555 0.237) 2.016 24.205 ( -4.583 -0.650 -1.739) 4.945 ======================= Grid point 118 (50/138) ======================= q-point: ( 0.11 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.204 ( -5.507 33.960 1.785) 34.450 1.804 ( 5.535 26.028 23.868) 35.746 2.714 ( 13.237 9.856 -14.110) 21.713 3.092 ( -1.363 15.588 -17.460) 23.445 3.105 ( 24.498 32.755 19.064) 45.128 3.425 ( 8.398 -5.545 11.795) 15.505 3.656 ( 12.521 19.327 7.139) 24.110 3.956 ( 5.219 -2.095 -6.650) 8.710 4.254 ( 1.288 -0.395 7.267) 7.391 4.468 ( -0.236 -4.834 -11.080) 12.091 4.705 ( 10.307 0.375 -3.036) 10.751 5.181 ( 8.356 0.070 -2.615) 8.755 5.376 ( -1.535 3.686 -5.005) 6.402 5.416 ( -3.042 -1.476 4.878) 5.935 5.520 ( -6.890 1.939 1.460) 7.305 6.067 ( 1.950 3.993 -1.640) 4.737 6.185 ( -0.857 8.588 -6.967) 11.092 6.322 ( 4.710 -3.244 -3.077) 6.494 6.752 ( -11.974 -4.822 -3.021) 13.257 6.843 ( 0.131 3.897 9.960) 10.696 6.941 ( -0.913 1.292 -3.541) 3.879 7.289 ( -0.675 -3.167 -1.284) 3.484 7.447 ( 1.807 -2.163 -3.454) 4.458 7.493 ( -2.125 2.785 -4.481) 5.688 7.644 ( 1.755 -3.560 0.833) 4.056 7.856 ( 0.731 -1.411 -1.330) 2.072 7.956 ( 0.644 -1.390 4.891) 5.125 8.169 ( -0.642 2.791 -4.847) 5.630 8.309 ( -8.067 10.594 5.579) 14.437 8.709 ( 7.585 -4.442 0.684) 8.817 8.895 ( 3.447 -2.500 1.435) 4.493 8.940 ( -2.612 -5.485 2.234) 6.473 9.283 ( -2.745 -6.678 -3.504) 8.025 9.608 ( -0.623 -7.081 1.966) 7.376 9.824 ( -3.624 -6.093 -8.183) 10.827 10.241 ( -3.647 -2.752 8.945) 10.044 10.568 ( 11.736 0.707 -13.676) 18.036 10.894 ( 3.896 2.235 -0.751) 4.554 12.704 ( 0.438 1.873 0.184) 1.932 12.849 ( 5.089 4.035 -1.332) 6.630 13.081 ( -1.336 -1.817 4.465) 5.002 13.334 ( -2.704 3.282 2.557) 4.962 13.767 ( -3.960 -1.577 -5.634) 7.064 13.965 ( -4.363 -0.130 -10.244) 11.135 14.508 ( -2.421 -0.987 0.026) 2.615 14.681 ( -4.222 -1.562 0.775) 4.568 14.705 ( -4.275 -3.028 13.262) 14.259 14.763 ( 0.678 -3.218 5.936) 6.786 14.966 ( 1.819 0.891 0.393) 2.063 15.153 ( -0.285 -2.253 0.296) 2.290 15.301 ( 0.136 -1.252 -0.919) 1.559 15.656 ( 5.264 -14.411 2.969) 15.627 16.505 ( -1.915 4.400 1.754) 5.109 16.763 ( 8.530 -6.685 5.435) 12.124 17.268 ( -11.752 6.945 -0.533) 13.661 17.438 ( 0.064 -5.071 -2.774) 5.780 17.856 ( 2.703 -0.827 -0.970) 2.988 18.350 ( 8.052 -2.196 -1.105) 8.419 18.811 ( -1.601 0.415 -3.548) 3.915 19.029 ( 9.294 1.529 4.870) 10.604 19.364 ( -1.386 4.131 5.424) 6.957 19.946 ( -5.698 -4.484 0.090) 7.251 20.062 ( 5.292 -3.111 -3.712) 7.174 20.162 ( 8.523 -5.177 0.572) 9.988 20.981 ( -2.232 -5.624 -0.893) 6.116 21.156 ( 6.349 -6.480 0.992) 9.126 22.221 ( -13.162 1.054 0.907) 13.235 22.657 ( -2.403 -5.678 -3.085) 6.894 23.307 ( -1.681 8.140 4.162) 9.295 23.932 ( -4.025 3.183 -3.453) 6.185 23.991 ( 1.318 -1.443 0.409) 1.997 24.335 ( 7.173 -0.080 -3.281) 7.889 ======================= Grid point 119 (51/138) ======================= q-point: ( 0.22 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.439 ( 25.615 3.255 11.941) 28.448 2.113 ( 19.874 18.017 13.948) 30.234 2.928 ( 10.817 8.328 -8.985) 16.343 3.079 ( 4.275 14.395 -19.499) 24.611 3.586 ( 15.583 17.202 4.818) 23.706 3.617 ( 6.612 -7.971 13.853) 17.296 3.971 ( 16.972 16.963 5.954) 24.723 4.073 ( 10.247 1.343 -4.147) 11.136 4.306 ( 3.275 -0.666 6.408) 7.227 4.506 ( 5.557 -0.089 -9.868) 11.325 4.878 ( 6.938 1.006 -3.908) 8.026 5.277 ( -8.247 -2.120 8.967) 12.366 5.354 ( 5.596 2.184 -10.813) 12.370 5.430 ( 9.686 -5.268 4.339) 11.849 5.459 ( -0.835 5.410 -3.575) 6.538 6.098 ( -0.075 0.367 -7.730) 7.739 6.135 ( -1.299 4.496 -2.553) 5.331 6.400 ( 0.891 -7.166 -1.731) 7.426 6.491 ( -9.095 -2.927 -3.332) 10.119 6.804 ( -7.563 6.358 4.565) 10.884 6.917 ( 1.481 -1.296 2.696) 3.338 7.279 ( 0.129 -1.199 0.006) 1.206 7.449 ( 1.501 2.794 -1.193) 3.388 7.503 ( -0.375 0.094 2.133) 2.167 7.696 ( 2.178 -1.940 2.712) 3.983 7.857 ( -2.287 -0.376 4.035) 4.653 7.963 ( -1.624 -3.568 5.220) 6.528 8.140 ( -0.930 8.072 -1.069) 8.196 8.206 ( -0.345 0.773 -0.735) 1.121 8.657 ( -6.992 -9.188 0.214) 11.548 8.924 ( 1.566 -5.621 -4.642) 7.456 9.084 ( 2.852 -5.154 -6.102) 8.481 9.223 ( 0.228 -5.741 -2.480) 6.258 9.587 ( 0.413 0.413 -1.372) 1.491 9.726 ( -3.079 -4.632 -7.168) 9.073 10.140 ( -6.852 -4.334 10.230) 13.053 10.662 ( 0.013 4.843 4.370) 6.523 10.972 ( 3.123 3.490 -1.368) 4.879 12.742 ( 3.268 0.716 -0.325) 3.361 12.953 ( 4.992 2.825 -1.378) 5.899 13.103 ( 2.248 -2.854 -2.071) 4.181 13.279 ( -3.047 4.013 3.067) 5.899 13.644 ( -7.200 -0.797 -2.001) 7.515 13.834 ( -6.219 0.262 -7.739) 9.932 14.478 ( -1.201 -0.189 -0.735) 1.421 14.609 ( -3.197 0.613 -1.924) 3.781 14.659 ( 1.412 0.411 3.230) 3.549 14.855 ( 3.395 -4.183 5.621) 7.786 15.002 ( 1.360 1.617 0.970) 2.325 15.151 ( -0.004 -2.307 1.994) 3.049 15.303 ( 0.417 -0.235 -0.049) 0.481 15.765 ( 4.812 -13.695 2.995) 14.821 16.483 ( -0.630 4.915 -0.070) 4.956 16.935 ( 7.525 -7.372 5.108) 11.708 17.010 ( -13.017 6.333 1.913) 14.601 17.529 ( 7.603 -1.136 -6.109) 9.819 17.929 ( 4.565 -4.612 1.958) 6.778 18.457 ( 4.921 -1.528 2.678) 5.807 18.831 ( 3.053 -3.950 -9.026) 10.315 19.176 ( 1.358 -3.449 4.123) 5.544 19.388 ( 4.075 3.949 5.804) 8.116 19.854 ( -3.103 -2.856 -0.334) 4.231 20.147 ( 3.496 -5.595 -3.821) 7.623 20.356 ( 10.992 -3.049 3.967) 12.078 20.942 ( -1.330 -4.415 -2.359) 5.179 21.252 ( 2.866 -4.027 -0.838) 5.014 21.941 ( -13.662 4.952 -0.580) 14.543 22.567 ( -5.624 -5.614 -3.060) 8.515 23.277 ( -1.623 6.622 2.399) 7.228 23.749 ( -8.751 7.068 0.392) 11.256 24.134 ( 6.766 -6.502 2.351) 9.674 24.446 ( 5.008 -2.019 -3.947) 6.688 ======================= Grid point 120 (52/138) ======================= q-point: ( 0.33 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.090 ( 33.368 -10.630 16.019) 38.511 2.606 ( 27.262 8.595 5.213) 29.056 3.069 ( 5.266 6.425 -13.747) 16.062 3.152 ( 5.633 11.694 -8.521) 15.528 3.558 ( -8.865 -2.933 -0.869) 9.378 3.811 ( 4.557 -4.555 2.204) 6.810 4.286 ( 7.504 11.719 1.340) 13.980 4.349 ( 17.111 7.486 -1.572) 18.743 4.415 ( 7.777 1.642 6.422) 10.218 4.633 ( 8.957 6.019 -2.741) 11.134 4.942 ( -0.658 -4.556 -0.378) 4.619 5.175 ( -1.638 1.786 -1.545) 2.874 5.414 ( 1.722 -8.723 1.703) 9.053 5.447 ( 0.621 5.343 -9.340) 10.778 5.639 ( 7.858 -3.435 1.038) 8.639 5.923 ( -12.625 -6.498 -6.223) 15.503 6.179 ( 3.595 -0.970 -3.171) 4.891 6.296 ( -2.606 -6.914 -0.547) 7.409 6.530 ( 5.327 -3.599 -2.438) 6.876 6.635 ( -8.780 3.388 5.555) 10.928 6.989 ( 3.822 1.060 6.194) 7.355 7.293 ( 0.861 0.580 1.929) 2.191 7.433 ( -5.014 2.136 3.364) 6.404 7.497 ( 0.204 2.510 5.259) 5.830 7.727 ( -0.113 0.449 4.000) 4.026 7.791 ( -2.836 1.537 1.880) 3.734 7.960 ( 0.235 -4.748 5.600) 7.346 8.107 ( -1.384 7.831 2.766) 8.419 8.296 ( 6.905 -4.746 -8.013) 11.594 8.499 ( -8.892 -5.422 4.072) 11.182 8.960 ( -3.181 -2.613 -13.156) 13.785 8.986 ( 0.532 -8.779 -7.018) 11.252 9.192 ( -3.232 -7.585 -0.210) 8.247 9.556 ( -3.903 0.489 -9.785) 10.546 9.803 ( 10.627 1.114 -2.162) 10.901 10.023 ( -7.572 -4.328 8.444) 12.140 10.671 ( 0.515 9.167 9.823) 13.446 10.986 ( -1.731 5.932 0.671) 6.215 12.825 ( 5.205 -0.409 -0.707) 5.269 13.022 ( 2.139 1.598 -1.316) 2.976 13.133 ( 1.134 -1.301 -1.412) 2.229 13.235 ( -2.024 2.838 0.265) 3.496 13.492 ( -7.763 0.747 2.465) 8.179 13.706 ( -4.875 0.768 -5.635) 7.491 14.435 ( -2.689 -0.540 -0.810) 2.860 14.586 ( 1.669 1.659 -5.839) 6.295 14.738 ( 5.377 1.286 -0.387) 5.543 14.898 ( -0.171 -3.841 4.380) 5.828 15.026 ( 0.926 2.014 1.353) 2.597 15.161 ( 0.350 -1.666 2.600) 3.107 15.326 ( 1.613 -0.496 3.141) 3.566 15.848 ( 2.826 -12.631 1.626) 13.045 16.480 ( 0.637 5.502 -1.947) 5.871 16.774 ( -11.028 5.663 0.083) 12.397 17.078 ( 5.628 -6.136 5.072) 9.749 17.643 ( 4.293 -3.370 -6.114) 8.195 18.056 ( 7.886 -5.824 3.570) 10.433 18.585 ( 6.212 -2.905 6.091) 9.173 18.838 ( -0.922 -6.257 -8.332) 10.461 19.153 ( -1.205 -6.946 -1.411) 7.190 19.485 ( 2.518 2.608 5.776) 6.820 19.829 ( 0.326 0.918 -0.202) 0.995 20.183 ( 1.305 -5.613 -2.002) 6.101 20.585 ( 9.558 -5.683 2.902) 11.492 20.926 ( 0.745 -0.851 -1.435) 1.827 21.253 ( -2.607 0.574 -1.081) 2.880 21.734 ( -6.222 5.656 -0.291) 8.414 22.437 ( -6.345 -6.516 -3.532) 9.757 23.257 ( -1.114 5.100 2.958) 6.000 23.608 ( -5.253 7.806 -2.051) 9.630 24.242 ( 3.411 -7.601 4.426) 9.434 24.519 ( 3.263 -3.128 -3.550) 5.747 ======================= Grid point 121 (53/138) ======================= q-point: ( 0.44 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.697 ( 20.565 -3.812 15.162) 25.833 3.043 ( -8.692 -5.162 -3.286) 10.630 3.115 ( 5.277 6.851 -7.465) 11.424 3.218 ( 22.379 -4.144 -4.580) 23.216 3.461 ( 2.089 6.097 5.283) 8.334 3.823 ( -1.461 0.198 -2.626) 3.012 4.258 ( -5.972 9.770 -6.794) 13.314 4.567 ( 0.060 1.160 3.837) 4.009 4.626 ( 6.171 9.015 -3.655) 11.520 4.710 ( -1.318 -2.742 -0.200) 3.049 4.974 ( 9.921 -5.228 -2.505) 11.490 5.175 ( -0.645 -0.522 -4.125) 4.207 5.380 ( -7.589 -9.314 -2.409) 12.253 5.428 ( 2.231 -2.962 -7.262) 8.154 5.674 ( -1.156 -7.966 -1.405) 8.171 5.824 ( 3.775 1.339 5.995) 7.210 6.192 ( -8.131 -7.069 -3.493) 11.326 6.237 ( 1.164 -1.115 -0.211) 1.625 6.527 ( -3.018 -1.126 5.587) 6.449 6.653 ( 5.614 -7.049 -0.704) 9.039 7.054 ( -0.068 0.323 8.526) 8.532 7.280 ( -3.073 1.335 2.032) 3.919 7.400 ( 3.347 7.455 5.017) 9.589 7.484 ( -3.066 3.190 7.109) 8.373 7.718 ( -1.026 1.039 2.448) 2.851 7.787 ( 1.441 0.301 -0.600) 1.590 7.973 ( -0.925 -3.262 5.139) 6.156 8.094 ( -1.150 4.364 3.258) 5.566 8.348 ( -3.904 -1.786 0.675) 4.346 8.397 ( 2.822 -5.678 -3.119) 7.066 8.808 ( -5.074 -5.882 -9.624) 12.368 9.069 ( 6.948 -5.862 -11.856) 14.940 9.181 ( 2.699 -3.609 -2.586) 5.195 9.448 ( -4.235 1.375 -10.005) 10.951 9.867 ( -9.086 -3.346 6.012) 11.397 10.004 ( 8.575 0.007 1.086) 8.644 10.730 ( 2.374 9.013 6.716) 11.488 10.913 ( -5.346 9.248 2.966) 11.086 12.936 ( 5.867 -0.612 -1.535) 6.096 13.027 ( -1.422 0.262 -1.345) 1.975 13.147 ( 0.868 1.136 0.132) 1.436 13.195 ( -1.620 0.454 -1.192) 2.062 13.369 ( -5.339 2.899 4.016) 7.283 13.635 ( -0.853 1.921 -2.953) 3.624 14.388 ( -1.516 -0.927 -1.957) 2.643 14.626 ( 3.492 1.023 -7.736) 8.550 14.836 ( 2.754 -0.776 4.009) 4.925 14.878 ( -1.285 -0.273 0.593) 1.441 15.046 ( 0.978 1.575 1.058) 2.135 15.176 ( 0.877 -0.921 0.531) 1.378 15.374 ( 1.614 -1.859 8.763) 9.103 15.877 ( -0.187 -11.352 -0.395) 11.361 16.506 ( 2.665 6.742 -2.959) 7.831 16.582 ( -7.999 5.480 -2.563) 10.029 17.168 ( 1.712 -5.652 6.234) 8.587 17.674 ( 1.153 -6.811 -5.952) 9.118 18.225 ( 6.680 -4.662 4.334) 9.227 18.653 ( -2.058 -6.332 2.437) 7.089 18.798 ( 0.025 -7.996 -0.882) 8.044 19.168 ( 3.481 -6.613 -6.295) 9.772 19.509 ( -0.977 1.727 6.946) 7.224 19.837 ( -0.069 3.120 -1.521) 3.472 20.209 ( 1.815 -4.882 0.754) 5.263 20.656 ( -2.388 -6.414 -6.591) 9.502 20.995 ( 5.048 1.220 4.291) 6.737 21.175 ( -3.334 3.261 -0.292) 4.673 21.704 ( 2.208 4.328 3.331) 5.891 22.317 ( -4.437 -7.400 -5.497) 10.230 23.242 ( -1.366 4.682 3.758) 6.157 23.536 ( -1.279 7.706 -4.169) 8.855 24.289 ( 0.386 -7.702 4.632) 8.996 24.560 ( 1.695 -3.609 -2.924) 4.945 ======================= Grid point 122 (54/138) ======================= q-point: (-0.44 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.588 ( -23.749 -2.081 4.984) 24.355 2.999 ( -3.098 4.873 5.379) 7.892 3.135 ( 1.392 2.979 -6.119) 6.946 3.483 ( -2.358 -0.146 1.076) 2.596 3.702 ( 11.413 3.418 5.575) 13.154 3.866 ( 10.354 -5.771 10.255) 15.674 4.101 ( -5.816 7.873 -13.582) 16.741 4.373 ( -11.585 -2.098 -9.563) 15.168 4.552 ( -8.048 6.757 -7.944) 13.173 4.699 ( -3.507 0.494 2.702) 4.454 5.070 ( -9.722 -0.612 0.981) 9.790 5.171 ( -2.804 -3.274 0.569) 4.348 5.293 ( 11.247 -11.935 -7.921) 18.212 5.498 ( 4.612 0.347 -7.106) 8.479 5.721 ( 2.659 -2.879 3.698) 5.388 5.868 ( -1.371 -7.586 3.692) 8.548 6.065 ( 0.569 0.478 -3.627) 3.703 6.254 ( 0.377 -4.632 -1.658) 4.934 6.427 ( -7.862 -3.512 1.028) 8.672 6.732 ( 1.504 -6.762 2.027) 7.217 7.017 ( -4.483 -0.641 8.917) 10.001 7.279 ( 2.438 2.955 2.125) 4.381 7.424 ( -4.156 3.377 6.306) 8.273 7.497 ( 2.880 8.065 6.888) 10.991 7.701 ( -0.958 -1.345 1.766) 2.418 7.814 ( 0.605 1.215 0.317) 1.394 7.931 ( -4.203 -3.485 3.036) 6.247 8.076 ( -0.752 4.650 3.698) 5.989 8.337 ( 3.554 1.103 0.897) 3.828 8.459 ( 3.256 -9.113 -3.116) 10.167 8.764 ( 3.627 -3.808 -11.063) 12.249 9.197 ( 7.683 -5.499 -12.217) 15.444 9.256 ( 4.667 -4.132 0.457) 6.250 9.361 ( -1.507 1.681 -10.110) 10.359 9.695 ( -8.900 -1.711 2.790) 9.483 10.152 ( 5.338 0.046 5.622) 7.753 10.669 ( -10.530 7.027 3.547) 13.147 10.890 ( 2.540 10.990 3.331) 11.761 12.935 ( -5.041 1.154 -1.490) 5.382 13.042 ( 1.515 -1.381 -0.969) 2.268 13.175 ( 3.459 0.670 0.178) 3.528 13.216 ( 3.292 1.693 1.002) 3.835 13.289 ( -2.814 1.835 0.257) 3.369 13.666 ( 4.241 2.863 -1.159) 5.247 14.371 ( 0.335 -1.004 -2.996) 3.178 14.676 ( 2.819 -0.309 -7.340) 7.869 14.796 ( -3.919 -1.675 3.307) 5.394 14.919 ( 1.721 0.765 3.225) 3.735 15.070 ( 1.245 1.121 0.243) 1.693 15.199 ( 1.585 -0.758 -1.927) 2.607 15.421 ( 0.318 -3.999 15.030) 15.556 15.834 ( -3.717 -9.804 -3.107) 10.936 16.447 ( -4.483 4.479 -3.983) 7.485 16.586 ( 6.066 8.114 -2.745) 10.496 17.155 ( -4.564 -5.934 5.590) 9.342 17.693 ( 2.438 -7.136 -5.190) 9.154 18.258 ( -5.066 -4.543 5.521) 8.763 18.583 ( -4.624 -1.925 -0.905) 5.090 18.831 ( 3.897 -13.845 1.481) 14.459 19.230 ( 3.127 -6.109 -7.244) 9.979 19.494 ( -2.300 1.797 9.011) 9.472 19.810 ( -1.914 3.409 -2.544) 4.664 20.258 ( 2.320 -4.278 3.232) 5.842 20.519 ( -8.020 -2.384 -8.848) 12.178 21.044 ( -0.935 -2.340 3.076) 3.977 21.192 ( 4.313 3.051 0.103) 5.284 21.791 ( 4.172 1.912 6.978) 8.352 22.258 ( 0.695 -5.995 -8.504) 10.428 23.216 ( -2.047 5.826 2.952) 6.845 23.542 ( 2.835 7.222 -3.671) 8.583 24.280 ( -2.255 -7.162 4.188) 8.597 24.572 ( 0.091 -3.772 -2.443) 4.495 ======================= Grid point 123 (55/138) ======================= q-point: (-0.33 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.114 ( -24.508 5.029 11.760) 27.645 2.761 ( -20.545 15.748 10.755) 28.031 3.103 ( -4.545 -1.481 -6.972) 8.454 3.300 ( -11.682 -7.706 -7.598) 15.924 3.793 ( -2.425 6.923 13.291) 15.181 3.878 ( -5.921 -2.333 -9.558) 11.483 4.032 ( -9.539 14.219 -2.414) 17.291 4.147 ( -15.537 13.231 3.515) 20.708 4.540 ( 6.493 0.909 -1.319) 6.688 4.571 ( -1.785 -4.681 -4.985) 7.068 4.891 ( -6.215 1.664 -2.917) 7.064 5.052 ( -6.961 -5.134 2.517) 9.009 5.476 ( 2.352 -6.224 -3.867) 7.696 5.486 ( -1.739 0.614 -9.438) 9.617 5.736 ( -1.275 1.292 7.517) 7.733 5.938 ( 8.727 -8.592 -8.261) 14.773 6.133 ( 3.082 -7.512 0.856) 8.165 6.256 ( -0.600 -1.636 -10.500) 10.643 6.308 ( 1.279 -0.362 3.081) 3.355 6.717 ( -3.461 -3.796 4.334) 6.721 6.969 ( -1.352 -1.579 7.033) 7.333 7.320 ( -0.911 1.983 2.704) 3.475 7.379 ( -0.005 3.444 3.779) 5.113 7.516 ( -1.464 4.053 3.277) 5.414 7.702 ( 0.470 0.171 1.867) 1.932 7.780 ( -4.710 0.482 1.322) 4.915 7.878 ( -0.011 -1.097 1.900) 2.194 8.085 ( 0.530 5.034 3.648) 6.239 8.433 ( 1.458 -6.568 -0.407) 6.741 8.527 ( 7.089 -3.941 1.760) 8.300 8.879 ( 8.849 0.668 -14.342) 16.866 9.245 ( 0.740 -5.861 -5.951) 8.385 9.335 ( 3.510 -3.054 -3.702) 5.946 9.426 ( 8.283 -4.661 -4.581) 10.551 9.550 ( -4.944 0.051 -1.912) 5.301 10.185 ( -7.720 5.105 10.589) 14.064 10.454 ( -7.383 4.362 2.303) 8.879 10.943 ( 1.585 7.737 0.613) 7.922 12.826 ( -5.124 1.132 -0.899) 5.324 13.019 ( -3.183 1.516 -0.299) 3.538 13.199 ( -0.934 5.233 4.230) 6.793 13.285 ( 3.739 -3.565 -1.216) 5.307 13.368 ( 9.511 -1.352 -3.722) 10.302 13.779 ( 7.159 2.567 -1.919) 7.843 14.387 ( 1.957 -0.714 -3.492) 4.066 14.676 ( -1.632 -1.365 -0.051) 2.128 14.766 ( 1.017 -1.858 -3.260) 3.887 14.928 ( -1.826 0.432 4.625) 4.991 15.099 ( 1.799 -0.420 0.442) 1.900 15.227 ( 1.691 -0.691 -2.882) 3.412 15.450 ( -1.647 -8.275 20.501) 22.170 15.723 ( -6.220 -8.467 -5.830) 12.015 16.383 ( -1.179 1.997 -3.802) 4.453 16.741 ( 10.199 9.593 -1.094) 14.044 17.024 ( -9.130 -5.723 3.173) 11.233 17.745 ( 3.487 -5.432 -3.469) 7.328 18.111 ( -9.573 -4.130 5.343) 11.715 18.434 ( -9.914 0.866 -0.425) 9.960 18.958 ( 7.210 -13.729 -0.167) 15.508 19.218 ( -2.687 -5.820 -6.562) 9.173 19.463 ( -2.940 2.693 10.381) 11.121 19.777 ( -0.289 1.762 -2.527) 3.094 20.267 ( -4.399 -3.411 -0.985) 5.653 20.375 ( -2.731 -3.971 -1.075) 4.938 21.026 ( -1.239 -3.667 1.373) 4.107 21.256 ( 0.829 -0.378 -1.283) 1.574 21.882 ( 4.541 -0.368 4.542) 6.433 22.319 ( 6.969 -1.632 -8.153) 10.850 23.181 ( -1.809 7.903 1.448) 8.236 23.625 ( 5.886 7.114 -1.396) 9.339 24.221 ( -4.501 -5.760 3.376) 8.052 24.552 ( -1.627 -3.989 -2.312) 4.889 ======================= Grid point 124 (56/138) ======================= q-point: (-0.22 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.738 ( -15.467 20.015 17.875) 30.974 2.344 ( -22.681 24.042 16.756) 37.056 2.847 ( -13.343 -8.332 -21.487) 26.630 3.178 ( -3.085 -0.957 4.569) 5.595 3.537 ( -30.202 22.391 12.323) 39.564 3.675 ( -12.546 6.306 -8.485) 16.406 3.794 ( -8.126 9.899 -7.165) 14.675 3.905 ( -6.082 12.142 12.151) 18.222 4.390 ( -9.066 2.843 0.993) 9.553 4.742 ( 2.838 -6.387 -11.221) 13.220 4.758 ( -7.756 4.139 -9.514) 12.954 5.047 ( 7.425 -8.419 8.631) 14.160 5.324 ( -7.285 4.479 -2.899) 9.030 5.518 ( -0.375 -3.306 -2.714) 4.294 5.712 ( -2.137 -0.304 9.356) 9.602 6.050 ( 2.180 -3.198 -6.644) 7.689 6.169 ( 2.855 -5.885 -1.787) 6.781 6.241 ( 2.413 1.954 -13.498) 13.850 6.486 ( 12.539 -2.034 -1.509) 12.792 6.644 ( -3.679 0.442 6.014) 7.064 7.005 ( 3.055 -1.809 3.829) 5.222 7.288 ( -1.099 -1.238 -1.556) 2.272 7.395 ( -0.565 1.138 0.399) 1.332 7.515 ( 2.848 0.362 0.904) 3.009 7.686 ( -3.777 0.269 -0.262) 3.796 7.713 ( 0.032 2.900 0.355) 2.922 7.916 ( 2.446 0.222 3.688) 4.431 8.107 ( 0.518 3.730 4.021) 5.508 8.385 ( -4.923 -4.795 2.002) 7.158 8.702 ( 7.589 -7.057 4.999) 11.506 8.961 ( 3.139 9.659 -19.436) 21.929 9.288 ( 3.958 -8.075 -1.185) 9.071 9.371 ( -1.084 -0.080 -1.929) 2.214 9.468 ( 0.005 -4.325 0.104) 4.327 9.626 ( 10.150 -6.492 -5.657) 13.310 9.887 ( -18.522 12.722 4.945) 23.008 10.431 ( 0.675 -1.491 5.217) 5.468 10.945 ( -1.300 4.782 -1.287) 5.120 12.743 ( -2.926 2.512 -0.271) 3.866 12.929 ( -5.295 2.349 -0.063) 5.793 13.232 ( 2.952 4.214 2.287) 5.631 13.321 ( -0.284 -4.764 1.460) 4.991 13.563 ( 10.473 -2.944 -5.532) 12.205 13.921 ( 7.408 1.650 -4.723) 8.939 14.430 ( 3.175 -0.448 -2.489) 4.059 14.660 ( 0.076 -2.758 3.515) 4.468 14.784 ( 1.354 -2.059 -4.037) 4.730 14.872 ( -4.467 0.326 4.469) 6.327 15.140 ( 1.804 -1.642 0.722) 2.544 15.251 ( 1.176 -1.062 -2.203) 2.714 15.441 ( -4.628 -15.048 23.579) 28.352 15.581 ( -5.970 -8.731 -7.191) 12.789 16.383 ( 1.833 -0.214 -2.167) 2.846 16.837 ( -9.761 -3.093 1.774) 10.392 16.987 ( 14.639 8.213 1.610) 16.863 17.786 ( -0.112 -5.338 -0.875) 5.410 17.942 ( -7.608 0.627 3.162) 8.263 18.227 ( -9.711 0.898 -2.618) 10.098 18.993 ( -4.940 -4.788 -5.802) 8.999 19.206 ( 4.291 -11.323 3.041) 12.485 19.426 ( -3.302 2.814 11.489) 12.281 19.784 ( 1.279 -0.462 -4.168) 4.384 20.123 ( -7.379 -3.380 -3.666) 8.905 20.354 ( -2.431 -7.575 3.659) 8.756 20.997 ( -1.791 -3.551 -1.128) 4.134 21.198 ( -5.458 -4.350 -2.274) 7.340 22.037 ( 10.811 0.956 2.027) 11.041 22.459 ( 8.062 0.381 -6.528) 10.380 23.160 ( -0.270 10.223 0.871) 10.264 23.759 ( 7.522 7.979 0.500) 10.977 24.123 ( -5.743 -3.417 1.692) 6.894 24.494 ( -3.753 -4.584 -2.601) 6.470 ======================= Grid point 125 (57/138) ======================= q-point: (-0.11 0.18 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.591 ( -6.185 31.713 16.057) 36.081 2.033 ( -10.050 34.063 14.632) 38.411 2.607 ( -6.618 0.163 -22.537) 23.489 2.848 ( -30.711 34.033 22.692) 51.150 3.207 ( -1.634 -3.835 11.313) 12.057 3.438 ( -9.870 12.588 -7.950) 17.862 3.600 ( -7.973 16.382 -10.784) 21.171 3.868 ( -1.694 4.850 10.057) 11.294 4.245 ( -4.517 1.139 -0.206) 4.663 4.591 ( -5.313 0.110 -10.182) 11.485 4.679 ( -5.208 -6.620 -4.951) 9.770 5.121 ( -2.765 1.690 -1.225) 3.464 5.319 ( 6.274 1.220 2.134) 6.738 5.479 ( -2.507 -1.943 -0.606) 3.229 5.715 ( -0.524 0.372 9.055) 9.077 6.034 ( -0.926 2.272 -4.638) 5.247 6.210 ( -0.346 3.307 -2.044) 3.903 6.248 ( 2.323 -2.959 -11.365) 11.971 6.643 ( 4.149 2.859 1.959) 5.406 6.731 ( 10.096 -0.826 0.433) 10.139 7.049 ( -0.501 -0.307 1.449) 1.564 7.290 ( 1.876 -3.397 -4.995) 6.325 7.378 ( 0.315 -2.911 -3.411) 4.495 7.576 ( -1.005 -4.699 -2.681) 5.502 7.693 ( 3.997 -2.376 -1.448) 4.870 7.719 ( 4.288 5.352 1.478) 7.015 7.975 ( 3.288 2.741 1.028) 4.402 8.099 ( -3.121 2.278 1.972) 4.338 8.289 ( -3.845 -0.554 2.388) 4.560 8.810 ( 1.041 -9.894 6.907) 12.112 8.975 ( 2.658 12.632 -11.161) 17.065 9.172 ( -18.721 8.210 11.541) 23.475 9.330 ( -0.397 -7.678 1.674) 7.869 9.505 ( 4.276 -2.970 -7.751) 9.337 9.732 ( 6.650 10.012 -12.386) 17.259 9.806 ( 8.109 -9.292 -5.566) 13.530 10.455 ( 0.204 -2.605 7.209) 7.668 10.894 ( -2.907 2.359 -2.915) 4.745 12.711 ( -0.425 3.872 0.356) 3.911 12.833 ( -4.049 2.049 0.168) 4.541 13.261 ( -3.915 -0.676 3.620) 5.375 13.317 ( 2.245 -1.708 1.665) 3.276 13.731 ( 7.336 -2.855 -6.230) 10.039 14.024 ( 4.139 0.420 -9.256) 10.148 14.502 ( 4.322 -0.715 0.579) 4.419 14.668 ( -1.871 -3.243 3.070) 4.842 14.779 ( -2.601 -0.549 5.138) 5.785 14.832 ( 2.095 -1.858 -0.873) 2.933 15.160 ( 0.102 -1.704 -0.757) 1.867 15.229 ( -5.891 -7.287 7.086) 11.748 15.356 ( -7.343 -13.852 13.644) 20.784 15.507 ( 0.562 -11.840 -3.389) 12.328 16.450 ( 5.159 -2.012 1.116) 5.649 16.668 ( -7.440 0.350 2.262) 7.784 17.298 ( 13.882 -1.424 1.333) 14.018 17.717 ( -4.399 -2.041 7.641) 9.050 17.834 ( -4.902 6.578 -8.218) 11.612 18.080 ( -3.846 -0.859 -2.627) 4.736 18.872 ( -3.812 -1.736 -3.538) 5.483 19.245 ( -6.318 -13.975 7.903) 17.253 19.391 ( -2.114 6.668 9.279) 11.620 19.813 ( 4.220 -1.617 -5.815) 7.365 20.001 ( -3.307 -2.041 -2.427) 4.582 20.257 ( -7.533 -7.708 0.630) 10.796 20.965 ( 0.124 -2.407 -2.130) 3.216 21.094 ( -4.004 -5.395 0.722) 6.757 22.278 ( 10.988 -1.725 2.958) 11.509 22.586 ( 5.965 -0.985 -5.787) 8.369 23.188 ( 3.162 11.987 1.904) 12.543 23.881 ( 2.190 9.621 -2.085) 10.085 24.048 ( 1.112 -1.085 0.133) 1.560 24.383 ( -7.199 -4.840 -2.785) 9.111 ======================= Grid point 126 (58/138) ======================= q-point: ( 0.00 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.109 ( -5.496 32.200 5.231) 33.082 2.608 ( -16.229 36.362 1.744) 39.857 2.727 ( 7.481 13.364 -11.708) 19.278 3.179 ( 2.845 -2.823 9.567) 10.373 3.309 ( 7.179 27.697 16.102) 32.832 3.540 ( -3.694 15.585 -8.469) 18.118 3.791 ( 1.031 2.022 -6.918) 7.281 3.955 ( 1.942 11.675 0.519) 11.847 4.180 ( -2.962 -2.178 5.887) 6.940 4.497 ( -3.672 1.065 -5.395) 6.613 4.616 ( 2.958 6.577 9.969) 12.304 5.108 ( -0.606 0.092 2.017) 2.108 5.377 ( -0.802 -3.498 3.508) 5.019 5.526 ( 3.655 5.673 -6.847) 9.613 5.651 ( -6.488 -0.784 2.087) 6.861 6.131 ( 3.750 3.551 -0.890) 5.240 6.190 ( 0.738 0.200 -2.975) 3.072 6.359 ( 4.499 6.994 -10.631) 13.497 6.782 ( 4.530 -2.243 -0.628) 5.094 6.856 ( 1.064 0.370 0.483) 1.226 6.997 ( -3.750 -0.442 -3.512) 5.157 7.205 ( 1.141 -6.770 -0.253) 6.870 7.310 ( 1.951 -3.440 -3.535) 5.304 7.468 ( 1.701 -4.636 -0.541) 4.967 7.642 ( -3.268 -1.658 -3.287) 4.923 7.810 ( 2.254 -1.588 0.634) 2.829 7.987 ( -4.414 -0.084 3.446) 5.600 8.183 ( 1.470 1.971 -5.589) 6.106 8.423 ( 9.310 4.927 -0.048) 10.534 8.613 ( -0.965 -8.440 5.995) 10.398 8.937 ( -9.636 -6.114 4.645) 12.321 9.062 ( -11.382 10.410 5.486) 16.372 9.156 ( -1.821 -6.047 6.986) 9.417 9.398 ( 2.088 -9.529 2.291) 10.021 9.722 ( 3.362 -7.693 -12.258) 14.858 10.185 ( 8.563 4.838 -4.381) 10.767 10.405 ( 3.033 -2.036 -3.256) 4.893 10.855 ( 0.992 -1.103 -3.703) 3.989 12.788 ( -3.233 3.774 -0.085) 4.970 12.859 ( 3.397 5.006 0.311) 6.058 13.095 ( -4.978 -3.179 7.994) 9.939 13.405 ( 0.654 2.881 0.514) 2.998 13.733 ( 1.993 -4.977 -3.752) 6.544 14.011 ( -0.350 -2.644 -9.407) 9.778 14.552 ( -3.625 -1.535 -0.474) 3.965 14.583 ( 4.298 -1.312 0.061) 4.494 14.703 ( -3.865 -3.037 5.292) 7.223 14.767 ( -3.363 -3.287 10.744) 11.728 14.959 ( -1.245 -0.519 0.149) 1.357 15.105 ( -0.117 -3.393 -0.602) 3.448 15.242 ( 0.655 -4.220 -1.627) 4.570 15.299 ( 2.279 -11.329 0.150) 11.557 16.545 ( 5.180 1.183 4.687) 7.085 16.645 ( -2.979 4.954 2.785) 6.417 17.261 ( 2.889 -7.636 -2.628) 8.576 17.530 ( -7.609 -5.532 2.170) 9.654 17.920 ( -5.095 6.693 -3.900) 9.272 18.148 ( 9.242 1.039 -3.920) 10.093 18.860 ( 4.166 -1.446 1.485) 4.653 18.931 ( -5.969 -4.614 3.156) 8.178 19.513 ( -3.472 6.453 2.628) 7.784 19.869 ( 6.964 -6.208 -2.997) 9.799 19.925 ( -0.355 -3.763 0.924) 3.891 20.021 ( -3.100 -1.610 -0.555) 3.537 20.936 ( -1.215 -3.314 0.659) 3.591 20.956 ( 1.977 -3.159 0.344) 3.743 22.328 ( -0.366 -2.794 2.393) 3.697 22.555 ( 0.728 -5.953 -2.975) 6.695 23.465 ( 1.861 9.112 6.022) 11.080 23.927 ( -1.271 1.419 -1.940) 2.719 24.161 ( -4.886 -0.270 -2.349) 5.427 24.220 ( 4.520 1.221 -4.084) 6.213 ======================= Grid point 127 (59/138) ======================= q-point: ( 0.11 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.965 ( -11.503 40.926 -10.764) 43.853 2.326 ( -3.681 28.144 17.645) 33.421 2.921 ( 11.026 11.538 -6.681) 17.301 3.284 ( 4.585 -3.507 12.121) 13.426 3.417 ( -0.523 13.582 -13.813) 19.378 3.623 ( 10.851 13.955 1.979) 17.788 3.884 ( 10.994 6.118 -3.459) 13.048 4.061 ( 6.897 13.868 7.682) 17.289 4.184 ( 2.511 -5.223 5.560) 8.031 4.472 ( 3.521 4.934 -6.753) 9.075 4.769 ( 9.032 5.214 7.848) 13.053 5.132 ( 2.727 -2.990 3.046) 5.065 5.359 ( -2.824 -3.199 4.645) 6.307 5.527 ( -0.482 5.507 -8.527) 10.162 5.536 ( -4.997 2.894 -0.141) 5.776 6.150 ( 0.154 4.735 -3.688) 6.004 6.234 ( 2.223 -2.121 -1.003) 3.232 6.365 ( -2.173 6.774 -8.533) 11.109 6.689 ( -11.913 -1.987 -2.204) 12.277 6.865 ( 1.279 -0.830 4.810) 5.046 6.945 ( -2.032 -2.024 -4.148) 5.043 7.231 ( 1.465 -2.631 2.098) 3.670 7.390 ( 5.191 -3.212 -2.457) 6.580 7.505 ( -1.534 -1.958 -5.450) 5.991 7.576 ( 1.850 -3.317 3.996) 5.513 7.835 ( 0.581 -0.731 -0.509) 1.063 7.945 ( -0.736 0.287 2.188) 2.327 8.175 ( -1.664 -0.911 -2.296) 2.978 8.532 ( -0.777 -6.702 1.859) 6.998 8.561 ( -7.480 7.793 8.066) 13.481 8.779 ( -3.849 -9.272 -1.260) 10.118 8.945 ( 1.274 5.216 1.103) 5.481 9.157 ( -0.954 -7.072 1.613) 7.316 9.462 ( 4.261 -6.360 1.329) 7.770 9.717 ( -0.458 -4.955 -13.950) 14.811 10.159 ( -7.968 -5.972 12.032) 15.618 10.590 ( 12.480 2.034 -9.806) 16.001 10.921 ( 5.272 0.377 -1.490) 5.491 12.748 ( -0.542 2.587 -0.927) 2.801 12.940 ( 4.363 5.362 -0.192) 6.915 13.041 ( -1.683 -2.325 5.877) 6.541 13.397 ( -1.581 3.248 1.404) 3.875 13.711 ( -3.082 -3.887 -2.105) 5.389 13.951 ( -3.736 -1.563 -8.535) 9.447 14.497 ( -1.199 -0.208 -2.869) 3.116 14.625 ( -1.182 -3.452 0.125) 3.651 14.680 ( -0.059 0.094 8.223) 8.224 14.717 ( -0.845 -1.801 4.770) 5.168 14.984 ( 2.735 0.930 -0.355) 2.911 15.104 ( -0.060 -2.801 0.384) 2.828 15.267 ( 1.202 -2.308 -1.401) 2.956 15.373 ( 5.371 -14.203 1.596) 15.268 16.601 ( -1.432 5.592 2.718) 6.380 16.676 ( 6.041 -1.915 4.863) 7.988 17.307 ( -3.978 -6.556 0.513) 7.685 17.376 ( -1.055 1.322 -3.355) 3.757 17.838 ( -2.067 0.254 -1.677) 2.674 18.315 ( 7.391 -1.150 -3.088) 8.092 18.808 ( -3.802 -0.994 -1.745) 4.300 18.997 ( 5.309 -5.200 4.463) 8.669 19.453 ( -2.072 5.120 2.657) 6.129 19.853 ( -2.423 -3.349 -1.680) 4.462 20.029 ( 2.858 -1.668 -1.616) 3.682 20.069 ( 9.775 -4.342 1.626) 10.819 20.904 ( -1.195 -2.450 -0.421) 2.758 21.046 ( 5.743 -4.890 0.805) 7.586 22.230 ( -9.149 0.058 1.426) 9.260 22.535 ( -2.464 -6.753 -2.356) 7.564 23.477 ( -1.974 8.918 5.750) 10.793 23.946 ( 3.376 -0.858 -0.780) 3.569 24.012 ( -7.635 2.743 -2.601) 8.519 24.319 ( 4.786 -1.499 -3.749) 6.261 ======================= Grid point 128 (60/138) ======================= q-point: ( 0.22 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.791 ( 0.644 30.205 -4.440) 30.536 2.487 ( 13.516 20.240 9.374) 26.081 3.099 ( 7.482 8.144 -4.018) 11.766 3.362 ( 3.174 12.128 -9.059) 15.467 3.466 ( 5.845 -5.243 9.141) 12.050 3.684 ( -2.107 -1.233 -7.297) 7.694 4.149 ( 11.142 1.731 -0.153) 11.277 4.188 ( 6.938 0.121 0.691) 6.974 4.373 ( 13.389 11.147 7.615) 19.014 4.616 ( 11.187 11.507 -1.500) 16.118 4.924 ( 4.020 3.876 0.328) 5.594 5.207 ( 0.514 -4.281 9.592) 10.517 5.327 ( 1.625 -5.686 2.914) 6.592 5.418 ( -4.999 2.364 -3.535) 6.563 5.522 ( 0.435 1.532 -8.869) 9.011 6.136 ( -2.719 4.270 -6.049) 7.888 6.194 ( -10.155 -1.334 -8.376) 13.231 6.255 ( 0.218 -0.999 -0.014) 1.023 6.506 ( -4.794 2.513 0.234) 5.418 6.841 ( -7.064 -2.270 -2.037) 7.695 6.913 ( 1.794 -0.945 7.549) 7.817 7.252 ( 0.398 -1.441 2.156) 2.623 7.461 ( 2.385 -2.381 -0.558) 3.416 7.487 ( 0.073 -2.016 2.529) 3.235 7.647 ( 2.720 -2.856 2.512) 4.675 7.850 ( 0.871 -0.797 2.129) 2.435 7.922 ( -3.258 0.599 2.806) 4.341 8.148 ( 1.578 -1.701 -3.716) 4.381 8.405 ( -8.101 12.839 7.610) 16.982 8.480 ( -3.448 -8.016 1.659) 8.882 8.770 ( 2.771 -9.038 -7.147) 11.851 8.944 ( -4.648 -8.330 -1.050) 9.597 9.130 ( -1.847 -5.035 0.824) 5.426 9.603 ( 9.848 0.959 -4.712) 10.959 9.657 ( -1.568 -2.291 -12.400) 12.707 10.034 ( -6.595 -6.533 9.439) 13.239 10.756 ( 5.379 4.918 2.129) 7.593 11.022 ( 4.633 1.706 -1.393) 5.130 12.760 ( 1.947 1.268 -1.341) 2.682 13.011 ( 2.556 1.519 -1.785) 3.468 13.058 ( 2.292 -0.199 2.625) 3.491 13.360 ( -2.303 4.264 1.616) 5.109 13.621 ( -5.589 -1.596 1.651) 6.042 13.838 ( -5.489 -0.036 -6.348) 8.392 14.477 ( -0.951 0.271 -2.871) 3.036 14.592 ( -1.243 -2.363 -3.606) 4.487 14.697 ( 2.868 3.666 4.219) 6.282 14.771 ( 2.560 -4.162 4.647) 6.743 15.043 ( 2.799 2.317 -0.007) 3.634 15.109 ( 0.439 -2.049 2.284) 3.099 15.281 ( 0.743 -2.022 -0.422) 2.195 15.495 ( 6.034 -13.628 1.487) 14.978 16.585 ( -0.343 5.539 -0.464) 5.569 16.804 ( 4.905 -4.641 6.091) 9.094 17.121 ( -9.619 3.226 0.317) 10.150 17.468 ( 5.577 -5.246 -3.889) 8.588 17.835 ( 2.211 -3.877 0.140) 4.466 18.429 ( 5.018 -1.808 0.941) 5.416 18.766 ( -0.411 -2.938 -5.793) 6.508 19.024 ( -3.119 -10.815 1.938) 11.422 19.484 ( 3.759 5.813 4.377) 8.190 19.837 ( 1.069 1.252 -0.213) 1.660 20.073 ( 2.007 -2.772 -3.319) 4.767 20.281 ( 10.766 -4.640 2.924) 12.082 20.896 ( 0.672 -0.669 -0.591) 1.117 21.160 ( 5.282 -5.091 -0.413) 7.348 22.018 ( -11.498 3.148 0.451) 11.930 22.443 ( -6.179 -7.030 -2.007) 9.572 23.434 ( -2.912 8.972 3.833) 10.182 23.863 ( -6.698 4.936 -2.403) 8.660 24.030 ( 4.143 -4.213 2.793) 6.535 24.389 ( 3.336 -3.801 -4.044) 6.475 ======================= Grid point 129 (61/138) ======================= q-point: ( 0.33 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.020 ( 21.250 5.553 3.347) 22.217 2.839 ( 19.948 14.150 2.036) 24.541 3.151 ( -2.833 -0.171 -5.739) 6.402 3.368 ( -0.956 11.053 -15.223) 18.837 3.571 ( -0.150 2.948 9.883) 10.315 3.684 ( 7.338 -5.037 3.764) 9.663 4.292 ( 6.489 -9.362 -0.329) 11.396 4.357 ( 8.109 -1.169 -7.300) 10.974 4.636 ( 9.569 14.032 8.233) 18.874 4.791 ( 2.119 7.188 -3.343) 8.206 4.952 ( 1.623 5.791 -0.547) 6.039 5.194 ( -4.787 -10.868 -3.344) 12.337 5.222 ( -5.227 -2.902 1.751) 6.230 5.432 ( -1.579 -4.869 -6.193) 8.034 5.566 ( 8.292 -2.204 3.298) 9.192 5.896 ( -10.825 3.382 -7.290) 13.482 6.144 ( -0.379 -1.076 -6.485) 6.585 6.263 ( 0.130 2.952 2.323) 3.759 6.473 ( 0.431 -1.371 1.750) 2.265 6.672 ( -8.834 -0.259 2.401) 9.158 6.983 ( 2.568 -2.115 9.613) 10.172 7.261 ( -0.680 -3.986 3.290) 5.213 7.448 ( -1.795 -0.814 3.549) 4.060 7.528 ( 2.124 -1.525 3.466) 4.342 7.690 ( 1.062 -2.361 3.243) 4.150 7.845 ( -3.125 -1.008 0.333) 3.300 7.883 ( 0.971 2.403 4.542) 5.229 8.212 ( 4.336 -3.467 -6.586) 8.614 8.287 ( -5.664 8.709 7.041) 12.550 8.429 ( -1.994 -0.533 1.435) 2.513 8.780 ( -6.885 -11.601 -1.146) 13.539 8.845 ( 3.477 -7.341 -10.329) 13.141 9.092 ( -1.026 -5.008 -2.693) 5.778 9.573 ( -3.112 0.798 -8.521) 9.107 9.824 ( 11.400 1.107 -5.099) 12.538 9.932 ( -5.843 -4.578 4.116) 8.488 10.842 ( 2.891 8.314 6.747) 11.091 11.077 ( 0.983 3.502 -0.462) 3.667 12.814 ( 3.789 -0.472 -1.499) 4.102 13.031 ( 0.060 -2.645 -2.937) 3.953 13.120 ( 3.071 2.492 0.626) 4.004 13.317 ( -2.404 4.947 1.120) 5.613 13.516 ( -5.536 1.338 5.386) 7.839 13.728 ( -4.013 1.538 -3.594) 5.602 14.432 ( -2.498 0.503 -2.540) 3.598 14.589 ( 1.806 -1.578 -6.683) 7.100 14.774 ( 2.159 0.623 5.787) 6.208 14.835 ( 4.172 -0.535 -0.051) 4.207 15.081 ( 1.056 3.254 -0.365) 3.440 15.135 ( 1.315 -0.879 4.150) 4.441 15.298 ( 0.870 -2.464 1.598) 3.063 15.601 ( 4.176 -12.390 0.747) 13.096 16.589 ( 1.241 5.626 -2.412) 6.246 16.821 ( -5.882 -1.195 1.733) 6.247 17.025 ( 1.079 0.985 3.961) 4.222 17.525 ( 1.052 -8.404 -3.420) 9.134 17.933 ( 7.181 -6.266 0.691) 9.556 18.515 ( 2.187 -6.042 2.598) 6.931 18.733 ( -1.940 -3.905 -2.994) 5.290 18.963 ( -1.228 -10.716 -3.601) 11.371 19.560 ( 2.050 5.184 5.347) 7.724 19.886 ( 3.252 4.611 -0.002) 5.643 20.094 ( 1.101 -3.819 -2.092) 4.491 20.475 ( 7.372 -5.782 0.575) 9.387 20.937 ( 3.657 1.531 0.948) 4.076 21.233 ( 1.825 -2.535 -1.536) 3.481 21.821 ( -7.493 3.727 0.512) 8.385 22.297 ( -7.595 -7.717 -2.156) 11.040 23.391 ( -2.193 8.298 3.590) 9.303 23.746 ( -4.321 6.538 -3.612) 8.629 24.105 ( 2.352 -6.520 4.796) 8.428 24.436 ( 2.366 -5.342 -3.818) 6.980 ======================= Grid point 130 (62/138) ======================= q-point: ( 0.44 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.542 ( 27.063 -9.025 9.423) 30.044 2.944 ( -14.952 -4.330 -0.936) 15.594 3.245 ( 19.304 7.928 0.022) 20.869 3.302 ( -1.005 9.879 -14.443) 17.527 3.584 ( -1.704 2.836 5.162) 6.131 3.848 ( 7.046 3.890 1.893) 8.268 4.298 ( -8.007 -12.284 -5.690) 15.729 4.502 ( 3.327 -0.741 0.337) 3.425 4.686 ( 0.935 -2.488 -7.010) 7.497 4.760 ( -4.049 2.749 -5.353) 7.253 4.909 ( -0.918 1.200 -2.180) 2.653 5.112 ( 1.213 -6.436 -0.025) 6.550 5.242 ( 0.267 0.781 1.736) 1.922 5.403 ( 0.516 -1.538 -2.122) 2.671 5.669 ( 0.594 3.780 -2.253) 4.441 5.774 ( -0.921 -4.379 -0.847) 4.554 6.105 ( -1.693 -0.400 -5.163) 5.448 6.268 ( -0.514 3.413 2.987) 4.565 6.476 ( -2.554 -5.831 7.634) 9.940 6.559 ( -1.821 -0.118 -0.885) 2.028 7.027 ( -0.973 -2.924 10.851) 11.280 7.238 ( -1.231 -5.185 2.534) 5.901 7.442 ( -0.939 -1.063 7.349) 7.485 7.579 ( 1.873 -1.580 4.261) 4.915 7.705 ( 0.407 0.996 3.084) 3.267 7.810 ( -0.069 1.012 -1.111) 1.505 7.908 ( -0.371 0.180 4.636) 4.654 8.210 ( -3.476 6.333 5.267) 8.940 8.259 ( 2.044 -4.063 -4.816) 6.624 8.401 ( -1.243 2.826 0.054) 3.088 8.647 ( -4.084 -9.154 -1.643) 10.157 8.936 ( 7.432 -7.824 -12.843) 16.775 9.099 ( 2.362 -5.354 -3.637) 6.890 9.490 ( -3.978 1.272 -3.806) 5.651 9.817 ( -5.922 -0.830 -2.065) 6.326 10.018 ( 8.970 1.101 -2.008) 9.257 10.892 ( -0.220 7.769 5.282) 9.397 11.066 ( -1.412 6.240 1.144) 6.499 12.901 ( 5.301 -2.263 -1.867) 6.059 12.997 ( -2.698 -3.375 -3.185) 5.368 13.177 ( 2.319 2.836 0.491) 3.696 13.274 ( -1.651 5.917 0.590) 6.171 13.429 ( -4.774 3.160 5.654) 8.046 13.682 ( 0.045 2.932 -0.049) 2.933 14.385 ( -1.342 0.918 -3.472) 3.834 14.617 ( 2.474 -1.942 -7.325) 7.972 14.794 ( -1.152 -2.779 6.631) 7.281 14.921 ( 3.705 3.772 -1.696) 5.553 15.090 ( 0.337 2.210 -1.057) 2.473 15.164 ( 0.620 0.323 2.620) 2.712 15.325 ( 0.875 -3.231 6.312) 7.145 15.655 ( 1.037 -11.192 -0.240) 11.243 16.629 ( 3.517 5.784 -2.747) 7.305 16.672 ( -7.476 3.534 -2.124) 8.537 17.080 ( 1.187 -2.996 6.410) 7.174 17.520 ( 0.147 -8.933 -3.344) 9.540 18.080 ( 5.868 -9.467 1.995) 11.315 18.496 ( -2.235 -10.886 -3.385) 11.617 18.698 ( -2.525 -2.102 4.092) 5.248 18.975 ( 3.103 -11.004 -5.906) 12.868 19.590 ( 0.012 5.888 5.996) 8.404 19.926 ( 0.318 5.820 -2.117) 6.201 20.128 ( 2.699 -3.607 1.841) 4.867 20.545 ( -0.017 -5.475 -4.017) 6.790 21.027 ( 3.611 1.992 2.602) 4.876 21.222 ( -1.514 1.159 -1.870) 2.671 21.757 ( 0.477 1.563 2.516) 3.001 22.159 ( -5.013 -8.548 -3.438) 10.489 23.364 ( -1.463 7.695 3.863) 8.734 23.683 ( -0.980 7.509 -4.656) 8.890 24.142 ( 0.245 -7.486 5.277) 9.162 24.465 ( 1.406 -6.122 -3.366) 7.127 ======================= Grid point 131 (63/138) ======================= q-point: (-0.44 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.597 ( -16.893 4.094 8.362) 19.289 3.034 ( 13.643 -4.667 7.949) 16.465 3.224 ( -3.321 5.978 -10.529) 12.555 3.421 ( -11.586 -5.494 -4.324) 13.532 3.636 ( 14.799 -4.182 5.124) 16.210 3.950 ( -1.217 9.411 13.165) 16.229 4.075 ( -4.230 -7.634 -18.165) 20.153 4.419 ( -2.163 4.237 -7.696) 9.048 4.603 ( -8.534 -0.673 -6.176) 10.556 4.788 ( 0.261 5.109 -0.942) 5.202 5.038 ( 10.575 -8.657 -5.684) 14.801 5.064 ( -3.738 2.786 1.064) 4.782 5.192 ( -5.191 -0.218 1.563) 5.426 5.485 ( 8.091 -3.196 -1.233) 8.786 5.649 ( -4.544 -6.733 3.010) 8.662 5.760 ( 2.956 1.450 -7.621) 8.301 6.070 ( -1.999 0.950 -0.546) 2.279 6.251 ( -1.225 3.806 1.746) 4.363 6.410 ( -4.115 0.297 -1.693) 4.460 6.570 ( 1.344 -8.465 5.588) 10.232 6.990 ( -4.450 -2.643 8.712) 10.133 7.257 ( 1.917 -4.769 3.409) 6.167 7.425 ( -2.099 -1.713 7.144) 7.641 7.578 ( -2.656 -5.170 3.629) 6.853 7.753 ( 2.565 7.061 4.919) 8.980 7.817 ( -0.298 -0.986 -0.547) 1.167 7.881 ( -2.180 1.547 3.211) 4.178 8.176 ( -0.977 5.050 4.879) 7.089 8.297 ( 2.654 -3.325 -3.306) 5.387 8.395 ( 1.712 0.590 -2.234) 2.876 8.637 ( 3.424 -7.428 -1.908) 8.398 9.059 ( 7.185 -8.800 -14.093) 18.102 9.155 ( 3.623 -5.975 0.530) 7.008 9.403 ( -4.146 -0.058 0.243) 4.154 9.701 ( -4.138 4.033 -8.607) 10.367 10.166 ( 5.997 0.831 1.777) 6.310 10.812 ( -8.770 7.651 2.892) 11.993 11.061 ( 0.243 6.570 1.656) 6.780 12.918 ( -3.902 -1.987 -1.977) 4.805 13.011 ( 5.286 -2.588 -1.942) 6.197 13.187 ( -0.681 1.664 0.287) 1.820 13.292 ( 2.965 4.241 -1.193) 5.311 13.352 ( -3.836 5.257 5.440) 8.482 13.725 ( 3.705 3.005 1.787) 5.094 14.368 ( 0.524 0.986 -4.217) 4.362 14.648 ( 2.055 -2.528 -6.500) 7.271 14.763 ( -3.023 -1.691 4.176) 5.426 14.957 ( 0.217 3.340 1.823) 3.811 15.095 ( 0.214 0.121 -1.424) 1.445 15.175 ( 0.439 -0.868 -0.025) 0.973 15.349 ( -0.731 -3.319 10.170) 10.723 15.637 ( -2.680 -10.143 -1.448) 10.591 16.533 ( -5.515 4.374 -3.456) 7.842 16.726 ( 6.719 5.884 -2.595) 9.301 17.066 ( -4.112 -2.985 6.001) 7.864 17.542 ( 2.964 -8.462 -2.574) 9.328 18.105 ( -4.082 -10.109 2.678) 11.226 18.521 ( 6.539 -11.047 -5.149) 13.832 18.615 ( -6.822 -2.580 3.695) 8.176 19.027 ( 2.471 -11.937 -4.268) 12.916 19.595 ( -0.853 6.957 6.689) 9.689 19.892 ( -2.633 4.928 -2.926) 6.307 20.193 ( 2.448 -2.646 4.330) 5.634 20.466 ( -6.182 -3.214 -6.780) 9.722 21.033 ( -2.768 0.843 2.397) 3.757 21.229 ( 2.040 0.642 -1.612) 2.678 21.803 ( 2.277 -0.202 4.277) 4.849 22.124 ( 3.272 -7.497 -4.978) 9.576 23.349 ( -0.930 7.851 3.319) 8.575 23.690 ( 2.714 7.868 -4.259) 9.349 24.140 ( -1.535 -7.319 5.099) 9.052 24.474 ( 0.200 -6.217 -3.052) 6.928 ======================= Grid point 132 (64/138) ======================= q-point: (-0.33 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.332 ( -11.371 16.784 13.657) 24.444 3.001 ( -15.800 -5.301 -12.212) 20.661 3.066 ( -9.247 9.131 3.390) 13.431 3.235 ( -3.965 4.183 -2.538) 6.297 3.761 ( -3.629 -4.842 0.273) 6.057 3.949 ( -0.901 2.983 12.721) 13.097 4.139 ( 8.058 -4.679 -0.816) 9.354 4.388 ( -10.479 8.051 -0.597) 13.228 4.482 ( 7.261 1.362 -14.865) 16.600 4.659 ( -11.661 9.921 1.285) 15.364 4.918 ( -5.747 2.687 -0.428) 6.358 5.047 ( -8.175 3.651 -1.696) 9.113 5.297 ( 9.998 -11.346 -2.308) 15.298 5.505 ( -4.177 1.672 -0.400) 4.517 5.751 ( 11.771 -6.682 2.510) 13.766 5.806 ( 3.246 0.646 -8.379) 9.009 6.006 ( -3.079 -2.930 -3.390) 5.436 6.268 ( 3.340 2.921 -4.542) 6.350 6.344 ( -0.814 2.948 -2.671) 4.061 6.602 ( 0.115 -7.827 7.105) 10.572 6.934 ( -1.911 -2.562 6.561) 7.298 7.272 ( -1.948 -5.823 2.866) 6.777 7.419 ( 0.189 -0.418 4.677) 4.700 7.515 ( -3.718 -3.644 2.621) 5.829 7.758 ( -4.153 -1.248 -1.224) 4.506 7.798 ( 0.596 4.980 4.496) 6.736 7.895 ( 2.524 5.268 2.465) 6.340 8.178 ( -0.261 3.660 3.336) 4.959 8.328 ( 0.801 -2.634 -1.622) 3.195 8.467 ( 4.992 -2.826 0.576) 5.765 8.767 ( 9.608 -9.425 -1.395) 13.531 9.116 ( 0.870 -7.391 -4.626) 8.763 9.232 ( 2.343 -8.324 0.873) 8.691 9.362 ( 1.975 -3.478 -2.935) 4.961 9.628 ( -0.625 8.452 -13.008) 15.525 10.247 ( 0.423 1.174 6.243) 6.366 10.593 ( -12.589 9.172 0.648) 15.589 11.056 ( -1.349 3.917 0.115) 4.144 12.842 ( -3.121 0.728 -1.049) 3.372 13.059 ( -1.154 1.935 -0.129) 2.256 13.188 ( 0.412 -4.058 0.062) 4.079 13.324 ( 2.168 4.063 1.779) 4.937 13.367 ( 3.782 2.932 -0.275) 4.793 13.824 ( 5.713 1.767 0.810) 6.035 14.386 ( 2.189 0.839 -4.324) 4.918 14.652 ( -1.147 -1.389 -1.517) 2.355 14.722 ( -0.565 -2.427 -1.297) 2.809 14.944 ( -2.469 1.390 4.461) 5.284 15.090 ( -0.263 -1.395 0.557) 1.525 15.188 ( 1.089 -2.822 -1.781) 3.510 15.327 ( -4.263 -4.420 11.229) 12.799 15.547 ( -5.716 -9.089 -2.684) 11.067 16.443 ( -2.694 4.327 -3.910) 6.424 16.878 ( 8.729 4.136 -0.956) 9.707 16.963 ( -6.686 -0.709 4.236) 7.947 17.611 ( 3.817 -8.292 -1.028) 9.186 17.993 ( -6.308 -6.900 1.853) 9.531 18.458 ( -9.169 0.281 1.312) 9.266 18.682 ( 9.473 -13.357 -3.257) 16.695 19.032 ( -1.296 -10.892 -3.247) 11.439 19.586 ( -1.824 7.849 7.317) 10.884 19.830 ( -2.499 3.671 -2.364) 5.031 20.209 ( -3.228 -2.719 1.486) 4.474 20.312 ( -6.025 -2.835 -3.649) 7.593 20.983 ( -2.387 -0.827 2.035) 3.243 21.222 ( -3.183 -2.899 -2.001) 4.747 21.881 ( 5.930 0.377 2.307) 6.374 22.245 ( 8.658 -5.505 -3.812) 10.946 23.344 ( -0.125 8.876 2.231) 9.153 23.767 ( 5.840 7.537 -2.732) 9.918 24.107 ( -2.818 -6.084 4.636) 8.151 24.457 ( -1.330 -5.725 -3.193) 6.688 ======================= Grid point 133 (65/138) ======================= q-point: (-0.22 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.231 ( -2.305 28.088 12.649) 30.891 2.690 ( -11.565 3.302 -11.068) 16.345 2.859 ( -9.752 18.414 6.974) 21.973 3.172 ( -2.559 2.529 1.889) 4.064 3.690 ( -2.031 0.002 -9.628) 9.840 3.865 ( -9.834 3.689 4.844) 11.566 4.070 ( -15.846 17.196 3.984) 23.720 4.146 ( -12.112 9.547 1.023) 15.456 4.444 ( -8.677 3.878 5.400) 10.931 4.624 ( 4.473 -4.409 -5.189) 8.147 4.802 ( -9.418 -1.199 1.762) 9.656 4.970 ( 5.267 4.182 -1.548) 6.901 5.409 ( 1.335 -7.106 2.042) 7.513 5.447 ( -1.388 7.790 -2.825) 8.402 5.757 ( -2.997 3.511 4.964) 6.779 5.980 ( 4.619 -2.509 -9.203) 10.598 6.048 ( 11.520 -6.768 -8.115) 15.632 6.265 ( -0.502 0.870 -11.377) 11.421 6.465 ( 11.264 -0.080 0.845) 11.296 6.618 ( 1.059 -3.061 3.562) 4.814 6.964 ( 3.365 -3.004 3.926) 5.980 7.216 ( -3.252 -6.582 0.100) 7.343 7.404 ( -2.623 0.184 1.868) 3.225 7.497 ( 1.478 -1.648 1.681) 2.779 7.662 ( -4.843 -2.156 -1.179) 5.431 7.805 ( -0.596 3.425 1.465) 3.773 7.971 ( 4.149 6.724 3.657) 8.706 8.177 ( -0.185 3.352 -0.748) 3.439 8.318 ( -1.734 -1.497 1.801) 2.914 8.557 ( 2.964 -7.497 4.912) 9.440 8.953 ( 7.381 -8.082 -1.730) 11.081 9.123 ( 2.112 -8.007 2.550) 8.665 9.234 ( -1.946 -9.387 3.879) 10.342 9.464 ( 8.412 -8.169 -9.459) 15.065 9.608 ( 0.020 10.627 -9.473) 14.237 10.141 ( -11.843 11.308 3.619) 16.770 10.424 ( -3.164 1.478 0.356) 3.510 11.002 ( -3.903 1.138 -1.657) 4.390 12.798 ( -1.055 3.162 -0.375) 3.354 12.986 ( -5.210 3.671 0.002) 6.373 13.197 ( -0.111 -5.380 3.421) 6.376 13.360 ( 0.399 6.385 2.921) 7.032 13.492 ( 8.805 -4.280 -4.927) 10.960 13.937 ( 5.488 -0.257 -2.328) 5.967 14.432 ( 3.334 0.687 -3.454) 4.849 14.622 ( -1.216 -0.984 2.543) 2.986 14.726 ( 1.007 -4.029 -3.541) 5.458 14.878 ( -5.109 0.355 5.899) 7.812 15.095 ( 0.317 -3.040 2.314) 3.834 15.204 ( -0.654 -4.417 -4.091) 6.056 15.236 ( -5.515 -6.089 11.685) 14.284 15.413 ( -6.730 -7.961 -3.194) 10.903 16.413 ( 0.464 3.875 -2.321) 4.541 16.830 ( -6.903 1.836 4.500) 8.443 17.062 ( 9.038 -0.421 -1.258) 9.134 17.659 ( 0.313 -7.860 0.927) 7.920 17.908 ( -1.831 -2.226 1.839) 3.419 18.278 ( -8.512 3.287 -2.791) 9.542 18.834 ( 4.708 -11.397 -4.233) 13.037 18.981 ( -1.574 -9.167 1.164) 9.374 19.561 ( -1.994 8.226 7.753) 11.478 19.794 ( -0.693 1.717 -2.809) 3.365 20.064 ( -8.015 -2.922 -3.988) 9.417 20.239 ( -3.912 -4.843 2.521) 6.717 20.948 ( -1.631 -1.627 0.932) 2.485 21.112 ( -6.400 -4.348 -1.853) 7.956 22.049 ( 9.859 0.432 1.394) 9.967 22.406 ( 7.721 -5.009 -3.097) 9.711 23.358 ( 1.196 10.067 1.870) 10.309 23.899 ( 7.749 6.624 -1.428) 10.294 24.053 ( -3.524 -3.949 3.675) 6.444 24.405 ( -3.230 -4.682 -3.921) 6.909 ======================= Grid point 134 (66/138) ======================= q-point: (-0.11 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.215 ( -5.028 31.306 10.016) 33.251 2.557 ( 2.677 14.779 -8.553) 17.284 2.790 ( 0.444 24.511 2.250) 24.618 3.145 ( -0.808 -0.354 6.000) 6.065 3.490 ( -24.908 26.844 10.477) 38.089 3.626 ( -2.762 7.219 -8.701) 11.638 3.845 ( -5.291 6.421 -2.775) 8.771 3.985 ( -4.877 7.516 -0.798) 8.996 4.285 ( -8.447 4.487 6.379) 11.497 4.595 ( -4.424 -0.977 -1.297) 4.713 4.635 ( -6.173 3.583 2.291) 7.496 5.101 ( 3.182 -2.128 2.745) 4.710 5.392 ( -1.687 -1.925 5.155) 5.755 5.450 ( 3.187 6.755 -6.528) 9.920 5.733 ( -2.013 0.174 4.525) 4.955 6.048 ( 4.072 0.499 -4.102) 5.801 6.196 ( 2.576 -1.654 -7.954) 8.523 6.261 ( 5.353 2.063 -9.667) 11.241 6.678 ( 5.835 0.492 -3.671) 6.911 6.714 ( 10.916 -1.623 1.805) 11.183 7.037 ( 1.616 -2.057 0.346) 2.639 7.175 ( 0.320 -8.129 -1.744) 8.320 7.346 ( -3.228 -0.032 -1.319) 3.487 7.496 ( -2.934 -2.971 -1.724) 4.518 7.634 ( 2.982 -3.531 0.819) 4.694 7.786 ( -0.779 1.546 -0.130) 1.736 8.042 ( -0.026 2.185 7.166) 7.492 8.168 ( 0.964 5.801 -8.795) 10.580 8.302 ( 1.198 2.399 3.571) 4.466 8.603 ( 0.618 -10.564 6.006) 12.167 9.021 ( 0.583 -3.767 1.497) 4.096 9.156 ( -3.494 -9.923 0.147) 10.522 9.229 ( 1.290 -8.775 10.338) 13.621 9.481 ( -11.856 7.270 4.777) 14.705 9.627 ( 8.549 -7.209 -10.734) 15.500 10.019 ( 4.810 14.281 -15.381) 21.533 10.401 ( -0.854 -2.896 5.003) 5.844 10.907 ( -4.429 -0.935 -3.536) 5.744 12.801 ( 1.352 5.277 0.065) 5.448 12.880 ( -5.064 3.071 0.229) 5.927 13.173 ( -3.815 -5.203 6.616) 9.241 13.379 ( 1.351 4.668 0.904) 4.943 13.647 ( 7.299 -5.415 -4.817) 10.286 14.009 ( 2.585 -2.174 -6.676) 7.482 14.500 ( 4.089 0.355 -1.826) 4.493 14.609 ( -1.580 -2.509 2.332) 3.772 14.741 ( 0.278 -4.261 0.873) 4.358 14.793 ( -3.883 -0.663 7.162) 8.174 15.061 ( -8.313 -5.376 7.380) 12.348 15.111 ( -0.377 -3.465 -0.968) 3.617 15.252 ( 1.626 -4.720 -0.086) 4.993 15.290 ( -4.105 -8.829 -2.562) 10.068 16.451 ( 3.412 2.891 0.961) 4.575 16.718 ( -5.233 4.085 4.125) 7.816 17.201 ( 4.878 -7.220 -2.105) 8.964 17.629 ( -3.468 -6.850 3.695) 8.521 17.939 ( 3.845 3.992 1.036) 5.639 18.119 ( -5.843 4.542 -7.800) 10.752 18.826 ( -0.863 -3.427 -3.429) 4.924 19.003 ( -0.683 -10.743 6.152) 12.399 19.550 ( -1.145 7.979 5.765) 9.910 19.784 ( 1.251 -0.967 -4.784) 5.039 19.945 ( -2.744 -3.658 -1.196) 4.727 20.136 ( -6.678 -4.986 0.989) 8.392 20.925 ( -0.415 -1.642 -0.271) 1.715 21.002 ( -4.145 -4.051 0.170) 5.798 22.238 ( 7.990 -1.971 1.815) 8.427 22.517 ( 4.074 -5.189 -2.930) 7.219 23.403 ( 2.669 10.310 3.208) 11.123 23.982 ( -3.280 0.226 1.137) 3.479 24.061 ( 7.739 3.311 -0.919) 8.468 24.310 ( -5.325 -2.881 -4.787) 7.718 ======================= Grid point 135 (67/138) ======================= q-point: ( 0.00 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.655 ( -3.252 23.697 5.765) 24.605 2.988 ( 7.863 15.058 -3.052) 17.259 3.153 ( -1.065 1.467 5.941) 6.211 3.277 ( -9.982 28.137 -1.107) 29.876 3.550 ( 0.267 1.161 -6.713) 6.818 3.691 ( 0.280 -1.531 -5.528) 5.743 3.962 ( 3.221 13.264 8.279) 15.964 4.066 ( -0.041 1.006 3.212) 3.366 4.271 ( -6.232 9.877 4.881) 12.657 4.577 ( -0.187 8.032 -3.411) 8.728 4.738 ( 1.383 3.802 10.597) 11.343 5.137 ( 0.451 3.263 1.730) 3.721 5.292 ( -0.967 -5.142 2.300) 5.715 5.462 ( -4.298 -7.050 0.649) 8.282 5.817 ( 0.345 14.207 -6.643) 15.687 6.190 ( 4.627 3.663 -0.376) 5.913 6.252 ( 2.956 3.602 -5.202) 6.984 6.447 ( 6.279 1.167 -11.885) 13.492 6.720 ( 0.749 -2.106 -1.269) 2.570 6.830 ( 4.326 -3.821 2.228) 6.187 6.948 ( -3.217 -4.892 -1.756) 6.113 7.053 ( 4.441 -7.598 -0.254) 8.804 7.304 ( -2.148 2.484 -3.597) 4.871 7.402 ( 1.579 -1.761 -1.571) 2.840 7.601 ( -2.891 -2.583 -0.544) 3.915 7.765 ( 2.434 -3.720 -1.187) 4.601 7.989 ( -3.047 0.676 3.990) 5.065 8.186 ( -2.481 -1.923 -0.066) 3.140 8.400 ( -1.644 -3.379 2.626) 4.584 8.577 ( 5.742 1.291 -2.331) 6.330 8.792 ( -9.406 -7.031 4.386) 12.536 8.958 ( 1.638 -9.668 2.826) 10.205 9.211 ( 7.890 -1.265 1.717) 8.173 9.374 ( -9.769 5.882 5.847) 12.815 9.617 ( 0.056 -0.515 -7.868) 7.885 10.159 ( -6.586 -6.643 13.062) 16.066 10.446 ( 9.380 5.717 -12.990) 17.012 10.808 ( 2.313 -3.842 -5.284) 6.931 12.850 ( -3.538 2.849 0.665) 4.591 12.985 ( 3.460 7.646 0.722) 8.423 13.032 ( -3.631 -3.147 6.405) 8.007 13.433 ( 0.568 -1.554 -2.271) 2.810 13.654 ( 1.949 -1.530 0.469) 2.522 13.930 ( -0.312 -5.666 -5.115) 7.640 14.527 ( -1.423 -0.248 -1.989) 2.458 14.567 ( 1.525 -0.080 -1.376) 2.055 14.672 ( -1.536 -0.892 3.854) 4.244 14.729 ( -2.194 -1.551 6.026) 6.598 14.956 ( 0.443 0.016 -1.674) 1.732 15.035 ( 0.629 -3.388 -0.280) 3.457 15.083 ( 0.192 -7.474 1.222) 7.576 15.195 ( 0.520 -3.666 -1.346) 3.940 16.611 ( 3.369 5.091 0.498) 6.125 16.752 ( -2.714 5.815 2.330) 6.827 17.120 ( 3.061 -6.167 0.772) 6.928 17.405 ( -4.276 -7.583 4.317) 9.717 18.044 ( -6.991 5.922 -4.769) 10.329 18.168 ( 7.339 1.054 -4.966) 8.924 18.804 ( 3.164 -4.096 1.186) 5.310 18.833 ( -1.543 -5.211 1.943) 5.771 19.610 ( -4.379 3.567 0.793) 5.703 19.772 ( 2.775 -3.237 -2.742) 5.070 19.876 ( 1.490 -1.163 2.565) 3.186 19.990 ( -0.892 -1.950 -0.797) 2.287 20.892 ( -1.252 -1.327 0.927) 2.047 20.911 ( 1.271 -1.631 0.726) 2.192 22.288 ( 0.516 -1.099 1.629) 2.032 22.442 ( 0.064 -5.612 -1.959) 5.944 23.628 ( 0.978 7.747 5.577) 9.596 23.923 ( -1.166 -1.806 2.079) 2.991 24.168 ( -3.043 1.078 -4.174) 5.277 24.234 ( 2.858 0.169 -4.830) 5.615 ======================= Grid point 136 (68/138) ======================= q-point: ( 0.11 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.648 ( 0.942 28.085 -3.515) 28.320 2.907 ( -17.010 30.934 5.551) 35.736 3.111 ( 4.473 7.025 0.891) 8.376 3.240 ( 2.997 1.085 4.995) 5.925 3.596 ( 3.389 1.246 -9.592) 10.249 3.700 ( 1.846 3.364 -4.544) 5.948 4.053 ( 0.377 2.914 1.809) 3.450 4.085 ( 2.073 -1.162 7.213) 7.594 4.288 ( 8.321 8.606 3.989) 12.618 4.651 ( 8.569 12.574 -1.757) 15.317 4.837 ( 6.063 0.303 9.337) 11.137 5.131 ( -0.539 2.967 0.936) 3.158 5.270 ( -2.296 -5.629 1.764) 6.331 5.416 ( -1.314 -9.713 -3.423) 10.382 5.773 ( -3.612 14.695 -5.897) 16.240 6.231 ( -1.828 3.641 -3.273) 5.226 6.274 ( 1.932 5.209 -0.765) 5.608 6.437 ( -4.399 0.842 -8.347) 9.473 6.672 ( -5.683 0.419 2.933) 6.409 6.843 ( -1.754 -1.715 1.831) 3.060 6.869 ( -3.132 -4.810 -3.263) 6.602 7.138 ( 3.242 -7.631 2.974) 8.808 7.339 ( 3.940 -2.201 -1.456) 4.742 7.430 ( -0.424 -5.197 -4.680) 7.007 7.558 ( 1.666 2.086 2.379) 3.575 7.811 ( 1.926 -2.468 -1.535) 3.486 7.964 ( -0.380 1.805 2.587) 3.178 8.148 ( -1.859 -1.924 -0.367) 2.701 8.362 ( -2.527 -5.886 2.468) 6.865 8.596 ( -2.259 -8.537 -3.381) 9.456 8.683 ( -2.827 0.521 3.253) 4.341 8.968 ( -2.025 -8.801 0.944) 9.080 9.152 ( -10.277 12.484 13.258) 20.910 9.405 ( 10.776 0.314 -5.388) 12.052 9.634 ( 2.632 -3.645 -15.096) 15.751 10.009 ( -9.649 -9.522 12.921) 18.728 10.652 ( 12.060 4.284 -6.674) 14.434 10.905 ( 7.150 -2.093 -2.555) 7.876 12.800 ( -1.343 2.857 -0.695) 3.233 12.984 ( -2.189 -2.961 4.329) 5.683 13.063 ( 3.977 6.917 1.306) 8.085 13.437 ( 0.024 -0.407 -1.367) 1.426 13.648 ( -2.279 -1.236 2.329) 3.485 13.894 ( -2.382 -4.404 -4.837) 6.962 14.504 ( -0.183 0.995 -3.988) 4.114 14.569 ( -1.056 -2.131 -0.466) 2.423 14.671 ( 0.829 -1.021 2.862) 3.150 14.716 ( 0.384 1.284 4.648) 4.837 15.003 ( 3.919 1.055 -1.035) 4.189 15.051 ( 0.619 -2.377 0.935) 2.628 15.137 ( 4.571 -9.769 1.633) 10.908 15.213 ( 1.708 -3.318 -1.517) 4.028 16.682 ( 3.141 2.251 -0.243) 3.872 16.718 ( -0.881 6.143 2.783) 6.801 17.168 ( 0.449 -6.679 2.380) 7.105 17.336 ( -2.505 -5.345 2.212) 6.303 17.898 ( -5.624 5.792 -4.812) 9.398 18.290 ( 5.238 -2.293 -3.352) 6.628 18.770 ( -3.125 -2.814 -1.017) 4.327 18.866 ( 0.610 -6.817 2.649) 7.339 19.559 ( -0.043 5.775 0.648) 5.811 19.821 ( 2.134 -0.987 -1.273) 2.674 19.969 ( 6.054 -3.474 2.518) 7.420 20.014 ( 4.180 -2.037 -1.401) 4.857 20.881 ( 0.116 -0.149 0.449) 0.487 20.969 ( 4.127 -3.190 0.970) 5.306 22.232 ( -6.312 0.327 1.119) 6.418 22.408 ( -3.084 -6.085 -1.601) 7.008 23.637 ( -1.516 7.505 6.038) 9.751 23.916 ( 0.037 -2.301 2.023) 3.064 24.075 ( -4.421 3.659 -4.885) 7.537 24.280 ( 2.211 -2.571 -4.222) 5.415 ======================= Grid point 137 (69/138) ======================= q-point: ( 0.22 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.470 ( -12.639 37.613 -10.179) 40.965 2.874 ( 8.942 19.610 5.578) 22.262 3.171 ( 0.667 -0.636 -0.542) 1.069 3.314 ( 3.354 -5.206 8.719) 10.694 3.610 ( 0.833 6.403 -10.504) 12.329 3.734 ( 1.471 6.342 2.287) 6.900 4.051 ( 1.002 -5.259 2.399) 5.866 4.177 ( 5.638 -3.081 -1.132) 6.524 4.520 ( 12.132 1.243 2.914) 12.538 4.854 ( 9.485 9.828 -2.355) 13.860 4.988 ( 6.181 0.903 4.789) 7.872 5.149 ( 2.662 -1.228 4.078) 5.022 5.195 ( -5.842 -5.492 -1.121) 8.096 5.334 ( -5.749 -7.716 -6.496) 11.609 5.668 ( -4.832 11.808 -4.880) 13.660 6.132 ( -6.465 -1.869 -9.214) 11.411 6.256 ( -4.120 7.267 -2.137) 8.623 6.362 ( -0.158 7.753 3.527) 8.520 6.559 ( -5.239 3.183 3.038) 6.842 6.761 ( -6.258 -5.496 -1.929) 8.550 6.859 ( 1.370 -3.767 5.688) 6.959 7.167 ( -1.232 -8.554 5.223) 10.098 7.376 ( 1.050 -4.779 0.607) 4.931 7.430 ( 0.389 -4.058 3.719) 5.518 7.622 ( 2.944 1.207 -0.653) 3.248 7.828 ( -0.559 -1.530 -0.092) 1.632 7.974 ( 0.899 3.756 0.759) 3.936 8.127 ( 1.230 -0.253 -2.824) 3.090 8.328 ( -1.446 -5.972 2.777) 6.743 8.567 ( -0.213 -4.145 -7.591) 8.652 8.622 ( -3.095 -2.796 3.698) 5.575 8.858 ( -7.678 -0.410 0.974) 7.750 9.048 ( -4.259 0.724 8.186) 9.256 9.602 ( 4.067 -2.833 -7.362) 8.875 9.640 ( 6.717 1.409 -9.484) 11.707 9.896 ( -3.295 -7.465 4.516) 9.326 10.852 ( 8.560 5.046 0.280) 9.941 11.037 ( 6.023 -0.264 -1.369) 6.182 12.791 ( 0.533 1.956 -1.315) 2.417 12.966 ( -0.487 -3.647 0.635) 3.734 13.141 ( 3.452 6.198 1.467) 7.245 13.425 ( -0.976 1.378 -1.051) 1.989 13.597 ( -3.434 0.190 5.661) 6.623 13.821 ( -3.752 -2.145 -3.220) 5.389 14.493 ( -0.369 1.296 -4.703) 4.892 14.539 ( -0.789 -2.505 -2.610) 3.702 14.704 ( 1.376 -1.963 4.246) 4.876 14.780 ( 4.958 3.546 1.421) 6.259 15.068 ( 1.999 -0.473 2.237) 3.038 15.088 ( 3.374 0.778 -0.252) 3.471 15.208 ( 1.591 -6.413 1.053) 6.691 15.286 ( 6.078 -6.489 -0.450) 8.902 16.690 ( -0.194 5.012 -2.467) 5.590 16.764 ( 2.562 0.429 4.015) 4.782 17.124 ( -4.585 -2.297 2.939) 5.910 17.333 ( 0.797 -8.337 0.843) 8.417 17.824 ( -0.659 3.128 -3.529) 4.762 18.347 ( 0.942 -7.722 -1.543) 7.931 18.717 ( -1.557 -1.629 -2.554) 3.406 18.845 ( -2.233 -6.417 0.714) 6.832 19.607 ( 3.561 6.884 2.493) 8.142 19.874 ( 3.826 1.611 0.319) 4.163 20.026 ( 1.570 -1.895 -2.299) 3.368 20.184 ( 10.024 -5.186 1.644) 11.405 20.904 ( 2.265 1.298 0.570) 2.672 21.067 ( 5.390 -4.428 0.250) 6.980 22.069 ( -9.569 2.429 0.135) 9.873 22.309 ( -6.653 -6.609 -1.207) 9.455 23.602 ( -2.870 8.157 4.912) 9.946 23.912 ( -1.794 -1.589 0.288) 2.413 24.000 ( -1.509 2.791 -1.117) 3.364 24.304 ( 1.336 -4.999 -4.213) 6.673 ======================= Grid point 138 (70/138) ======================= q-point: ( 0.33 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.309 ( -0.015 23.184 -6.559) 24.094 3.082 ( -2.745 -0.330 -4.784) 5.525 3.134 ( 9.559 11.512 3.392) 15.343 3.437 ( 5.949 -9.186 7.619) 13.335 3.597 ( 0.892 9.911 -8.016) 12.778 3.771 ( 0.846 4.019 5.259) 6.673 4.093 ( 1.870 -8.451 0.095) 8.656 4.273 ( 4.401 -8.758 -6.634) 11.835 4.708 ( 5.240 -8.116 -5.786) 11.261 4.883 ( -5.750 -2.569 -0.874) 6.358 5.007 ( -7.850 6.082 -2.687) 10.287 5.089 ( 2.768 6.403 -1.497) 7.135 5.241 ( 3.045 0.304 4.101) 5.116 5.310 ( 4.271 -6.841 1.124) 8.143 5.594 ( -0.652 5.826 -1.297) 6.005 5.984 ( -5.341 2.889 -10.807) 12.396 6.153 ( -5.251 2.509 -3.439) 6.760 6.375 ( -0.979 8.245 6.090) 10.297 6.494 ( -3.545 2.658 8.215) 9.333 6.635 ( -4.255 -2.353 -2.594) 5.511 6.915 ( 1.672 -4.664 10.374) 11.496 7.133 ( -2.670 -9.201 3.799) 10.307 7.408 ( 0.369 -3.040 4.577) 5.507 7.439 ( 0.110 -5.699 6.728) 8.818 7.661 ( 1.563 -0.685 -0.212) 1.720 7.792 ( -1.981 -2.683 0.098) 3.336 8.005 ( 2.109 7.194 -0.483) 7.513 8.171 ( 2.603 -0.608 -4.818) 5.509 8.308 ( -1.374 -3.448 3.158) 4.873 8.536 ( -1.523 3.469 -2.584) 4.586 8.572 ( -3.538 -7.708 0.607) 8.502 8.756 ( -0.865 -0.526 -5.006) 5.107 8.994 ( -1.990 -2.838 2.682) 4.383 9.537 ( -5.419 -5.776 4.377) 9.049 9.840 ( 9.395 0.707 -7.993) 12.355 9.883 ( 2.818 -0.214 -8.186) 8.660 10.983 ( 4.156 6.204 3.763) 8.362 11.123 ( 2.849 1.219 -0.852) 3.214 12.814 ( 2.055 0.511 -1.464) 2.574 12.955 ( -0.690 -4.174 -1.910) 4.642 13.204 ( 2.624 5.300 1.172) 6.029 13.397 ( -1.481 2.309 -1.401) 3.080 13.547 ( -3.210 2.651 8.012) 9.029 13.751 ( -2.542 0.205 0.013) 2.550 14.460 ( -1.386 2.181 -5.088) 5.707 14.543 ( 1.541 -2.588 -5.118) 5.938 14.736 ( 0.593 -1.751 5.924) 6.206 14.890 ( 5.618 2.790 -1.903) 6.555 15.124 ( 2.576 -0.665 1.756) 3.188 15.139 ( 1.740 2.942 2.385) 4.168 15.230 ( 0.793 -4.519 0.645) 4.633 15.403 ( 5.101 -7.302 0.346) 8.914 16.690 ( 1.058 4.757 -2.895) 5.669 16.788 ( -1.524 -1.001 1.703) 2.495 17.056 ( -2.125 1.059 4.197) 4.822 17.341 ( -0.296 -10.144 1.096) 10.207 17.849 ( 3.417 -1.555 -2.645) 4.593 18.318 ( -3.065 -13.256 -2.669) 13.865 18.701 ( -0.172 0.026 0.638) 0.661 18.809 ( -0.843 -5.054 -2.751) 5.815 19.675 ( 2.207 6.511 3.823) 7.866 19.975 ( 5.688 2.092 2.007) 6.384 20.038 ( 0.257 -0.094 -3.062) 3.074 20.361 ( 6.889 -6.104 0.030) 9.204 20.976 ( 4.662 2.379 1.218) 5.374 21.167 ( 4.383 -3.929 -0.708) 5.929 21.885 ( -8.242 3.135 -0.167) 8.820 22.153 ( -8.302 -6.984 -1.365) 10.935 23.557 ( -2.588 8.538 4.307) 9.906 23.856 ( -2.404 4.121 -3.636) 5.999 24.000 ( 0.145 -3.486 3.960) 5.278 24.318 ( 1.099 -6.815 -3.926) 7.942 ======================= Grid point 139 (71/138) ======================= q-point: ( 0.44 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.458 ( 15.126 1.887 -0.732) 15.261 2.907 ( -10.192 0.614 4.477) 11.148 3.412 ( 11.654 5.908 -0.950) 13.100 3.453 ( -3.376 -0.231 -6.751) 7.552 3.582 ( -5.399 5.033 -6.277) 9.689 3.823 ( 6.963 -14.409 -5.287) 16.854 4.101 ( -0.717 2.360 8.700) 9.043 4.354 ( 5.935 -13.722 -8.403) 17.150 4.673 ( -10.222 -1.523 -2.657) 10.671 4.721 ( 0.997 -0.200 -10.140) 10.190 5.019 ( 3.427 5.907 5.237) 8.606 5.112 ( 0.727 3.401 -0.563) 3.523 5.243 ( -2.935 0.066 0.816) 3.047 5.365 ( 0.247 -4.390 -0.459) 4.421 5.637 ( 2.066 1.001 2.881) 3.684 5.885 ( -2.138 9.622 -10.974) 14.751 6.080 ( 0.172 -4.135 -1.970) 4.583 6.329 ( -4.997 1.701 6.475) 8.354 6.430 ( -3.855 2.479 9.256) 10.328 6.599 ( -0.821 4.441 -3.758) 5.875 6.945 ( -1.599 -5.594 11.595) 12.973 7.105 ( -0.199 -7.958 2.547) 8.358 7.390 ( -2.556 -3.600 8.324) 9.423 7.459 ( -0.839 -7.463 5.746) 9.456 7.701 ( 2.494 -1.307 1.955) 3.428 7.788 ( 1.433 -2.223 -0.934) 2.804 8.040 ( 1.107 9.972 0.488) 10.045 8.187 ( 1.026 -2.690 -5.396) 6.116 8.284 ( -1.837 -1.503 1.903) 3.042 8.453 ( -4.367 0.398 2.534) 5.064 8.558 ( 0.564 2.913 -0.783) 3.068 8.782 ( 4.720 -7.485 -12.237) 15.102 8.997 ( 1.772 -3.749 1.284) 4.341 9.432 ( -6.687 -7.217 10.122) 14.115 9.864 ( 0.780 5.005 -13.277) 14.211 10.036 ( 8.836 0.530 -6.347) 10.892 11.026 ( -0.938 6.043 3.451) 7.022 11.150 ( 0.305 2.480 0.138) 2.502 12.865 ( 3.351 -1.316 -1.536) 3.914 12.928 ( -1.363 -3.313 -2.454) 4.343 13.243 ( 0.870 3.778 0.919) 3.984 13.364 ( -1.322 2.285 -1.978) 3.298 13.508 ( -2.477 5.726 7.995) 10.141 13.731 ( 0.198 1.539 3.723) 4.034 14.427 ( -0.640 3.103 -6.027) 6.808 14.565 ( 1.832 -3.058 -5.750) 6.765 14.752 ( -0.459 -0.972 6.097) 6.191 14.977 ( 3.563 0.706 -2.816) 4.596 15.124 ( -1.820 1.272 -0.783) 2.354 15.183 ( 0.411 0.626 1.546) 1.718 15.261 ( 2.097 -2.377 5.248) 6.131 15.475 ( 1.936 -6.650 0.190) 6.929 16.713 ( -3.262 2.421 0.773) 4.135 16.728 ( 1.503 3.152 -4.754) 5.899 17.054 ( -0.230 0.024 6.100) 6.104 17.337 ( 0.119 -9.826 1.395) 9.925 17.918 ( 3.147 -5.930 -1.518) 6.883 18.248 ( -2.029 -13.794 -4.825) 14.754 18.686 ( -2.180 0.218 2.045) 2.997 18.808 ( 1.426 -6.054 -3.694) 7.235 19.713 ( 0.814 6.618 4.691) 8.153 20.021 ( -1.185 0.213 -2.721) 2.975 20.088 ( 4.604 2.784 3.327) 6.326 20.438 ( 1.127 -5.681 -2.393) 6.266 21.070 ( 3.371 2.464 1.584) 4.466 21.217 ( 0.781 -1.487 -1.396) 2.184 21.781 ( -1.727 1.343 0.730) 2.306 22.005 ( -5.322 -7.176 -2.224) 9.207 23.524 ( -1.697 8.565 4.010) 9.609 23.821 ( -0.022 6.437 -4.414) 7.805 24.007 ( -0.518 -5.974 5.085) 7.863 24.330 ( 0.970 -7.789 -3.491) 8.591 ======================= Grid point 140 (72/138) ======================= q-point: (-0.44 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.733 ( -6.512 7.505 8.904) 13.342 2.842 ( 18.892 -11.582 3.691) 22.465 3.187 ( -14.242 -8.381 -9.830) 19.227 3.444 ( -4.395 9.954 -11.111) 15.552 3.669 ( 9.381 4.037 1.204) 10.283 3.897 ( -0.338 -6.710 -6.272) 9.191 4.119 ( -2.158 2.727 6.775) 7.616 4.367 ( -1.260 -8.758 -2.771) 9.272 4.595 ( 1.126 -0.004 -7.803) 7.884 4.798 ( 10.719 -0.242 -8.740) 13.832 5.016 ( -4.940 3.094 4.741) 7.514 5.145 ( -0.081 -1.655 4.370) 4.674 5.194 ( -1.319 5.721 -2.033) 6.213 5.352 ( 1.897 -7.443 -1.626) 7.851 5.628 ( -2.511 4.621 1.574) 5.490 5.862 ( 2.023 7.290 -11.118) 13.448 6.093 ( -2.689 -0.050 1.658) 3.159 6.292 ( 2.678 -7.022 4.450) 8.733 6.389 ( -2.210 4.708 6.816) 8.573 6.537 ( -4.675 5.185 -2.938) 7.575 6.905 ( -4.151 -6.091 8.486) 11.240 7.134 ( 1.325 -7.381 3.777) 8.397 7.364 ( -1.697 -3.990 7.257) 8.454 7.439 ( -1.766 -7.683 4.929) 9.297 7.759 ( 2.185 -1.791 3.597) 4.574 7.800 ( -0.769 -0.930 -0.521) 1.314 8.056 ( 0.865 10.771 0.096) 10.807 8.196 ( 0.354 -1.520 -3.936) 4.234 8.284 ( 2.827 -2.899 1.089) 4.194 8.410 ( -0.852 4.138 2.238) 4.781 8.563 ( 0.334 0.144 -0.868) 0.941 8.868 ( 6.512 -10.656 -13.693) 18.533 9.051 ( 2.585 -3.950 3.226) 5.718 9.327 ( -6.119 -6.873 10.634) 14.063 9.842 ( 0.347 8.950 -14.572) 17.105 10.167 ( 5.414 -1.050 -3.018) 6.287 10.954 ( -6.785 6.939 1.721) 9.857 11.142 ( -1.338 1.943 0.483) 2.408 12.884 ( -1.350 -1.229 -1.426) 2.316 12.950 ( 4.443 -3.237 -1.781) 5.779 13.236 ( -1.747 3.035 0.912) 3.618 13.337 ( -0.926 0.846 -2.192) 2.526 13.493 ( -0.733 8.380 7.117) 11.019 13.768 ( 2.312 1.069 4.829) 5.459 14.411 ( 0.506 3.168 -6.287) 7.059 14.587 ( 1.704 -3.502 -5.497) 6.736 14.740 ( -2.032 -0.116 4.970) 5.371 15.019 ( 1.221 0.088 -1.382) 1.846 15.063 ( -3.948 -0.687 0.379) 4.025 15.168 ( -1.375 -1.113 -0.957) 2.011 15.302 ( -0.214 -1.123 6.539) 6.639 15.477 ( -1.750 -5.629 -0.095) 5.896 16.619 ( -4.199 4.671 -2.127) 6.632 16.801 ( 5.056 1.750 -2.829) 6.052 17.041 ( -2.766 0.263 6.169) 6.766 17.365 ( 2.311 -9.890 2.142) 10.380 17.934 ( -1.231 -6.181 -1.156) 6.407 18.254 ( 3.734 -14.020 -4.874) 15.305 18.627 ( -3.642 1.508 0.137) 3.944 18.833 ( 1.454 -7.760 -2.330) 8.232 19.732 ( -0.034 7.009 5.491) 8.904 19.976 ( -2.805 2.609 -2.639) 4.651 20.160 ( 1.598 -0.087 4.425) 4.705 20.394 ( -4.658 -4.253 -4.374) 7.676 21.066 ( -3.673 2.328 1.439) 4.580 21.218 ( -0.619 -1.679 -1.326) 2.228 21.800 ( 2.537 0.179 1.467) 2.936 21.985 ( 4.602 -6.572 -2.962) 8.552 23.510 ( -0.591 8.631 3.408) 9.299 23.838 ( 2.723 7.133 -4.023) 8.630 24.003 ( -1.089 -6.530 5.146) 8.385 24.339 ( 0.602 -7.758 -3.204) 8.415 ======================= Grid point 141 (73/138) ======================= q-point: (-0.33 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.632 ( -3.408 8.153 -0.894) 8.882 2.967 ( -4.756 11.017 -1.823) 12.137 3.157 ( 5.565 -4.199 6.364) 9.439 3.365 ( 0.229 7.575 -9.175) 11.900 3.729 ( -6.152 4.269 13.329) 15.289 3.874 ( 2.488 -8.142 -1.717) 8.685 4.040 ( -3.112 -6.114 -2.190) 7.202 4.325 ( -4.602 -7.830 -6.004) 10.887 4.642 ( 5.365 8.857 -7.579) 12.833 4.866 ( -7.411 9.482 3.016) 12.406 5.027 ( 2.072 -0.371 -3.020) 3.681 5.102 ( -2.366 0.446 0.270) 2.423 5.110 ( -1.422 1.720 -1.037) 2.461 5.520 ( 10.261 -6.765 6.429) 13.871 5.625 ( 5.941 3.060 -6.023) 8.996 5.866 ( 0.264 3.792 -11.730) 12.330 6.017 ( -3.478 2.311 -0.195) 4.180 6.369 ( 2.655 4.936 3.305) 6.507 6.410 ( -1.247 4.127 -6.939) 8.169 6.427 ( -0.358 -8.027 8.371) 11.603 6.854 ( -1.783 -5.579 6.090) 8.450 7.129 ( -2.865 -8.556 2.548) 9.376 7.368 ( 0.729 -3.833 4.936) 6.292 7.425 ( -0.546 -5.150 5.025) 7.216 7.745 ( -3.620 0.228 -1.583) 3.958 7.808 ( 1.223 -1.197 2.313) 2.877 8.092 ( 2.896 10.952 -0.483) 11.339 8.190 ( 0.216 -1.085 0.111) 1.112 8.353 ( 0.838 1.195 3.994) 4.253 8.423 ( 2.268 1.151 -3.161) 4.057 8.600 ( 4.835 -6.935 1.243) 8.545 8.957 ( 4.687 -9.776 -9.034) 14.112 9.083 ( -1.077 -5.323 5.731) 7.896 9.263 ( -1.251 -6.349 4.136) 7.680 9.820 ( 0.667 10.332 -12.131) 15.948 10.233 ( 1.419 -2.579 1.275) 3.208 10.777 ( -11.008 9.387 -0.614) 14.481 11.092 ( -3.817 -0.174 -0.660) 3.878 12.860 ( -0.584 1.290 -0.728) 1.592 13.035 ( 3.829 -4.135 -0.327) 5.645 13.180 ( -4.139 3.035 0.831) 5.199 13.335 ( 1.852 -0.757 -1.988) 2.820 13.498 ( -0.535 8.104 5.231) 9.661 13.835 ( 3.278 -0.920 3.220) 4.686 14.421 ( 1.870 2.612 -5.537) 6.402 14.606 ( 1.364 -3.406 -4.366) 5.703 14.696 ( -3.139 0.246 2.785) 4.204 14.974 ( -4.961 0.162 3.523) 6.087 15.033 ( 0.143 -2.899 0.093) 2.904 15.134 ( -1.599 -3.362 -2.590) 4.535 15.269 ( -4.358 -1.318 5.524) 7.158 15.410 ( -4.776 -4.626 -0.313) 6.656 16.551 ( -1.999 6.750 -2.863) 7.600 16.898 ( 4.557 -1.792 -1.646) 5.166 16.983 ( -3.718 2.478 5.105) 6.785 17.426 ( 2.867 -10.795 3.117) 11.596 17.899 ( -1.077 -1.892 -1.626) 2.717 18.324 ( 2.311 -12.949 -2.265) 13.348 18.576 ( 0.117 1.454 -2.711) 3.079 18.846 ( 0.175 -8.063 -1.402) 8.186 19.735 ( -1.144 7.380 6.131) 9.663 19.905 ( -3.494 3.533 -2.091) 5.391 20.159 ( -3.437 -2.371 2.352) 4.792 20.256 ( -7.087 -3.172 -3.582) 8.551 20.988 ( -3.776 1.196 1.616) 4.278 21.155 ( -5.255 -3.809 -1.142) 6.590 21.898 ( 7.268 1.483 0.291) 7.424 22.128 ( 8.959 -6.224 -2.040) 11.098 23.516 ( 0.547 8.904 2.754) 9.336 23.906 ( 4.773 5.951 -3.006) 8.199 23.990 ( -1.162 -5.204 4.706) 7.112 24.337 ( -0.126 -6.680 -3.376) 7.486 ======================= Grid point 142 (74/138) ======================= q-point: (-0.22 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.627 ( 4.286 11.784 -7.894) 14.817 2.921 ( -3.047 22.864 4.333) 23.470 3.147 ( -2.341 8.310 5.936) 10.477 3.340 ( -3.334 13.320 0.770) 13.752 3.671 ( -0.549 -0.367 1.052) 1.242 3.827 ( -6.403 -6.575 -3.001) 9.656 4.083 ( 3.896 -13.783 6.275) 15.637 4.186 ( -7.696 -2.985 -0.814) 8.295 4.654 ( -13.371 14.925 8.339) 21.704 4.690 ( -0.834 9.333 -6.902) 11.638 4.868 ( -9.139 8.303 0.898) 12.380 5.076 ( -0.066 5.137 -1.407) 5.326 5.240 ( 6.142 -9.157 2.804) 11.377 5.633 ( 3.269 9.625 -0.764) 10.193 5.791 ( -0.844 -1.167 -4.099) 4.344 5.907 ( 12.430 -5.391 -11.240) 17.604 5.997 ( 4.841 2.865 -3.939) 6.867 6.298 ( -3.730 2.589 -6.703) 8.096 6.479 ( 7.717 1.395 2.378) 8.195 6.533 ( 6.205 -5.199 0.728) 8.128 6.879 ( 2.864 -5.532 3.988) 7.397 7.058 ( -3.910 -8.969 1.164) 9.853 7.388 ( -0.110 -2.188 3.090) 3.788 7.459 ( 3.169 -2.526 4.051) 5.730 7.636 ( -6.838 0.474 -3.213) 7.570 7.817 ( -0.700 -1.361 -0.544) 1.624 8.113 ( -2.268 5.178 6.193) 8.385 8.253 ( 6.689 5.319 -7.547) 11.401 8.334 ( -2.244 1.906 3.779) 4.791 8.439 ( -0.610 -3.135 3.285) 4.582 8.764 ( 9.574 -9.432 1.233) 13.496 8.997 ( 0.687 -5.850 0.077) 5.891 9.052 ( -2.863 -8.136 6.206) 10.626 9.297 ( 4.609 -8.905 -6.743) 12.083 9.811 ( -0.240 9.899 -4.595) 10.916 10.228 ( -2.590 -1.884 5.815) 6.638 10.546 ( -10.383 10.416 -5.737) 15.786 10.988 ( -6.135 -2.560 -2.562) 7.125 12.862 ( 0.880 3.436 0.113) 3.549 13.068 ( -3.063 3.759 -0.543) 4.879 13.098 ( -1.867 -3.603 4.215) 5.851 13.402 ( 4.466 -4.956 -3.462) 7.516 13.497 ( 0.222 7.525 3.375) 8.250 13.901 ( 2.744 -3.716 0.088) 4.620 14.457 ( 2.878 1.918 -4.085) 5.353 14.619 ( -0.204 -0.142 0.481) 0.541 14.645 ( -1.139 -3.012 -1.670) 3.628 14.881 ( -5.491 -0.853 5.834) 8.057 15.035 ( 0.013 -2.846 0.976) 3.009 15.087 ( -2.968 -5.824 -3.226) 7.289 15.179 ( -4.889 -0.922 4.373) 6.624 15.298 ( -5.886 -4.250 -1.031) 7.333 16.530 ( 0.452 7.784 -2.398) 8.158 16.887 ( -4.342 3.120 4.385) 6.915 17.002 ( 3.543 -4.025 -1.094) 5.473 17.474 ( 0.747 -11.137 3.970) 11.847 17.910 ( 2.948 2.600 -1.567) 4.231 18.301 ( -3.354 -2.802 -2.193) 4.889 18.639 ( 5.770 -6.037 -4.075) 9.292 18.837 ( -0.702 -6.490 0.199) 6.531 19.710 ( -2.600 6.955 6.057) 9.582 19.845 ( -1.920 3.283 -1.424) 4.061 20.010 ( -9.152 -2.632 -3.637) 10.193 20.152 ( -4.689 -4.467 1.475) 6.642 20.932 ( -2.292 -0.073 1.483) 2.730 21.036 ( -5.897 -3.530 -0.756) 6.914 22.063 ( 8.638 1.268 0.075) 8.730 22.293 ( 7.671 -6.159 -1.572) 9.963 23.543 ( 1.503 9.092 2.713) 9.607 23.963 ( -0.784 -4.921 3.459) 6.066 24.021 ( 5.392 5.523 -1.624) 7.887 24.315 ( -1.263 -4.648 -4.193) 6.386 ======================= Grid point 143 (75/138) ======================= q-point: (-0.11 0.36 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.711 ( 0.665 18.158 0.613) 18.180 2.861 ( 1.457 21.046 -0.763) 21.110 3.149 ( -0.163 4.885 3.828) 6.209 3.317 ( 1.191 20.143 4.313) 20.634 3.655 ( -4.507 1.836 -3.589) 6.047 3.703 ( -1.201 -4.557 -7.237) 8.636 4.021 ( -9.595 5.750 7.434) 13.431 4.094 ( -2.986 0.793 2.499) 3.973 4.422 ( -9.898 11.286 6.528) 16.370 4.634 ( -3.846 6.713 -2.334) 8.081 4.741 ( -3.923 6.295 6.962) 10.172 5.100 ( 2.300 2.311 0.445) 3.291 5.301 ( -0.122 -5.229 4.018) 6.596 5.585 ( -7.178 2.056 0.713) 7.500 5.796 ( 3.177 9.688 -5.908) 11.784 6.075 ( 7.589 0.747 -3.383) 8.342 6.165 ( 7.613 -1.533 -9.552) 12.311 6.301 ( 7.708 2.594 -10.558) 13.327 6.651 ( 6.651 -3.148 0.793) 7.401 6.674 ( 9.292 -2.203 -1.718) 9.702 6.961 ( 4.132 -5.432 0.966) 6.893 7.000 ( -2.015 -8.794 0.655) 9.045 7.372 ( -1.946 1.351 0.033) 2.369 7.472 ( -7.527 0.761 -3.332) 8.267 7.561 ( 5.047 -3.645 2.503) 6.710 7.779 ( -2.423 -2.529 -2.517) 4.313 8.056 ( -4.424 0.556 6.336) 7.748 8.252 ( -3.607 0.639 -1.121) 3.831 8.400 ( 3.490 5.163 -1.153) 6.337 8.452 ( 3.846 -1.943 2.271) 4.871 8.901 ( 2.845 -7.434 3.586) 8.730 8.964 ( -6.655 -9.282 2.835) 11.768 9.061 ( 5.594 -6.047 5.536) 9.925 9.396 ( 6.113 -9.923 -10.801) 15.890 9.738 ( -8.484 10.844 7.361) 15.613 10.190 ( -1.154 0.581 4.985) 5.150 10.400 ( -1.918 5.877 -9.603) 11.421 10.858 ( -5.312 -4.218 -4.990) 8.421 12.890 ( 1.008 3.412 1.338) 3.801 12.972 ( -3.932 6.873 -0.312) 7.925 13.082 ( -2.486 -4.165 6.245) 7.908 13.432 ( 0.154 -2.175 -2.519) 3.332 13.571 ( 5.601 0.647 0.103) 5.639 13.935 ( 0.970 -5.587 -3.175) 6.498 14.510 ( 3.020 0.832 -2.493) 4.004 14.582 ( -2.373 -0.062 -0.135) 2.377 14.665 ( 1.572 -3.022 1.045) 3.563 14.788 ( -5.109 -0.788 6.485) 8.294 15.000 ( -3.933 -3.345 -2.439) 5.710 15.037 ( -0.461 -2.108 1.779) 2.796 15.111 ( -3.065 -5.662 1.392) 6.587 15.208 ( -2.141 -3.416 -1.715) 4.381 16.554 ( 2.337 7.205 -1.025) 7.644 16.812 ( -3.970 5.086 3.758) 7.466 17.062 ( 2.868 -6.163 -0.689) 6.832 17.465 ( -2.578 -9.831 4.750) 11.218 18.008 ( 6.926 3.716 -1.851) 8.075 18.204 ( -5.525 2.893 -5.477) 8.300 18.732 ( 4.034 -5.628 -2.635) 7.409 18.838 ( 0.438 -6.300 2.815) 6.915 19.673 ( -2.316 4.402 4.572) 6.756 19.794 ( -3.637 2.172 -4.461) 6.152 19.874 ( -2.365 -3.185 0.664) 4.022 20.054 ( -4.957 -3.893 0.249) 6.308 20.903 ( -0.946 -0.710 0.994) 1.545 20.941 ( -3.483 -2.378 0.289) 4.227 22.215 ( 6.152 -0.259 0.699) 6.196 22.407 ( 4.009 -5.870 -1.542) 7.274 23.585 ( 1.924 8.701 3.768) 9.675 23.945 ( -1.528 -3.332 3.295) 4.929 24.129 ( 5.359 3.226 -2.223) 6.638 24.266 ( -2.530 -1.894 -5.524) 6.364 ======================= Grid point 144 (76/138) ======================= q-point: ( 0.00 0.45 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.999 ( 0.302 12.247 3.956) 12.873 3.141 ( 0.807 -2.653 2.158) 3.514 3.262 ( -3.124 11.227 0.816) 11.682 3.443 ( -0.177 -7.314 -2.782) 7.827 3.709 ( 4.136 11.933 -1.120) 12.679 3.790 ( -4.649 12.671 5.055) 14.413 3.984 ( 2.535 -9.358 5.617) 11.205 4.008 ( -0.297 -4.263 5.261) 6.777 4.506 ( -5.512 11.184 0.226) 12.471 4.680 ( -1.283 -6.325 -0.561) 6.478 4.844 ( 1.753 15.329 -2.777) 15.677 5.111 ( 2.485 -9.777 -5.346) 11.417 5.273 ( -4.393 4.708 7.548) 9.922 5.358 ( -9.343 -4.039 6.851) 12.270 6.086 ( 4.132 11.743 -10.862) 16.521 6.219 ( 8.792 -2.311 -8.395) 12.374 6.322 ( 3.768 4.889 -0.910) 6.240 6.420 ( 1.552 -3.311 -7.685) 8.511 6.699 ( 2.130 -1.580 0.269) 2.666 6.717 ( 3.970 -5.391 2.979) 7.328 6.887 ( 0.254 0.677 0.452) 0.853 6.945 ( 3.408 -4.253 -0.294) 5.458 7.356 ( -4.786 2.270 -4.116) 6.709 7.390 ( -1.405 -0.759 -3.863) 4.180 7.578 ( 0.939 1.608 0.108) 1.865 7.663 ( 2.649 -6.057 -1.533) 6.787 8.028 ( -2.260 3.454 5.017) 6.497 8.112 ( -2.515 -4.827 4.500) 7.062 8.418 ( -3.743 4.572 -0.245) 5.914 8.530 ( -2.838 -5.712 -1.353) 6.521 8.723 ( -3.662 0.260 5.269) 6.422 8.792 ( -0.547 -6.659 5.198) 8.466 9.238 ( 11.399 4.391 -7.215) 14.188 9.346 ( 7.779 -5.743 -9.984) 13.899 9.765 ( -12.109 11.836 11.283) 20.347 9.987 ( -10.330 -10.615 13.899) 20.312 10.576 ( 6.653 7.215 -9.836) 13.895 10.709 ( 4.127 -6.267 -7.256) 10.438 12.905 ( -3.148 2.954 2.981) 5.246 12.965 ( -3.104 -3.324 5.623) 7.232 13.153 ( 2.594 9.208 -1.744) 9.724 13.327 ( 1.747 -8.267 -2.992) 8.964 13.696 ( 0.765 4.814 1.213) 5.023 13.809 ( 0.000 -6.489 -1.330) 6.624 14.550 ( -0.941 2.303 -0.822) 2.620 14.580 ( -1.180 0.458 -0.456) 1.345 14.650 ( 1.002 -0.481 0.468) 1.206 14.686 ( -0.274 -2.943 1.419) 3.279 14.942 ( 1.023 -0.336 -0.241) 1.104 14.972 ( -0.866 -3.185 1.014) 3.453 15.046 ( 0.192 2.832 0.277) 2.852 15.119 ( 0.363 -4.152 -0.923) 4.269 16.719 ( 1.615 5.758 -3.339) 6.849 16.808 ( -0.348 -1.884 -3.977) 4.414 17.090 ( 0.208 4.640 8.073) 9.314 17.241 ( -2.412 -9.097 6.915) 11.678 18.139 ( -3.197 3.681 -4.700) 6.772 18.178 ( 3.041 -0.442 -5.167) 6.011 18.736 ( 1.979 -1.925 0.879) 2.897 18.749 ( 0.218 -3.073 0.977) 3.231 19.664 ( -2.054 2.619 -0.083) 3.330 19.719 ( 0.272 -2.881 -1.304) 3.174 19.891 ( 0.943 2.356 1.234) 2.822 19.944 ( -0.080 -2.752 -0.215) 2.762 20.881 ( -0.465 0.004 1.230) 1.315 20.889 ( 0.337 -0.767 1.204) 1.466 22.292 ( 0.515 1.553 0.490) 1.708 22.347 ( 0.160 -4.058 -0.784) 4.136 23.761 ( 0.221 6.151 4.710) 7.750 23.863 ( -0.535 -4.311 3.671) 5.688 24.197 ( -1.028 1.693 -4.637) 5.042 24.225 ( 0.839 -1.081 -4.837) 5.027 ======================= Grid point 145 (77/138) ======================= q-point: ( 0.11 0.45 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.057 ( 4.803 12.706 3.722) 14.084 3.163 ( -0.384 -1.193 3.855) 4.054 3.202 ( -2.865 8.940 -1.133) 9.456 3.461 ( 2.797 -12.205 -4.568) 13.328 3.586 ( -11.072 25.409 -0.854) 27.730 3.809 ( 0.531 4.920 5.001) 7.036 4.013 ( -0.328 -5.431 7.236) 9.053 4.032 ( 1.021 -6.764 3.334) 7.610 4.468 ( 1.986 11.869 -2.259) 12.244 4.710 ( 3.702 -10.269 -0.787) 10.944 4.929 ( 7.280 12.103 -2.447) 14.335 5.144 ( 1.707 -9.455 -7.441) 12.153 5.196 ( -3.598 2.686 2.446) 5.113 5.247 ( -3.557 -4.334 4.094) 6.942 6.064 ( -4.624 14.115 -6.048) 16.037 6.251 ( -6.283 -3.946 -6.644) 9.959 6.370 ( 4.269 4.717 0.142) 6.364 6.433 ( 1.819 -1.328 -1.889) 2.940 6.688 ( -2.792 0.993 3.007) 4.222 6.749 ( -1.681 -5.589 1.816) 6.112 6.858 ( -3.260 3.475 1.021) 4.873 6.979 ( -0.448 -7.900 2.509) 8.300 7.308 ( 0.193 -0.500 -2.119) 2.186 7.337 ( -1.377 -3.611 -3.673) 5.332 7.635 ( 4.034 5.109 -0.530) 6.532 7.735 ( 4.022 -4.972 -1.790) 6.641 8.021 ( 0.302 3.939 3.615) 5.355 8.096 ( -0.339 -3.467 2.760) 4.444 8.333 ( -4.037 2.673 -0.681) 4.889 8.440 ( -3.666 -7.517 -3.004) 8.887 8.690 ( -2.075 2.344 2.771) 4.181 8.794 ( -0.752 -8.041 2.771) 8.538 9.383 ( -3.655 8.028 3.601) 9.528 9.443 ( 8.423 1.588 -7.638) 11.481 9.609 ( -1.250 4.070 -3.969) 5.821 9.799 ( -9.397 -11.935 11.331) 18.951 10.746 ( 10.960 5.282 -4.842) 13.095 10.842 ( 9.203 -4.342 -3.672) 10.819 12.858 ( -1.851 3.149 0.995) 3.786 12.921 ( -2.159 -3.387 3.139) 5.098 13.210 ( 3.107 8.044 0.071) 8.623 13.358 ( 1.816 -6.806 -1.387) 7.179 13.689 ( -1.721 4.555 2.324) 5.395 13.792 ( -1.482 -5.752 -0.838) 5.998 14.526 ( -0.898 0.942 -2.691) 2.989 14.541 ( -1.970 -0.909 -1.064) 2.417 14.676 ( 1.549 1.723 0.718) 2.426 14.717 ( 2.665 -1.597 1.522) 3.460 14.997 ( 3.656 -1.098 0.830) 3.906 15.010 ( 4.039 -3.079 1.649) 5.340 15.063 ( 1.745 3.208 -0.079) 3.653 15.140 ( 1.915 -4.177 -1.146) 4.736 16.747 ( 1.805 4.002 -3.467) 5.594 16.797 ( 0.057 0.451 -3.280) 3.311 17.101 ( -0.952 1.313 7.743) 7.911 17.204 ( -2.706 -7.458 6.696) 10.382 18.040 ( -4.767 8.465 -5.509) 11.169 18.199 ( -0.349 -7.200 -4.459) 8.476 18.732 ( -0.940 -0.089 0.310) 0.994 18.768 ( 0.274 -3.489 1.410) 3.773 19.671 ( 2.647 5.749 -0.232) 6.333 19.772 ( 4.321 -4.373 -0.828) 6.203 19.941 ( 3.945 0.699 1.359) 4.230 19.973 ( 3.313 -2.133 -0.400) 3.960 20.891 ( 1.314 1.083 1.066) 2.009 20.920 ( 2.573 -1.942 1.185) 3.435 22.251 ( -4.671 1.894 0.320) 5.050 22.309 ( -3.788 -4.136 -0.687) 5.650 23.764 ( -1.172 5.691 5.127) 7.748 23.856 ( -0.914 -3.964 3.630) 5.452 24.149 ( -2.348 3.935 -5.034) 6.807 24.221 ( -0.222 -3.468 -4.679) 5.828 ======================= Grid point 146 (78/138) ======================= q-point: ( 0.22 0.45 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.065 ( -9.901 13.092 3.156) 16.716 3.138 ( -3.449 -1.840 2.353) 4.563 3.219 ( 9.213 17.678 -3.048) 20.166 3.371 ( -8.512 19.365 -1.885) 21.237 3.534 ( 5.413 -12.308 -4.740) 14.257 3.783 ( -4.750 -9.056 1.020) 10.277 4.010 ( 0.003 -0.859 3.229) 3.341 4.067 ( 1.676 -5.881 5.312) 8.100 4.543 ( 5.214 7.726 -4.297) 10.264 4.782 ( 2.420 -12.899 -0.876) 13.153 5.087 ( 7.790 6.931 -2.692) 10.769 5.147 ( 1.072 0.136 -1.757) 2.063 5.167 ( -0.118 0.330 1.129) 1.183 5.212 ( -0.194 -4.517 -2.844) 5.341 5.906 ( -8.706 11.645 -5.067) 15.397 6.075 ( -8.324 -5.430 -7.458) 12.426 6.403 ( -2.513 7.339 0.169) 7.759 6.478 ( 1.779 1.961 6.142) 6.689 6.635 ( -2.265 3.373 4.555) 6.104 6.662 ( -6.334 -3.065 -1.057) 7.115 6.809 ( -1.138 0.938 4.796) 5.018 6.956 ( -2.399 -11.640 6.952) 13.769 7.316 ( 1.134 -0.896 1.279) 1.929 7.347 ( 1.166 -3.703 2.625) 4.686 7.686 ( 0.746 4.600 -2.114) 5.117 7.775 ( -0.435 -4.078 -1.809) 4.483 8.050 ( 2.335 4.022 0.873) 4.732 8.117 ( 2.551 -2.155 -0.092) 3.341 8.280 ( -1.160 2.303 -0.591) 2.645 8.399 ( -0.075 -8.876 -4.523) 9.962 8.640 ( -2.670 3.797 -1.325) 4.827 8.758 ( -2.835 -7.600 -1.327) 8.220 9.241 ( -9.351 14.008 13.123) 21.351 9.481 ( -5.865 -9.874 6.034) 12.973 9.689 ( 9.925 3.346 -10.883) 15.104 9.769 ( 5.239 -5.297 -6.834) 10.110 10.944 ( 8.963 4.281 -0.899) 9.973 11.010 ( 7.701 -2.489 -1.368) 8.208 12.836 ( -0.466 2.739 -0.491) 2.822 12.896 ( -0.888 -3.449 0.448) 3.589 13.268 ( 2.448 6.715 1.005) 7.218 13.384 ( 0.819 -4.878 -0.217) 4.951 13.654 ( -2.227 4.918 4.309) 6.908 13.752 ( -2.257 -4.741 0.724) 5.300 14.508 ( -0.093 -0.107 -3.437) 3.440 14.510 ( -0.701 -0.425 -3.724) 3.813 14.714 ( 2.021 3.175 1.768) 4.158 14.790 ( 4.217 -2.974 0.457) 5.180 15.064 ( 2.330 0.545 1.919) 3.068 15.094 ( 3.790 -2.391 1.785) 4.824 15.131 ( 4.351 2.129 0.143) 4.846 15.200 ( 4.865 -4.007 -0.859) 6.361 16.766 ( 0.808 3.079 -4.358) 5.397 16.794 ( 0.169 0.868 -1.349) 1.613 17.089 ( -1.819 0.573 6.978) 7.234 17.174 ( -1.744 -7.375 6.302) 9.856 17.945 ( -3.337 8.929 -5.387) 10.949 18.148 ( -3.365 -11.555 -4.464) 12.836 18.719 ( -0.349 1.556 0.040) 1.595 18.764 ( -0.785 -2.953 0.481) 3.093 19.742 ( 3.616 6.804 1.016) 7.772 19.853 ( 3.758 -4.154 0.140) 5.604 20.027 ( 4.633 2.201 -0.512) 5.154 20.092 ( 7.952 -4.249 0.460) 9.028 20.940 ( 3.409 2.322 0.934) 4.229 20.993 ( 4.486 -3.272 0.748) 5.603 22.121 ( -8.146 3.149 -0.297) 8.738 22.197 ( -7.228 -4.884 -0.675) 8.749 23.741 ( -2.078 6.247 4.816) 8.157 23.844 ( -1.086 -4.547 3.538) 5.863 24.091 ( -2.363 5.543 -4.162) 7.323 24.200 ( -0.713 -5.675 -4.408) 7.221 ======================= Grid point 147 (79/138) ======================= q-point: ( 0.33 0.45 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.815 ( -12.717 24.948 -5.509) 28.539 3.041 ( -6.558 -2.263 4.017) 8.016 3.289 ( -0.402 0.693 5.406) 5.465 3.423 ( 9.665 10.276 -4.855) 14.919 3.568 ( -7.740 -16.498 -4.253) 18.713 3.670 ( 4.125 -9.232 -11.302) 15.165 4.068 ( 4.496 3.080 1.142) 5.568 4.116 ( 1.937 -3.097 3.847) 5.305 4.629 ( 4.500 2.286 -4.634) 6.852 4.759 ( -4.061 -8.958 -1.213) 9.910 5.139 ( -1.317 4.763 0.815) 5.008 5.179 ( 1.013 2.177 0.346) 2.426 5.222 ( 3.882 -0.707 -1.369) 4.177 5.243 ( 3.034 -1.380 0.031) 3.333 5.753 ( -4.377 9.579 -3.977) 11.258 5.925 ( -4.456 -7.450 -6.960) 11.127 6.284 ( -7.781 9.314 -2.406) 12.372 6.451 ( -7.718 -7.075 2.912) 10.867 6.555 ( -1.764 9.535 10.286) 14.137 6.661 ( 1.640 1.785 4.462) 5.078 6.829 ( 0.877 -1.770 6.976) 7.250 6.937 ( -0.288 -9.925 2.478) 10.234 7.350 ( 0.713 -1.678 5.868) 6.145 7.361 ( -1.255 -2.502 7.733) 8.224 7.673 ( -0.430 2.024 -1.602) 2.617 7.732 ( -1.964 -3.574 -1.211) 4.254 8.120 ( 4.475 4.308 -2.190) 6.586 8.182 ( 3.026 -0.892 -2.548) 4.055 8.259 ( -1.370 2.153 0.123) 2.555 8.386 ( -0.502 -8.571 -3.280) 9.190 8.607 ( 0.511 3.654 -5.907) 6.965 8.706 ( -1.045 -5.723 -5.689) 8.137 9.107 ( -7.064 12.554 13.262) 19.580 9.357 ( -7.813 -12.082 12.611) 19.133 9.865 ( 8.946 1.550 -11.863) 14.939 9.885 ( 8.248 -0.305 -12.294) 14.808 11.078 ( 4.414 3.671 1.270) 5.880 11.124 ( 3.926 -1.128 -0.312) 4.096 12.836 ( 0.616 1.827 -1.240) 2.292 12.884 ( -0.343 -3.149 -1.268) 3.412 13.306 ( 1.101 5.028 0.884) 5.222 13.386 ( -0.556 -2.917 -0.401) 2.996 13.630 ( -1.277 5.315 6.395) 8.413 13.720 ( -1.245 -3.422 3.545) 5.082 14.493 ( -0.120 0.798 -5.319) 5.380 14.506 ( 0.724 -1.072 -4.303) 4.493 14.759 ( 1.841 4.528 2.535) 5.507 14.870 ( 3.700 -5.082 -0.973) 6.361 15.106 ( 1.584 0.328 0.538) 1.705 15.147 ( 1.307 -3.461 0.448) 3.726 15.222 ( 4.525 5.009 2.426) 7.174 15.309 ( 5.292 -3.912 0.945) 6.648 16.764 ( 0.243 2.663 -3.541) 4.437 16.786 ( -0.948 0.112 -1.160) 1.502 17.073 ( -1.107 1.840 6.467) 6.814 17.163 ( -0.847 -7.560 5.649) 9.475 17.891 ( -0.864 5.930 -4.940) 7.766 18.066 ( -3.373 -11.795 -4.881) 13.203 18.714 ( -0.355 1.189 0.259) 1.268 18.745 ( -0.882 -2.159 -1.111) 2.583 19.802 ( 2.103 6.478 2.386) 7.217 19.916 ( 2.330 -5.202 1.297) 5.846 20.125 ( 5.100 5.995 -0.863) 7.918 20.242 ( 6.463 -6.158 -0.299) 8.932 21.028 ( 5.069 3.021 0.828) 5.959 21.092 ( 5.143 -3.707 0.166) 6.342 21.949 ( -8.467 3.729 -0.721) 9.280 22.035 ( -8.496 -5.262 -0.987) 10.042 23.710 ( -2.041 7.206 4.410) 8.691 23.832 ( -0.889 -5.247 3.127) 6.172 24.042 ( -1.629 6.330 -2.966) 7.178 24.179 ( -0.334 -7.426 -3.924) 8.406 ======================= Grid point 148 (80/138) ======================= q-point: ( 0.44 0.45 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.629 ( -3.077 14.807 -7.610) 16.930 2.898 ( -8.948 -6.897 0.794) 11.325 3.277 ( -5.917 -4.548 -1.219) 7.562 3.391 ( 4.395 -11.659 3.325) 12.896 3.681 ( 11.315 7.147 -10.505) 17.014 3.758 ( 4.859 2.939 -7.465) 9.380 4.129 ( 1.040 -3.672 -3.243) 5.009 4.153 ( 0.321 -3.160 2.885) 4.291 4.660 ( -1.927 2.109 -2.478) 3.781 4.718 ( 3.490 -2.151 -4.387) 6.004 5.082 ( -3.241 2.380 3.430) 5.286 5.138 ( -5.637 -2.245 2.860) 6.708 5.270 ( 1.105 2.320 -1.814) 3.145 5.300 ( 2.558 -1.179 -0.465) 2.855 5.737 ( 2.178 7.625 -0.797) 7.970 5.896 ( 2.611 -8.057 -2.101) 8.726 6.127 ( -6.596 9.355 -4.517) 12.306 6.286 ( -8.467 -6.085 1.214) 10.497 6.551 ( -1.805 8.792 9.392) 12.991 6.685 ( -1.130 -0.630 6.380) 6.510 6.847 ( -0.644 -0.257 4.430) 4.484 6.955 ( 1.287 -7.541 1.614) 7.819 7.334 ( -2.948 -1.585 8.498) 9.134 7.349 ( -2.181 -3.407 7.314) 8.358 7.691 ( 2.216 0.859 1.270) 2.695 7.734 ( 2.172 -3.120 0.076) 3.802 8.158 ( -1.265 0.182 -2.738) 3.022 8.186 ( -1.713 -0.230 -1.427) 2.242 8.261 ( 3.442 6.170 -3.578) 7.919 8.406 ( 3.608 -5.842 -3.403) 7.664 8.621 ( 1.595 2.214 -6.248) 6.818 8.681 ( -0.634 -3.660 -7.490) 8.361 9.036 ( -2.780 8.404 11.957) 14.877 9.245 ( -6.464 -11.418 14.268) 19.384 9.964 ( 4.901 4.587 -13.346) 14.939 10.026 ( 7.409 -1.818 -10.339) 12.849 11.120 ( -0.407 3.702 1.511) 4.019 11.165 ( 0.335 -0.837 0.263) 0.939 12.855 ( 1.567 0.322 -1.445) 2.156 12.877 ( 0.073 -1.950 -1.750) 2.622 13.314 ( -0.454 3.339 0.322) 3.385 13.364 ( -1.378 -1.691 -0.985) 2.393 13.632 ( -0.280 6.257 7.540) 9.802 13.722 ( 0.215 -2.714 6.366) 6.924 14.480 ( 0.100 1.933 -6.121) 6.420 14.513 ( 1.005 -2.083 -4.956) 5.469 14.791 ( 0.579 5.391 2.731) 6.071 14.922 ( 1.634 -6.351 -1.438) 6.714 15.118 ( -0.530 0.133 -0.783) 0.955 15.153 ( -0.583 -2.925 -0.724) 3.069 15.305 ( 2.699 5.210 4.371) 7.316 15.391 ( 2.431 -3.528 1.742) 4.625 16.752 ( -1.961 1.862 -0.992) 2.880 16.769 ( 1.043 0.601 -3.181) 3.401 17.074 ( -0.440 2.333 6.210) 6.648 17.165 ( -0.144 -7.303 5.345) 9.051 17.884 ( 0.888 2.549 -4.401) 5.163 18.010 ( -0.846 -10.109 -5.268) 11.431 18.698 ( -1.443 0.999 -0.198) 1.766 18.730 ( -0.295 -2.546 -1.932) 3.209 19.839 ( 1.053 6.343 3.488) 7.315 19.951 ( 0.900 -5.180 1.876) 5.583 20.202 ( 2.441 6.590 -0.395) 7.039 20.325 ( 1.850 -6.125 -1.366) 6.543 21.121 ( 3.197 2.773 0.741) 4.296 21.174 ( 2.461 -2.692 -0.234) 3.654 21.818 ( -3.681 2.666 -0.732) 4.604 21.889 ( -4.914 -4.801 -1.525) 7.037 23.685 ( -1.394 8.013 3.998) 9.063 23.826 ( -0.370 -6.153 2.923) 6.822 24.016 ( -0.319 7.035 -2.271) 7.399 24.172 ( 0.464 -8.456 -3.399) 9.125 ======================= Grid point 149 (81/138) ======================= q-point: (-0.44 0.45 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.684 ( 9.602 -2.894 -3.820) 10.732 2.732 ( -4.815 -6.081 -7.364) 10.696 3.247 ( 2.320 13.911 5.344) 15.082 3.525 ( 6.331 -10.320 0.407) 12.114 3.728 ( -2.322 10.049 -7.585) 12.803 3.886 ( 6.788 0.517 -8.456) 10.856 4.045 ( -8.798 -3.860 0.977) 9.657 4.166 ( 0.586 -10.835 -0.666) 10.872 4.670 ( 4.084 6.944 -3.587) 8.818 4.782 ( 4.191 -3.253 -5.835) 7.887 5.043 ( -2.877 0.660 3.981) 4.956 5.084 ( 2.359 -3.584 4.299) 6.074 5.282 ( 0.641 2.643 -0.945) 2.879 5.302 ( -1.875 0.621 -1.740) 2.633 5.776 ( 0.845 9.913 0.878) 9.988 5.959 ( 0.629 -4.724 -1.795) 5.092 6.048 ( 0.903 2.591 -3.581) 4.511 6.156 ( -3.079 -5.774 -0.164) 6.546 6.518 ( -3.286 7.648 7.184) 10.996 6.638 ( -4.797 -0.760 4.786) 6.819 6.823 ( -2.464 2.665 2.952) 4.678 6.976 ( -0.153 -9.128 2.231) 9.398 7.303 ( -1.571 -1.561 7.124) 7.460 7.323 ( -1.324 -3.738 6.266) 7.416 7.746 ( 2.268 0.755 3.377) 4.138 7.776 ( 0.974 -1.706 1.684) 2.587 8.137 ( 0.187 -0.501 -4.170) 4.204 8.152 ( 0.987 -2.690 -3.325) 4.389 8.342 ( 4.463 9.343 -2.860) 10.742 8.468 ( 2.189 -1.137 0.714) 2.568 8.597 ( -3.173 2.433 -3.265) 5.162 8.678 ( 3.342 -7.733 -10.481) 13.447 9.042 ( 0.134 3.644 9.622) 10.290 9.171 ( -4.149 -8.514 12.945) 16.040 10.005 ( 2.259 7.450 -11.796) 14.134 10.118 ( 3.939 -4.212 -7.628) 9.563 11.071 ( -4.745 5.010 0.520) 6.919 11.140 ( -2.902 -1.980 0.039) 3.513 12.875 ( 0.738 0.347 -1.182) 1.436 12.898 ( 2.587 -2.005 -1.327) 3.532 13.293 ( -1.646 2.665 0.234) 3.141 13.332 ( -1.514 -1.266 -1.059) 2.240 13.647 ( -0.140 7.113 7.376) 10.247 13.750 ( 0.827 -3.240 6.881) 7.650 14.471 ( 0.529 2.737 -6.260) 6.853 14.523 ( 1.150 -2.985 -5.150) 6.062 14.788 ( -1.483 5.461 2.518) 6.194 14.925 ( -1.070 -7.407 -0.973) 7.546 15.085 ( -2.293 1.304 -0.687) 2.726 15.123 ( -2.051 -2.704 -1.317) 3.640 15.334 ( -0.956 3.903 4.335) 5.911 15.406 ( -1.384 -3.090 1.813) 3.841 16.713 ( -1.444 4.973 -1.726) 5.458 16.792 ( 1.831 -2.594 -2.526) 4.058 17.075 ( -1.064 3.394 6.122) 7.080 17.184 ( 0.829 -8.067 5.544) 9.823 17.897 ( 1.484 2.450 -4.124) 5.021 18.019 ( 2.903 -9.797 -5.093) 11.417 18.662 ( -1.766 2.302 -1.155) 3.123 18.722 ( -0.086 -4.152 -1.711) 4.492 19.860 ( 0.181 6.164 4.205) 7.464 19.959 ( -0.532 -3.758 1.683) 4.152 20.210 ( -1.715 4.544 0.291) 4.866 20.305 ( -3.421 -4.983 -2.309) 6.470 21.117 ( -3.599 2.891 0.658) 4.663 21.173 ( -2.615 -2.796 -0.254) 3.837 21.819 ( 3.684 1.983 -0.606) 4.228 21.880 ( 4.585 -4.336 -1.820) 6.568 23.675 ( -0.434 8.446 3.526) 9.163 23.829 ( -0.029 -7.262 3.191) 7.932 24.022 ( 1.493 7.728 -2.241) 8.184 24.182 ( 1.208 -8.413 -3.036) 9.025 ======================= Grid point 150 (82/138) ======================= q-point: (-0.33 0.45 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.723 ( 5.492 6.757 -6.918) 11.121 2.935 ( 13.917 -14.151 1.562) 19.909 3.339 ( 4.030 20.817 7.130) 22.371 3.559 ( -2.529 9.817 -9.481) 13.880 3.685 ( 0.180 -9.197 1.146) 9.270 3.832 ( -8.989 -10.060 -5.565) 14.594 3.923 ( -3.421 8.114 2.159) 9.067 4.139 ( -3.145 -11.549 1.393) 12.050 4.783 ( 6.779 6.224 -4.091) 10.072 4.893 ( 7.419 -5.851 0.464) 9.460 5.020 ( -2.296 5.944 -0.422) 6.386 5.109 ( -2.653 -2.726 0.734) 3.874 5.245 ( -1.765 6.887 -1.321) 7.231 5.365 ( 9.379 -6.659 2.451) 11.761 5.784 ( 1.537 10.043 -5.874) 11.736 5.909 ( -2.147 -1.172 -10.468) 10.750 6.068 ( 0.827 3.682 0.829) 3.864 6.204 ( 4.367 -10.442 6.197) 12.904 6.473 ( -1.737 5.258 2.889) 6.246 6.538 ( -4.926 2.179 0.530) 5.412 6.784 ( -1.491 2.317 3.973) 4.835 6.945 ( -3.235 -10.490 2.270) 11.210 7.313 ( 1.099 -1.110 5.261) 5.488 7.337 ( 1.340 -3.393 5.362) 6.486 7.763 ( -1.802 1.370 -0.406) 2.300 7.787 ( 0.320 -1.025 1.198) 1.609 8.170 ( 3.708 0.210 -2.570) 4.517 8.196 ( 3.150 -1.417 -2.025) 4.004 8.393 ( -0.376 5.902 4.574) 7.476 8.496 ( -1.647 -4.609 2.290) 5.404 8.543 ( 2.964 8.946 -6.076) 11.213 8.746 ( 5.435 -11.452 -9.708) 15.966 9.053 ( -1.658 1.906 8.286) 8.663 9.137 ( -1.805 -6.166 7.807) 10.110 10.006 ( 0.308 8.768 -7.580) 11.594 10.150 ( 0.675 -6.026 -3.173) 6.843 10.940 ( -8.355 7.314 -1.434) 11.196 11.050 ( -6.005 -4.061 -1.356) 7.375 12.895 ( 1.502 2.398 -0.291) 2.844 12.954 ( 3.027 -3.749 -0.048) 4.819 13.249 ( -2.883 3.536 0.189) 4.567 13.306 ( -0.765 -2.287 -0.949) 2.591 13.653 ( -0.797 7.666 5.718) 9.597 13.778 ( 0.599 -4.981 5.065) 7.129 14.476 ( 1.458 3.007 -5.372) 6.327 14.537 ( 1.527 -3.432 -4.643) 5.972 14.745 ( -3.237 5.060 1.829) 6.279 14.876 ( -3.580 -7.639 0.118) 8.437 15.041 ( -1.831 1.502 0.186) 2.375 15.075 ( -2.380 -2.252 -1.203) 3.491 15.286 ( -4.553 2.673 3.213) 6.180 15.345 ( -4.988 -3.006 1.292) 5.966 16.692 ( -0.282 7.493 -2.444) 7.887 16.822 ( 1.608 -5.696 -2.561) 6.449 17.062 ( -1.492 5.969 6.390) 8.871 17.218 ( 1.151 -10.065 6.041) 11.795 17.932 ( 3.098 5.119 -4.076) 7.240 18.086 ( 4.608 -10.685 -4.553) 12.495 18.632 ( -0.791 3.787 -1.585) 4.181 18.719 ( 0.118 -5.391 -1.170) 5.518 19.862 ( -1.107 5.649 4.431) 7.265 19.935 ( -2.247 -1.230 0.857) 2.701 20.140 ( -5.482 1.036 0.327) 5.589 20.190 ( -6.974 -3.472 -2.396) 8.151 21.025 ( -4.963 2.557 0.840) 5.646 21.084 ( -5.602 -3.480 -0.070) 6.596 21.942 ( 8.096 3.081 -0.842) 8.703 22.019 ( 8.669 -4.934 -1.356) 10.067 23.684 ( 0.511 8.434 3.184) 9.030 23.838 ( 0.119 -7.504 3.501) 8.281 24.064 ( 3.117 7.234 -2.465) 8.253 24.203 ( 1.556 -7.154 -3.065) 7.937 ======================= Grid point 151 (83/138) ======================= q-point: (-0.22 0.45 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.876 ( 9.327 14.893 -2.999) 17.827 3.130 ( 3.154 -7.427 3.036) 8.622 3.382 ( -2.194 17.524 6.072) 18.676 3.509 ( 0.940 7.462 -6.620) 10.020 3.631 ( -4.375 -8.771 -3.826) 10.522 3.751 ( 1.781 -12.778 0.843) 12.929 3.855 ( -2.605 9.138 6.214) 11.354 4.078 ( -3.120 -9.167 2.583) 10.022 4.850 ( -4.122 7.605 6.373) 10.744 4.875 ( -4.845 6.820 -1.440) 8.488 4.975 ( -9.000 0.219 -3.242) 9.569 5.050 ( 3.882 -7.691 -3.972) 9.487 5.288 ( 4.334 15.226 5.329) 16.704 5.584 ( 6.881 -13.463 6.307) 16.382 5.828 ( 5.674 5.229 -15.954) 17.722 5.883 ( 4.413 -0.632 -15.396) 16.029 6.102 ( 3.488 8.644 3.475) 9.948 6.278 ( 1.690 -7.107 2.182) 7.624 6.479 ( 3.091 1.933 -1.817) 4.073 6.514 ( 3.292 0.342 -0.956) 3.445 6.800 ( 2.019 -0.400 4.239) 4.712 6.890 ( -2.216 -8.016 3.006) 8.844 7.356 ( 1.837 -0.163 3.468) 3.928 7.393 ( 3.034 -3.571 4.125) 6.243 7.688 ( -5.138 4.126 -3.878) 7.646 7.767 ( -2.315 -3.664 -2.673) 5.092 8.183 ( -3.364 3.376 4.229) 6.372 8.258 ( -0.168 -4.137 1.841) 4.531 8.392 ( 2.614 4.605 3.361) 6.272 8.458 ( -0.110 -0.395 -1.078) 1.154 8.676 ( 8.822 3.082 -2.490) 9.671 8.828 ( 3.558 -9.896 -4.360) 11.384 9.017 ( -2.711 3.046 5.662) 6.977 9.131 ( 0.677 -7.953 -0.445) 7.994 9.988 ( -1.257 8.599 -0.207) 8.693 10.137 ( -1.683 -6.677 3.035) 7.525 10.748 ( -9.776 9.636 -5.174) 14.670 10.903 ( -8.053 -6.332 -3.865) 10.949 12.930 ( 1.621 3.613 1.388) 4.196 13.004 ( 1.278 -4.179 2.754) 5.165 13.184 ( -3.409 6.033 -0.629) 6.958 13.299 ( 0.290 -5.748 -1.911) 6.064 13.648 ( -0.403 8.008 3.234) 8.646 13.795 ( 0.346 -6.986 2.175) 7.325 14.504 ( 2.297 2.871 -3.629) 5.166 14.565 ( 2.122 -3.340 -3.146) 5.055 14.680 ( -3.387 4.530 0.844) 5.719 14.798 ( -4.239 -6.919 1.400) 8.235 15.011 ( -1.759 0.715 0.333) 1.927 15.032 ( -1.526 -1.239 0.078) 1.967 15.184 ( -6.053 1.378 1.988) 6.519 15.230 ( -6.236 -3.122 0.023) 6.974 16.690 ( 0.635 8.293 -3.123) 8.884 16.837 ( 0.443 -6.792 -3.191) 7.517 17.052 ( -0.849 8.215 7.173) 10.939 17.250 ( 0.452 -11.609 6.620) 13.372 18.001 ( 4.817 6.790 -4.148) 9.301 18.162 ( 3.651 -9.354 -4.298) 10.923 18.633 ( 1.384 3.512 -1.564) 4.086 18.723 ( 0.476 -5.410 -0.162) 5.434 19.823 ( -4.048 4.758 3.227) 7.031 19.885 ( -2.792 -0.802 1.098) 3.105 19.990 ( -8.281 1.916 -2.434) 8.842 20.064 ( -5.391 -4.628 0.080) 7.106 20.944 ( -3.396 1.208 1.144) 3.781 20.978 ( -4.710 -2.399 0.326) 5.296 22.104 ( 7.945 3.096 -0.642) 8.551 22.183 ( 7.731 -5.066 -0.972) 9.294 23.707 ( 1.097 7.996 3.236) 8.696 23.849 ( 0.185 -6.711 3.650) 7.642 24.127 ( 3.660 5.291 -2.824) 7.026 24.224 ( 1.225 -4.859 -3.640) 6.194 ======================= Grid point 152 (84/138) ======================= q-point: (-0.11 0.45 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.994 ( 1.546 12.133 1.651) 12.342 3.134 ( -0.557 0.003 1.794) 1.879 3.322 ( -3.467 15.197 2.573) 15.798 3.482 ( -2.959 -1.571 -0.696) 3.422 3.611 ( 3.875 1.595 -6.998) 8.156 3.820 ( 1.326 2.399 5.923) 6.527 3.889 ( 4.537 -6.892 7.194) 10.947 4.028 ( -2.609 -4.640 3.752) 6.513 4.664 ( -10.219 9.018 2.835) 13.921 4.777 ( -7.968 -2.500 0.458) 8.363 4.857 ( -1.585 13.782 -4.102) 14.466 5.083 ( 1.359 -8.100 -2.964) 8.732 5.330 ( -2.612 11.195 10.192) 15.363 5.542 ( -9.501 -7.180 8.091) 14.397 5.963 ( 10.835 4.658 -18.525) 21.961 6.039 ( 11.489 -3.783 -12.653) 17.505 6.217 ( 6.097 8.471 -0.730) 10.462 6.342 ( 6.292 -0.881 -5.228) 8.228 6.589 ( 6.882 -2.071 1.347) 7.312 6.616 ( 6.137 -3.483 -2.080) 7.356 6.861 ( 2.399 -2.460 2.828) 4.450 6.884 ( 1.290 -3.861 2.169) 4.613 7.390 ( 1.016 1.596 0.676) 2.009 7.447 ( -0.328 -3.819 0.188) 3.838 7.577 ( -2.897 5.273 -2.682) 6.587 7.692 ( -3.830 -5.936 -3.905) 8.072 8.093 ( -5.415 3.544 5.563) 8.534 8.185 ( -5.545 -5.481 4.857) 9.186 8.457 ( 0.067 4.187 0.758) 4.255 8.507 ( 4.633 0.574 -1.522) 4.911 8.791 ( 0.963 -2.790 4.140) 5.084 8.817 ( -4.764 -5.339 3.949) 8.173 9.047 ( 7.261 4.798 -2.358) 9.017 9.202 ( 7.790 -9.858 -9.473) 15.735 9.934 ( -6.334 9.451 9.379) 14.745 10.099 ( -4.137 -7.507 10.089) 13.238 10.575 ( -4.349 9.819 -10.423) 14.965 10.744 ( -5.479 -7.518 -7.255) 11.797 12.947 ( -1.093 2.852 3.568) 4.696 13.006 ( -2.005 -3.332 5.970) 7.125 13.134 ( -0.592 8.910 -2.640) 9.311 13.306 ( 1.066 -8.610 -3.381) 9.311 13.664 ( 1.541 6.834 1.402) 7.145 13.805 ( 0.428 -7.446 -0.235) 7.462 14.543 ( 1.890 2.637 -1.528) 3.586 14.595 ( 0.493 -1.490 -1.277) 2.023 14.632 ( -0.532 2.267 -0.055) 2.329 14.725 ( -3.397 -5.506 2.027) 6.780 14.964 ( -2.585 1.055 0.008) 2.792 15.012 ( -1.588 -2.996 1.305) 3.633 15.074 ( -4.299 2.249 0.595) 4.888 15.138 ( -2.438 -3.791 -1.004) 4.618 16.700 ( 1.148 7.423 -3.446) 8.264 16.826 ( -0.512 -4.870 -3.780) 6.186 17.065 ( 0.274 7.678 7.847) 10.982 17.260 ( -1.024 -11.134 6.961) 13.171 18.094 ( 5.199 5.223 -4.311) 8.538 18.192 ( 0.127 -3.989 -4.776) 6.224 18.677 ( 3.156 0.792 -0.732) 3.336 18.737 ( 0.780 -4.505 0.943) 4.668 19.734 ( -4.730 2.671 1.401) 5.610 19.788 ( -6.275 -2.867 -1.195) 7.001 19.892 ( -1.362 4.363 0.367) 4.585 19.977 ( -3.210 -4.219 -0.016) 5.301 20.897 ( -1.608 0.124 1.281) 2.059 20.908 ( -2.482 -1.058 0.860) 2.831 22.234 ( 5.052 2.356 -0.098) 5.575 22.303 ( 4.408 -4.694 -0.737) 6.481 23.738 ( 1.057 7.163 3.825) 8.188 23.860 ( -0.039 -5.466 3.713) 6.609 24.185 ( 2.700 2.614 -3.363) 5.043 24.230 ( 0.237 -2.039 -4.678) 5.108 ======================= Grid point 198 (85/138) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.343 ( 5.313 0.000 32.131) 32.567 1.557 ( 4.827 0.000 31.059) 31.431 2.042 ( -0.151 0.000 -23.828) 23.829 2.289 ( -11.342 0.000 -21.864) 24.631 2.709 ( -11.980 0.000 54.668) 55.966 3.216 ( 1.057 0.000 14.225) 14.264 3.433 ( 3.328 0.000 -6.336) 7.157 3.849 ( 11.352 0.000 -53.968) 55.149 4.075 ( -1.124 0.000 5.891) 5.998 4.104 ( 2.269 0.000 0.487) 2.321 4.727 ( -5.652 0.000 -0.353) 5.663 4.788 ( 3.462 0.000 -6.577) 7.433 5.359 ( -5.778 0.000 -0.096) 5.779 5.371 ( 3.403 0.000 -1.322) 3.650 5.820 ( -7.150 0.000 11.319) 13.388 5.987 ( 6.070 0.000 -2.111) 6.427 6.131 ( 2.884 0.000 -2.794) 4.015 6.139 ( -5.027 0.000 1.587) 5.272 6.861 ( 2.009 0.000 3.076) 3.674 6.863 ( 4.876 0.000 5.035) 7.009 7.034 ( -4.076 0.000 -2.547) 4.806 7.120 ( 0.717 0.000 -10.457) 10.481 7.389 ( -0.687 0.000 3.115) 3.190 7.505 ( 5.992 0.000 -8.359) 10.285 7.514 ( 0.075 0.000 4.699) 4.700 7.619 ( 2.019 0.000 -6.610) 6.911 8.028 ( -5.005 0.000 1.226) 5.153 8.052 ( 8.889 0.000 -1.361) 8.993 8.355 ( -7.829 0.000 9.520) 12.325 8.432 ( 18.392 0.000 -0.421) 18.397 8.665 ( -2.164 0.000 11.382) 11.586 8.972 ( 0.104 0.000 -17.363) 17.364 9.411 ( 1.728 0.000 10.101) 10.248 9.525 ( -2.818 0.000 -1.236) 3.077 10.067 ( 7.955 0.000 1.416) 8.080 10.081 ( -5.392 0.000 -0.039) 5.392 10.615 ( -6.714 0.000 5.304) 8.557 10.706 ( 5.069 0.000 -3.943) 6.422 12.680 ( 1.529 0.000 2.650) 3.060 12.726 ( -1.920 0.000 -1.860) 2.674 13.291 ( 1.712 0.000 3.250) 3.674 13.334 ( -4.912 0.000 -0.684) 4.959 13.751 ( 0.270 0.000 -0.177) 0.323 13.820 ( 0.555 0.000 -7.827) 7.847 14.737 ( -1.964 0.000 3.487) 4.002 14.772 ( -4.805 0.000 0.224) 4.810 14.776 ( 3.132 0.000 4.397) 5.399 14.848 ( 4.085 0.000 -3.127) 5.144 15.208 ( 0.492 0.000 0.922) 1.045 15.233 ( 0.368 0.000 -1.709) 1.748 15.944 ( 11.632 0.000 3.158) 12.053 16.033 ( -23.732 0.000 -5.826) 24.437 16.535 ( -8.139 0.000 4.337) 9.223 16.621 ( 6.599 0.000 -4.489) 7.981 17.597 ( 16.578 0.000 7.755) 18.302 17.732 ( -20.452 0.000 -6.005) 21.316 17.814 ( -15.500 0.000 5.800) 16.550 17.948 ( 18.606 0.000 -7.284) 19.981 18.839 ( -9.756 0.000 -0.565) 9.772 18.854 ( 3.053 0.000 -1.455) 3.382 19.592 ( -16.314 0.000 11.768) 20.115 19.795 ( 9.502 0.000 -8.891) 13.013 20.174 ( -1.096 0.000 0.905) 1.421 20.190 ( 2.414 0.000 -0.778) 2.536 21.255 ( -1.819 0.000 3.280) 3.751 21.321 ( 1.917 0.000 -3.282) 3.800 22.525 ( -10.495 0.000 5.141) 11.686 22.638 ( 17.064 0.000 -6.280) 18.183 23.141 ( 27.767 0.000 5.232) 28.256 23.234 ( -16.430 0.000 -4.274) 16.977 24.190 ( 9.456 0.000 3.325) 10.024 24.253 ( -13.573 0.000 -2.953) 13.891 ======================= Grid point 199 (86/138) ======================= q-point: ( 0.11 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.742 ( 22.876 0.000 28.310) 36.397 1.860 ( 20.113 0.000 0.926) 20.135 2.186 ( 6.781 0.000 -24.519) 25.440 2.210 ( 17.857 0.000 4.324) 18.373 2.739 ( 3.878 0.000 50.551) 50.700 3.397 ( 13.000 0.000 12.422) 17.981 3.553 ( 10.645 0.000 -11.122) 15.396 4.047 ( 18.509 0.000 -47.697) 51.162 4.127 ( 5.343 0.000 0.952) 5.427 4.231 ( 10.852 0.000 2.907) 11.234 4.566 ( -9.420 0.000 -5.768) 11.045 4.786 ( -2.960 0.000 -2.308) 3.754 5.308 ( 1.176 0.000 2.158) 2.458 5.473 ( 6.301 0.000 1.230) 6.420 5.702 ( -7.751 0.000 10.941) 13.409 6.083 ( 2.826 0.000 2.155) 3.554 6.083 ( -0.684 0.000 -0.276) 0.738 6.183 ( 3.499 0.000 -2.870) 4.525 6.776 ( -8.826 0.000 -2.115) 9.076 6.868 ( -2.811 0.000 1.557) 3.214 6.982 ( 0.925 0.000 1.470) 1.737 7.102 ( 0.049 0.000 -7.093) 7.093 7.408 ( 1.435 0.000 1.981) 2.446 7.545 ( 1.341 0.000 3.686) 3.922 7.583 ( 2.701 0.000 -12.944) 13.222 7.694 ( 8.301 0.000 -8.020) 11.542 7.902 ( -3.880 0.000 -1.144) 4.045 8.076 ( -0.807 0.000 -3.697) 3.784 8.323 ( -0.538 0.000 10.280) 10.294 8.729 ( -1.063 0.000 -14.246) 14.286 8.829 ( 13.257 0.000 7.206) 15.089 9.220 ( 14.274 0.000 -9.296) 17.034 9.403 ( -4.801 0.000 11.272) 12.252 9.499 ( 12.476 0.000 -11.528) 16.987 9.910 ( -10.839 0.000 -1.240) 10.910 10.203 ( 6.970 0.000 -6.937) 9.834 10.496 ( -5.949 0.000 7.443) 9.528 10.794 ( 3.978 0.000 -2.524) 4.711 12.703 ( 0.716 0.000 -2.252) 2.364 12.726 ( 2.377 0.000 3.194) 3.981 13.234 ( -4.767 0.000 3.453) 5.886 13.314 ( -0.605 0.000 5.117) 5.152 13.718 ( -3.312 0.000 -0.207) 3.318 13.769 ( -3.976 0.000 -7.493) 8.482 14.638 ( -7.347 0.000 -1.488) 7.497 14.640 ( -5.285 0.000 4.938) 7.233 14.898 ( 4.068 0.000 0.534) 4.103 14.941 ( 4.843 0.000 -1.436) 5.052 15.221 ( 0.866 0.000 1.045) 1.357 15.230 ( -0.369 0.000 -2.902) 2.925 15.438 ( -29.734 0.000 16.644) 34.076 16.122 ( 5.576 0.000 7.941) 9.703 16.433 ( -4.081 0.000 3.147) 5.154 16.762 ( 8.075 0.000 -1.063) 8.145 17.372 ( -9.192 0.000 0.855) 9.231 17.483 ( -17.225 0.000 -2.526) 17.409 17.949 ( 13.828 0.000 10.156) 17.157 18.265 ( 13.702 0.000 -8.992) 16.389 18.782 ( 1.673 0.000 3.599) 3.969 18.986 ( 9.241 0.000 2.945) 9.699 19.463 ( -2.767 0.000 10.995) 11.338 19.949 ( 3.277 0.000 -0.758) 3.363 20.239 ( 2.356 0.000 -2.296) 3.290 20.247 ( 12.214 0.000 1.956) 12.370 21.222 ( -2.189 0.000 2.477) 3.305 21.337 ( 0.368 0.000 -2.535) 2.562 22.084 ( -29.386 0.000 -6.057) 30.004 22.665 ( -3.854 0.000 -6.523) 7.576 23.091 ( 0.477 0.000 -6.600) 6.617 23.733 ( 15.738 0.000 -7.177) 17.297 24.016 ( -2.040 0.000 0.763) 2.178 24.369 ( 7.154 0.000 5.350) 8.934 ======================= Grid point 200 (87/138) ======================= q-point: ( 0.22 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.222 ( 19.496 0.000 26.216) 32.671 2.273 ( 21.828 0.000 -17.018) 27.678 2.394 ( 16.818 0.000 -20.663) 26.642 2.679 ( 25.003 0.000 21.924) 33.254 3.104 ( 20.884 0.000 32.830) 38.910 3.719 ( 15.875 0.000 8.407) 17.964 3.773 ( 12.961 0.000 -11.811) 17.535 4.163 ( -5.296 0.000 -3.510) 6.354 4.270 ( 8.909 0.000 -2.184) 9.173 4.414 ( 2.937 0.000 -28.682) 28.832 4.623 ( 28.804 0.000 -12.573) 31.428 4.684 ( -6.378 0.000 4.776) 7.968 5.426 ( 9.967 0.000 -0.998) 10.017 5.553 ( -9.704 0.000 11.690) 15.193 5.582 ( 3.435 0.000 0.683) 3.502 6.071 ( -5.000 0.000 8.362) 9.743 6.103 ( 2.825 0.000 -4.724) 5.504 6.285 ( 7.522 0.000 -3.736) 8.399 6.646 ( -3.835 0.000 1.232) 4.028 6.819 ( -2.010 0.000 0.890) 2.199 7.031 ( 3.188 0.000 2.075) 3.804 7.109 ( 2.008 0.000 -4.165) 4.624 7.427 ( -0.489 0.000 3.144) 3.182 7.576 ( 1.203 0.000 3.316) 3.527 7.577 ( 0.013 0.000 -13.147) 13.147 7.867 ( 8.999 0.000 -5.441) 10.515 7.878 ( 0.302 0.000 2.362) 2.381 8.063 ( 1.682 0.000 -8.282) 8.451 8.328 ( -1.566 0.000 13.174) 13.266 8.598 ( -6.829 0.000 -13.995) 15.573 9.083 ( 2.663 0.000 5.223) 5.863 9.125 ( -9.257 0.000 -7.567) 11.956 9.348 ( 4.565 0.000 6.386) 7.850 9.679 ( -11.977 0.000 0.742) 12.000 9.731 ( 0.578 0.000 -4.729) 4.765 10.364 ( 11.225 0.000 -15.679) 19.283 10.422 ( -4.168 0.000 8.701) 9.648 10.837 ( 0.812 0.000 -2.123) 2.273 12.770 ( 6.827 0.000 -5.330) 8.661 12.789 ( 3.232 0.000 3.552) 4.802 13.176 ( -1.897 0.000 3.223) 3.740 13.286 ( -3.598 0.000 6.556) 7.478 13.631 ( -5.242 0.000 0.082) 5.243 13.642 ( -6.511 0.000 -7.942) 10.270 14.501 ( -5.452 0.000 -2.871) 6.162 14.559 ( -4.267 0.000 4.899) 6.496 14.870 ( -5.907 0.000 3.316) 6.774 15.016 ( 2.693 0.000 0.700) 2.782 15.115 ( -5.481 0.000 11.811) 13.020 15.205 ( -1.307 0.000 -3.408) 3.651 15.303 ( 4.652 0.000 6.352) 7.874 16.209 ( 1.777 0.000 6.114) 6.367 16.371 ( -2.805 0.000 1.305) 3.094 16.816 ( -8.499 0.000 0.595) 8.520 17.269 ( 3.217 0.000 -10.132) 10.631 17.331 ( 2.077 0.000 5.231) 5.628 18.163 ( 6.950 0.000 6.265) 9.357 18.479 ( 10.814 0.000 -10.246) 14.897 18.859 ( 4.336 0.000 5.508) 7.010 19.165 ( 6.983 0.000 1.610) 7.166 19.463 ( -0.032 0.000 7.592) 7.592 19.924 ( -3.518 0.000 0.521) 3.557 20.271 ( 1.523 0.000 -2.273) 2.736 20.623 ( 20.103 0.000 13.457) 24.191 21.186 ( -1.685 0.000 0.911) 1.915 21.322 ( -2.835 0.000 -0.269) 2.848 21.519 ( -22.054 0.000 -13.114) 25.658 22.547 ( -6.046 0.000 -8.016) 10.041 23.121 ( 3.056 0.000 -6.133) 6.852 23.629 ( -11.116 0.000 3.329) 11.604 24.259 ( 14.110 0.000 -6.272) 15.441 24.488 ( 3.825 0.000 4.763) 6.109 ======================= Grid point 201 (88/138) ======================= q-point: ( 0.33 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.612 ( 16.089 0.000 -12.285) 20.243 2.660 ( 18.129 0.000 22.409) 28.824 2.705 ( 19.179 0.000 -10.408) 21.821 3.229 ( 24.079 0.000 17.911) 30.010 3.456 ( 5.137 0.000 0.893) 5.214 3.875 ( -9.966 0.000 -0.772) 9.996 3.986 ( 0.030 0.000 -10.148) 10.148 4.072 ( 17.514 0.000 14.018) 22.433 4.469 ( 12.865 0.000 -3.207) 13.258 4.524 ( 12.706 0.000 -28.402) 31.115 4.610 ( -2.340 0.000 11.537) 11.772 5.211 ( 29.010 0.000 -5.643) 29.554 5.352 ( -9.493 0.000 7.641) 12.186 5.583 ( -3.603 0.000 0.074) 3.604 5.688 ( 13.975 0.000 -9.040) 16.644 5.975 ( -5.437 0.000 9.213) 10.697 6.146 ( 3.018 0.000 -7.639) 8.214 6.429 ( 6.191 0.000 1.050) 6.279 6.620 ( 0.599 0.000 3.721) 3.769 6.778 ( -3.240 0.000 1.270) 3.480 7.102 ( 2.801 0.000 3.833) 4.747 7.141 ( 1.144 0.000 -0.750) 1.368 7.392 ( -3.866 0.000 1.726) 4.234 7.510 ( -4.457 0.000 -9.729) 10.702 7.622 ( 2.894 0.000 5.365) 6.096 7.898 ( 0.424 0.000 7.856) 7.867 7.923 ( -1.914 0.000 1.345) 2.340 8.182 ( 11.502 0.000 -12.620) 17.075 8.330 ( -1.332 0.000 12.856) 12.925 8.445 ( -3.742 0.000 -19.122) 19.485 8.911 ( -15.107 0.000 12.005) 19.296 8.954 ( -4.417 0.000 -14.831) 15.475 9.460 ( -10.045 0.000 2.889) 10.452 9.603 ( -9.490 0.000 -1.835) 9.666 9.646 ( 18.564 0.000 -3.176) 18.834 10.310 ( -9.027 0.000 9.509) 13.112 10.521 ( 6.276 0.000 -4.580) 7.769 10.817 ( -2.438 0.000 -1.423) 2.823 12.866 ( 3.577 0.000 3.557) 5.044 12.905 ( 7.079 0.000 -7.266) 10.144 13.168 ( 0.330 0.000 1.386) 1.425 13.210 ( -5.098 0.000 6.626) 8.360 13.508 ( -4.340 0.000 -9.577) 10.514 13.515 ( -6.677 0.000 1.459) 6.834 14.429 ( -0.846 0.000 -4.057) 4.144 14.490 ( -3.787 0.000 4.263) 5.702 14.823 ( 0.833 0.000 5.028) 5.096 15.043 ( -0.598 0.000 2.598) 2.665 15.087 ( -0.901 0.000 4.819) 4.903 15.170 ( -1.249 0.000 -3.943) 4.136 15.438 ( 7.028 0.000 8.636) 11.134 16.225 ( -1.357 0.000 2.954) 3.251 16.328 ( -1.703 0.000 -0.226) 1.718 16.521 ( -15.402 0.000 -8.220) 17.458 17.414 ( 3.722 0.000 8.872) 9.621 17.466 ( 13.199 0.000 -6.966) 14.924 18.292 ( 5.556 0.000 5.606) 7.893 18.648 ( 8.616 0.000 -13.071) 15.656 18.951 ( 2.653 0.000 9.397) 9.765 19.245 ( 1.282 0.000 -2.695) 2.984 19.493 ( 1.872 0.000 6.032) 6.315 19.852 ( -3.531 0.000 -0.549) 3.573 20.299 ( 2.020 0.000 -0.704) 2.139 20.935 ( -1.706 0.000 -0.824) 1.894 21.068 ( -5.920 0.000 4.709) 7.564 21.165 ( -0.311 0.000 -0.865) 0.920 21.420 ( 6.340 0.000 4.218) 7.615 22.398 ( -6.906 0.000 -10.517) 12.582 23.173 ( 3.660 0.000 -5.491) 6.599 23.438 ( -9.130 0.000 4.104) 10.010 24.457 ( 7.586 0.000 -4.066) 8.607 24.546 ( 1.207 0.000 3.511) 3.713 ======================= Grid point 202 (89/138) ======================= q-point: ( 0.44 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.860 ( 10.815 0.000 -4.107) 11.569 2.937 ( 4.992 0.000 4.526) 6.738 3.119 ( 19.647 0.000 10.166) 22.121 3.403 ( -1.980 0.000 -7.270) 7.535 3.479 ( -11.281 0.000 7.284) 13.428 3.678 ( -0.776 0.000 -11.557) 11.583 4.031 ( 8.281 0.000 -0.578) 8.301 4.272 ( -1.073 0.000 3.251) 3.423 4.568 ( -5.105 0.000 10.740) 11.891 4.736 ( 12.990 0.000 -23.001) 26.415 4.872 ( 24.854 0.000 0.651) 24.862 5.134 ( -11.838 0.000 7.955) 14.263 5.473 ( -6.476 0.000 5.004) 8.184 5.709 ( 13.169 0.000 -2.417) 13.389 5.797 ( 3.389 0.000 -14.655) 15.042 5.903 ( -5.189 0.000 6.846) 8.590 6.311 ( 16.575 0.000 -8.517) 18.635 6.425 ( -12.015 0.000 8.965) 14.991 6.671 ( 2.763 0.000 2.651) 3.829 6.706 ( -1.672 0.000 1.222) 2.071 7.137 ( -0.897 0.000 6.990) 7.047 7.155 ( 1.364 0.000 1.194) 1.813 7.299 ( -4.326 0.000 -0.932) 4.425 7.394 ( -4.013 0.000 -7.254) 8.290 7.714 ( 4.704 0.000 6.877) 8.332 7.872 ( -3.130 0.000 -0.557) 3.180 7.936 ( 1.401 0.000 10.999) 11.088 8.302 ( 0.936 0.000 -15.333) 15.361 8.305 ( -5.051 0.000 12.042) 13.059 8.440 ( 8.981 0.000 -18.952) 20.973 8.654 ( -12.409 0.000 15.213) 19.632 8.908 ( 3.672 0.000 -19.796) 20.133 9.328 ( -3.103 0.000 3.917) 4.997 9.429 ( -6.287 0.000 -1.729) 6.521 9.985 ( 16.407 0.000 -5.911) 17.440 10.112 ( -12.835 0.000 8.774) 15.548 10.610 ( 3.174 0.000 4.204) 5.267 10.737 ( -5.616 0.000 0.661) 5.655 12.926 ( 0.859 0.000 3.312) 3.422 12.995 ( 3.703 0.000 -6.223) 7.241 13.150 ( -1.067 0.000 4.488) 4.613 13.183 ( 0.813 0.000 -0.475) 0.942 13.380 ( -7.495 0.000 4.198) 8.590 13.449 ( 0.835 0.000 -9.297) 9.334 14.429 ( -3.168 0.000 2.664) 4.140 14.447 ( 3.420 0.000 -5.325) 6.328 14.899 ( 5.032 0.000 3.406) 6.077 14.999 ( -4.245 0.000 2.795) 5.082 15.084 ( -0.391 0.000 2.785) 2.812 15.149 ( 0.025 0.000 -3.582) 3.582 15.619 ( 9.168 0.000 11.944) 15.057 16.106 ( -11.050 0.000 -7.687) 13.460 16.305 ( -0.407 0.000 -1.088) 1.161 16.313 ( -2.786 0.000 -3.387) 4.385 17.487 ( 0.826 0.000 10.487) 10.520 17.657 ( 7.041 0.000 -8.541) 11.069 18.414 ( 4.559 0.000 8.572) 9.709 18.712 ( -0.548 0.000 -12.696) 12.708 19.016 ( 2.963 0.000 9.130) 9.599 19.223 ( -1.616 0.000 -5.547) 5.777 19.576 ( 4.900 0.000 6.380) 8.045 19.777 ( -4.012 0.000 -2.494) 4.724 20.362 ( 4.633 0.000 2.282) 5.164 20.662 ( -13.067 0.000 -9.317) 16.049 21.117 ( 0.483 0.000 5.559) 5.580 21.170 ( 1.110 0.000 -2.132) 2.404 21.655 ( 12.748 0.000 15.311) 19.923 22.225 ( -7.991 0.000 -14.294) 16.376 23.245 ( 4.847 0.000 -4.240) 6.440 23.285 ( -7.378 0.000 3.809) 8.303 24.553 ( -1.218 0.000 2.716) 2.977 24.557 ( 3.631 0.000 -2.415) 4.361 ======================= Grid point 203 (90/138) ======================= q-point: (-0.44 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.775 ( -18.207 0.000 6.308) 19.269 2.933 ( -9.227 0.000 -0.057) 9.228 3.208 ( -8.900 0.000 2.324) 9.198 3.453 ( 9.565 0.000 9.547) 13.514 3.541 ( -7.041 0.000 -16.216) 17.679 3.554 ( 15.651 0.000 -1.533) 15.726 4.115 ( -12.833 0.000 -7.603) 14.916 4.269 ( 10.584 0.000 1.986) 10.768 4.391 ( -15.279 0.000 11.130) 18.903 4.866 ( -8.342 0.000 -6.576) 10.623 4.880 ( -3.340 0.000 -13.017) 13.439 5.314 ( 17.415 0.000 -8.708) 19.471 5.401 ( -4.397 0.000 20.237) 20.709 5.635 ( -3.454 0.000 -10.070) 10.646 5.685 ( -18.977 0.000 2.995) 19.212 6.020 ( 10.088 0.000 -4.634) 11.102 6.137 ( -11.682 0.000 8.768) 14.607 6.539 ( 2.197 0.000 -2.120) 3.053 6.691 ( -1.727 0.000 -0.062) 1.728 6.713 ( 2.234 0.000 1.158) 2.516 7.117 ( -1.813 0.000 6.247) 6.504 7.238 ( 6.323 0.000 2.263) 6.716 7.263 ( 0.157 0.000 3.511) 3.514 7.321 ( -2.306 0.000 -7.327) 7.682 7.797 ( -3.922 0.000 -2.585) 4.698 7.820 ( 4.089 0.000 6.452) 7.639 8.011 ( 3.857 0.000 11.574) 12.200 8.169 ( -10.637 0.000 9.880) 14.518 8.248 ( -1.606 0.000 -20.393) 20.456 8.550 ( -0.557 0.000 15.198) 15.208 8.557 ( 4.782 0.000 -13.103) 13.948 8.986 ( 8.239 0.000 -18.012) 19.807 9.375 ( 6.608 0.000 3.658) 7.553 9.393 ( 3.317 0.000 -2.256) 4.011 9.857 ( -14.511 0.000 7.094) 16.152 10.255 ( 11.846 0.000 -5.308) 12.980 10.595 ( -9.297 0.000 4.013) 10.126 10.674 ( 2.026 0.000 7.655) 7.919 12.901 ( -3.635 0.000 3.323) 4.925 13.015 ( -0.840 0.000 -5.504) 5.567 13.198 ( 2.911 0.000 -1.496) 3.273 13.215 ( 3.704 0.000 -2.480) 4.458 13.265 ( -3.100 0.000 8.864) 9.391 13.491 ( 4.680 0.000 -6.608) 8.097 14.384 ( -1.554 0.000 0.861) 1.776 14.521 ( 4.983 0.000 -6.407) 8.116 14.910 ( -4.732 0.000 2.038) 5.152 15.008 ( 4.589 0.000 3.742) 5.921 15.079 ( -0.565 0.000 1.044) 1.187 15.151 ( 0.958 0.000 -3.039) 3.186 15.860 ( -10.407 0.000 -12.187) 16.026 15.864 ( 12.816 0.000 15.670) 20.244 16.303 ( 1.210 0.000 -1.414) 1.861 16.307 ( 0.958 0.000 -1.292) 1.608 17.477 ( -4.447 0.000 9.317) 10.324 17.698 ( -0.454 0.000 -10.423) 10.433 18.468 ( -2.314 0.000 11.995) 12.217 18.582 ( -8.724 0.000 -7.784) 11.692 19.112 ( 4.276 0.000 4.868) 6.479 19.186 ( -0.650 0.000 -7.611) 7.639 19.678 ( -4.779 0.000 -4.190) 6.356 19.693 ( 5.063 0.000 6.384) 8.148 20.436 ( -8.137 0.000 -5.335) 9.730 20.503 ( 8.745 0.000 6.737) 11.040 21.128 ( 0.404 0.000 2.182) 2.219 21.194 ( 1.715 0.000 -2.681) 3.182 21.932 ( 11.405 0.000 15.279) 19.066 22.007 ( -10.619 0.000 -19.661) 22.345 23.163 ( -5.837 0.000 3.981) 7.065 23.347 ( 6.295 0.000 -2.546) 6.790 24.507 ( -4.254 0.000 2.510) 4.939 24.598 ( 1.210 0.000 -1.740) 2.120 ======================= Grid point 204 (91/138) ======================= q-point: (-0.33 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.377 ( -23.424 0.000 12.303) 26.458 2.527 ( -26.926 0.000 6.079) 27.604 3.043 ( -11.313 0.000 -14.390) 18.305 3.469 ( 1.216 0.000 -1.305) 1.784 3.489 ( -8.734 0.000 -3.022) 9.242 3.762 ( -13.995 0.000 6.911) 15.608 3.883 ( 8.418 0.000 0.600) 8.439 4.057 ( -20.422 0.000 16.531) 26.274 4.367 ( -1.236 0.000 -9.692) 9.771 4.477 ( -19.294 0.000 -8.527) 21.095 4.874 ( -0.220 0.000 -15.119) 15.121 5.059 ( -25.836 0.000 7.357) 26.863 5.439 ( 0.278 0.000 1.441) 1.468 5.600 ( -0.046 0.000 -2.186) 2.187 5.647 ( 8.610 0.000 -5.281) 10.101 6.028 ( -2.698 0.000 3.332) 4.287 6.155 ( 5.712 0.000 -8.644) 10.361 6.426 ( -9.594 0.000 1.719) 9.746 6.652 ( -1.334 0.000 -0.265) 1.360 6.756 ( 0.228 0.000 4.689) 4.695 7.066 ( -4.994 0.000 7.893) 9.341 7.244 ( -2.992 0.000 -9.199) 9.673 7.293 ( 1.145 0.000 8.495) 8.571 7.384 ( 6.268 0.000 2.508) 6.751 7.716 ( -3.248 0.000 -4.332) 5.415 7.881 ( -3.681 0.000 12.673) 13.197 7.955 ( -5.840 0.000 1.262) 5.975 8.139 ( -5.140 0.000 -18.522) 19.222 8.165 ( 6.180 0.000 12.116) 13.601 8.569 ( -0.120 0.000 -10.238) 10.238 8.703 ( 11.997 0.000 9.766) 15.469 9.143 ( 10.255 0.000 -12.103) 15.864 9.487 ( 0.817 0.000 0.901) 1.217 9.560 ( 9.752 0.000 2.766) 10.137 9.613 ( -6.016 0.000 0.210) 6.020 10.300 ( -13.629 0.000 13.024) 18.851 10.500 ( 5.273 0.000 -7.128) 8.866 10.724 ( 1.090 0.000 8.308) 8.379 12.811 ( -5.910 0.000 2.660) 6.481 12.948 ( -4.117 0.000 -4.340) 5.982 13.170 ( -1.304 0.000 3.078) 3.343 13.311 ( 5.776 0.000 -3.429) 6.717 13.380 ( 8.732 0.000 1.886) 8.933 13.586 ( 6.194 0.000 -6.191) 8.757 14.384 ( 1.670 0.000 0.362) 1.709 14.602 ( 4.600 0.000 -6.741) 8.161 14.844 ( -1.990 0.000 2.036) 2.847 15.042 ( -2.469 0.000 5.329) 5.873 15.106 ( 3.251 0.000 -0.478) 3.286 15.178 ( 2.751 0.000 -3.317) 4.309 15.654 ( -7.427 0.000 -12.944) 14.924 16.187 ( 14.265 0.000 13.551) 19.676 16.344 ( 3.240 0.000 -2.202) 3.917 16.353 ( 5.933 0.000 2.997) 6.647 17.345 ( -10.587 0.000 5.393) 11.882 17.608 ( -5.703 0.000 -10.543) 11.987 18.384 ( -8.155 0.000 13.451) 15.730 18.390 ( -8.456 0.000 -4.188) 9.436 19.126 ( -4.625 0.000 -7.505) 8.816 19.179 ( 1.259 0.000 3.436) 3.660 19.609 ( -0.425 0.000 -5.784) 5.800 19.802 ( 4.864 0.000 5.007) 6.980 20.309 ( -4.226 0.000 -1.954) 4.656 20.740 ( 13.160 0.000 12.103) 17.880 21.156 ( 2.213 0.000 0.123) 2.216 21.218 ( 1.139 0.000 -3.598) 3.773 21.699 ( -15.879 0.000 -24.297) 29.026 22.171 ( 9.729 0.000 12.581) 15.905 23.074 ( -4.236 0.000 4.576) 6.235 23.479 ( 7.403 0.000 -0.420) 7.415 24.390 ( -8.376 0.000 2.502) 8.741 24.601 ( -0.448 0.000 -1.988) 2.038 ======================= Grid point 205 (92/138) ======================= q-point: (-0.22 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.919 ( -26.352 0.000 17.911) 31.863 1.999 ( -27.637 0.000 17.077) 32.487 2.711 ( -17.452 0.000 -22.908) 28.798 3.131 ( -20.688 0.000 -21.820) 30.069 3.389 ( -26.226 0.000 33.462) 42.515 3.478 ( -1.357 0.000 0.448) 1.429 3.650 ( -23.200 0.000 20.462) 30.934 4.072 ( -12.291 0.000 -30.051) 32.467 4.074 ( 3.778 0.000 17.909) 18.303 4.284 ( -7.515 0.000 -5.146) 9.108 4.739 ( -4.498 0.000 -17.079) 17.662 4.831 ( -0.925 0.000 -8.565) 8.614 5.403 ( -3.606 0.000 2.347) 4.302 5.578 ( -2.518 0.000 0.181) 2.524 5.781 ( 6.703 0.000 -9.427) 11.567 6.018 ( 1.110 0.000 1.333) 1.734 6.142 ( -8.793 0.000 3.205) 9.359 6.304 ( -0.031 0.000 -6.577) 6.577 6.646 ( 0.563 0.000 0.830) 1.003 6.740 ( -2.570 0.000 11.255) 11.545 7.014 ( -0.498 0.000 3.238) 3.276 7.166 ( -2.235 0.000 -10.554) 10.788 7.341 ( 1.611 0.000 8.574) 8.724 7.474 ( 2.317 0.000 -1.561) 2.794 7.654 ( -1.964 0.000 -5.048) 5.417 7.706 ( -10.438 0.000 8.864) 13.694 7.975 ( -7.216 0.000 -9.913) 12.261 7.979 ( 2.381 0.000 1.539) 2.836 8.303 ( 4.210 0.000 16.183) 16.722 8.520 ( -3.359 0.000 -5.233) 6.219 8.993 ( 13.528 0.000 6.594) 15.049 9.210 ( -5.414 0.000 -9.005) 10.508 9.420 ( 4.204 0.000 -0.527) 4.237 9.624 ( -12.487 0.000 6.834) 14.235 9.717 ( 8.813 0.000 -2.031) 9.044 10.045 ( -6.385 0.000 14.036) 15.420 10.590 ( 4.131 0.000 -7.542) 8.599 10.746 ( -0.968 0.000 7.454) 7.517 12.706 ( -4.418 0.000 1.832) 4.783 12.854 ( -4.214 0.000 -2.739) 5.026 13.187 ( 1.902 0.000 2.357) 3.029 13.395 ( 3.037 0.000 -4.198) 5.181 13.561 ( 8.695 0.000 0.303) 8.700 13.697 ( 6.316 0.000 -7.386) 9.718 14.457 ( 5.532 0.000 1.498) 5.731 14.673 ( 4.278 0.000 -6.488) 7.772 14.843 ( 0.785 0.000 3.905) 3.983 14.980 ( -4.888 0.000 4.822) 6.867 15.158 ( 1.976 0.000 0.767) 2.120 15.241 ( 3.239 0.000 -2.218) 3.926 15.535 ( 0.266 0.000 -14.298) 14.301 16.310 ( 1.456 0.000 -3.524) 3.813 16.418 ( 4.838 0.000 -3.596) 6.028 16.718 ( 22.396 0.000 13.655) 26.231 17.116 ( -11.023 0.000 4.071) 11.751 17.457 ( -6.372 0.000 -7.624) 9.936 18.237 ( -9.615 0.000 13.088) 16.240 18.243 ( -6.009 0.000 -1.991) 6.331 18.987 ( -6.759 0.000 -5.750) 8.874 19.172 ( -2.583 0.000 1.062) 2.793 19.622 ( 2.781 0.000 -8.298) 8.752 19.909 ( 4.976 0.000 2.750) 5.685 20.245 ( -2.401 0.000 0.254) 2.414 20.954 ( -8.724 0.000 -11.485) 14.423 21.212 ( 3.511 0.000 -1.714) 3.907 21.262 ( 12.913 0.000 5.318) 13.965 21.347 ( -8.593 0.000 -5.152) 10.019 22.373 ( 8.239 0.000 9.662) 12.698 23.014 ( -3.085 0.000 4.822) 5.725 23.625 ( 6.229 0.000 3.155) 6.982 24.187 ( -12.140 0.000 1.123) 12.192 24.569 ( -2.461 0.000 -3.352) 4.158 ======================= Grid point 206 (93/138) ======================= q-point: (-0.11 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 138 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.467 ( -21.653 0.000 25.452) 33.416 1.598 ( -16.283 0.000 30.896) 34.924 2.294 ( -16.856 0.000 -27.191) 31.991 2.670 ( -19.877 0.000 -24.929) 31.883 2.952 ( -25.131 0.000 54.567) 60.076 3.311 ( -13.748 0.000 15.344) 20.602 3.435 ( -1.567 0.000 -3.957) 4.256 3.859 ( -0.811 0.000 -44.079) 44.087 4.111 ( -2.987 0.000 14.183) 14.494 4.137 ( -4.975 0.000 -3.379) 6.014 4.723 ( 4.517 0.000 -16.783) 17.380 4.797 ( -1.781 0.000 -2.234) 2.857 5.352 ( -0.913 0.000 -1.971) 2.172 5.490 ( -6.225 0.000 -0.796) 6.276 5.877 ( 5.430 0.000 -4.465) 7.030 5.956 ( -9.552 0.000 9.252) 13.297 6.071 ( 3.694 0.000 -2.066) 4.233 6.252 ( -5.250 0.000 -1.408) 5.436 6.699 ( 5.673 0.000 5.277) 7.748 6.774 ( 3.757 0.000 7.919) 8.765 7.044 ( 2.243 0.000 -1.623) 2.769 7.125 ( 0.651 0.000 -11.466) 11.485 7.386 ( 0.759 0.000 6.574) 6.618 7.471 ( -0.704 0.000 -4.453) 4.508 7.558 ( -5.909 0.000 5.753) 8.247 7.617 ( -0.615 0.000 -4.187) 4.232 7.884 ( 1.347 0.000 -0.108) 1.351 8.027 ( 2.095 0.000 1.812) 2.770 8.399 ( 1.098 0.000 18.589) 18.621 8.411 ( -6.147 0.000 0.388) 6.159 9.031 ( -26.505 0.000 9.074) 28.015 9.061 ( -4.576 0.000 -14.918) 15.604 9.312 ( 1.901 0.000 9.769) 9.952 9.523 ( 3.424 0.000 -0.534) 3.466 9.892 ( 9.082 0.000 0.697) 9.108 10.097 ( 2.946 0.000 4.438) 5.327 10.637 ( 3.051 0.000 -6.453) 7.138 10.712 ( -4.126 0.000 6.051) 7.324 12.662 ( -0.566 0.000 1.882) 1.966 12.778 ( -2.974 0.000 -1.816) 3.484 13.240 ( 2.675 0.000 2.049) 3.369 13.403 ( -1.238 0.000 -3.906) 4.097 13.700 ( 5.004 0.000 -0.006) 5.004 13.788 ( 4.336 0.000 -8.057) 9.150 14.597 ( 7.804 0.000 2.627) 8.235 14.744 ( 4.370 0.000 -5.439) 6.977 14.859 ( -1.150 0.000 4.015) 4.177 14.875 ( -6.668 0.000 5.235) 8.478 15.190 ( 1.135 0.000 1.057) 1.551 15.244 ( -1.313 0.000 -1.449) 1.955 15.671 ( 14.513 0.000 -8.639) 16.889 16.287 ( -3.435 0.000 -8.074) 8.774 16.513 ( 5.705 0.000 -4.934) 7.543 16.754 ( -12.820 0.000 -1.433) 12.900 17.389 ( 28.624 0.000 9.132) 30.046 17.390 ( 2.603 0.000 -1.324) 2.921 18.059 ( -11.562 0.000 10.833) 15.844 18.109 ( -8.643 0.000 -5.279) 10.128 18.869 ( -3.457 0.000 -4.053) 5.327 19.069 ( -8.284 0.000 -4.664) 9.507 19.675 ( 5.063 0.000 -10.280) 11.459 19.965 ( -4.570 0.000 -2.410) 5.167 20.206 ( -1.949 0.000 1.183) 2.280 20.355 ( -30.654 0.000 -13.121) 33.344 21.276 ( 3.287 0.000 -2.964) 4.426 21.279 ( -1.449 0.000 3.193) 3.506 21.890 ( 41.086 0.000 15.890) 44.051 22.529 ( 4.885 0.000 7.299) 8.783 22.975 ( -1.474 0.000 5.092) 5.301 23.607 ( -14.121 0.000 5.881) 15.297 24.039 ( 2.246 0.000 -1.541) 2.724 24.471 ( -7.105 0.000 -5.139) 8.769 ======================= Grid point 207 (94/138) ======================= q-point: ( 0.00 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.373 ( -10.316 6.810 30.741) 33.134 1.759 ( 9.397 18.486 21.679) 30.000 2.029 ( 2.015 2.591 -16.263) 16.591 2.450 ( -9.041 14.112 -28.423) 32.996 2.932 ( -8.180 20.176 50.828) 55.294 3.321 ( 1.876 10.039 11.537) 15.408 3.469 ( 3.124 3.134 -2.113) 4.904 3.901 ( 6.616 2.291 -34.270) 34.978 4.021 ( 2.425 -1.217 -2.081) 3.419 4.147 ( 1.888 2.536 -8.117) 8.711 4.696 ( -3.760 -1.753 4.083) 5.821 4.832 ( 0.604 4.625 -8.555) 9.743 5.361 ( -0.408 0.910 2.178) 2.395 5.416 ( -1.040 2.627 -2.985) 4.109 5.822 ( -7.439 0.060 9.788) 12.295 5.973 ( 5.300 -0.720 -2.500) 5.904 6.118 ( -2.539 -0.304 0.438) 2.594 6.144 ( 1.768 -0.117 -2.955) 3.446 6.838 ( 6.190 -0.340 3.827) 7.285 6.932 ( 0.310 2.989 1.678) 3.442 6.990 ( -4.969 -2.523 2.105) 5.957 7.184 ( 1.666 3.289 -10.676) 11.294 7.414 ( 1.378 -3.613 -1.005) 3.996 7.422 ( -2.506 1.534 -2.163) 3.649 7.614 ( -0.615 2.196 -1.671) 2.827 7.667 ( 3.484 6.665 -6.325) 9.826 8.003 ( 9.473 -1.297 2.651) 9.922 8.047 ( -6.856 -0.837 -1.976) 7.184 8.429 ( -7.437 5.981 12.630) 15.830 8.618 ( 18.191 15.453 -4.298) 24.253 8.732 ( -6.294 7.576 6.735) 11.932 8.995 ( 4.556 2.723 -14.967) 15.881 9.379 ( 3.379 -2.185 7.160) 8.213 9.470 ( -3.656 -5.407 -0.902) 6.589 9.979 ( 7.541 -8.317 0.944) 11.267 9.996 ( -4.331 -8.206 -0.788) 9.312 10.620 ( -4.990 0.304 6.591) 8.273 10.733 ( 3.414 2.026 -4.898) 6.305 12.696 ( 1.279 1.627 2.416) 3.181 12.738 ( -1.620 1.223 -1.651) 2.617 13.291 ( -1.214 -0.023 4.004) 4.184 13.341 ( -1.616 0.787 -0.666) 1.917 13.749 ( 0.283 -0.343 -0.500) 0.669 13.820 ( 0.422 0.022 -8.111) 8.122 14.687 ( -5.801 -3.633 2.698) 7.358 14.715 ( 6.132 -3.579 0.655) 7.130 14.825 ( -3.693 1.974 3.426) 5.411 14.873 ( 3.837 1.712 -1.775) 4.561 15.186 ( 0.988 -2.127 0.775) 2.470 15.218 ( -0.916 -1.786 -2.213) 2.987 15.790 ( -15.333 -19.517 3.921) 25.128 15.818 ( 5.413 -12.979 0.406) 14.069 16.556 ( -5.516 2.473 4.545) 7.563 16.653 ( 6.253 1.008 -5.082) 8.121 17.491 ( -3.295 -6.939 7.031) 10.413 17.621 ( -0.697 -7.172 -5.577) 9.112 17.877 ( -9.818 2.406 5.397) 11.459 17.995 ( 13.417 2.963 -6.180) 15.066 18.859 ( 2.672 2.559 2.217) 4.314 18.923 ( -9.507 4.727 -4.188) 11.413 19.581 ( -11.411 -0.696 13.555) 17.732 19.810 ( 8.005 1.129 -9.929) 12.804 20.111 ( 5.111 -4.636 2.971) 7.513 20.164 ( -3.829 -3.690 -2.697) 5.962 21.175 ( -1.556 -7.131 2.168) 7.613 21.206 ( 3.522 -8.955 -0.548) 9.638 22.510 ( -7.945 -1.685 5.228) 9.659 22.625 ( 10.057 -1.848 -6.362) 12.043 23.237 ( 10.425 8.971 7.232) 15.539 23.396 ( -2.441 13.352 -9.525) 16.581 24.185 ( 8.589 -0.483 2.405) 8.933 24.230 ( -11.555 -2.164 -1.956) 11.918 ======================= Grid point 208 (95/138) ======================= q-point: ( 0.11 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.545 ( 19.764 -12.194 30.405) 38.259 2.043 ( 11.315 14.216 24.239) 30.293 2.168 ( 14.897 7.075 -14.528) 21.978 2.347 ( 4.521 10.863 -21.996) 24.946 3.063 ( 10.898 24.832 37.018) 45.888 3.496 ( 12.180 9.575 9.766) 18.315 3.592 ( 10.357 3.438 -7.141) 13.041 4.021 ( 7.783 -5.149 -3.599) 10.002 4.118 ( 9.901 3.361 -23.669) 25.876 4.245 ( 10.886 -1.040 -14.986) 18.551 4.600 ( -4.387 5.562 3.658) 7.973 4.825 ( -1.099 3.755 -6.153) 7.292 5.344 ( 0.475 2.920 1.233) 3.205 5.462 ( 4.217 -1.037 1.382) 4.558 5.698 ( -7.815 -0.586 11.060) 13.556 6.023 ( -1.349 -3.151 -2.515) 4.251 6.076 ( 2.456 -0.772 0.784) 2.691 6.243 ( 5.604 3.150 -1.958) 6.720 6.760 ( -10.954 -3.093 -4.989) 12.428 6.883 ( -1.898 0.764 0.326) 2.072 6.971 ( -1.488 2.512 7.798) 8.327 7.179 ( 1.397 4.591 -7.704) 9.076 7.388 ( 0.527 -1.431 -0.092) 1.528 7.506 ( 4.495 -2.411 1.310) 5.266 7.623 ( 2.234 3.338 -4.645) 6.141 7.738 ( 6.303 2.514 -7.030) 9.771 7.924 ( -2.872 1.107 -5.580) 6.373 8.101 ( -1.426 3.976 1.885) 4.626 8.316 ( -2.341 0.651 7.808) 8.178 8.729 ( -3.071 -0.555 -12.448) 12.833 8.833 ( 11.429 0.681 6.007) 12.930 9.216 ( 1.123 -2.996 0.258) 3.210 9.358 ( -5.672 -4.468 3.470) 8.011 9.574 ( 18.495 7.447 -8.668) 21.741 9.848 ( -9.239 -6.072 -2.994) 11.453 10.138 ( 11.242 -5.455 -10.288) 16.186 10.496 ( -7.003 -0.258 6.805) 9.768 10.824 ( 4.619 2.505 -2.064) 5.646 12.699 ( 0.116 0.187 -0.236) 0.323 12.762 ( 3.223 3.041 0.984) 4.540 13.229 ( -4.193 -0.382 5.304) 6.773 13.335 ( -0.849 1.964 3.123) 3.786 13.697 ( -4.632 -1.605 -2.365) 5.443 13.786 ( -2.595 1.185 -5.652) 6.331 14.574 ( -5.148 -3.411 1.326) 6.316 14.690 ( -7.008 1.842 1.626) 7.426 14.860 ( 5.063 -2.801 -0.466) 5.804 14.962 ( 3.270 1.026 -0.303) 3.440 15.155 ( -6.309 -7.473 3.713) 10.461 15.210 ( 0.261 -1.404 1.567) 2.120 15.375 ( -15.733 -4.553 10.491) 19.450 15.991 ( 6.118 -12.607 4.942) 14.859 16.465 ( -4.197 2.693 2.327) 5.503 16.789 ( 7.938 1.942 -3.658) 8.953 17.358 ( -8.019 -1.748 6.919) 10.735 17.465 ( -12.837 -1.895 -2.065) 13.140 17.879 ( 11.379 -3.177 3.582) 12.345 18.286 ( 11.242 -0.745 -8.436) 14.075 18.787 ( -0.831 0.513 2.505) 2.689 19.053 ( 10.793 5.946 5.409) 13.457 19.480 ( -3.331 1.647 10.686) 11.314 19.959 ( 2.907 0.840 -1.088) 3.215 20.102 ( 4.171 -10.997 -5.409) 12.946 20.256 ( 8.429 -1.414 2.158) 8.815 21.103 ( -4.477 -8.962 -0.766) 10.047 21.274 ( 2.464 -5.695 -1.778) 6.455 22.178 ( -23.037 6.561 -0.171) 23.953 22.642 ( -3.130 -2.385 -6.098) 7.257 23.151 ( -1.993 6.691 -4.733) 8.435 23.781 ( 13.825 3.978 -5.863) 15.535 24.016 ( -3.026 -0.007 1.024) 3.195 24.349 ( 6.646 -1.930 3.548) 7.777 ======================= Grid point 209 (96/138) ======================= q-point: ( 0.22 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.157 ( 32.962 -16.698 17.278) 40.791 2.315 ( 13.805 7.513 12.681) 20.195 2.474 ( 13.444 2.991 -6.173) 15.093 2.509 ( 17.084 8.044 -3.218) 19.155 3.411 ( 13.322 16.295 13.015) 24.746 3.791 ( 16.535 7.690 0.482) 18.242 3.832 ( 13.149 5.256 0.899) 14.189 4.087 ( -2.822 -3.554 5.482) 7.117 4.266 ( 9.889 2.143 -13.144) 16.588 4.431 ( 7.840 -4.782 -6.827) 11.443 4.696 ( 9.901 12.358 -22.389) 27.423 4.775 ( 6.425 6.131 3.252) 9.458 5.419 ( 5.300 -0.727 -0.780) 5.406 5.513 ( -3.629 -2.494 7.591) 8.776 5.599 ( 0.000 -0.094 6.081) 6.082 5.994 ( -1.368 -5.435 -4.111) 6.951 6.108 ( 0.319 0.575 3.156) 3.224 6.347 ( 5.484 3.313 -3.989) 7.547 6.571 ( -6.400 -7.891 -2.009) 10.357 6.810 ( -4.407 -0.367 1.009) 4.536 6.990 ( 2.078 0.096 4.464) 4.925 7.212 ( 2.751 6.062 -2.224) 7.018 7.419 ( 2.262 0.043 1.354) 2.636 7.560 ( 0.545 -0.670 2.086) 2.258 7.657 ( 1.851 6.015 -6.332) 8.928 7.880 ( 1.489 -0.183 1.565) 2.168 7.909 ( 8.717 2.305 -9.517) 13.110 8.062 ( -1.528 2.424 -1.317) 3.154 8.304 ( -1.846 -2.188 10.898) 11.268 8.583 ( -7.002 -1.699 -13.290) 15.117 9.044 ( -1.517 -3.763 -1.758) 4.421 9.094 ( -6.072 -3.479 0.687) 7.032 9.307 ( 4.719 -3.146 5.070) 7.607 9.626 ( -10.495 -4.648 0.736) 11.502 9.734 ( -2.461 -1.592 -2.914) 4.133 10.392 ( -1.803 -2.346 4.300) 5.220 10.402 ( 11.164 3.577 -13.755) 18.073 10.881 ( 1.457 3.852 -1.216) 4.294 12.741 ( 4.281 -1.081 -1.164) 4.566 12.843 ( 4.842 3.666 -0.278) 6.080 13.179 ( -1.893 0.224 4.614) 4.992 13.302 ( -3.502 1.662 5.089) 6.397 13.579 ( -5.858 -2.423 -4.988) 8.066 13.695 ( -5.380 2.651 -2.922) 6.672 14.488 ( -3.578 -1.175 -2.100) 4.312 14.566 ( -5.619 0.559 3.327) 6.554 14.837 ( -5.509 -3.066 3.514) 7.218 15.006 ( 2.594 -0.926 1.230) 3.017 15.079 ( -1.678 -2.789 9.514) 10.055 15.202 ( -1.250 -0.610 -1.009) 1.718 15.315 ( 3.521 0.638 4.524) 5.768 16.083 ( 2.319 -11.785 3.988) 12.656 16.397 ( -2.899 2.166 -0.293) 3.631 16.867 ( -5.756 4.654 0.063) 7.402 17.159 ( -1.635 -5.977 -4.119) 7.441 17.443 ( 4.920 5.519 2.895) 7.940 18.099 ( 8.729 -5.564 4.772) 11.399 18.448 ( 9.302 -2.722 -9.191) 13.357 18.831 ( 3.236 -2.591 4.071) 5.811 19.231 ( 4.503 4.850 2.594) 7.108 19.469 ( 0.321 0.854 7.390) 7.446 19.904 ( -4.263 -2.600 -0.587) 5.027 20.207 ( 3.895 -6.684 -3.055) 8.318 20.541 ( 17.384 -7.108 8.572) 20.645 21.000 ( -5.395 -8.873 -4.373) 11.268 21.294 ( -0.280 -2.928 -1.051) 3.123 21.755 ( -16.795 14.441 -1.700) 22.215 22.534 ( -5.888 -1.537 -7.149) 9.388 23.150 ( 1.950 3.675 -4.622) 6.218 23.675 ( -10.857 4.075 2.047) 11.776 24.235 ( 13.047 -2.377 -3.806) 13.797 24.460 ( 3.859 -2.793 3.041) 5.652 ======================= Grid point 210 (97/138) ======================= q-point: ( 0.33 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.607 ( 15.211 1.762 -15.084) 21.495 2.703 ( 17.016 4.354 19.965) 26.591 2.834 ( 17.640 10.182 -6.648) 21.425 2.938 ( 29.180 -20.907 21.706) 41.949 3.507 ( -2.930 -0.450 -5.086) 5.887 3.867 ( -9.590 -0.426 0.342) 9.606 4.056 ( 3.187 6.553 -7.765) 10.649 4.213 ( 17.132 12.133 11.231) 23.809 4.476 ( 14.146 3.393 -5.796) 15.659 4.567 ( 6.198 -0.829 1.306) 6.388 4.671 ( 2.707 7.975 -12.683) 15.225 5.170 ( 14.630 -2.877 -1.832) 15.022 5.339 ( -4.094 -0.841 4.735) 6.315 5.605 ( 7.750 -6.880 -3.384) 10.901 5.641 ( 1.697 3.403 -0.102) 3.804 5.927 ( -4.000 -6.255 -1.064) 7.500 6.132 ( 2.260 0.265 -2.353) 3.273 6.430 ( 5.239 -3.383 -1.546) 6.425 6.517 ( -1.119 -7.065 -0.830) 7.201 6.739 ( -2.639 -2.870 3.224) 5.058 7.058 ( 3.262 0.418 4.311) 5.423 7.261 ( 1.889 6.868 2.101) 7.426 7.434 ( -3.484 3.606 1.069) 5.127 7.571 ( 1.910 2.084 -1.056) 3.018 7.646 ( -2.158 5.538 -0.046) 5.944 7.870 ( -1.378 -1.136 3.971) 4.354 8.012 ( -1.557 6.755 5.553) 8.883 8.127 ( 10.590 -5.007 -9.375) 15.004 8.300 ( -0.813 -2.894 8.722) 9.225 8.441 ( -2.779 -0.593 -17.135) 17.369 8.876 ( -10.705 -2.854 -0.103) 11.080 8.937 ( -7.365 -2.154 -2.745) 8.150 9.395 ( -7.216 -7.476 1.299) 10.471 9.487 ( -3.051 -5.264 -0.690) 6.123 9.719 ( 9.012 2.238 -3.635) 9.972 10.277 ( -8.730 -3.113 8.786) 12.771 10.583 ( 6.991 5.897 -5.149) 10.495 10.875 ( -1.890 5.220 -0.859) 5.618 12.840 ( 5.316 -1.774 -0.275) 5.611 12.936 ( 4.309 2.361 -2.583) 5.551 13.170 ( -0.166 -0.069 2.575) 2.582 13.227 ( -4.849 1.783 4.923) 7.136 13.466 ( -3.843 -1.097 -5.697) 6.959 13.573 ( -6.106 3.108 -1.693) 7.057 14.435 ( -0.600 0.607 -4.925) 4.998 14.483 ( -3.915 -0.762 4.128) 5.740 14.806 ( 1.546 -1.439 4.202) 4.703 15.035 ( -0.731 -0.541 2.265) 2.441 15.074 ( -0.542 -1.401 5.372) 5.578 15.170 ( -1.136 0.006 -3.240) 3.434 15.439 ( 6.810 -0.174 8.099) 10.583 16.100 ( -1.320 -10.769 0.291) 10.853 16.351 ( -1.382 2.247 -1.995) 3.308 16.613 ( -13.769 7.449 -4.184) 16.205 17.282 ( 8.834 -7.461 1.239) 11.629 17.561 ( 5.393 3.401 0.008) 6.375 18.254 ( 6.863 -3.987 5.319) 9.555 18.626 ( 9.786 -1.538 -11.040) 14.833 18.898 ( 1.785 -4.968 8.417) 9.936 19.240 ( -2.203 -1.650 -1.030) 2.939 19.521 ( 2.883 2.889 4.849) 6.339 19.830 ( -2.948 -2.193 -1.616) 4.014 20.259 ( 2.567 -4.034 -0.697) 4.832 20.775 ( -2.611 -15.410 -5.829) 16.682 20.946 ( 6.348 0.143 6.054) 8.774 21.244 ( -4.541 0.494 0.991) 4.674 21.591 ( 0.524 12.431 4.716) 13.306 22.388 ( -6.962 -1.347 -9.165) 11.588 23.191 ( 3.031 2.361 -3.580) 5.251 23.483 ( -8.939 4.228 2.119) 10.113 24.422 ( 6.773 -3.494 -1.419) 7.752 24.519 ( 1.803 -2.706 1.362) 3.526 ======================= Grid point 211 (98/138) ======================= q-point: ( 0.44 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.840 ( 10.969 -0.496 -6.571) 12.796 2.989 ( -0.982 3.197 3.407) 4.774 3.108 ( 13.839 -1.058 10.771) 17.568 3.376 ( 7.926 -2.203 -1.608) 8.383 3.491 ( 0.901 0.700 8.407) 8.484 3.674 ( -1.201 -0.191 -10.609) 10.678 4.045 ( 1.562 3.069 0.240) 3.452 4.364 ( -3.334 7.044 -2.822) 8.288 4.601 ( -4.082 3.452 9.899) 11.251 4.775 ( 11.085 4.114 -20.870) 23.987 4.851 ( 18.371 -2.169 0.572) 18.507 5.088 ( -8.815 -5.248 4.777) 11.317 5.400 ( -1.718 -4.920 3.884) 6.499 5.611 ( -4.344 -11.800 -8.911) 15.411 5.811 ( 12.145 3.790 0.100) 12.723 5.877 ( -1.476 -3.885 4.141) 5.867 6.240 ( 9.925 -5.385 -5.918) 12.749 6.377 ( -13.779 -8.016 4.277) 16.505 6.592 ( 9.127 -0.993 -0.246) 9.184 6.714 ( -1.965 -3.229 0.160) 3.784 7.124 ( 2.941 2.450 4.248) 5.718 7.263 ( -5.443 5.140 2.325) 7.839 7.341 ( -0.194 7.517 3.762) 8.408 7.527 ( -4.445 9.357 -4.111) 11.145 7.693 ( 4.767 -1.342 6.621) 8.269 7.840 ( -2.285 -1.802 1.127) 3.121 8.014 ( 0.371 6.071 8.089) 10.121 8.248 ( -2.387 -5.459 8.997) 10.791 8.302 ( 3.082 -1.102 -11.563) 12.017 8.412 ( 3.612 -1.641 -17.035) 17.491 8.653 ( -11.196 -0.190 12.619) 16.871 8.886 ( 3.953 -2.530 -17.993) 18.595 9.284 ( -2.179 -4.516 2.304) 5.519 9.368 ( -5.499 -5.044 -1.831) 7.683 9.975 ( 14.086 -1.040 -5.032) 14.994 10.089 ( -11.989 -2.279 8.239) 14.725 10.686 ( 4.029 6.922 2.943) 8.533 10.802 ( -5.477 6.130 0.807) 8.259 12.931 ( 2.783 0.025 1.466) 3.145 12.990 ( 2.141 -0.167 -3.750) 4.321 13.157 ( -2.087 0.873 3.011) 3.766 13.172 ( -0.036 -1.113 -0.424) 1.192 13.397 ( -4.632 2.281 3.671) 6.335 13.480 ( -0.370 2.715 -7.141) 7.648 14.417 ( -2.842 -0.998 2.555) 3.949 14.454 ( 2.847 0.498 -5.869) 6.542 14.889 ( 5.197 -0.755 2.823) 5.962 14.987 ( -4.255 -1.123 2.723) 5.176 15.077 ( -0.362 -0.621 3.321) 3.398 15.152 ( 0.098 0.216 -3.512) 3.520 15.609 ( 8.177 -1.213 11.529) 14.187 16.016 ( -6.729 -7.753 -6.314) 12.052 16.339 ( 0.787 3.648 -2.261) 4.363 16.397 ( -6.539 6.683 -2.857) 9.777 17.425 ( 3.401 -5.424 8.460) 10.609 17.628 ( 2.545 -3.314 -7.522) 8.605 18.404 ( 5.985 -1.463 7.851) 9.980 18.692 ( -1.909 -2.273 -10.625) 11.032 18.973 ( 4.829 -4.332 8.664) 10.824 19.185 ( -2.306 -3.951 -4.015) 6.087 19.595 ( 3.461 1.704 5.303) 6.558 19.769 ( -3.096 -0.577 -3.163) 4.463 20.325 ( 4.259 -3.521 2.407) 6.027 20.595 ( -9.665 -5.627 -9.248) 14.512 21.092 ( 4.933 -1.712 3.203) 6.125 21.164 ( -3.215 -0.099 1.241) 3.448 21.734 ( 9.606 6.083 12.249) 16.713 22.219 ( -7.609 -0.970 -12.483) 14.651 23.249 ( 2.442 1.510 0.234) 2.881 23.338 ( -5.008 4.614 -0.863) 6.864 24.499 ( 0.547 -4.385 3.235) 5.477 24.549 ( 1.898 -1.932 -2.697) 3.823 ======================= Grid point 212 (99/138) ======================= q-point: (-0.44 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.736 ( -19.431 -3.132 4.659) 20.226 2.968 ( -1.706 2.480 1.191) 3.238 3.179 ( -9.614 -0.877 5.572) 11.147 3.457 ( -0.759 0.698 0.707) 1.250 3.591 ( 13.340 3.873 -3.912) 14.431 3.635 ( -0.079 6.725 -12.530) 14.221 4.113 ( -13.180 -0.347 -4.665) 13.985 4.287 ( 10.904 1.034 3.265) 11.429 4.436 ( -14.117 4.900 10.524) 18.278 4.829 ( -12.162 -3.645 1.165) 12.750 4.889 ( 1.954 1.253 -16.527) 16.689 5.241 ( 14.659 -7.120 -7.944) 18.130 5.366 ( -3.280 -3.346 12.020) 12.901 5.487 ( -4.863 -8.453 -3.315) 10.300 5.792 ( -9.231 4.487 0.385) 10.271 5.995 ( 4.544 -2.519 -5.648) 7.674 6.096 ( -8.293 -3.835 8.059) 12.183 6.408 ( 5.637 -11.394 0.643) 12.729 6.578 ( -8.749 -6.061 1.281) 10.721 6.749 ( 3.475 -0.201 -2.762) 4.444 7.151 ( -2.970 1.612 2.630) 4.282 7.242 ( 5.760 4.434 3.277) 7.974 7.385 ( -0.132 9.300 5.458) 10.784 7.449 ( -1.305 9.670 -2.027) 9.965 7.770 ( -1.896 -1.796 1.053) 2.816 7.813 ( 2.895 -0.748 2.165) 3.692 8.061 ( 2.673 4.450 9.603) 10.917 8.118 ( -10.385 -4.163 7.233) 13.323 8.312 ( 0.545 5.314 -17.753) 18.539 8.470 ( 4.080 -6.341 -6.723) 10.103 8.555 ( -0.677 -1.531 9.196) 9.347 8.975 ( 8.306 -1.382 -17.321) 19.259 9.318 ( 3.205 -5.457 0.085) 6.330 9.347 ( 5.701 -4.148 -0.362) 7.060 9.853 ( -13.270 -0.770 7.077) 15.059 10.214 ( 10.865 -3.166 -3.719) 11.912 10.649 ( -10.032 5.295 5.120) 12.445 10.771 ( 2.884 8.350 4.386) 9.863 12.910 ( -4.261 0.675 1.943) 4.731 13.011 ( -0.240 -0.271 -4.218) 4.234 13.185 ( 4.250 -1.488 -1.227) 4.667 13.199 ( 3.392 -0.432 -1.066) 3.582 13.302 ( -4.427 3.193 7.158) 9.002 13.525 ( 5.025 3.276 -6.015) 8.495 14.375 ( -1.487 -0.833 1.352) 2.175 14.519 ( 4.697 -0.216 -6.983) 8.418 14.889 ( -4.820 -1.686 2.360) 5.625 15.009 ( 5.081 -0.088 2.430) 5.633 15.070 ( -0.979 -0.555 2.099) 2.382 15.155 ( 0.917 0.131 -3.346) 3.472 15.810 ( 8.524 -5.037 13.668) 16.878 15.832 ( -8.515 -3.135 -10.101) 13.578 16.327 ( -1.003 2.462 -1.022) 2.848 16.383 ( 4.491 6.953 -1.317) 8.381 17.414 ( -6.556 -5.784 8.175) 11.970 17.658 ( 2.415 -4.007 -8.944) 10.094 18.458 ( -4.401 -1.781 9.030) 10.202 18.572 ( -6.133 -0.802 -4.785) 7.820 19.082 ( 3.701 -5.549 3.009) 7.317 19.151 ( 0.399 -1.965 -6.085) 6.407 19.658 ( -0.990 -1.482 3.580) 3.999 19.706 ( 0.207 1.203 -1.275) 1.765 20.396 ( -6.203 -3.474 -3.471) 7.912 20.453 ( 5.448 -4.274 3.733) 7.867 21.117 ( -1.710 -1.435 -0.038) 2.232 21.179 ( 3.837 -0.555 0.062) 3.877 21.939 ( 3.544 0.563 8.369) 9.106 22.052 ( -2.043 3.132 -11.892) 12.466 23.196 ( -5.353 3.398 3.924) 7.457 23.375 ( 6.157 2.972 -2.945) 7.444 24.470 ( -3.840 -3.610 3.631) 6.401 24.575 ( 0.959 -2.498 -2.826) 3.891 ======================= Grid point 213 (100/138) ======================= q-point: (-0.33 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.327 ( -23.210 -1.540 12.726) 26.515 2.676 ( -22.933 12.395 8.092) 27.295 3.012 ( -12.706 -3.754 -11.543) 17.573 3.396 ( -2.192 -5.087 4.566) 7.178 3.452 ( -12.915 -4.771 -25.112) 28.639 3.862 ( -8.746 5.668 3.362) 10.951 3.897 ( 9.825 5.305 6.919) 13.135 4.133 ( -18.040 8.169 17.417) 26.373 4.434 ( 0.291 6.217 -6.848) 9.254 4.520 ( -16.141 2.915 -4.164) 16.922 4.803 ( -8.196 -4.262 -8.699) 12.689 5.129 ( -15.081 5.160 -0.054) 15.939 5.391 ( 1.942 -4.341 1.337) 4.940 5.546 ( 4.668 -7.635 -0.946) 8.999 5.684 ( 2.560 4.575 -4.320) 6.793 5.949 ( -1.830 -6.001 -2.299) 6.682 6.154 ( 4.419 -1.306 -4.348) 6.335 6.398 ( -7.322 -2.312 2.735) 8.151 6.465 ( 0.074 -14.095 3.385) 14.496 6.772 ( -0.054 -0.399 0.052) 0.406 7.094 ( -3.504 1.111 2.649) 4.531 7.296 ( -3.995 6.128 1.427) 7.453 7.389 ( 3.656 4.438 4.627) 7.381 7.455 ( -0.319 8.499 3.850) 9.336 7.704 ( -2.964 -0.579 -3.350) 4.510 7.871 ( -3.333 -0.946 9.866) 10.457 7.927 ( -5.085 -1.972 0.561) 5.483 8.172 ( 5.439 0.938 10.981) 12.290 8.251 ( -2.711 10.140 -18.988) 21.696 8.507 ( 0.706 -6.029 -8.774) 10.669 8.676 ( 10.731 -2.632 8.574) 13.985 9.124 ( 9.623 -1.956 -11.298) 14.969 9.410 ( 3.160 -6.849 -0.370) 7.552 9.504 ( 8.000 -4.522 -0.948) 9.239 9.641 ( -5.897 0.433 4.217) 7.262 10.329 ( -7.564 1.820 10.165) 12.800 10.459 ( -2.263 -0.829 -0.955) 2.592 10.826 ( 1.415 7.859 4.077) 8.966 12.810 ( -5.719 -0.051 1.350) 5.876 12.962 ( -3.513 1.387 -3.094) 4.882 13.199 ( -1.083 2.773 2.150) 3.673 13.300 ( 5.493 -1.163 -2.315) 6.073 13.357 ( 7.794 -1.773 1.498) 8.132 13.626 ( 6.233 3.632 -5.467) 9.051 14.377 ( 1.625 -0.650 0.796) 1.923 14.595 ( 4.489 -0.732 -6.875) 8.243 14.820 ( -2.199 -2.113 1.935) 3.612 15.038 ( -2.714 -0.291 4.496) 5.259 15.105 ( 3.685 -0.158 0.148) 3.692 15.176 ( 2.243 -0.347 -3.624) 4.277 15.637 ( -7.663 -1.876 -11.672) 14.089 16.008 ( 7.145 -12.504 11.712) 18.563 16.332 ( 1.543 0.236 -0.450) 1.625 16.535 ( 11.591 11.317 2.478) 16.388 17.236 ( -11.892 -7.883 4.218) 14.878 17.659 ( -0.944 2.019 -7.962) 8.268 18.311 ( -9.456 -5.255 3.142) 11.265 18.429 ( -9.050 2.097 4.965) 10.534 19.072 ( -4.015 -5.076 -8.079) 10.352 19.199 ( 3.784 0.156 2.560) 4.571 19.607 ( -1.208 0.011 -2.929) 3.168 19.766 ( 3.364 -3.165 4.368) 6.357 20.271 ( -4.931 -3.450 -2.097) 6.373 20.609 ( 7.180 -10.455 8.866) 15.475 21.070 ( -3.621 -3.737 -4.362) 6.790 21.254 ( 3.295 -0.072 0.020) 3.296 21.799 ( -6.614 7.025 -15.226) 18.025 22.205 ( 9.166 2.829 8.197) 12.618 23.112 ( -3.924 4.115 4.007) 6.956 23.511 ( 7.851 3.158 -0.638) 8.487 24.366 ( -7.655 -2.431 3.094) 8.607 24.570 ( -0.821 -3.169 -2.667) 4.222 ======================= Grid point 214 (101/138) ======================= q-point: (-0.22 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.915 ( -21.107 4.242 21.730) 30.590 2.206 ( -26.650 17.077 13.414) 34.377 2.617 ( -20.838 -9.900 -21.519) 31.549 3.101 ( -13.046 -0.149 -30.998) 33.632 3.377 ( -6.980 -0.543 14.414) 16.024 3.626 ( -14.533 11.072 14.977) 23.624 3.736 ( -23.845 8.801 24.420) 35.248 4.058 ( -0.469 2.536 10.862) 11.164 4.160 ( -12.394 5.774 -20.355) 24.521 4.361 ( -8.062 6.658 -5.147) 11.654 4.655 ( -0.340 -3.671 -10.438) 11.069 4.949 ( -3.508 7.746 -11.623) 14.402 5.389 ( -2.113 -1.658 3.164) 4.151 5.551 ( -2.184 -3.128 0.236) 3.823 5.790 ( 6.175 1.026 -6.867) 9.292 5.944 ( 1.861 -5.333 -3.307) 6.546 6.132 ( -5.781 -1.932 1.857) 6.372 6.333 ( -1.082 1.138 -1.798) 2.387 6.511 ( 4.861 -9.917 2.852) 11.407 6.762 ( -0.738 1.183 6.223) 6.378 7.063 ( 0.659 2.461 0.908) 2.705 7.198 ( -4.482 3.714 -3.629) 6.859 7.435 ( -1.730 -1.393 -0.087) 2.222 7.477 ( 3.297 8.954 6.299) 11.434 7.648 ( -2.280 0.097 -3.623) 4.282 7.723 ( -7.304 0.540 6.676) 9.910 7.933 ( -0.860 -1.211 -2.340) 2.772 8.139 ( -2.932 13.819 -11.676) 18.327 8.301 ( 4.292 0.206 14.571) 15.192 8.474 ( -2.538 -4.176 -4.553) 6.680 8.939 ( 12.206 -5.258 6.050) 14.602 9.202 ( -3.022 -1.060 -8.694) 9.265 9.394 ( 2.894 -1.935 -1.756) 3.899 9.626 ( 3.474 -4.690 1.819) 6.113 9.696 ( 1.429 -0.035 0.935) 1.708 10.030 ( -15.061 0.289 17.170) 22.841 10.525 ( 4.163 -4.071 -3.477) 6.782 10.836 ( -1.315 6.364 2.787) 7.071 12.714 ( -3.794 0.792 1.082) 4.024 12.874 ( -4.372 1.921 -1.924) 5.149 13.212 ( 1.736 2.557 1.934) 3.645 13.377 ( 2.604 -1.649 -2.585) 4.022 13.532 ( 9.062 -2.505 -1.220) 9.480 13.733 ( 5.705 3.168 -6.494) 9.206 14.446 ( 5.018 -1.065 1.555) 5.360 14.668 ( 4.618 -0.555 -6.210) 7.758 14.815 ( 0.636 -2.649 3.551) 4.476 14.977 ( -4.419 -0.275 4.520) 6.327 15.155 ( 1.455 -0.374 -0.026) 1.503 15.230 ( 3.298 -1.147 -2.583) 4.343 15.501 ( -1.987 -3.276 -12.499) 13.073 16.113 ( 1.315 -17.484 3.147) 17.813 16.391 ( 4.561 -0.843 0.261) 4.645 16.835 ( 11.947 6.997 3.696) 14.330 17.028 ( -3.880 -4.122 6.777) 8.830 17.580 ( -4.558 7.847 -9.359) 13.036 18.124 ( -10.825 -6.860 4.587) 13.611 18.273 ( -7.025 -0.416 5.361) 8.847 18.944 ( -6.105 -3.408 -6.105) 9.282 19.245 ( -0.444 5.325 1.196) 5.476 19.616 ( 3.041 -0.737 -7.000) 7.668 19.853 ( 4.612 -6.658 5.179) 9.613 20.175 ( -5.544 -6.424 -0.007) 8.486 20.680 ( -8.453 -21.722 -0.615) 23.317 20.953 ( -1.406 -0.769 -3.746) 4.074 21.271 ( -1.526 -3.674 0.953) 4.091 21.796 ( 11.234 20.224 -7.039) 24.182 22.389 ( 7.558 1.401 7.122) 10.479 23.059 ( -2.406 5.073 4.409) 7.139 23.671 ( 7.481 4.219 2.190) 8.863 24.181 ( -11.285 -0.641 1.368) 11.386 24.527 ( -2.987 -4.056 -3.332) 6.040 ======================= Grid point 215 (102/138) ======================= q-point: (-0.11 0.09 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.668 ( -9.168 10.958 29.481) 32.761 1.715 ( -24.375 20.338 17.618) 36.307 2.200 ( -13.860 -6.445 -25.533) 29.758 2.767 ( -14.274 9.248 -29.440) 34.000 3.126 ( -21.174 15.772 47.704) 54.523 3.397 ( -12.489 7.932 13.096) 19.759 3.475 ( -3.766 3.771 4.417) 6.923 3.941 ( -2.581 6.609 -33.994) 34.727 4.030 ( -3.393 -3.399 7.370) 8.797 4.201 ( -5.464 4.076 -5.655) 8.857 4.692 ( 3.238 -1.686 -5.067) 6.245 4.875 ( -2.177 6.278 -9.238) 11.379 5.359 ( -0.646 0.743 -0.149) 0.996 5.486 ( -3.978 -0.694 -1.009) 4.162 5.877 ( 4.556 0.262 -2.613) 5.259 5.946 ( -5.180 -1.356 3.773) 6.550 6.055 ( 1.922 -1.359 -3.103) 3.895 6.260 ( -6.238 0.150 0.689) 6.278 6.660 ( 9.050 -3.023 3.307) 10.098 6.826 ( 5.470 3.667 7.693) 10.127 7.078 ( -2.165 1.055 0.469) 2.454 7.147 ( 2.572 1.865 -9.823) 10.324 7.399 ( -0.996 -3.880 -0.875) 4.100 7.537 ( -2.843 5.892 -3.704) 7.518 7.593 ( 2.163 7.582 -0.022) 7.884 7.648 ( -2.144 1.594 0.646) 2.748 7.872 ( -0.671 -1.090 -0.635) 1.429 8.134 ( 1.150 10.226 -2.215) 10.527 8.388 ( 1.412 2.798 6.032) 6.798 8.424 ( 0.516 0.637 10.171) 10.204 9.042 ( -2.718 -2.759 -9.537) 10.294 9.112 ( -14.203 4.862 5.923) 16.138 9.321 ( -8.015 3.354 6.656) 10.945 9.497 ( 0.234 -2.052 1.573) 2.596 9.815 ( 8.390 -7.542 0.781) 11.309 10.010 ( 2.426 -8.634 4.129) 9.873 10.592 ( 3.559 -2.373 -0.991) 4.391 10.783 ( -4.297 4.456 0.763) 6.237 12.677 ( -0.323 1.504 1.449) 2.114 12.793 ( -3.359 1.515 -1.336) 3.920 13.260 ( 2.370 2.100 1.723) 3.604 13.386 ( -1.101 -1.726 -2.167) 2.981 13.684 ( 6.129 -1.583 -1.418) 6.487 13.806 ( 3.062 1.659 -7.479) 8.250 14.569 ( 6.802 -2.516 1.712) 7.452 14.751 ( 4.791 0.357 -4.359) 6.488 14.808 ( -3.782 -3.090 4.136) 6.400 14.909 ( -2.927 1.295 5.138) 6.053 15.170 ( 0.423 -1.875 -0.385) 1.960 15.241 ( -1.121 -0.555 -1.785) 2.180 15.577 ( 11.476 -8.740 -8.603) 16.796 16.065 ( -6.883 -20.650 -1.429) 21.814 16.504 ( 6.525 -0.377 -0.868) 6.593 16.728 ( -9.720 -1.344 1.784) 9.974 17.394 ( 24.115 -0.498 5.617) 24.766 17.486 ( -1.280 7.518 -6.100) 9.766 17.906 ( -11.297 -7.784 2.630) 13.969 18.154 ( -7.960 -0.745 3.483) 8.720 18.843 ( -2.325 -1.659 -3.099) 4.215 19.164 ( -8.068 7.427 -4.858) 11.993 19.678 ( 4.559 0.285 -8.922) 10.024 19.959 ( -19.468 -10.788 0.603) 22.266 19.976 ( 6.389 -8.780 5.368) 12.113 20.327 ( -14.300 -3.076 -5.650) 15.680 21.062 ( 7.490 -9.945 3.705) 12.990 21.235 ( -2.341 -5.085 2.080) 5.972 22.186 ( 27.054 15.195 -1.331) 31.057 22.522 ( 3.933 -0.306 5.714) 6.943 23.049 ( 1.306 8.075 5.216) 9.702 23.692 ( -11.481 7.667 3.356) 14.207 24.039 ( 2.427 -0.046 -1.329) 2.767 24.425 ( -6.969 -4.334 -3.983) 9.122 ======================= Grid point 216 (103/138) ======================= q-point: ( 0.00 0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.679 ( -19.076 24.289 18.827) 36.170 2.096 ( 14.441 14.951 -19.641) 28.598 2.299 ( -0.376 25.819 21.776) 33.778 2.793 ( -6.517 20.649 -25.243) 33.257 3.340 ( -2.382 18.289 29.766) 35.017 3.446 ( 3.702 -0.862 7.085) 8.041 3.609 ( 0.509 12.699 6.875) 14.449 3.889 ( 1.164 0.558 -1.497) 1.977 4.077 ( 3.778 5.347 -10.913) 12.726 4.227 ( -0.163 5.820 -18.344) 19.246 4.716 ( -0.056 4.587 12.201) 13.035 4.958 ( -0.418 7.954 -11.563) 14.041 5.373 ( -1.166 -0.020 2.525) 2.781 5.440 ( 0.413 -0.349 -2.591) 2.647 5.809 ( -7.302 -1.612 9.037) 11.730 5.986 ( 3.931 1.900 -6.788) 8.071 6.131 ( 3.010 1.566 -1.669) 3.781 6.136 ( -0.936 -0.241 -2.565) 2.741 6.825 ( 7.430 -1.045 2.397) 7.876 6.917 ( -8.345 -2.167 -4.498) 9.725 6.990 ( 2.369 -0.150 9.848) 10.131 7.193 ( 2.683 -2.291 -9.524) 10.157 7.351 ( 2.057 -2.599 1.927) 3.834 7.439 ( -3.598 -0.292 -6.477) 7.415 7.645 ( 0.433 1.222 3.510) 3.742 7.765 ( -1.588 2.385 -7.709) 8.224 8.005 ( 9.449 1.678 1.260) 9.679 8.034 ( -6.174 -0.078 -1.580) 6.374 8.520 ( 1.599 2.988 14.849) 15.231 8.804 ( -0.760 0.123 -10.924) 10.951 8.932 ( -16.430 11.351 8.331) 21.638 9.054 ( 7.792 0.589 0.278) 7.819 9.350 ( -5.778 -4.678 2.475) 7.836 9.441 ( 13.045 9.963 -8.653) 18.556 9.786 ( 5.458 -10.561 -2.022) 12.059 9.799 ( 1.511 -10.786 -3.315) 11.385 10.612 ( -4.293 -1.494 8.494) 9.634 10.759 ( 2.662 0.267 -6.415) 6.950 12.742 ( -0.349 3.068 1.931) 3.642 12.776 ( 0.136 2.768 -1.299) 3.061 13.286 ( -4.111 -0.680 6.013) 7.316 13.363 ( 1.854 1.384 -1.297) 2.652 13.733 ( 0.904 -1.324 -0.237) 1.620 13.821 ( -0.237 0.032 -8.840) 8.843 14.618 ( -5.757 -3.491 1.783) 6.965 14.644 ( 6.051 -3.637 -0.180) 7.062 14.839 ( -2.054 -0.599 4.210) 4.722 14.895 ( 2.166 0.361 -1.377) 2.592 15.123 ( -0.699 -5.110 1.359) 5.333 15.161 ( -2.766 -3.767 -1.791) 5.004 15.424 ( -9.940 -15.052 8.773) 20.059 15.538 ( 7.461 -15.160 -2.973) 17.156 16.616 ( -5.025 3.387 3.008) 6.766 16.647 ( 7.458 -0.843 0.567) 7.527 17.383 ( -3.089 -4.942 4.023) 7.082 17.510 ( -2.723 -3.897 -7.694) 9.044 17.901 ( -4.286 0.773 6.664) 7.961 18.032 ( 8.936 0.955 -6.301) 10.976 18.908 ( 8.283 1.762 3.603) 9.203 18.984 ( -13.008 0.891 -3.564) 13.516 19.582 ( -4.993 0.940 12.649) 13.631 19.814 ( 6.648 -1.296 -10.505) 12.499 20.026 ( 6.473 -3.897 2.652) 8.008 20.070 ( -7.039 -4.946 -1.920) 8.814 21.038 ( 0.827 -6.050 1.130) 6.210 21.052 ( 0.637 -6.534 -0.093) 6.565 22.461 ( -3.788 -3.236 4.899) 6.987 22.566 ( 4.052 -4.012 -5.581) 7.979 23.435 ( 4.220 10.600 9.517) 14.857 23.642 ( -1.684 11.196 -11.514) 16.148 24.172 ( 3.513 -1.081 0.413) 3.699 24.182 ( -4.565 -2.345 -0.727) 5.183 ======================= Grid point 217 (104/138) ======================= q-point: ( 0.11 0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.509 ( 0.364 11.320 24.964) 27.413 2.368 ( 2.116 19.269 30.700) 36.308 2.400 ( 18.036 15.625 -18.255) 30.044 2.676 ( 0.906 22.239 -19.927) 29.874 3.458 ( 6.696 10.786 7.009) 14.502 3.619 ( 11.078 -1.915 6.986) 13.236 3.715 ( 9.800 12.037 5.300) 16.402 4.011 ( 8.908 7.755 10.714) 15.946 4.177 ( 8.100 4.240 -9.120) 12.914 4.234 ( 4.795 0.719 -18.779) 19.395 4.775 ( 4.674 10.465 10.055) 15.246 4.935 ( 0.706 8.351 -15.938) 18.007 5.365 ( 1.099 -1.324 1.989) 2.630 5.452 ( 0.390 -0.277 -0.279) 0.554 5.674 ( -8.437 -1.796 11.931) 14.723 5.999 ( -2.635 0.891 -4.746) 5.501 6.072 ( 1.875 0.927 -4.887) 5.315 6.270 ( 5.828 -0.801 -1.852) 6.167 6.665 ( -13.134 -4.556 -4.900) 14.740 6.907 ( -2.064 1.099 0.298) 2.357 7.020 ( -0.878 0.177 7.491) 7.544 7.220 ( 3.024 -0.327 -7.688) 8.268 7.373 ( 1.505 -0.404 -1.903) 2.460 7.469 ( 5.072 -1.315 1.634) 5.488 7.690 ( 3.052 2.644 4.297) 5.897 7.755 ( 2.627 -0.191 -6.462) 6.978 7.920 ( -1.436 -0.475 -6.856) 7.021 8.179 ( 3.918 1.263 3.809) 5.608 8.448 ( -10.585 13.580 9.026) 19.440 8.688 ( -6.159 -3.894 -8.019) 10.836 8.860 ( 7.225 2.129 2.323) 7.882 9.078 ( -5.328 -10.485 5.228) 12.871 9.275 ( -3.003 -2.944 3.808) 5.673 9.644 ( 1.242 -3.733 1.254) 4.130 9.696 ( -4.834 -9.492 -5.132) 11.824 10.097 ( 24.293 3.859 -21.089) 32.400 10.474 ( -8.213 -2.312 6.565) 10.766 10.867 ( 6.173 1.530 -2.041) 6.680 12.715 ( -0.727 1.512 0.669) 1.807 12.834 ( 4.129 4.338 -0.216) 5.993 13.220 ( -3.854 -0.749 7.412) 8.387 13.377 ( -0.525 2.147 0.912) 2.391 13.670 ( -5.142 -0.962 -4.067) 6.626 13.803 ( -1.290 0.548 -4.322) 4.544 14.513 ( -4.030 -2.928 0.552) 5.012 14.696 ( -5.239 -1.631 1.154) 5.607 14.809 ( 3.005 -2.263 -0.403) 3.783 14.965 ( -1.194 -1.376 0.586) 1.913 14.994 ( -3.656 -6.794 9.886) 12.540 15.175 ( 0.871 -2.158 1.782) 2.931 15.299 ( -2.793 -3.494 1.881) 4.852 15.691 ( 7.068 -17.090 0.274) 18.496 16.522 ( -4.325 3.183 -0.243) 5.375 16.807 ( 8.318 -0.325 -1.532) 8.464 17.313 ( -9.353 -1.998 4.255) 10.468 17.422 ( -0.833 -2.364 2.256) 3.373 17.866 ( 3.245 0.442 1.440) 3.577 18.232 ( 9.773 -3.231 -8.348) 13.253 18.794 ( -4.574 0.049 0.403) 4.592 19.146 ( 11.251 1.728 6.457) 13.086 19.514 ( -4.304 1.536 9.157) 10.234 19.883 ( -0.809 -9.374 -8.537) 12.705 19.973 ( 2.604 0.438 -2.042) 3.338 20.203 ( 9.570 -3.863 2.378) 10.590 20.962 ( -3.755 -5.153 -1.043) 6.461 21.153 ( 4.801 -6.273 -1.106) 7.976 22.260 ( -15.144 1.821 2.886) 15.524 22.577 ( -2.079 -4.359 -4.511) 6.609 23.337 ( -5.612 11.616 -1.550) 12.994 23.855 ( 10.401 3.392 -2.552) 11.234 24.016 ( -4.466 -0.112 1.341) 4.664 24.303 ( 5.452 -2.743 -0.065) 6.103 ======================= Grid point 218 (105/138) ======================= q-point: ( 0.22 0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.837 ( 25.084 -9.949 25.033) 36.809 2.533 ( 8.900 13.896 21.292) 26.939 2.620 ( 8.160 12.560 -14.994) 21.193 2.811 ( 14.859 18.885 -8.386) 25.451 3.524 ( 0.425 -2.062 -9.604) 9.832 3.855 ( 7.976 -3.363 8.996) 12.484 3.993 ( 14.380 9.418 1.675) 17.271 4.175 ( 5.560 8.165 3.884) 10.615 4.353 ( 11.194 5.828 -1.393) 12.697 4.376 ( 12.280 5.634 -0.518) 13.520 4.855 ( -1.835 4.775 -3.134) 5.999 5.006 ( 13.693 15.341 -14.009) 24.882 5.389 ( -3.008 -3.098 -0.799) 4.391 5.461 ( 0.869 -3.346 2.385) 4.200 5.570 ( -1.974 -2.172 10.724) 11.119 5.928 ( -3.189 -0.904 -6.548) 7.339 6.095 ( 0.340 -1.875 -2.596) 3.220 6.338 ( -0.071 -10.129 -4.772) 11.197 6.422 ( -6.369 0.964 -2.377) 6.866 6.818 ( -5.591 0.683 -0.663) 5.671 7.027 ( 1.286 1.773 5.387) 5.815 7.281 ( 3.538 0.841 -0.441) 3.663 7.441 ( 4.892 1.790 -0.045) 5.209 7.547 ( 1.802 -0.662 2.326) 3.016 7.762 ( 3.402 3.770 1.569) 5.315 7.845 ( 5.648 -3.552 -2.755) 7.219 7.907 ( 1.303 -0.587 -9.053) 9.165 8.207 ( -0.873 3.808 8.340) 9.210 8.293 ( -6.707 8.465 7.510) 13.154 8.528 ( -6.750 -3.959 -10.008) 12.704 8.936 ( -5.867 -7.990 -6.036) 11.606 9.006 ( -1.417 -4.636 5.760) 7.529 9.256 ( 1.059 -2.152 5.761) 6.240 9.520 ( -7.013 -5.928 -4.049) 10.036 9.645 ( -1.601 -7.155 -1.942) 7.585 10.330 ( -6.231 -3.961 8.085) 10.949 10.501 ( 16.681 6.081 -16.761) 24.416 10.956 ( 3.016 3.409 -0.495) 4.579 12.735 ( 2.689 0.374 -0.111) 2.717 12.919 ( 4.278 4.107 -0.512) 5.952 13.175 ( -2.283 -1.016 6.246) 6.727 13.344 ( -3.200 2.432 2.914) 4.965 13.558 ( -4.322 0.573 -6.791) 8.070 13.736 ( -4.712 1.643 -0.676) 5.036 14.461 ( -1.368 -1.662 -1.813) 2.814 14.572 ( -6.485 -0.171 1.438) 6.645 14.775 ( -2.863 -2.664 2.516) 4.650 14.985 ( 3.517 -1.883 5.225) 6.574 15.029 ( 0.368 -1.674 4.325) 4.652 15.182 ( -0.346 -1.313 0.512) 1.451 15.310 ( 3.303 -1.237 2.162) 4.137 15.805 ( 4.271 -15.993 0.591) 16.564 16.448 ( -2.608 3.161 -3.133) 5.159 16.957 ( 4.374 3.056 -2.009) 5.701 17.066 ( -10.457 -2.804 1.295) 10.904 17.498 ( 4.726 0.118 3.994) 6.189 17.985 ( 6.805 -6.016 3.105) 9.599 18.402 ( 10.535 -1.390 -7.317) 12.902 18.770 ( 0.395 -3.594 2.426) 4.354 19.248 ( -3.414 -5.456 2.465) 6.892 19.511 ( 3.226 3.660 6.510) 8.135 19.820 ( -1.899 -4.180 -3.772) 5.942 20.078 ( 5.557 -4.852 -2.474) 7.781 20.418 ( 10.879 -5.560 1.870) 12.360 20.909 ( -0.846 -1.759 -0.420) 1.997 21.222 ( 2.441 -4.276 -1.958) 5.299 21.960 ( -14.072 6.790 2.501) 15.823 22.483 ( -5.871 -3.750 -4.890) 8.511 23.275 ( -0.776 8.994 -2.311) 9.319 23.760 ( -9.692 4.278 0.532) 10.607 24.176 ( 10.239 -3.573 1.084) 10.898 24.391 ( 3.687 -4.132 -0.746) 5.588 ======================= Grid point 219 (106/138) ======================= q-point: ( 0.33 0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.495 ( 33.591 -18.943 19.213) 43.085 2.740 ( 9.881 8.851 -14.733) 19.825 2.824 ( 13.802 7.832 18.778) 24.585 3.055 ( 8.076 9.903 -4.064) 13.409 3.481 ( -0.114 0.860 -7.062) 7.115 3.861 ( -7.512 -0.771 3.959) 8.527 4.188 ( 5.000 5.901 -6.545) 10.132 4.393 ( 14.297 0.868 0.543) 14.334 4.536 ( 5.526 5.297 4.747) 9.007 4.638 ( 12.081 9.852 3.356) 15.946 4.828 ( 1.837 7.000 -11.179) 13.317 5.143 ( -6.448 0.547 0.404) 6.484 5.340 ( 4.410 0.757 -0.331) 4.487 5.409 ( -4.370 -14.174 -6.668) 16.262 5.637 ( 3.323 -3.474 2.512) 5.424 5.864 ( -0.381 2.193 0.224) 2.237 6.094 ( 0.805 -6.896 -3.841) 7.934 6.258 ( -1.274 -7.322 -2.961) 8.000 6.464 ( 5.538 -1.089 -4.366) 7.136 6.715 ( -4.804 0.087 2.993) 5.661 7.097 ( 4.134 2.160 3.643) 5.918 7.349 ( 3.022 1.630 3.257) 4.732 7.497 ( -1.857 2.375 1.947) 3.589 7.589 ( 4.112 1.250 3.061) 5.277 7.792 ( -3.195 7.153 0.241) 7.838 7.845 ( -1.719 -1.813 4.032) 4.744 7.990 ( 6.249 -7.044 -6.218) 11.284 8.204 ( -2.478 11.560 8.751) 14.709 8.223 ( -0.692 -4.682 4.470) 6.510 8.430 ( -0.132 -0.233 -12.384) 12.387 8.805 ( -4.599 -5.192 -11.151) 13.132 8.877 ( -10.169 -3.592 7.128) 12.927 9.220 ( -5.293 -8.941 2.053) 10.591 9.405 ( -5.325 -3.854 -3.874) 7.630 9.724 ( 10.653 -1.203 -5.233) 11.930 10.202 ( -8.594 -4.540 8.650) 13.011 10.720 ( 8.546 7.627 -5.546) 12.727 10.981 ( -0.439 5.180 -0.328) 5.209 12.811 ( 4.775 -1.120 -0.594) 4.941 12.986 ( 2.401 2.706 -0.640) 3.673 13.151 ( -1.345 -1.855 2.973) 3.753 13.275 ( -4.193 2.936 2.462) 5.680 13.488 ( -1.018 3.530 -5.576) 6.678 13.628 ( -5.936 2.604 1.104) 6.576 14.444 ( 0.520 -0.241 -5.142) 5.174 14.464 ( -4.708 -0.766 2.424) 5.350 14.787 ( 3.175 -0.070 2.015) 3.761 15.018 ( -2.206 -2.517 6.003) 6.873 15.048 ( 1.541 0.274 2.203) 2.703 15.168 ( -0.702 -0.252 -2.188) 2.312 15.420 ( 6.165 -2.041 6.688) 9.322 15.858 ( 1.115 -13.646 -1.199) 13.744 16.412 ( -0.066 3.972 -4.221) 5.796 16.757 ( -12.855 6.813 -1.527) 14.629 17.160 ( 8.554 -4.975 1.456) 10.002 17.563 ( 0.767 -2.898 -0.404) 3.025 18.141 ( 8.543 -7.627 4.263) 12.220 18.614 ( 10.695 0.364 -7.080) 12.831 18.773 ( -1.279 -8.083 6.241) 10.292 19.137 ( -5.525 -9.472 -0.958) 11.008 19.592 ( 2.599 4.085 4.985) 6.949 19.795 ( -0.144 -0.020 -3.502) 3.505 20.164 ( 3.916 -4.957 0.372) 6.328 20.556 ( 1.995 -7.748 -5.043) 9.457 20.957 ( 5.159 0.846 3.865) 6.501 21.232 ( -1.446 -1.311 -0.890) 2.145 21.778 ( -4.069 6.476 4.709) 8.982 22.337 ( -7.457 -4.007 -6.088) 10.427 23.280 ( 1.430 6.883 -0.947) 7.093 23.580 ( -8.192 5.503 -0.370) 9.876 24.331 ( 5.081 -5.617 3.229) 8.234 24.448 ( 2.564 -4.561 -2.424) 5.766 ======================= Grid point 220 (107/138) ======================= q-point: ( 0.44 0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.872 ( 8.191 4.129 -10.284) 13.780 2.983 ( -9.123 -3.033 -2.030) 9.826 3.115 ( 14.047 -2.543 23.983) 27.910 3.253 ( 26.886 -6.130 3.595) 27.809 3.579 ( 5.417 7.860 4.241) 10.445 3.683 ( -4.908 0.934 -9.968) 11.150 4.157 ( -4.924 7.389 -1.850) 9.070 4.464 ( -11.292 1.863 -8.590) 14.310 4.671 ( 3.781 1.180 5.227) 6.558 4.802 ( 7.265 -0.963 1.372) 7.456 4.855 ( 0.703 -1.392 -7.854) 8.008 4.981 ( -1.600 0.824 -6.197) 6.453 5.337 ( -0.082 -4.827 -1.731) 5.128 5.359 ( -3.604 -8.937 -1.420) 9.741 5.731 ( 5.044 -7.856 6.538) 11.398 5.931 ( 4.926 6.050 -0.193) 7.804 6.081 ( -2.350 -12.781 -1.119) 13.043 6.228 ( -2.642 -2.963 -3.522) 5.307 6.592 ( 7.543 -1.609 -3.408) 8.432 6.636 ( -4.619 -3.075 3.864) 6.762 7.189 ( 4.546 2.918 3.444) 6.406 7.333 ( -6.957 1.552 2.519) 7.560 7.510 ( 5.808 7.492 4.948) 10.693 7.647 ( -4.406 2.490 8.034) 9.495 7.723 ( 2.315 4.757 -2.192) 5.726 7.810 ( -2.952 -1.529 1.894) 3.826 8.081 ( 1.657 -4.786 4.307) 6.648 8.183 ( -1.883 2.270 5.591) 6.321 8.225 ( 1.661 -2.432 -3.319) 4.438 8.438 ( 2.610 3.368 -10.785) 11.596 8.638 ( -10.960 -1.754 6.299) 12.762 8.804 ( 4.330 -5.882 -14.664) 16.382 9.169 ( 0.969 -6.340 0.727) 6.455 9.285 ( -5.169 -2.958 -4.620) 7.538 9.948 ( 11.732 -1.709 -5.101) 12.907 10.029 ( -10.571 -3.883 7.952) 13.787 10.838 ( 3.656 8.156 2.394) 9.253 10.937 ( -3.529 7.071 -0.313) 7.909 12.911 ( 5.372 -1.815 -0.877) 5.738 12.992 ( -2.077 -0.480 -1.015) 2.361 13.150 ( 1.511 0.186 0.305) 1.553 13.199 ( -3.482 3.077 0.957) 4.744 13.470 ( -3.460 4.972 4.977) 7.840 13.543 ( 0.393 3.885 -5.361) 6.632 14.395 ( -3.110 -1.272 3.211) 4.648 14.461 ( 2.689 0.129 -7.684) 8.142 14.884 ( 5.503 0.487 1.136) 5.640 14.961 ( -4.356 -1.515 3.844) 6.004 15.068 ( 0.078 0.075 3.074) 3.075 15.154 ( -0.045 0.009 -3.184) 3.184 15.563 ( 6.042 -3.751 9.840) 12.141 15.838 ( -2.695 -10.442 -4.295) 11.608 16.433 ( 3.307 5.763 -3.586) 7.550 16.533 ( -9.105 7.008 -1.657) 11.609 17.313 ( 4.634 -5.637 7.057) 10.151 17.535 ( -1.503 -5.865 -6.810) 9.112 18.333 ( 8.786 -6.483 5.657) 12.297 18.611 ( -6.648 -6.719 -5.438) 10.904 18.867 ( 5.932 -5.825 6.527) 10.570 19.059 ( -1.474 -9.301 -4.651) 10.503 19.638 ( 1.006 2.963 5.963) 6.734 19.779 ( -0.875 2.275 -4.439) 5.064 20.250 ( 4.531 -3.611 3.632) 6.839 20.498 ( -5.101 -4.020 -8.394) 10.613 21.074 ( 4.887 -0.175 2.798) 5.634 21.170 ( -3.651 0.605 -0.077) 3.701 21.824 ( 5.801 2.585 8.472) 10.588 22.172 ( -7.213 -4.097 -8.634) 11.973 23.317 ( 1.442 5.515 2.918) 6.404 23.447 ( -4.068 6.502 -3.700) 8.516 24.394 ( 0.359 -6.335 5.473) 8.379 24.485 ( 2.012 -4.590 -4.515) 6.746 ======================= Grid point 221 (108/138) ======================= q-point: (-0.44 0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.701 ( -16.920 0.601 6.994) 18.318 2.997 ( 4.516 1.090 -3.488) 5.809 3.217 ( -9.691 3.601 8.694) 13.508 3.457 ( -9.136 -2.525 1.945) 9.675 3.632 ( 3.308 -0.860 -20.427) 20.711 3.749 ( 6.717 4.131 -10.941) 13.486 4.122 ( -5.116 2.454 6.323) 8.496 4.283 ( 11.157 -1.032 6.430) 12.919 4.557 ( -12.649 5.325 7.678) 15.725 4.761 ( -7.401 -1.453 2.863) 8.067 4.933 ( -1.120 3.489 -11.122) 11.710 5.076 ( 11.872 -9.156 -9.667) 17.839 5.260 ( -4.091 -6.120 3.614) 8.200 5.390 ( 2.925 -1.354 -2.722) 4.219 5.821 ( 0.521 -2.226 5.725) 6.165 5.882 ( -7.415 -9.801 -6.021) 13.685 6.062 ( 1.687 1.967 5.800) 6.353 6.197 ( -0.212 -8.005 -3.267) 8.649 6.494 ( -8.669 -2.754 5.090) 10.423 6.717 ( 3.819 -3.034 -3.090) 5.774 7.177 ( -5.659 0.857 4.791) 7.465 7.331 ( 5.845 2.959 2.520) 7.019 7.538 ( -6.080 4.564 3.140) 8.226 7.634 ( 1.970 8.799 5.881) 10.765 7.744 ( -0.858 -0.477 0.801) 1.267 7.814 ( 3.595 0.868 0.109) 3.700 8.010 ( -7.845 -5.704 5.544) 11.172 8.181 ( -0.507 7.058 8.383) 10.970 8.296 ( 5.557 -7.837 -7.284) 12.056 8.461 ( 0.837 5.710 -16.294) 17.285 8.510 ( 0.071 -2.186 10.581) 10.805 8.917 ( 9.193 -5.061 -15.459) 18.685 9.210 ( -0.637 -4.202 -3.994) 5.833 9.253 ( 6.654 -5.172 -0.341) 8.435 9.818 ( -11.853 -2.813 7.430) 14.269 10.158 ( 10.073 -2.609 -4.258) 11.243 10.776 ( -9.900 7.277 6.512) 13.906 10.940 ( 2.442 8.311 0.766) 8.696 12.909 ( -4.927 -0.996 -0.782) 5.087 13.006 ( 3.102 -0.661 -2.029) 3.765 13.161 ( 0.750 -0.054 -0.883) 1.160 13.215 ( 4.497 1.980 -0.636) 4.954 13.380 ( -5.284 5.005 7.461) 10.423 13.606 ( 5.374 4.931 -5.127) 8.915 14.357 ( -1.243 -0.953 2.334) 2.810 14.511 ( 3.936 -0.726 -8.018) 8.961 14.861 ( -5.255 -1.086 2.922) 6.110 15.006 ( 5.358 -0.082 0.892) 5.432 15.067 ( -0.971 0.344 2.932) 3.107 15.150 ( 0.469 -0.531 -3.552) 3.622 15.687 ( 3.690 -7.471 10.954) 13.763 15.735 ( -5.984 -6.845 -7.025) 11.489 16.398 ( -4.389 4.752 -0.460) 6.485 16.535 ( 7.767 8.032 -1.791) 11.315 17.293 ( -7.883 -5.867 7.514) 12.370 17.558 ( 5.204 -5.886 -7.574) 10.913 18.369 ( -8.561 -7.680 3.819) 12.118 18.549 ( 2.362 -2.373 -1.096) 3.523 18.896 ( -1.854 -12.081 4.094) 12.890 19.082 ( 3.530 -6.464 -7.222) 10.315 19.656 ( -0.975 2.129 7.073) 7.451 19.745 ( -1.126 3.018 -3.919) 5.072 20.332 ( -2.504 -2.752 0.557) 3.762 20.377 ( 0.046 -3.116 -1.492) 3.454 21.087 ( -3.048 -1.113 1.181) 3.454 21.182 ( 4.062 0.475 -1.040) 4.219 21.934 ( -1.372 -1.455 4.440) 4.869 22.080 ( 4.355 -0.781 -6.149) 7.575 23.292 ( -3.940 6.467 4.235) 8.676 23.461 ( 5.511 5.896 -4.008) 9.011 24.378 ( -3.000 -5.718 5.360) 8.392 24.502 ( 0.598 -4.984 -4.543) 6.770 ======================= Grid point 222 (109/138) ======================= q-point: (-0.33 0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.380 ( -17.527 7.425 15.124) 24.312 2.873 ( -21.036 -10.436 -14.381) 27.536 2.950 ( -14.799 14.482 7.154) 21.907 3.246 ( -4.552 -6.993 -6.282) 10.444 3.440 ( -7.799 3.099 -18.125) 19.973 3.970 ( 7.245 7.084 -5.919) 11.735 4.049 ( -3.585 7.509 8.607) 11.971 4.313 ( -12.194 5.334 8.902) 16.012 4.532 ( -10.302 4.949 6.423) 13.110 4.589 ( 3.341 5.234 2.506) 6.696 4.798 ( -9.316 3.979 -6.406) 11.986 5.159 ( -3.811 -7.781 5.785) 10.418 5.281 ( 3.509 -3.617 -6.319) 8.082 5.406 ( 3.362 -3.099 -3.326) 5.654 5.747 ( 0.852 -0.986 -6.951) 7.073 5.860 ( -0.608 -0.999 1.345) 1.782 6.096 ( -0.898 -5.182 -4.698) 7.051 6.193 ( 2.531 -11.074 3.777) 11.971 6.375 ( -3.502 -0.036 4.134) 5.418 6.750 ( 0.870 -1.688 -0.406) 1.942 7.101 ( -3.328 -0.490 3.747) 5.035 7.377 ( -3.918 0.556 1.503) 4.233 7.474 ( -0.078 4.355 4.338) 6.147 7.583 ( -4.933 2.634 3.424) 6.557 7.749 ( -0.786 6.194 2.960) 6.909 7.837 ( -6.651 -3.072 5.686) 9.274 7.896 ( 0.591 -0.927 -0.544) 1.226 8.211 ( 2.152 3.337 8.498) 9.380 8.364 ( 2.625 -7.711 -6.647) 10.513 8.481 ( 4.468 11.029 -17.288) 20.988 8.619 ( 7.948 -1.838 4.572) 9.352 9.064 ( 8.352 -4.557 -10.147) 13.910 9.257 ( 5.409 -7.714 -2.299) 9.698 9.399 ( 7.620 -6.292 -1.521) 9.998 9.614 ( -9.223 -2.686 5.652) 11.146 10.316 ( 5.732 -2.399 -0.916) 6.281 10.538 ( -15.416 7.438 9.166) 19.417 10.969 ( 0.031 6.474 1.339) 6.611 12.810 ( -4.609 0.075 -0.518) 4.638 13.000 ( -2.615 2.562 -1.396) 3.917 13.222 ( 3.741 -2.522 -3.577) 5.758 13.306 ( 3.741 2.761 0.230) 4.655 13.343 ( 2.107 1.824 5.790) 6.426 13.707 ( 5.794 4.492 -4.983) 8.864 14.363 ( 1.526 -0.665 1.649) 2.343 14.573 ( 4.126 -1.518 -7.078) 8.332 14.780 ( -3.078 -1.735 2.081) 4.101 15.038 ( -2.773 0.470 4.030) 4.914 15.097 ( 3.503 -0.668 0.009) 3.567 15.159 ( 1.465 -1.388 -3.916) 4.405 15.576 ( -7.484 -4.601 -8.595) 12.291 15.759 ( 0.575 -13.093 10.136) 16.568 16.353 ( -0.417 2.199 1.013) 2.457 16.733 ( 12.366 8.701 0.540) 15.130 17.113 ( -10.742 -4.431 4.943) 12.627 17.638 ( 3.622 -3.832 -6.379) 8.276 18.183 ( -9.415 -7.964 0.801) 12.358 18.476 ( -10.133 2.637 5.137) 11.663 18.914 ( 1.644 -11.972 -5.692) 13.358 19.127 ( 3.799 -7.703 -1.335) 8.692 19.632 ( -2.313 3.409 4.512) 6.110 19.730 ( -0.120 0.346 -0.451) 0.581 20.202 ( -6.436 -3.281 -3.390) 7.980 20.441 ( 1.537 -6.376 5.752) 8.724 21.023 ( -3.662 -1.448 -1.966) 4.401 21.230 ( 0.085 -1.965 -0.885) 2.157 21.888 ( 1.485 2.058 -4.714) 5.354 22.241 ( 9.028 0.053 1.949) 9.236 23.232 ( -2.613 8.121 3.224) 9.120 23.594 ( 8.167 5.286 -1.469) 9.839 24.302 ( -5.894 -4.070 4.305) 8.357 24.484 ( -1.418 -5.517 -4.146) 7.046 ======================= Grid point 223 (110/138) ======================= q-point: (-0.22 0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.105 ( -13.290 13.244 15.489) 24.330 2.401 ( -19.527 -5.648 -17.770) 26.999 2.616 ( -18.484 22.301 9.236) 30.402 3.156 ( -3.514 4.481 -27.312) 27.900 3.338 ( -1.490 -2.214 5.816) 6.399 3.839 ( -12.458 9.782 5.288) 16.698 3.953 ( -17.589 12.473 21.333) 30.332 4.127 ( -9.320 -1.173 2.618) 9.752 4.286 ( -9.810 11.893 -3.078) 15.721 4.541 ( -10.231 11.408 -11.051) 18.893 4.646 ( -0.138 2.665 2.730) 3.817 5.088 ( -2.951 5.550 -7.803) 10.020 5.315 ( 1.912 -5.921 4.813) 7.866 5.479 ( 1.141 -3.157 -0.387) 3.380 5.820 ( 6.022 1.270 -8.005) 10.097 5.862 ( 2.241 -2.862 -3.145) 4.807 6.060 ( -1.587 -5.078 -0.859) 5.389 6.233 ( -0.245 -9.830 5.106) 11.080 6.427 ( 8.115 1.038 -2.686) 8.611 6.773 ( 1.660 -0.393 4.854) 5.145 7.074 ( 0.348 -1.057 1.461) 1.836 7.262 ( -6.870 1.370 0.169) 7.007 7.427 ( -4.768 0.929 1.570) 5.106 7.556 ( 0.443 -0.560 2.434) 2.537 7.711 ( -4.953 -0.893 3.138) 5.931 7.731 ( -1.078 7.054 3.065) 7.766 7.911 ( -0.586 -1.219 -3.262) 3.531 8.279 ( 0.960 -0.332 9.359) 9.414 8.377 ( 0.235 -3.658 -1.638) 4.015 8.526 ( 5.814 19.680 -18.171) 27.410 8.811 ( 8.580 -7.318 5.614) 12.597 9.154 ( 1.689 -4.086 -8.683) 9.744 9.358 ( 3.931 -2.122 -2.088) 4.931 9.480 ( 2.914 -8.119 -0.379) 8.635 9.606 ( 6.844 -9.554 2.047) 11.929 10.129 ( -23.739 9.091 17.501) 30.862 10.459 ( 4.509 -2.998 -2.879) 6.133 10.941 ( -3.258 4.103 0.773) 5.296 12.738 ( -2.413 1.684 -0.256) 2.954 12.923 ( -4.513 3.131 -0.518) 5.518 13.265 ( 2.265 1.180 -1.271) 2.853 13.352 ( 0.819 0.619 2.244) 2.468 13.479 ( 8.837 -2.628 -1.278) 9.308 13.799 ( 4.412 3.281 -6.201) 8.288 14.422 ( 3.917 -1.283 1.337) 4.334 14.650 ( 5.324 -1.391 -5.270) 7.619 14.754 ( -0.286 -3.273 2.820) 4.329 14.975 ( -4.334 0.287 4.018) 5.917 15.136 ( 0.585 -1.803 -2.064) 2.803 15.197 ( 2.902 -2.323 -2.545) 4.505 15.421 ( -5.450 -4.758 -8.416) 11.098 15.750 ( -3.849 -18.630 7.878) 20.590 16.386 ( 3.424 0.638 2.402) 4.231 16.895 ( -7.861 0.944 3.717) 8.747 17.039 ( 13.738 2.706 2.989) 14.317 17.652 ( -0.496 -0.828 -9.777) 9.824 18.011 ( -8.721 -4.858 1.407) 10.081 18.259 ( -11.099 0.246 5.552) 12.413 18.866 ( -3.453 -4.923 -6.463) 8.827 19.255 ( 6.723 -7.971 1.577) 10.546 19.602 ( -0.657 1.444 1.340) 2.077 19.722 ( -1.341 -2.912 2.133) 3.851 20.070 ( -6.564 -3.949 -1.516) 7.809 20.415 ( -5.934 -8.378 2.091) 10.478 20.941 ( -2.703 -0.429 -3.447) 4.402 21.188 ( -3.310 -4.614 1.121) 5.787 22.024 ( 12.509 5.059 -3.149) 13.856 22.407 ( 7.149 -0.245 1.721) 7.357 23.211 ( -0.126 10.176 3.602) 10.796 23.765 ( 8.857 5.129 0.035) 10.235 24.162 ( -8.959 -1.301 1.924) 9.255 24.427 ( -3.557 -6.008 -3.604) 7.857 ======================= Grid point 224 (111/138) ======================= q-point: (-0.11 0.18 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.955 ( -4.797 16.194 6.924) 18.254 2.059 ( -13.146 11.829 -7.202) 19.095 2.338 ( -9.286 26.707 8.024) 29.392 2.995 ( -6.381 13.654 -28.764) 32.474 3.341 ( -0.931 0.595 13.062) 13.109 3.559 ( -18.008 10.853 22.580) 30.854 3.669 ( -9.918 16.602 16.845) 25.647 3.961 ( -6.703 -2.311 -3.949) 8.116 4.111 ( -5.324 9.646 -8.521) 13.928 4.332 ( -6.640 9.202 -14.982) 18.794 4.686 ( 1.271 1.975 6.976) 7.361 5.013 ( -2.406 7.649 -10.143) 12.930 5.359 ( 1.588 -1.316 2.116) 2.955 5.466 ( -1.611 -1.412 -1.149) 2.430 5.887 ( -0.024 -0.175 7.612) 7.614 5.920 ( 3.650 0.017 -10.364) 10.988 6.028 ( 1.602 -1.164 -4.436) 4.858 6.228 ( -2.722 -3.775 2.612) 5.337 6.615 ( 11.117 -0.936 -0.719) 11.180 6.869 ( 6.276 0.169 7.559) 9.826 7.074 ( -4.956 -1.159 2.247) 5.564 7.158 ( 0.570 -0.729 -6.465) 6.531 7.353 ( -2.464 -1.387 0.474) 2.867 7.534 ( -3.152 -2.214 -3.290) 5.066 7.656 ( -1.952 0.071 1.588) 2.517 7.788 ( 7.397 7.804 1.548) 10.864 7.846 ( -3.822 -0.742 -5.736) 6.933 8.211 ( -8.160 -1.223 1.498) 8.386 8.431 ( 3.173 0.416 13.232) 13.613 8.678 ( 12.969 20.342 -13.984) 27.885 8.921 ( 2.061 -8.984 1.423) 9.326 9.156 ( 0.388 0.556 -6.255) 6.292 9.370 ( -1.427 -1.268 -3.945) 4.382 9.551 ( -10.338 3.519 12.197) 16.371 9.654 ( 0.052 -3.487 -0.420) 3.513 9.801 ( -1.492 -11.172 6.129) 12.830 10.550 ( 5.072 -2.373 0.536) 5.625 10.845 ( -6.165 1.718 -0.857) 6.457 12.719 ( 0.497 2.907 0.272) 2.962 12.835 ( -4.166 2.802 -0.111) 5.021 13.314 ( 2.544 2.594 -0.968) 3.760 13.344 ( -1.892 -1.835 2.897) 3.916 13.643 ( 7.409 -2.594 -1.924) 8.082 13.840 ( 1.171 1.605 -7.426) 7.687 14.516 ( 5.473 -2.691 0.412) 6.113 14.726 ( -1.766 -3.464 -0.085) 3.889 14.767 ( 3.737 -0.829 1.017) 3.961 14.917 ( -1.801 -0.263 4.903) 5.230 15.120 ( -0.858 -3.563 -3.566) 5.113 15.217 ( -1.224 -1.947 -2.364) 3.298 15.385 ( 4.496 -9.944 -5.577) 12.256 15.638 ( -9.104 -20.838 6.912) 23.768 16.493 ( 6.640 -0.357 2.480) 7.097 16.738 ( -7.609 2.268 4.387) 9.071 17.328 ( 11.011 -6.039 1.395) 12.636 17.587 ( -2.920 1.577 -12.094) 12.541 17.863 ( -3.716 3.383 3.246) 5.983 18.098 ( -7.330 -3.727 4.165) 9.217 18.816 ( 0.546 -1.356 -2.000) 2.477 19.253 ( -8.805 -1.480 -3.894) 9.740 19.652 ( -1.576 -8.734 12.330) 15.192 19.687 ( 4.056 0.668 -6.052) 7.316 19.965 ( -1.932 -0.752 -0.877) 2.251 20.243 ( -9.555 -5.229 -1.674) 11.020 20.946 ( 3.369 -3.233 0.271) 4.677 21.123 ( -3.708 -5.898 1.760) 7.186 22.309 ( 14.739 -0.002 -0.889) 14.766 22.517 ( 3.402 -1.075 0.215) 3.574 23.263 ( 5.322 12.737 4.908) 14.651 23.847 ( -7.011 7.468 -1.212) 10.315 24.039 ( 2.884 0.073 -0.968) 3.042 24.327 ( -5.968 -5.390 -2.375) 8.386 ======================= Grid point 225 (112/138) ======================= q-point: ( 0.00 0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.231 ( -16.327 30.756 8.505) 35.844 2.451 ( 16.513 22.021 -13.342) 30.587 2.838 ( -6.499 28.220 16.920) 33.540 3.191 ( -1.957 18.980 -17.667) 26.004 3.355 ( 4.434 -5.151 8.877) 11.180 3.517 ( -2.609 -1.077 -6.290) 6.894 3.860 ( -1.915 14.610 14.476) 20.656 4.012 ( 5.656 8.742 1.738) 10.556 4.226 ( -0.417 9.556 0.874) 9.605 4.344 ( -3.635 6.308 -8.805) 11.426 4.867 ( 2.295 10.125 14.235) 17.618 5.109 ( -0.488 6.959 -6.566) 9.581 5.348 ( -0.123 -3.783 -1.470) 4.060 5.415 ( 0.872 -0.821 -4.692) 4.843 5.769 ( -7.605 -2.014 10.646) 13.237 6.016 ( 5.257 0.847 -12.806) 13.869 6.144 ( 1.192 2.161 1.023) 2.671 6.193 ( 3.065 4.002 -4.897) 7.028 6.794 ( 6.414 -2.222 3.223) 7.514 6.895 ( -8.756 -0.242 -5.100) 10.136 6.953 ( 2.159 -2.864 6.712) 7.610 7.116 ( 3.179 -5.211 -8.207) 10.228 7.302 ( 2.086 -2.610 3.431) 4.789 7.400 ( -2.203 -3.496 -5.701) 7.041 7.661 ( -0.395 0.203 4.811) 4.832 7.770 ( -0.058 -1.325 -4.877) 5.054 8.031 ( -6.930 1.083 1.468) 7.166 8.075 ( 6.969 3.644 -3.836) 8.749 8.550 ( 3.549 0.124 10.359) 10.951 8.694 ( -0.583 -8.867 -1.040) 8.947 8.990 ( -4.759 -4.573 0.555) 6.623 9.015 ( -2.556 -3.310 -2.922) 5.102 9.438 ( -7.384 -0.041 10.956) 13.212 9.470 ( -5.812 4.359 9.202) 11.725 9.548 ( -0.037 -12.945 -4.647) 13.754 9.840 ( 19.838 13.185 -20.838) 31.649 10.555 ( -5.131 -4.421 10.253) 12.288 10.736 ( 3.366 -2.640 -8.055) 9.120 12.810 ( -3.577 3.940 1.942) 5.664 12.847 ( 3.434 4.671 -1.482) 5.984 13.259 ( -3.972 -2.324 8.116) 9.330 13.383 ( 1.983 0.142 -3.830) 4.316 13.704 ( 1.839 -1.298 2.210) 3.155 13.821 ( -0.828 -0.115 -8.917) 8.956 14.553 ( -4.783 -3.105 0.856) 5.766 14.576 ( 4.716 -3.259 -1.087) 5.834 14.808 ( -1.989 -2.297 5.065) 5.907 14.881 ( 1.553 -2.077 -1.238) 2.873 14.999 ( -4.433 -5.770 5.257) 8.977 15.086 ( 0.044 -4.182 -2.639) 4.946 15.234 ( -0.607 -6.426 1.874) 6.721 15.283 ( 2.863 -10.212 -1.959) 10.785 16.636 ( 6.155 0.143 4.112) 7.404 16.683 ( -4.738 3.211 -0.087) 5.725 17.291 ( 3.315 -4.271 6.210) 8.234 17.459 ( -6.253 -2.188 -8.729) 10.959 17.927 ( -6.050 2.222 4.637) 7.941 18.044 ( 8.096 0.564 -6.315) 10.283 18.907 ( 8.396 -2.105 2.877) 9.122 18.952 ( -9.347 -3.915 -1.135) 10.197 19.612 ( -3.856 1.911 7.203) 8.390 19.760 ( 4.407 -3.507 -7.246) 9.178 19.964 ( 4.039 -2.607 2.249) 5.308 20.001 ( -4.320 -2.311 -1.469) 5.115 20.951 ( -2.280 -3.167 0.704) 3.965 20.959 ( 2.736 -3.179 -0.093) 4.195 22.393 ( -0.812 -3.598 4.123) 5.532 22.479 ( 1.029 -4.772 -4.473) 6.621 23.625 ( 2.983 8.913 9.893) 13.646 23.820 ( -2.876 7.448 -9.037) 12.059 24.129 ( -5.702 -2.566 0.211) 6.256 24.159 ( 5.725 -0.905 -2.378) 6.265 ======================= Grid point 226 (113/138) ======================= q-point: ( 0.11 0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.943 ( -12.329 30.813 8.069) 34.155 2.737 ( 8.446 18.812 2.381) 20.758 2.774 ( 2.265 21.912 11.136) 24.684 3.126 ( -0.413 22.423 -12.845) 25.845 3.479 ( 0.945 -3.010 -9.155) 9.684 3.512 ( 8.492 -6.967 8.022) 13.601 3.956 ( 7.383 9.923 4.306) 13.097 4.219 ( 10.853 3.983 -1.041) 11.607 4.249 ( 2.442 8.009 6.847) 10.816 4.367 ( 8.843 12.884 -1.385) 15.688 4.941 ( 1.381 6.983 8.453) 11.051 5.134 ( 5.738 9.112 -8.044) 13.441 5.336 ( -0.469 -1.476 -2.577) 3.006 5.404 ( -1.268 -3.072 -2.973) 4.459 5.634 ( -8.335 -2.682 10.984) 14.047 6.059 ( -1.909 4.938 -5.158) 7.392 6.116 ( 2.251 3.556 -8.962) 9.901 6.213 ( -2.366 -3.530 -6.017) 7.366 6.642 ( -10.922 1.946 -2.231) 11.316 6.899 ( -2.377 -2.339 -0.789) 3.427 6.967 ( 1.435 -4.578 5.087) 6.993 7.183 ( 4.811 -3.157 -6.543) 8.713 7.358 ( 3.761 -0.965 -1.762) 4.264 7.443 ( 5.418 -2.113 0.878) 5.882 7.682 ( 1.667 -3.078 6.078) 7.014 7.762 ( 0.890 0.446 -5.330) 5.422 7.940 ( -1.675 2.651 -2.209) 3.836 8.175 ( 2.193 -0.756 1.689) 2.869 8.548 ( -4.315 -6.664 -1.364) 8.055 8.719 ( -3.117 7.061 7.627) 10.851 8.821 ( -5.547 -11.080 0.792) 12.416 8.962 ( -3.525 4.151 4.069) 6.798 9.279 ( -4.352 4.419 9.758) 11.562 9.486 ( -0.535 -11.006 0.623) 11.036 9.492 ( -3.429 -9.641 -7.943) 12.954 10.236 ( 20.475 7.997 -16.134) 27.267 10.406 ( -6.905 -4.380 5.448) 9.826 10.873 ( 8.210 -0.961 -3.009) 8.797 12.757 ( -1.704 2.870 1.515) 3.666 12.926 ( 4.329 5.205 -1.107) 6.860 13.191 ( -4.229 -2.379 7.952) 9.316 13.407 ( 0.402 0.619 -1.053) 1.286 13.665 ( -3.626 0.490 -3.107) 4.800 13.808 ( -0.524 0.054 -3.477) 3.516 14.465 ( -3.070 -1.850 -0.377) 3.604 14.634 ( -1.396 -3.949 0.805) 4.265 14.767 ( -1.232 -2.491 0.517) 2.827 14.877 ( -2.855 -3.934 9.371) 10.556 14.964 ( 3.726 -0.010 -1.345) 3.961 15.128 ( 1.563 -2.691 1.860) 3.625 15.234 ( 0.907 -3.327 -1.382) 3.715 15.381 ( 6.489 -14.325 -1.167) 15.769 16.585 ( -3.856 3.345 -2.913) 5.877 16.786 ( 7.084 -1.427 3.633) 8.088 17.291 ( -8.943 -1.019 -4.607) 10.112 17.378 ( 3.923 -1.806 6.798) 8.053 17.856 ( -1.907 -1.343 3.172) 3.937 18.205 ( 9.626 0.327 -7.036) 11.927 18.782 ( -6.277 -1.487 -1.003) 6.528 19.075 ( 4.624 -8.429 2.913) 10.045 19.545 ( -2.362 2.321 5.922) 6.785 19.792 ( 1.045 -0.885 -4.481) 4.686 19.973 ( 1.386 -0.460 -2.722) 3.089 20.116 ( 9.557 -4.922 2.009) 10.936 20.902 ( -1.578 -1.428 0.190) 2.137 21.047 ( 4.925 -4.573 -0.701) 6.758 22.265 ( -10.527 -0.718 1.787) 10.702 22.480 ( -1.752 -5.519 -2.613) 6.352 23.561 ( -6.007 11.120 0.913) 12.671 23.913 ( 6.815 2.768 -0.285) 7.362 24.010 ( -4.856 -0.481 1.670) 5.158 24.247 ( 3.924 -3.063 -3.075) 5.851 ======================= Grid point 227 (114/138) ======================= q-point: ( 0.22 0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.882 ( 5.515 14.873 13.191) 20.631 2.812 ( 3.886 14.880 21.920) 26.776 2.930 ( 6.114 17.597 -14.413) 23.554 3.153 ( 4.338 14.200 -6.476) 16.199 3.493 ( 3.872 2.617 -10.720) 11.694 3.719 ( 8.484 -9.305 12.474) 17.725 4.116 ( 8.278 3.300 -2.585) 9.279 4.214 ( -0.933 -0.672 0.711) 1.352 4.546 ( 14.940 10.712 9.112) 20.518 4.596 ( 12.132 11.913 -0.525) 17.011 4.945 ( -1.042 4.791 -0.005) 4.903 5.234 ( -1.971 -3.244 -10.264) 10.944 5.299 ( 0.426 5.625 -6.970) 8.967 5.405 ( 1.183 -2.984 3.367) 4.652 5.491 ( -5.390 -6.595 9.724) 12.927 5.983 ( -6.371 5.598 -6.638) 10.770 6.033 ( -4.452 -3.470 -7.199) 9.148 6.207 ( 3.133 0.718 -4.519) 5.546 6.483 ( -4.391 3.733 -1.897) 6.067 6.806 ( -5.248 -2.532 -1.952) 6.145 7.015 ( 2.759 -3.013 3.118) 5.139 7.263 ( 3.994 -2.267 -1.221) 4.752 7.455 ( 5.205 -0.845 0.250) 5.279 7.536 ( 3.157 -0.607 1.924) 3.746 7.747 ( 2.720 -5.166 5.677) 8.143 7.797 ( 4.090 -1.073 -5.864) 7.229 7.927 ( -0.193 2.945 -2.405) 3.807 8.173 ( -2.367 -2.544 5.081) 6.156 8.443 ( -3.911 -4.231 -4.730) 7.455 8.569 ( -8.912 10.706 9.422) 16.817 8.761 ( -3.895 -7.365 2.055) 8.581 8.925 ( -3.937 -3.658 1.735) 5.647 9.216 ( -6.251 -1.963 6.805) 9.446 9.416 ( -1.963 -4.458 -8.873) 10.122 9.509 ( 6.079 -5.392 -5.490) 9.806 10.234 ( -7.615 -6.163 9.397) 13.575 10.623 ( 16.647 6.401 -13.164) 22.168 11.002 ( 4.968 1.205 -0.851) 5.183 12.754 ( 1.090 1.607 0.766) 2.088 12.999 ( 2.793 3.927 -0.093) 4.820 13.138 ( -2.405 -2.298 5.121) 6.107 13.384 ( -2.438 1.564 0.685) 2.976 13.604 ( -1.229 3.725 -5.471) 6.732 13.761 ( -3.840 1.035 1.358) 4.203 14.429 ( -0.579 -1.352 -2.095) 2.560 14.553 ( -5.604 -1.809 0.716) 5.932 14.748 ( 0.927 -0.403 -0.402) 1.088 14.918 ( 1.900 -4.139 9.031) 10.114 15.035 ( 3.246 1.521 -0.530) 3.623 15.154 ( 0.916 -1.532 1.285) 2.199 15.269 ( 2.998 -2.996 0.301) 4.248 15.506 ( 5.990 -14.221 -0.856) 15.455 16.519 ( -1.791 4.172 -4.989) 6.746 16.923 ( 4.913 -4.303 3.974) 7.644 17.099 ( -8.506 3.928 -2.641) 9.734 17.461 ( 2.540 -3.474 3.884) 5.797 17.869 ( 2.667 -5.703 2.791) 6.887 18.395 ( 10.892 -0.385 -4.322) 11.725 18.693 ( -3.454 -4.335 -0.641) 5.579 19.044 ( -6.089 -12.609 -0.177) 14.004 19.594 ( 4.233 4.662 6.309) 8.914 19.812 ( 2.050 2.734 -2.750) 4.386 20.013 ( 3.030 -2.498 -2.188) 4.495 20.312 ( 9.124 -5.684 0.056) 10.749 20.902 ( 1.741 0.661 1.306) 2.275 21.137 ( 4.281 -4.345 -1.797) 6.359 22.040 ( -11.704 2.228 1.565) 12.016 22.392 ( -6.236 -5.567 -2.649) 8.769 23.473 ( -2.838 10.950 -0.574) 11.326 23.834 ( -7.766 3.493 -0.007) 8.515 24.107 ( 6.676 -3.419 4.360) 8.676 24.305 ( 2.881 -4.798 -3.734) 6.728 ======================= Grid point 228 (115/138) ======================= q-point: ( 0.33 0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.224 ( 24.276 -6.901 16.025) 29.896 2.971 ( 4.458 9.645 -1.929) 10.799 2.997 ( 6.797 12.773 0.317) 14.472 3.171 ( -0.921 4.788 -1.830) 5.208 3.605 ( 8.485 9.209 -6.966) 14.329 3.819 ( -3.136 -3.292 11.579) 12.439 4.255 ( 7.000 -2.919 -3.985) 8.567 4.279 ( 7.882 -4.416 -0.308) 9.041 4.706 ( -5.204 0.239 -5.220) 7.375 4.796 ( 6.416 10.676 7.749) 14.669 4.933 ( -1.844 4.356 -2.742) 5.467 5.059 ( -3.869 -16.086 -7.982) 18.370 5.198 ( -6.466 4.021 -3.502) 8.381 5.385 ( 1.126 2.090 0.638) 2.458 5.614 ( 4.847 0.950 1.508) 5.164 5.828 ( -3.520 -9.195 0.868) 9.884 6.006 ( 0.417 3.656 -5.835) 6.898 6.242 ( 1.652 4.354 -3.894) 6.070 6.465 ( 2.410 1.682 -2.577) 3.909 6.702 ( -5.164 -2.296 0.958) 5.732 7.102 ( 5.008 -2.106 1.760) 5.710 7.327 ( 1.865 -3.677 2.157) 4.653 7.517 ( 0.985 -0.267 3.120) 3.283 7.604 ( 3.924 -0.563 2.618) 4.751 7.787 ( -0.075 -4.302 5.172) 6.727 7.845 ( -1.766 -3.825 -2.071) 4.695 7.923 ( 2.903 3.326 -0.595) 4.454 8.137 ( -1.789 -3.096 1.841) 4.023 8.415 ( 1.312 2.035 -4.146) 4.801 8.450 ( -4.482 6.468 7.106) 10.602 8.685 ( -3.270 -5.620 -4.315) 7.804 8.787 ( -9.594 -5.551 3.664) 11.674 9.098 ( -4.737 -3.202 2.917) 6.419 9.354 ( -2.501 -0.647 -9.137) 9.495 9.692 ( 12.112 -1.824 -7.554) 14.390 10.100 ( -8.473 -6.229 9.726) 14.324 10.859 ( 9.640 6.613 -5.562) 12.946 11.062 ( 1.208 3.083 -0.138) 3.314 12.798 ( 3.129 -0.169 0.059) 3.135 13.011 ( -1.799 -1.294 1.027) 2.443 13.137 ( 1.705 1.918 1.030) 2.765 13.330 ( -2.992 2.530 0.059) 3.919 13.591 ( 0.758 6.485 -3.180) 7.263 13.677 ( -4.837 2.670 3.532) 6.557 14.419 ( -1.025 -1.623 -0.425) 1.966 14.458 ( -2.571 -0.544 -3.409) 4.304 14.806 ( 4.590 1.631 -1.169) 5.010 14.948 ( -0.762 -4.087 7.808) 8.846 15.081 ( 1.279 2.520 0.489) 2.868 15.165 ( 0.177 0.048 -1.596) 1.606 15.358 ( 5.100 -4.256 4.905) 8.257 15.600 ( 3.519 -12.546 -1.375) 13.103 16.500 ( 1.173 5.013 -5.327) 7.408 16.845 ( -10.076 1.645 0.381) 10.217 17.105 ( 6.141 -0.253 2.343) 6.577 17.476 ( -1.452 -5.504 -0.183) 5.695 17.977 ( 7.431 -8.825 3.002) 11.921 18.566 ( -1.411 -13.184 2.651) 13.522 18.633 ( 4.938 0.482 -6.193) 7.935 18.929 ( -4.519 -9.825 -0.053) 10.814 19.674 ( 2.207 4.568 5.769) 7.682 19.851 ( 1.952 5.180 -3.888) 6.764 20.086 ( 4.618 -3.278 1.583) 5.880 20.437 ( 3.518 -5.403 -3.948) 7.560 20.977 ( 4.970 1.285 2.600) 5.754 21.197 ( 1.734 -2.279 -1.742) 3.352 21.855 ( -6.328 2.268 2.660) 7.229 22.238 ( -8.278 -6.019 -3.327) 10.762 23.443 ( -0.337 9.667 0.712) 9.700 23.687 ( -6.655 5.506 -1.396) 8.749 24.217 ( 3.229 -6.060 5.844) 9.017 24.347 ( 2.381 -5.916 -4.683) 7.912 ======================= Grid point 229 (116/138) ======================= q-point: ( 0.44 0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.816 ( 28.295 -16.668 14.745) 35.997 2.948 ( -6.224 1.715 1.574) 6.645 3.055 ( 2.484 8.591 -7.408) 11.613 3.313 ( 13.374 6.688 6.424) 16.274 3.654 ( -14.584 -3.256 2.562) 15.162 3.713 ( 2.215 0.522 -15.043) 15.214 4.256 ( -6.568 1.488 3.051) 7.393 4.452 ( -5.931 1.411 -9.371) 11.180 4.544 ( 13.201 -12.374 -2.676) 18.290 4.741 ( -11.298 -6.164 2.648) 13.140 4.907 ( 2.472 9.276 2.333) 9.879 5.085 ( -0.621 3.154 -5.505) 6.374 5.209 ( 7.864 0.060 -2.608) 8.285 5.363 ( -5.181 1.714 -0.314) 5.467 5.616 ( 1.655 -2.057 1.571) 3.072 5.810 ( -4.082 -12.645 -2.929) 13.606 6.057 ( 5.429 5.421 3.235) 8.326 6.256 ( -0.373 4.795 -4.271) 6.432 6.533 ( 4.801 -2.228 -1.940) 5.637 6.590 ( -7.099 -3.030 3.717) 8.566 7.202 ( 4.275 -1.858 3.666) 5.930 7.302 ( -4.774 -4.715 3.800) 7.711 7.587 ( 4.133 0.574 5.598) 6.982 7.683 ( 2.947 -0.384 5.360) 6.129 7.754 ( -4.196 -2.413 0.159) 4.843 7.783 ( -0.764 -0.510 -0.021) 0.919 7.999 ( 1.997 -0.785 2.853) 3.570 8.104 ( -0.310 -3.309 -5.462) 6.393 8.378 ( -2.670 8.761 8.580) 12.550 8.478 ( 0.924 -0.295 4.337) 4.444 8.580 ( -7.213 -3.674 -3.026) 8.641 8.675 ( 2.914 -6.614 -11.730) 13.778 9.080 ( 2.129 -2.375 2.178) 3.863 9.278 ( -2.660 2.911 -10.813) 11.509 9.910 ( 10.655 -2.148 -6.806) 12.824 9.940 ( -9.104 -5.379 8.463) 13.544 10.981 ( 2.312 6.428 2.239) 7.188 11.054 ( -0.847 4.891 -1.662) 5.235 12.874 ( 4.539 -1.888 -0.691) 4.964 12.955 ( -3.535 -2.921 -0.624) 4.628 13.190 ( 2.983 3.489 0.653) 4.637 13.268 ( -3.048 3.647 -0.683) 4.802 13.572 ( -4.755 5.458 8.061) 10.834 13.640 ( 2.833 6.297 -4.874) 8.451 14.371 ( -2.704 -1.050 2.900) 4.101 14.454 ( 2.143 -0.874 -8.055) 8.381 14.904 ( 4.812 1.032 -1.201) 5.066 14.925 ( -2.658 -2.123 5.411) 6.391 15.090 ( -0.329 2.105 1.865) 2.832 15.159 ( -0.208 0.661 -2.667) 2.756 15.468 ( 4.089 -5.723 7.235) 10.090 15.631 ( -0.060 -10.475 -2.658) 10.807 16.547 ( 4.752 5.729 -4.103) 8.499 16.651 ( -9.045 4.903 -0.316) 10.293 17.225 ( 3.623 -3.184 6.968) 8.475 17.423 ( -2.018 -5.453 -5.464) 7.979 18.153 ( 8.531 -11.589 4.449) 15.062 18.418 ( -8.007 -13.229 -3.808) 15.925 18.774 ( 3.563 -3.779 2.123) 5.611 18.867 ( -0.478 -9.108 -3.276) 9.691 19.716 ( 0.830 4.982 6.244) 8.031 19.856 ( -0.387 5.174 -4.922) 7.152 20.197 ( 5.438 -1.928 5.128) 7.719 20.432 ( -2.523 -3.202 -6.809) 7.936 21.082 ( 4.261 0.868 2.286) 4.912 21.182 ( -2.340 0.492 -1.658) 2.910 21.835 ( 3.034 -0.954 4.979) 5.908 22.069 ( -7.208 -6.212 -5.120) 10.805 23.452 ( 0.077 8.212 4.304) 9.271 23.581 ( -2.625 7.307 -4.810) 9.134 24.263 ( 0.091 -7.141 6.595) 9.721 24.377 ( 1.789 -6.518 -5.471) 8.696 ======================= Grid point 230 (117/138) ======================= q-point: (-0.44 0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.774 ( -11.134 6.155 9.560) 15.914 3.038 ( -1.406 2.608 -7.807) 8.351 3.205 ( -14.478 -7.522 -5.542) 17.230 3.315 ( -0.370 -9.019 7.586) 11.791 3.638 ( 3.239 2.230 -15.096) 15.600 3.716 ( 20.151 -6.797 -4.520) 21.742 4.214 ( 0.261 6.827 12.315) 14.084 4.327 ( -4.535 5.372 -1.404) 7.169 4.522 ( -9.370 -6.706 -1.273) 11.592 4.801 ( 7.684 -4.087 -0.484) 8.717 4.950 ( 0.077 4.125 -1.169) 4.288 5.030 ( 0.474 5.454 -4.203) 6.902 5.200 ( -7.840 -0.654 -0.233) 7.871 5.397 ( 8.287 0.567 -4.120) 9.272 5.681 ( -5.298 -9.010 -2.357) 10.715 5.715 ( 5.171 -5.814 3.320) 8.459 6.124 ( -2.902 2.549 4.427) 5.875 6.186 ( -3.143 6.433 -4.705) 8.568 6.460 ( -5.905 -0.662 4.798) 7.637 6.634 ( 4.651 -5.375 0.057) 7.107 7.163 ( -6.861 -2.817 6.773) 10.043 7.321 ( 3.607 -3.952 2.192) 5.782 7.571 ( -5.393 -0.988 6.101) 8.203 7.675 ( -3.569 -2.708 5.587) 7.162 7.775 ( 2.318 -1.436 -2.102) 3.443 7.819 ( 3.702 0.712 -0.953) 3.889 7.960 ( -4.093 2.315 3.592) 5.917 8.154 ( 4.872 -4.690 -6.128) 9.126 8.352 ( -3.271 8.894 7.649) 12.178 8.420 ( -1.871 -4.947 7.135) 8.882 8.565 ( 4.535 1.265 -5.525) 7.259 8.786 ( 9.515 -7.795 -13.631) 18.361 9.163 ( 4.912 -3.404 1.417) 6.142 9.215 ( -0.639 5.062 -11.548) 12.625 9.752 ( -10.771 -3.888 8.011) 13.975 10.105 ( 9.641 -3.122 -6.919) 12.271 10.911 ( -8.741 6.502 6.338) 12.603 11.071 ( 1.182 5.181 -1.040) 5.415 12.880 ( -3.565 -1.681 -1.367) 4.172 12.970 ( 5.325 -2.831 -1.865) 6.313 13.195 ( -2.742 3.150 0.219) 4.182 13.265 ( 3.055 2.729 -0.660) 4.150 13.498 ( -4.049 7.332 8.307) 11.796 13.708 ( 4.560 5.564 -4.304) 8.383 14.342 ( -0.788 -0.485 2.495) 2.661 14.488 ( 3.070 -1.642 -8.200) 8.909 14.847 ( -5.039 -0.494 3.945) 6.419 15.004 ( 4.444 -0.474 -1.258) 4.643 15.084 ( -0.960 1.201 2.984) 3.357 15.145 ( -0.548 0.282 -2.545) 2.619 15.534 ( 0.639 -7.933 7.527) 10.955 15.583 ( -3.914 -8.287 -4.320) 10.132 16.499 ( -5.991 5.506 0.354) 8.145 16.670 ( 8.286 5.663 -2.332) 10.303 17.207 ( -6.544 -2.980 7.350) 10.282 17.448 ( 5.366 -5.291 -6.380) 9.874 18.173 ( -8.178 -12.108 3.044) 14.924 18.417 ( 9.695 -12.438 -4.272) 16.338 18.708 ( -7.905 -5.550 5.453) 11.091 18.924 ( 3.816 -8.688 -5.632) 11.034 19.737 ( -0.253 5.642 7.052) 9.034 19.821 ( -1.824 4.676 -4.428) 6.693 20.290 ( -0.349 -1.848 3.446) 3.926 20.332 ( -3.111 -1.869 -4.394) 5.699 21.081 ( -3.847 0.445 2.080) 4.395 21.189 ( 2.624 0.182 -2.100) 3.366 21.886 ( -2.054 -3.164 2.399) 4.470 22.025 ( 6.824 -4.433 -3.169) 8.733 23.435 ( -2.483 8.168 4.891) 9.839 23.594 ( 4.594 7.635 -4.953) 10.195 24.256 ( -2.110 -6.875 6.326) 9.578 24.388 ( 0.475 -6.721 -5.602) 8.762 ======================= Grid point 231 (118/138) ======================= q-point: (-0.33 0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.512 ( -17.195 -1.872 -4.973) 17.998 2.759 ( -11.903 8.586 1.141) 14.721 3.120 ( 1.001 2.436 -1.844) 3.216 3.258 ( -6.543 7.485 0.135) 9.942 3.543 ( -6.718 6.959 -10.123) 14.001 4.078 ( 4.924 0.317 -12.944) 13.853 4.152 ( -1.269 2.188 6.472) 6.948 4.269 ( -7.707 -4.125 0.540) 8.758 4.557 ( 12.816 -8.835 11.465) 19.333 4.753 ( -8.214 13.490 9.863) 18.620 4.912 ( -2.116 5.396 -2.554) 6.334 5.002 ( -9.393 -0.770 -1.333) 9.518 5.211 ( 10.965 -4.617 -4.979) 12.897 5.438 ( -2.075 3.772 -4.381) 6.142 5.662 ( 2.488 -3.539 -3.905) 5.828 5.818 ( 4.869 -9.974 2.428) 11.361 5.988 ( -6.079 1.890 -1.960) 6.661 6.170 ( -0.400 5.344 0.722) 5.407 6.395 ( -1.344 2.138 3.937) 4.677 6.696 ( 1.742 -4.435 2.158) 5.231 7.065 ( -4.082 -3.418 5.231) 7.463 7.323 ( -4.152 -5.397 2.102) 7.126 7.517 ( -0.736 -0.760 3.582) 3.735 7.598 ( -5.459 0.100 3.891) 6.704 7.752 ( -4.125 -4.676 2.377) 6.674 7.852 ( -0.140 -0.289 -0.020) 0.321 7.923 ( -0.305 6.237 0.667) 6.280 8.221 ( 2.814 -4.755 -3.471) 6.525 8.312 ( -0.682 4.610 3.045) 5.567 8.504 ( 7.131 -3.538 4.153) 8.979 8.685 ( 8.309 0.861 -6.771) 10.754 8.945 ( 8.672 -7.141 -9.428) 14.665 9.204 ( 2.914 3.972 -8.687) 9.987 9.272 ( 5.008 -6.190 0.670) 7.990 9.562 ( -9.394 -2.013 4.594) 10.649 10.256 ( 6.905 -3.968 -5.146) 9.482 10.693 ( -15.045 8.144 8.928) 19.297 11.063 ( -2.079 3.174 0.221) 3.801 12.815 ( -2.574 0.490 -1.421) 2.981 13.044 ( 0.824 0.800 -1.552) 1.931 13.164 ( 1.136 -1.540 -1.772) 2.608 13.326 ( 3.430 0.487 0.133) 3.467 13.460 ( -1.692 8.082 7.283) 11.010 13.788 ( 4.396 3.763 -4.709) 7.461 14.354 ( 1.447 -0.223 1.666) 2.217 14.537 ( 3.746 -2.221 -6.951) 8.202 14.760 ( -4.231 -0.359 3.025) 5.213 15.054 ( -2.284 0.752 4.838) 5.402 15.071 ( 1.751 -2.423 -3.703) 4.759 15.134 ( 0.154 -0.855 -1.195) 1.478 15.466 ( -6.449 -6.497 -5.254) 10.555 15.523 ( -3.372 -10.563 6.949) 13.086 16.422 ( -2.049 4.944 1.873) 5.670 16.853 ( 10.259 3.369 -0.838) 10.831 17.068 ( -8.113 -0.227 5.111) 9.592 17.541 ( 4.645 -5.575 -5.282) 8.975 18.013 ( -7.175 -9.181 -0.244) 11.654 18.521 ( -10.308 1.321 4.817) 11.454 18.621 ( 8.703 -16.876 -2.946) 19.215 18.959 ( 1.480 -8.493 -3.160) 9.182 19.735 ( -1.553 6.593 6.707) 9.532 19.772 ( -2.085 3.546 -3.281) 5.261 20.151 ( -7.811 -2.053 -4.687) 9.338 20.347 ( -0.857 -4.087 4.698) 6.285 21.008 ( -3.677 -0.133 -0.006) 3.680 21.186 ( -2.877 -2.487 -1.008) 3.934 21.899 ( 4.973 -0.216 -1.003) 5.077 22.198 ( 9.315 -4.147 -0.091) 10.196 23.407 ( -0.961 9.640 3.540) 10.314 23.708 ( 7.414 6.372 -2.857) 10.185 24.211 ( -3.800 -5.369 5.401) 8.511 24.367 ( -1.389 -6.490 -5.514) 8.628 ======================= Grid point 232 (119/138) ======================= q-point: (-0.22 0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.219 ( -6.571 4.079 -17.848) 19.452 2.623 ( -6.263 23.701 13.877) 28.169 3.037 ( -9.485 18.313 5.861) 21.440 3.207 ( 2.375 1.909 -4.853) 5.730 3.389 ( -5.126 8.129 -10.826) 14.477 3.897 ( -12.377 -6.272 -3.318) 14.267 4.094 ( -7.589 2.560 -1.534) 8.155 4.197 ( -5.077 11.290 2.014) 12.542 4.555 ( -10.904 12.119 5.281) 17.136 4.663 ( -8.583 0.490 3.045) 9.120 4.804 ( -4.505 11.620 4.664) 13.307 5.045 ( 9.933 -6.980 7.835) 14.448 5.300 ( -0.405 3.516 -7.084) 7.919 5.447 ( 1.153 0.511 -0.469) 1.346 5.711 ( 7.946 -9.302 -11.051) 16.486 5.925 ( -0.270 6.552 3.295) 7.339 5.946 ( 6.743 -6.552 -1.453) 9.514 6.132 ( -3.318 0.821 0.312) 3.433 6.461 ( 7.366 2.115 0.043) 7.663 6.735 ( 1.929 -3.643 5.692) 7.028 7.029 ( -0.350 -3.638 1.874) 4.107 7.225 ( -5.441 -4.653 1.513) 7.317 7.456 ( -6.875 1.400 1.390) 7.153 7.533 ( -1.467 -1.391 1.893) 2.769 7.673 ( -3.342 -2.753 3.448) 5.534 7.824 ( -2.226 -0.543 0.311) 2.312 7.935 ( 1.569 6.256 -4.601) 7.923 8.241 ( -0.848 -3.151 1.161) 3.463 8.345 ( 2.971 0.812 3.621) 4.754 8.656 ( 6.092 -6.800 4.374) 10.123 8.820 ( 6.653 4.199 -9.818) 12.581 9.065 ( 5.285 -4.284 -8.101) 10.578 9.280 ( 5.220 -3.995 -0.390) 6.585 9.382 ( 6.320 -10.998 0.640) 12.701 9.434 ( -2.587 3.139 -3.871) 5.615 10.302 ( -12.278 5.400 9.154) 16.239 10.417 ( -3.907 0.942 -0.106) 4.021 10.988 ( -5.671 0.706 0.284) 5.722 12.779 ( -0.609 2.624 -1.400) 3.036 12.993 ( -4.436 4.064 0.483) 6.035 13.220 ( 3.500 -4.300 -1.876) 5.853 13.400 ( 2.114 0.206 -1.526) 2.615 13.469 ( 2.902 4.055 6.021) 7.818 13.850 ( 2.766 1.836 -5.833) 6.712 14.402 ( 3.027 -0.693 0.293) 3.119 14.614 ( 5.427 -2.452 -4.547) 7.493 14.702 ( -2.256 -1.921 3.130) 4.310 14.989 ( -4.718 1.016 4.227) 6.416 15.076 ( -0.625 -4.757 -5.700) 7.451 15.149 ( 1.223 -2.426 0.424) 2.750 15.326 ( -6.026 -4.949 -4.500) 9.004 15.438 ( -6.543 -12.948 6.617) 15.945 16.428 ( 2.001 3.866 3.479) 5.572 16.922 ( -7.331 1.420 3.857) 8.404 17.054 ( 9.273 -0.798 0.746) 9.337 17.589 ( 1.393 -4.679 -7.138) 8.648 17.914 ( -2.245 -5.004 -1.271) 5.630 18.298 ( -12.305 2.810 4.268) 13.324 18.738 ( 3.071 -8.835 -4.511) 10.384 19.019 ( 5.174 -12.126 2.120) 13.354 19.700 ( -3.201 6.726 0.393) 7.459 19.728 ( -1.949 2.354 1.224) 3.292 20.006 ( -5.576 -2.944 -1.531) 6.489 20.288 ( -5.927 -5.661 2.188) 8.483 20.938 ( -2.814 0.150 -1.835) 3.363 21.104 ( -4.565 -4.004 1.119) 6.174 22.063 ( 10.641 0.326 -0.317) 10.650 22.365 ( 7.225 -4.008 -0.403) 8.272 23.421 ( 1.666 11.028 3.847) 11.797 23.861 ( 8.343 4.792 -2.178) 9.864 24.128 ( -5.775 -2.429 2.965) 6.931 24.309 ( -3.144 -5.915 -4.554) 8.100 ======================= Grid point 233 (120/138) ======================= q-point: (-0.11 0.27 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.211 ( 9.170 17.130 -16.835) 25.709 2.494 ( -11.508 26.776 13.590) 32.157 2.903 ( -4.416 28.235 7.030) 29.431 3.247 ( 2.090 7.728 -11.565) 14.066 3.306 ( -1.455 3.466 -2.402) 4.461 3.649 ( -10.423 -3.246 -2.746) 11.256 3.970 ( -6.467 4.930 2.479) 8.502 4.013 ( -9.980 16.014 14.734) 23.941 4.334 ( -9.949 12.550 -1.110) 16.054 4.480 ( -7.625 4.520 -8.547) 12.314 4.805 ( 0.712 10.123 13.668) 17.024 5.147 ( -0.778 5.086 -2.511) 5.726 5.314 ( 3.719 -3.398 -2.684) 5.708 5.425 ( -1.368 -1.069 -2.467) 3.017 5.833 ( 1.931 -4.947 0.479) 5.332 5.969 ( 2.114 3.186 -5.519) 6.714 6.036 ( 4.603 2.922 -0.128) 5.453 6.139 ( 4.718 -3.986 -0.555) 6.201 6.626 ( 8.591 1.485 -1.032) 8.780 6.829 ( 6.348 -3.787 7.381) 10.446 7.033 ( -1.379 -3.298 -1.331) 3.814 7.123 ( -3.908 -3.241 -1.948) 5.437 7.327 ( -5.098 -0.751 0.140) 5.155 7.482 ( -3.816 -2.779 -1.101) 4.847 7.658 ( 0.166 -0.501 2.819) 2.868 7.784 ( -1.196 -2.896 -1.338) 3.406 7.967 ( 3.725 8.229 -6.771) 11.288 8.176 ( -6.282 -1.850 2.463) 6.996 8.437 ( 4.660 0.338 8.869) 10.025 8.718 ( -0.945 -9.809 5.307) 11.192 8.924 ( 6.612 2.041 -9.123) 11.450 9.109 ( -0.404 -4.542 -6.530) 7.965 9.359 ( 3.531 -8.786 4.020) 10.287 9.482 ( 7.520 -2.852 -5.746) 9.885 9.522 ( 7.317 -0.782 -4.381) 8.564 9.909 ( -22.611 14.585 11.222) 29.153 10.488 ( 5.721 -4.321 0.416) 7.181 10.846 ( -8.240 -1.718 -1.271) 8.513 12.788 ( 1.873 4.255 -1.314) 4.831 12.900 ( -4.932 3.966 1.399) 6.482 13.274 ( 1.545 -3.763 1.991) 4.529 13.383 ( -1.641 1.911 -0.493) 2.567 13.598 ( 7.106 -1.246 1.338) 7.338 13.861 ( -0.267 0.413 -6.983) 7.000 14.474 ( 4.473 -1.592 -0.978) 4.848 14.648 ( -2.892 -4.208 0.251) 5.113 14.743 ( 5.594 -2.081 1.323) 6.113 14.911 ( -3.361 -0.102 4.554) 5.660 15.025 ( -2.161 -5.944 -5.735) 8.537 15.163 ( -1.634 -3.791 -0.225) 4.134 15.233 ( -1.706 -5.681 -1.729) 6.179 15.318 ( -5.883 -12.110 4.973) 14.352 16.509 ( 5.105 2.234 4.255) 7.011 16.794 ( -6.391 2.878 2.546) 7.457 17.203 ( 5.259 -5.747 2.748) 8.261 17.564 ( -2.091 -3.311 -9.396) 10.180 17.925 ( 3.747 0.482 -2.893) 4.758 18.081 ( -10.033 3.309 4.239) 11.384 18.780 ( 3.650 -2.728 -1.065) 4.679 19.088 ( -1.684 -11.985 1.952) 12.259 19.640 ( -1.261 3.507 -0.501) 3.760 19.708 ( 0.109 1.555 0.756) 1.732 19.939 ( -1.237 -1.872 0.650) 2.336 20.140 ( -8.345 -5.181 -0.509) 9.835 20.911 ( 0.677 -0.736 -0.777) 1.267 21.023 ( -3.984 -4.254 1.517) 6.022 22.274 ( 9.693 -2.424 1.211) 10.064 22.465 ( 2.858 -4.060 -1.544) 5.199 23.498 ( 5.153 11.220 5.649) 13.578 23.964 ( -4.661 4.528 -3.382) 7.326 24.042 ( 4.123 0.303 -1.084) 4.274 24.228 ( -4.301 -4.733 -2.004) 6.702 ======================= Grid point 234 (121/138) ======================= q-point: ( 0.00 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.774 ( -7.194 23.588 6.291) 25.451 2.898 ( 9.324 22.280 -6.064) 24.902 3.263 ( 3.017 -0.253 5.162) 5.985 3.364 ( -9.170 20.724 6.886) 23.686 3.393 ( -1.877 1.114 -4.954) 5.414 3.564 ( 2.614 11.154 -8.552) 14.297 4.098 ( -0.379 7.373 4.316) 8.551 4.119 ( 1.539 2.118 1.668) 3.104 4.388 ( -5.086 7.291 6.173) 10.823 4.493 ( 1.689 9.019 -4.885) 10.395 4.984 ( 1.017 -2.602 13.267) 13.558 5.209 ( 0.123 -8.991 -7.662) 11.814 5.239 ( -3.362 8.190 7.655) 11.703 5.455 ( 1.697 4.318 -8.963) 10.093 5.766 ( -6.536 2.677 8.239) 10.852 6.025 ( 8.988 -0.140 -14.259) 16.856 6.211 ( 1.389 4.257 0.221) 4.484 6.261 ( 3.322 2.749 -5.810) 7.235 6.758 ( 4.050 -0.991 5.290) 6.736 6.870 ( -1.139 -3.506 -3.104) 4.819 6.912 ( -2.813 -1.055 2.277) 3.769 7.001 ( 3.257 -6.412 -4.538) 8.504 7.269 ( 1.143 -0.194 1.039) 1.556 7.334 ( -2.220 -2.590 -4.567) 5.700 7.638 ( -1.814 -2.489 3.862) 4.940 7.718 ( 2.242 -4.120 -3.610) 5.919 8.065 ( -4.562 2.568 3.778) 6.456 8.141 ( 1.954 3.026 -3.871) 5.288 8.495 ( -3.854 -5.621 5.871) 8.995 8.565 ( 5.223 -3.643 -0.827) 6.421 8.878 ( -7.261 -4.195 4.651) 9.589 8.964 ( 2.528 -3.343 -2.769) 5.023 9.246 ( 3.018 -9.396 1.858) 10.042 9.310 ( 2.437 -10.886 -5.886) 12.613 9.760 ( -16.175 15.388 16.082) 27.515 10.097 ( 15.064 12.546 -17.290) 26.139 10.441 ( -6.615 -7.396 11.598) 15.264 10.656 ( 4.858 -5.751 -9.879) 12.421 12.892 ( -4.510 4.589 3.124) 7.153 12.953 ( 4.204 6.177 -2.748) 7.961 13.196 ( -3.500 -3.998 8.733) 10.222 13.348 ( 2.196 -3.941 -6.428) 7.854 13.699 ( 1.726 0.862 4.297) 4.710 13.810 ( -0.837 -1.252 -6.560) 6.731 14.513 ( -3.505 -0.433 0.403) 3.555 14.535 ( 3.319 -0.517 -1.627) 3.732 14.754 ( -1.260 -3.580 4.203) 5.663 14.808 ( -0.580 -5.247 0.155) 5.281 14.942 ( -0.239 -0.478 2.005) 2.075 15.008 ( 0.579 -3.049 -2.984) 4.306 15.118 ( 0.163 -5.052 2.303) 5.554 15.161 ( 0.415 -4.134 -2.024) 4.622 16.653 ( 3.522 1.524 3.497) 5.192 16.730 ( -3.060 1.323 -3.723) 4.998 17.238 ( 3.012 -0.842 9.806) 10.293 17.408 ( -3.745 -3.282 -5.274) 7.254 17.986 ( -7.979 3.645 0.572) 8.791 18.059 ( 8.016 0.996 -5.642) 9.853 18.834 ( 5.157 -4.874 1.606) 7.275 18.853 ( -4.125 -5.674 -0.087) 7.016 19.645 ( -4.774 1.395 2.768) 5.692 19.710 ( 3.717 -1.529 -3.550) 5.363 19.926 ( 2.231 -1.319 2.413) 3.542 19.966 ( -1.740 -1.648 -1.648) 2.908 20.912 ( -1.854 -1.002 0.913) 2.296 20.921 ( 1.866 -1.085 0.100) 2.160 22.333 ( 0.497 -2.448 2.818) 3.766 22.391 ( -0.144 -4.161 -3.019) 5.143 23.775 ( 1.986 6.760 9.034) 11.457 23.931 ( -2.318 3.961 -4.285) 6.279 24.083 ( -3.495 -1.909 -0.970) 4.099 24.139 ( 3.600 -1.188 -4.594) 5.956 ======================= Grid point 235 (122/138) ======================= q-point: ( 0.11 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.581 ( -11.735 32.790 -0.951) 34.839 3.059 ( 5.410 12.269 -0.168) 13.409 3.183 ( -8.311 19.748 12.882) 25.000 3.365 ( 3.745 -3.121 2.052) 5.290 3.376 ( 3.878 0.865 -5.265) 6.596 3.614 ( 2.934 16.154 -5.177) 17.215 4.070 ( 1.408 2.945 0.396) 3.288 4.223 ( 1.269 -1.049 4.718) 4.997 4.402 ( 6.138 4.231 7.137) 10.321 4.604 ( 9.754 10.676 -2.758) 14.722 5.030 ( 0.437 -0.279 7.730) 7.747 5.169 ( -0.381 -8.528 -5.143) 9.966 5.201 ( -2.122 -1.887 4.171) 5.046 5.486 ( -1.230 -1.505 4.166) 4.597 5.627 ( -6.066 10.385 -5.265) 13.129 6.127 ( -4.374 0.369 -7.290) 8.510 6.192 ( 5.089 5.282 -6.612) 9.875 6.245 ( -1.393 6.691 -8.531) 10.931 6.696 ( -8.608 2.470 -2.025) 9.181 6.818 ( -3.393 -5.509 -2.006) 6.774 6.885 ( 0.856 -3.201 3.558) 4.862 7.105 ( 6.047 -5.060 -4.528) 9.093 7.337 ( 3.035 -1.727 -2.139) 4.095 7.381 ( 7.546 -3.726 3.012) 8.939 7.616 ( -0.621 -2.658 3.036) 4.083 7.747 ( 1.621 -2.269 -4.349) 5.166 8.011 ( -1.500 4.563 2.845) 5.583 8.164 ( -0.000 -0.346 1.299) 1.344 8.428 ( -3.587 -4.480 2.926) 6.442 8.594 ( -3.454 -10.288 1.344) 10.936 8.774 ( -3.220 -0.612 5.449) 6.359 8.986 ( -1.785 -3.859 1.407) 4.479 9.292 ( 2.675 -5.834 -6.311) 9.001 9.321 ( 0.730 -6.424 -5.982) 8.808 9.504 ( -10.705 14.150 12.242) 21.557 10.243 ( -9.476 -7.737 9.627) 15.567 10.435 ( 17.597 7.780 -13.079) 23.265 10.827 ( 10.529 -3.818 -4.675) 12.136 12.825 ( -2.760 4.113 2.651) 5.619 13.026 ( 2.761 4.308 -0.985) 5.211 13.135 ( -3.042 -2.387 6.059) 7.188 13.389 ( 2.120 -2.665 -3.349) 4.777 13.687 ( -1.780 1.773 0.129) 2.516 13.803 ( 0.021 -0.775 -2.330) 2.456 14.452 ( -2.235 0.686 -0.984) 2.537 14.570 ( -0.832 -2.331 0.519) 2.529 14.710 ( -1.194 -3.156 0.367) 3.394 14.816 ( 0.406 -3.068 4.954) 5.841 14.978 ( 4.326 1.427 -1.417) 4.770 15.073 ( 2.979 -2.881 1.276) 4.336 15.160 ( 4.871 -6.763 0.280) 8.340 15.173 ( 1.130 -4.579 -1.968) 5.110 16.646 ( -2.282 2.863 -3.432) 5.018 16.764 ( 4.447 -0.960 2.490) 5.186 17.261 ( -3.943 -1.482 2.432) 4.864 17.356 ( 0.758 -1.318 1.937) 2.462 17.853 ( -5.269 2.074 1.167) 5.782 18.206 ( 7.515 -1.657 -4.437) 8.883 18.737 ( -5.874 -2.669 -2.050) 6.770 18.899 ( -0.103 -8.081 0.608) 8.104 19.608 ( 1.231 3.999 3.972) 5.769 19.791 ( 4.169 -0.255 -1.762) 4.533 19.958 ( 0.896 -0.876 -2.554) 2.844 20.026 ( 7.572 -4.044 1.659) 8.743 20.895 ( 0.082 0.490 0.862) 0.995 20.978 ( 3.727 -2.713 -0.203) 4.614 22.249 ( -7.654 -0.617 0.392) 7.688 22.375 ( -2.350 -5.083 -1.284) 5.745 23.751 ( -4.374 8.429 2.962) 9.948 23.961 ( 4.247 1.785 1.176) 4.755 24.000 ( -4.881 -0.095 0.768) 4.942 24.184 ( 2.117 -3.513 -4.945) 6.424 ======================= Grid point 236 (123/138) ======================= q-point: ( 0.22 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.347 ( -9.719 30.961 -0.952) 32.465 3.093 ( -1.903 13.138 14.087) 19.356 3.154 ( 2.568 5.346 -0.241) 5.936 3.380 ( 0.888 10.249 -10.404) 14.631 3.510 ( 5.963 -6.787 8.751) 12.577 3.690 ( 6.598 9.712 -5.488) 12.961 4.135 ( 2.594 -0.023 2.561) 3.646 4.205 ( -2.227 -1.494 5.876) 6.459 4.552 ( 4.619 -9.206 -0.894) 10.338 4.810 ( 9.926 8.330 -1.032) 12.999 5.036 ( 0.375 4.095 -0.028) 4.112 5.076 ( -6.243 -5.657 -6.294) 10.516 5.281 ( 6.004 -6.875 9.104) 12.892 5.354 ( -9.662 -6.018 3.450) 11.894 5.557 ( -0.657 13.307 -5.428) 14.386 5.961 ( -8.369 -0.586 -7.674) 11.370 6.164 ( -2.857 8.773 -5.878) 10.940 6.330 ( 6.069 10.292 -5.493) 13.150 6.561 ( -3.374 4.596 -2.419) 6.193 6.714 ( -5.158 -6.777 -3.024) 9.038 6.930 ( 2.928 -5.007 2.019) 6.141 7.189 ( 3.037 -5.960 -2.468) 7.130 7.410 ( 3.938 -3.198 2.482) 5.648 7.518 ( 4.274 -1.715 3.249) 5.636 7.636 ( 2.142 -4.837 1.976) 5.648 7.770 ( 1.698 -2.106 -4.947) 5.638 8.004 ( -0.463 4.568 2.153) 5.071 8.140 ( -2.196 -0.735 3.230) 3.974 8.385 ( -0.795 -1.715 0.980) 2.129 8.505 ( -4.887 -8.370 2.892) 10.114 8.702 ( -5.700 -5.120 3.315) 8.348 8.892 ( -7.485 -3.587 2.982) 8.820 9.241 ( -6.731 6.211 6.644) 11.314 9.362 ( 3.357 -1.155 -11.291) 11.836 9.477 ( 7.230 2.831 -3.748) 8.622 10.088 ( -8.165 -9.068 10.799) 16.295 10.745 ( 15.142 6.217 -9.617) 18.984 11.000 ( 7.326 -1.417 -2.201) 7.780 12.797 ( -0.611 2.821 1.689) 3.344 13.015 ( -3.244 -2.938 3.541) 5.630 13.151 ( 3.032 4.512 -0.187) 5.439 13.396 ( -0.774 -0.615 -1.846) 2.094 13.678 ( 1.012 3.601 -0.734) 3.812 13.778 ( -2.284 0.681 1.865) 3.026 14.419 ( -0.863 0.379 -2.537) 2.706 14.509 ( -4.291 -2.476 0.283) 4.962 14.737 ( 3.591 -1.124 -1.456) 4.035 14.854 ( 1.498 -2.388 5.617) 6.285 15.063 ( 3.887 0.807 -1.473) 4.234 15.129 ( 2.846 -0.703 1.633) 3.356 15.198 ( 2.174 -4.395 -0.460) 4.925 15.289 ( 6.976 -7.524 0.108) 10.261 16.605 ( -0.790 4.579 -4.815) 6.692 16.843 ( 2.178 -3.832 3.176) 5.432 17.167 ( -4.076 3.009 -0.473) 5.089 17.381 ( 0.039 -4.418 4.354) 6.203 17.796 ( -0.613 -0.962 1.136) 1.610 18.306 ( 2.310 -10.182 -2.103) 10.650 18.642 ( -2.251 0.360 -4.173) 4.755 18.855 ( -3.302 -6.661 -0.004) 7.435 19.689 ( 4.382 5.139 5.126) 8.479 19.877 ( 5.379 2.778 -0.265) 6.059 19.974 ( 1.248 -1.164 -2.774) 3.257 20.199 ( 8.654 -5.917 -0.152) 10.484 20.925 ( 2.727 1.531 1.360) 3.410 21.060 ( 4.610 -3.567 -0.982) 5.911 22.071 ( -9.874 1.481 0.003) 9.985 22.280 ( -6.778 -5.780 -1.362) 9.011 23.676 ( -3.195 9.827 0.825) 10.366 23.895 ( -5.551 2.824 0.029) 6.229 24.047 ( 3.217 -2.716 4.998) 6.535 24.206 ( 1.459 -5.446 -5.142) 7.631 ======================= Grid point 237 (124/138) ======================= q-point: ( 0.33 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.280 ( 4.174 12.909 4.143) 14.185 3.069 ( -2.743 3.480 3.509) 5.652 3.249 ( 5.988 11.087 4.856) 13.504 3.358 ( -0.470 11.926 -7.397) 14.042 3.630 ( 4.310 -5.293 1.734) 7.043 3.768 ( -4.726 -7.751 -0.485) 9.091 4.080 ( -0.834 -9.568 0.076) 9.605 4.261 ( 3.423 -2.235 2.329) 4.705 4.537 ( -1.667 -5.917 -7.555) 9.740 4.866 ( -8.032 -4.988 -0.914) 9.499 5.019 ( 4.206 9.029 2.947) 10.387 5.058 ( 1.597 6.572 -1.041) 6.842 5.241 ( -1.387 -0.041 -3.787) 4.033 5.379 ( 1.464 -4.715 4.410) 6.620 5.608 ( 5.053 0.872 2.502) 5.705 5.792 ( -5.682 5.075 -8.351) 11.303 6.074 ( -4.117 2.993 -3.389) 6.115 6.400 ( 1.473 10.785 -3.084) 11.314 6.548 ( 1.478 6.954 -1.959) 7.375 6.615 ( -4.462 -6.314 -0.034) 7.732 7.021 ( 5.451 -5.871 0.527) 8.029 7.206 ( -1.115 -8.915 1.873) 9.177 7.496 ( 3.934 -1.448 3.629) 5.544 7.568 ( 1.268 -2.282 3.624) 4.466 7.691 ( 1.990 -5.022 2.789) 6.080 7.774 ( -0.830 -3.888 -1.945) 4.426 7.997 ( 0.348 3.972 0.891) 4.086 8.124 ( -0.317 1.653 0.662) 1.808 8.399 ( 1.795 -1.843 -3.833) 4.616 8.423 ( -3.578 -6.940 3.697) 8.639 8.595 ( -4.905 -5.283 0.946) 7.271 8.738 ( -7.840 -2.377 1.502) 8.329 9.138 ( -4.876 8.696 10.944) 14.804 9.387 ( 2.030 3.365 -12.878) 13.464 9.663 ( 11.486 -0.989 -9.090) 14.681 9.959 ( -7.746 -8.446 10.606) 15.615 10.970 ( 9.295 4.914 -5.113) 11.692 11.099 ( 3.036 0.791 -0.766) 3.230 12.806 ( 1.168 0.971 0.670) 1.661 12.954 ( -3.264 -3.659 1.657) 5.175 13.213 ( 2.954 4.869 -0.270) 5.702 13.364 ( -1.736 0.881 -1.858) 2.692 13.706 ( 0.348 4.772 4.704) 6.710 13.739 ( -1.029 3.852 0.773) 4.061 14.397 ( -1.371 -0.465 -1.380) 2.000 14.439 ( -1.676 -1.246 -3.568) 4.134 14.820 ( 4.540 -1.028 -1.035) 4.769 14.885 ( 0.590 -1.759 4.358) 4.737 15.115 ( 1.659 -0.081 -0.813) 1.850 15.167 ( 0.967 -0.325 -2.398) 2.606 15.277 ( 4.888 -2.842 4.729) 7.371 15.409 ( 4.835 -6.417 -0.143) 8.036 16.599 ( 1.468 5.179 -4.679) 7.132 16.830 ( -4.229 -2.362 1.531) 5.080 17.140 ( 1.287 2.990 2.631) 4.186 17.369 ( -1.892 -5.336 1.976) 5.997 17.832 ( 3.757 -5.306 1.053) 6.586 18.262 ( -5.449 -16.798 -2.206) 17.797 18.651 ( 3.487 1.239 -4.547) 5.862 18.794 ( -2.872 -4.674 0.765) 5.539 19.769 ( 2.558 5.170 5.031) 7.654 19.962 ( 1.327 5.117 -4.193) 6.748 20.034 ( 6.528 -1.527 3.544) 7.584 20.333 ( 4.730 -5.621 -2.696) 7.825 21.006 ( 4.872 1.696 1.515) 5.376 21.146 ( 3.968 -2.890 -1.238) 5.062 21.889 ( -7.733 1.744 0.542) 7.946 22.118 ( -8.788 -6.155 -1.831) 10.885 23.634 ( -1.433 9.787 1.890) 10.070 23.791 ( -4.553 5.297 -1.570) 7.159 24.103 ( 1.180 -5.642 6.163) 8.438 24.222 ( 1.451 -6.947 -5.457) 8.952 ======================= Grid point 238 (125/138) ======================= q-point: ( 0.44 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.542 ( 19.824 -9.128 9.089) 23.641 3.001 ( -5.972 2.237 5.214) 8.237 3.278 ( -2.135 11.800 -10.014) 15.623 3.389 ( -15.827 -13.459 -12.154) 24.069 3.465 ( 3.871 2.310 5.076) 6.789 3.689 ( 0.561 -1.151 -4.791) 4.959 4.243 ( 11.655 -11.212 1.393) 16.233 4.309 ( 1.073 -3.919 6.106) 7.334 4.540 ( 2.974 5.035 -7.518) 9.524 4.638 ( -12.801 -2.190 -0.861) 13.015 5.094 ( 1.640 8.699 2.376) 9.165 5.123 ( 5.282 1.408 2.555) 6.034 5.219 ( -0.704 -0.307 -3.726) 3.805 5.349 ( -5.955 -4.446 -1.189) 7.527 5.635 ( 1.928 1.683 -2.176) 3.359 5.747 ( -2.817 9.191 -3.268) 10.153 6.085 ( 6.746 -3.362 2.814) 8.045 6.349 ( -6.216 1.080 -3.646) 7.287 6.544 ( -2.061 2.091 2.860) 4.098 6.576 ( 0.220 6.764 -0.218) 6.771 7.120 ( 3.571 -6.388 2.520) 7.740 7.163 ( -3.424 -9.325 4.334) 10.838 7.551 ( 0.345 -3.164 5.373) 6.245 7.594 ( -1.827 -6.039 6.641) 9.160 7.732 ( 4.105 -1.262 -1.454) 4.534 7.757 ( -0.239 -2.043 0.516) 2.121 8.040 ( 3.431 3.999 -1.806) 5.569 8.088 ( -2.841 1.422 -1.526) 3.524 8.372 ( -4.872 -6.383 7.439) 10.946 8.433 ( 3.576 -6.721 -6.806) 10.212 8.544 ( 0.964 -0.277 -0.762) 1.259 8.617 ( -4.137 0.066 -2.487) 4.828 9.111 ( -0.485 6.549 10.661) 12.521 9.385 ( 0.878 6.789 -13.468) 15.108 9.823 ( -7.700 -6.459 8.801) 13.359 9.863 ( 10.128 -2.991 -10.046) 14.575 11.081 ( 1.472 3.981 1.273) 4.431 11.124 ( 0.820 2.409 -2.040) 3.261 12.845 ( 2.743 -1.009 -0.332) 2.941 12.898 ( -2.525 -2.704 -0.341) 3.716 13.261 ( 1.746 3.506 0.736) 3.986 13.324 ( -1.822 1.944 -1.851) 3.244 13.685 ( -2.724 6.259 9.179) 11.439 13.767 ( 2.495 6.049 -1.871) 6.806 14.359 ( -1.786 -0.136 0.511) 1.862 14.429 ( 1.299 -1.600 -6.987) 7.284 14.872 ( -0.782 -2.405 5.497) 6.051 14.920 ( 3.423 -0.397 -3.131) 4.656 15.124 ( -0.611 0.286 0.749) 1.008 15.167 ( -0.292 -0.657 -2.429) 2.533 15.377 ( 3.357 -2.466 5.359) 6.787 15.470 ( 1.300 -5.266 -1.109) 5.536 16.645 ( 4.102 4.384 -3.460) 6.929 16.718 ( -6.282 2.204 0.408) 6.670 17.193 ( 1.552 -0.314 6.708) 6.892 17.330 ( -1.148 -4.202 -2.380) 4.964 17.930 ( 4.903 -10.196 2.836) 11.663 18.135 ( -5.184 -14.937 -5.539) 16.754 18.716 ( 2.144 -2.358 -1.361) 3.465 18.740 ( -1.825 -4.164 -0.448) 4.568 19.819 ( 1.419 5.498 5.519) 7.918 19.952 ( -0.852 4.043 -4.361) 6.007 20.175 ( 5.613 -0.219 5.357) 7.762 20.365 ( -0.623 -3.901 -4.867) 6.269 21.105 ( 4.053 1.478 1.527) 4.577 21.184 ( -0.239 -0.394 -1.570) 1.637 21.810 ( 0.066 -1.094 2.009) 2.289 21.950 ( -6.868 -5.836 -2.886) 9.463 23.619 ( -1.294 8.837 5.065) 10.268 23.725 ( -0.810 7.550 -4.965) 9.072 24.123 ( -0.513 -7.201 6.524) 9.731 24.238 ( 1.411 -7.769 -5.692) 9.734 ======================= Grid point 239 (126/138) ======================= q-point: (-0.44 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.746 ( -17.971 -11.585 -8.498) 23.008 3.010 ( 20.913 -16.517 9.695) 28.358 3.113 ( -3.998 8.866 4.492) 10.713 3.244 ( -0.155 8.105 -5.809) 9.972 3.637 ( 4.729 -0.779 -6.785) 8.307 3.693 ( 7.144 2.931 -7.682) 10.892 4.227 ( -10.793 -8.989 3.138) 14.392 4.366 ( -4.720 -5.475 1.565) 7.396 4.491 ( 1.426 6.468 -3.081) 7.305 4.666 ( 12.428 -2.865 -4.231) 13.437 5.109 ( -1.445 6.145 5.165) 8.156 5.153 ( -2.384 6.420 -2.827) 7.409 5.175 ( -6.383 -1.233 -1.011) 6.580 5.328 ( 9.326 -7.048 0.249) 11.692 5.631 ( -4.708 4.562 -0.968) 6.627 5.726 ( 3.762 6.937 -2.215) 8.197 6.136 ( -8.178 -2.647 0.274) 8.600 6.289 ( 5.897 -0.431 -0.226) 5.917 6.508 ( -2.861 6.783 5.174) 8.998 6.567 ( -1.032 1.997 2.074) 3.059 7.064 ( -6.113 -7.299 6.705) 11.645 7.198 ( 1.869 -8.474 1.649) 8.833 7.511 ( -4.563 -3.992 6.637) 8.989 7.584 ( -0.357 -6.044 8.497) 10.434 7.738 ( -1.584 -0.832 -4.456) 4.802 7.815 ( 2.186 -1.201 -0.488) 2.542 8.036 ( 0.081 2.866 -2.778) 3.992 8.121 ( 3.143 1.986 -2.343) 4.394 8.297 ( -0.947 -6.849 3.042) 7.554 8.496 ( 1.108 2.332 3.518) 4.363 8.531 ( -0.724 -1.808 -3.639) 4.128 8.645 ( 7.492 -6.090 -6.911) 11.874 9.151 ( 1.738 2.911 8.375) 9.035 9.366 ( -0.006 7.934 -11.390) 13.881 9.685 ( -7.277 -2.052 4.771) 8.940 10.028 ( 8.625 -5.110 -10.042) 14.190 11.021 ( -6.924 4.937 4.591) 9.664 11.137 ( -0.377 1.722 -1.153) 2.106 12.854 ( -1.551 -0.898 -1.235) 2.177 12.913 ( 4.269 -2.813 -1.660) 5.375 13.260 ( -2.453 3.146 1.083) 4.134 13.308 ( 0.861 1.614 -0.550) 1.910 13.654 ( -2.462 8.423 8.363) 12.122 13.811 ( 2.346 4.686 -2.221) 5.692 14.341 ( -0.094 0.400 0.586) 0.715 14.449 ( 2.268 -2.383 -7.277) 7.986 14.836 ( -3.644 -0.552 4.571) 5.872 14.973 ( 2.304 -2.912 -3.819) 5.327 15.104 ( -1.730 0.343 3.445) 3.870 15.145 ( -1.434 -1.165 -1.213) 2.210 15.414 ( -1.129 -3.648 4.105) 5.606 15.457 ( -1.946 -3.739 -2.084) 4.702 16.603 ( -4.904 5.193 0.681) 7.175 16.744 ( 6.114 2.028 -2.349) 6.857 17.178 ( -4.219 -0.117 6.813) 8.015 17.357 ( 4.019 -4.317 -3.474) 6.845 17.942 ( -4.492 -10.538 2.041) 11.636 18.135 ( 6.751 -14.821 -5.857) 17.307 18.656 ( -4.716 -0.952 2.701) 5.518 18.781 ( 2.669 -5.901 -2.747) 7.035 19.850 ( 0.411 5.730 6.035) 8.332 19.912 ( -2.202 4.415 -3.984) 6.341 20.255 ( -0.174 -1.800 4.120) 4.499 20.294 ( -3.915 -2.160 -4.590) 6.408 21.101 ( -4.269 1.483 1.762) 4.851 21.186 ( 0.357 -0.592 -1.630) 1.770 21.830 ( -0.103 -2.243 0.881) 2.412 21.930 ( 6.965 -5.016 -1.726) 8.756 23.599 ( -1.623 8.710 5.263) 10.305 23.746 ( 3.733 7.944 -5.217) 10.211 24.117 ( -1.491 -7.425 6.332) 9.872 24.248 ( 0.820 -7.669 -5.812) 9.657 ======================= Grid point 240 (127/138) ======================= q-point: (-0.33 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.452 ( -7.049 1.590 -12.044) 14.045 3.095 ( -0.896 19.617 9.279) 21.720 3.198 ( 1.829 6.121 -5.973) 8.746 3.328 ( 2.795 -2.172 7.712) 8.486 3.648 ( 0.849 2.075 -9.949) 10.199 3.920 ( -0.903 -13.921 -10.078) 17.210 4.019 ( 5.892 -10.080 8.493) 14.438 4.256 ( -5.995 -0.705 0.221) 6.040 4.523 ( 2.174 6.281 -4.521) 8.039 4.876 ( 5.261 -1.782 -1.675) 5.802 5.040 ( -5.262 8.972 2.307) 10.654 5.074 ( -3.946 4.605 -2.442) 6.538 5.137 ( 3.409 -2.144 4.369) 5.942 5.481 ( 2.838 -2.520 -6.467) 7.498 5.632 ( 7.396 -2.055 3.881) 8.601 5.706 ( -5.182 5.721 -3.426) 8.445 6.040 ( 0.061 1.862 0.760) 2.012 6.335 ( -2.467 10.155 1.300) 10.531 6.471 ( -1.646 6.004 5.192) 8.107 6.570 ( 1.172 -8.034 5.127) 9.602 6.969 ( -4.199 -6.357 5.026) 9.127 7.187 ( -3.311 -8.632 2.911) 9.693 7.468 ( -0.873 -2.981 4.666) 5.606 7.577 ( -2.659 -3.367 8.552) 9.568 7.673 ( -3.678 -2.101 -4.363) 6.081 7.817 ( -1.057 -2.419 -2.282) 3.489 8.047 ( 1.414 5.215 -2.752) 6.064 8.161 ( 2.548 -1.044 -2.913) 4.009 8.368 ( 4.301 -0.325 -2.065) 4.782 8.461 ( -0.510 0.279 3.869) 3.913 8.607 ( 6.123 -5.570 -0.703) 8.307 8.795 ( 8.539 -8.732 -5.273) 13.303 9.193 ( 0.349 -1.050 6.516) 6.609 9.323 ( -3.108 3.364 -2.661) 5.296 9.587 ( -1.446 6.639 -5.893) 8.994 10.156 ( 6.483 -6.608 -8.294) 12.429 10.841 ( -12.598 7.151 6.379) 15.828 11.090 ( -4.345 -0.346 0.285) 4.368 12.832 ( -0.243 1.384 -1.759) 2.251 13.002 ( 4.958 -3.887 -2.650) 6.835 13.199 ( -3.692 3.785 0.971) 5.376 13.332 ( 1.436 -0.033 1.202) 1.873 13.622 ( -2.612 8.336 6.755) 11.042 13.846 ( 1.770 1.976 -3.192) 4.150 14.358 ( 1.697 0.769 0.087) 1.865 14.488 ( 3.334 -2.861 -6.084) 7.504 14.761 ( -4.636 0.351 3.561) 5.856 14.987 ( 0.014 -5.670 -4.353) 7.148 15.071 ( -2.740 0.391 4.596) 5.365 15.113 ( -1.365 -1.838 0.987) 2.493 15.347 ( -5.372 -4.249 0.015) 6.850 15.393 ( -4.590 -3.352 0.102) 5.684 16.536 ( -2.042 6.677 1.413) 7.124 16.858 ( 5.190 -2.378 -1.738) 5.967 17.101 ( -4.229 3.314 5.577) 7.744 17.432 ( 3.829 -5.870 -2.849) 7.565 17.862 ( -2.621 -5.489 -1.653) 6.303 18.266 ( 5.828 -17.206 -2.657) 18.359 18.574 ( -3.257 2.581 2.533) 4.867 18.817 ( 1.552 -6.348 -1.418) 6.687 19.848 ( -3.035 4.417 -0.922) 5.438 19.864 ( -0.772 5.876 3.660) 6.966 20.120 ( -8.752 -1.151 -4.797) 10.046 20.268 ( -2.671 -4.284 3.482) 6.133 21.016 ( -4.141 0.918 0.746) 4.307 21.136 ( -4.684 -2.724 -0.466) 5.438 21.900 ( 6.985 0.579 -0.298) 7.015 22.100 ( 9.334 -5.542 -0.347) 10.861 23.592 ( 0.007 9.454 4.412) 10.433 23.833 ( 5.845 6.386 -4.181) 9.614 24.096 ( -1.983 -6.414 5.840) 8.898 24.241 ( -0.337 -6.560 -6.049) 8.929 ======================= Grid point 241 (128/138) ======================= q-point: (-0.22 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.434 ( 6.903 18.210 -8.918) 21.419 3.073 ( -3.983 18.535 8.002) 20.578 3.219 ( 0.422 7.508 3.083) 8.127 3.344 ( 0.789 7.678 -3.990) 8.689 3.607 ( -2.429 12.790 -3.222) 13.411 3.705 ( -9.865 -11.298 -7.976) 16.988 4.139 ( -5.057 0.044 0.423) 5.075 4.276 ( 5.261 -11.206 4.277) 13.098 4.543 ( 0.267 2.514 -4.279) 4.970 4.791 ( -10.855 7.794 2.555) 13.606 4.953 ( -3.549 3.829 6.290) 8.174 5.052 ( 2.504 4.811 -0.658) 5.463 5.312 ( 8.546 -2.512 4.953) 10.192 5.486 ( 0.880 -0.414 -10.392) 10.437 5.593 ( 0.327 1.419 -9.864) 9.971 5.852 ( 10.161 -2.196 3.209) 10.880 6.062 ( 0.505 7.092 4.996) 8.690 6.232 ( -7.012 8.399 1.916) 11.107 6.507 ( 5.084 2.529 2.265) 6.114 6.630 ( 3.491 -7.225 5.668) 9.824 6.936 ( 0.040 -5.498 1.463) 5.689 7.112 ( -4.511 -6.751 4.205) 9.144 7.449 ( -3.708 -2.118 0.918) 4.368 7.531 ( -2.722 1.751 0.241) 3.246 7.596 ( -2.698 -5.316 3.782) 7.059 7.773 ( -2.354 -3.713 -3.856) 5.848 8.082 ( 2.776 7.586 -6.249) 10.213 8.194 ( 0.226 -1.262 -0.909) 1.572 8.385 ( 0.921 3.002 1.348) 3.418 8.528 ( 2.976 -6.085 2.977) 7.400 8.752 ( 8.014 -6.699 -2.434) 10.725 8.945 ( 7.182 -8.879 -2.116) 11.615 9.195 ( -0.705 -6.353 6.064) 8.811 9.237 ( -4.745 -2.086 1.380) 5.364 9.620 ( 6.546 13.248 -12.558) 19.392 10.251 ( 4.776 -6.712 -4.507) 9.391 10.559 ( -17.038 9.686 7.060) 20.831 10.967 ( -8.198 -2.841 0.611) 8.698 12.839 ( 1.432 3.622 -2.136) 4.442 13.063 ( -0.608 1.278 -0.813) 1.632 13.145 ( 0.195 -1.254 0.595) 1.401 13.367 ( 1.488 -2.613 0.354) 3.028 13.589 ( -1.478 6.862 5.668) 9.022 13.863 ( 0.690 -0.650 -4.038) 4.148 14.403 ( 2.833 0.938 -1.066) 3.169 14.556 ( 4.503 -3.371 -4.015) 6.911 14.683 ( -3.679 -0.168 3.268) 4.923 14.955 ( -2.398 -7.194 -2.897) 8.118 15.012 ( -3.900 1.036 2.409) 4.699 15.101 ( -0.531 -2.577 2.596) 3.696 15.238 ( -4.746 -3.774 -1.376) 6.218 15.273 ( -7.434 -4.548 0.811) 8.753 16.530 ( 0.901 6.396 2.307) 6.858 16.895 ( -1.745 -4.546 -2.190) 5.339 17.078 ( 1.266 4.280 6.823) 8.153 17.482 ( 1.669 -6.523 -3.660) 7.664 17.849 ( 2.072 -0.997 -3.650) 4.314 18.282 ( -4.206 -7.285 0.205) 8.415 18.593 ( 4.782 -2.368 0.106) 5.337 18.846 ( 1.859 -6.549 0.662) 6.839 19.777 ( -3.621 3.238 -2.625) 5.522 19.840 ( -3.524 6.814 3.266) 8.337 19.953 ( -5.814 -2.658 -1.351) 6.534 20.182 ( -6.317 -5.497 1.401) 8.490 20.946 ( -2.901 0.628 -0.419) 2.997 21.037 ( -4.753 -2.940 0.993) 5.676 22.068 ( 9.216 0.675 0.307) 9.246 22.270 ( 7.477 -5.424 -0.485) 9.250 23.622 ( 1.977 9.753 4.702) 11.006 23.947 ( 6.397 3.924 -3.846) 8.433 24.064 ( -2.560 -4.025 4.499) 6.558 24.206 ( -1.736 -4.742 -5.959) 7.811 ======================= Grid point 242 (129/138) ======================= q-point: (-0.11 0.36 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.629 ( 12.846 24.448 -5.201) 28.103 2.966 ( -8.168 19.893 7.380) 22.736 3.225 ( -0.077 3.724 4.711) 6.006 3.375 ( 2.760 13.264 -0.760) 13.569 3.517 ( -7.393 -5.642 -7.908) 12.208 3.580 ( -0.161 16.333 -5.212) 17.145 4.064 ( -1.907 3.060 0.614) 3.658 4.227 ( -7.581 3.265 5.071) 9.687 4.504 ( -4.107 2.518 0.677) 4.865 4.570 ( -9.592 9.469 -2.400) 13.690 4.943 ( 0.040 -0.599 11.313) 11.329 5.141 ( 5.232 -2.700 1.961) 6.206 5.319 ( -3.981 4.776 -2.257) 6.614 5.496 ( -1.883 8.054 -7.578) 11.217 5.712 ( 10.866 -6.941 -4.302) 13.592 5.994 ( -0.790 -1.156 0.110) 1.405 6.098 ( 5.224 4.267 2.953) 7.364 6.175 ( 4.094 6.883 -1.623) 8.172 6.646 ( 6.722 0.001 1.528) 6.894 6.744 ( 7.246 -4.804 5.117) 10.088 6.953 ( 0.858 -4.361 -2.195) 4.957 7.034 ( -4.233 -5.359 2.659) 7.328 7.336 ( -6.034 1.046 -2.552) 6.634 7.435 ( -6.088 -1.856 -1.351) 6.506 7.619 ( 2.594 -3.269 3.237) 5.281 7.720 ( -1.939 -3.965 -2.725) 5.187 8.114 ( 1.989 6.675 -7.782) 10.444 8.153 ( -4.097 -0.129 2.909) 5.026 8.452 ( 5.024 1.293 1.124) 5.308 8.547 ( -1.987 -7.561 6.218) 9.989 8.869 ( 4.724 -4.252 -4.198) 7.617 9.021 ( -2.019 -5.711 -0.118) 6.059 9.176 ( 0.917 -7.872 5.519) 9.658 9.246 ( 4.276 -11.219 -1.856) 12.149 9.769 ( 10.443 13.843 -9.304) 19.679 10.181 ( -16.938 12.724 6.315) 22.106 10.385 ( 4.810 -5.895 -0.579) 7.630 10.778 ( -10.321 -5.282 -1.205) 11.657 12.880 ( 3.180 5.133 -2.372) 6.488 12.988 ( -5.171 5.221 2.132) 7.651 13.193 ( 2.152 -4.511 2.774) 5.716 13.362 ( -1.600 -3.993 -2.667) 5.061 13.622 ( 3.515 3.428 4.427) 6.611 13.850 ( -1.076 -1.749 -4.794) 5.215 14.463 ( 3.643 0.714 -1.865) 4.154 14.583 ( -2.447 -2.022 -0.411) 3.201 14.688 ( 4.256 -3.318 1.727) 5.666 14.881 ( -4.608 -5.415 0.651) 7.140 14.946 ( -2.057 0.094 -0.404) 2.098 15.088 ( -3.238 -3.116 1.490) 4.734 15.132 ( -4.402 -4.806 0.632) 6.548 15.174 ( -1.604 -4.154 -0.972) 4.558 16.576 ( 3.002 4.415 2.921) 6.085 16.818 ( -4.502 -1.101 -2.459) 5.246 17.150 ( 3.448 0.902 8.306) 9.038 17.474 ( -1.496 -5.712 -4.619) 7.496 17.925 ( 6.279 0.992 -5.196) 8.210 18.151 ( -8.191 1.600 0.396) 8.355 18.709 ( 6.335 -3.863 0.392) 7.430 18.886 ( 0.955 -8.152 1.813) 8.405 19.698 ( -2.542 2.148 -4.875) 5.903 19.749 ( -5.118 2.144 2.754) 6.195 19.906 ( -0.485 -0.995 2.446) 2.685 20.050 ( -6.267 -4.249 -0.700) 7.604 20.908 ( -0.643 0.244 -0.345) 0.770 20.961 ( -3.271 -2.303 1.352) 4.222 22.238 ( 7.274 -1.087 1.362) 7.479 22.376 ( 3.190 -4.852 -1.271) 5.944 23.691 ( 3.613 8.865 6.257) 11.436 24.008 ( -3.768 -0.509 1.231) 3.997 24.058 ( 5.428 1.638 -4.606) 7.305 24.150 ( -2.664 -3.130 -3.902) 5.668 ======================= Grid point 243 (130/138) ======================= q-point: ( 0.00 0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.089 ( -0.084 8.851 4.615) 9.982 3.154 ( 1.178 1.946 -1.549) 2.752 3.291 ( -2.360 5.424 2.694) 6.500 3.364 ( 0.257 -1.378 -4.527) 4.740 3.775 ( 4.723 18.031 5.657) 19.479 3.846 ( -5.001 16.852 -0.457) 17.584 4.062 ( 2.623 -9.142 3.562) 10.156 4.095 ( -1.675 -6.963 1.201) 7.262 4.537 ( -4.756 7.515 3.452) 9.539 4.626 ( 1.378 1.573 -4.739) 5.180 4.873 ( 0.648 -1.716 5.590) 5.883 4.999 ( -0.473 -11.000 -6.279) 12.675 5.423 ( -8.224 7.950 8.140) 14.039 5.506 ( -5.077 -0.449 4.387) 6.725 5.870 ( 4.294 6.939 -6.253) 10.280 5.986 ( 11.790 -4.318 -13.153) 18.184 6.290 ( 2.734 3.238 -1.493) 4.493 6.304 ( -0.260 1.628 -3.411) 3.789 6.746 ( 3.286 -0.602 4.032) 5.236 6.780 ( 2.459 -4.629 1.798) 5.541 6.892 ( -2.738 -0.347 0.052) 2.761 6.913 ( 1.890 -2.220 -2.289) 3.707 7.289 ( -2.190 1.511 -1.747) 3.183 7.308 ( -1.885 -0.578 -3.448) 3.972 7.594 ( -0.207 -0.923 1.489) 1.764 7.629 ( 2.556 -4.162 -1.901) 5.241 8.128 ( -2.139 3.680 4.539) 6.222 8.175 ( -1.121 -0.257 0.551) 1.275 8.431 ( -2.344 0.164 2.183) 3.207 8.489 ( -0.770 -4.445 -2.868) 5.346 8.846 ( -3.644 0.553 6.311) 7.308 8.890 ( -1.017 -3.733 3.125) 4.973 9.127 ( 5.336 -2.450 -3.817) 7.003 9.153 ( 5.229 -4.993 -7.567) 10.466 10.034 ( -12.671 12.993 14.998) 23.544 10.249 ( -6.320 -7.200 10.167) 13.970 10.341 ( 7.712 7.525 -10.868) 15.304 10.517 ( 7.157 -8.542 -11.865) 16.278 12.985 ( -4.070 4.980 4.711) 7.973 13.055 ( 0.065 1.048 -0.156) 1.062 13.136 ( -0.006 1.051 3.179) 3.348 13.242 ( 2.946 -6.563 -5.517) 9.066 13.729 ( 0.772 2.053 2.112) 3.045 13.773 ( -0.299 -2.329 -2.204) 3.220 14.545 ( -2.167 3.283 0.361) 3.950 14.562 ( 1.219 2.618 -1.144) 3.106 14.671 ( 0.159 -4.062 1.496) 4.331 14.696 ( -0.012 -5.664 -0.650) 5.701 14.955 ( 0.832 1.501 1.623) 2.362 14.983 ( -0.801 -0.683 -0.502) 1.166 15.056 ( 0.055 -0.748 1.156) 1.378 15.090 ( 0.289 -3.253 -1.925) 3.791 16.690 ( 1.245 2.210 0.343) 2.560 16.728 ( -0.672 -1.368 -3.356) 3.686 17.261 ( 0.370 3.005 7.811) 8.377 17.334 ( -1.582 -4.129 1.138) 4.566 18.050 ( -4.064 2.594 -2.628) 5.491 18.074 ( 4.088 0.131 -4.461) 6.053 18.754 ( 2.310 -2.429 0.850) 3.458 18.762 ( -1.023 -3.117 0.183) 3.285 19.669 ( -2.228 1.197 0.657) 2.613 19.690 ( 1.211 -0.931 -1.434) 2.095 19.916 ( 0.841 0.347 1.228) 1.528 19.935 ( -0.387 -1.443 -0.691) 1.646 20.905 ( -0.581 0.031 0.926) 1.093 20.909 ( 0.498 -0.348 0.562) 0.828 22.306 ( 0.478 -0.180 0.955) 1.083 22.327 ( -0.061 -2.333 -1.140) 2.597 23.886 ( 0.643 4.738 7.500) 8.895 23.953 ( -0.851 -1.840 4.336) 4.786 24.076 ( -1.299 1.390 -6.247) 6.531 24.111 ( 1.199 -1.753 -6.261) 6.611 ======================= Grid point 244 (131/138) ======================= q-point: ( 0.11 0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.095 ( -0.964 17.504 -0.733) 17.545 3.177 ( 1.363 2.256 -0.180) 2.642 3.272 ( -0.515 -1.055 5.875) 5.991 3.372 ( 1.492 -4.195 -3.737) 5.813 3.628 ( -11.386 23.565 3.194) 26.365 3.887 ( -0.420 8.891 1.948) 9.111 4.068 ( 1.194 -5.564 -1.291) 5.835 4.101 ( -1.100 -10.939 3.075) 11.416 4.507 ( 0.306 10.046 5.967) 11.689 4.703 ( 6.118 -4.265 -0.664) 7.488 4.939 ( 4.632 -2.285 3.913) 6.480 4.999 ( 2.428 -6.407 -6.131) 9.194 5.267 ( -7.107 5.092 5.937) 10.568 5.375 ( -8.907 -6.303 8.067) 13.570 5.905 ( -0.450 13.814 -9.930) 17.019 6.091 ( -2.973 -5.026 -9.414) 11.078 6.307 ( 6.305 5.365 -5.097) 9.722 6.347 ( 4.211 2.179 -5.503) 7.263 6.710 ( -6.541 -0.690 -2.630) 7.083 6.725 ( -5.037 -3.095 -3.393) 6.816 6.879 ( 0.296 3.247 2.036) 3.844 6.988 ( 4.069 -6.794 -1.129) 8.000 7.298 ( 2.319 -1.064 0.380) 2.580 7.317 ( 3.792 -2.730 3.453) 5.809 7.613 ( 1.622 2.304 -1.679) 3.280 7.681 ( 2.794 -4.063 -3.569) 6.087 8.103 ( -1.481 4.322 4.597) 6.481 8.156 ( -1.456 -1.049 2.728) 3.265 8.385 ( -2.796 0.046 4.783) 5.541 8.441 ( -3.205 -5.524 1.979) 6.686 8.767 ( -5.588 1.634 4.485) 7.349 8.859 ( -3.689 -7.201 3.330) 8.749 9.230 ( 6.990 -0.954 -10.540) 12.683 9.242 ( 6.059 -2.106 -11.069) 12.794 9.794 ( -12.495 14.678 14.217) 23.952 10.051 ( -11.664 -11.861 12.335) 20.709 10.590 ( 15.651 7.875 -9.811) 20.080 10.729 ( 13.019 -6.329 -6.913) 16.042 12.913 ( -3.738 4.925 3.999) 7.364 13.007 ( -4.146 -4.533 4.802) 7.797 13.188 ( 4.057 6.139 -2.126) 7.659 13.307 ( 3.744 -5.639 -3.644) 7.687 13.729 ( -0.467 2.423 0.860) 2.613 13.775 ( 0.295 -2.118 -0.380) 2.172 14.488 ( -2.837 2.691 -0.681) 3.969 14.537 ( -3.497 -1.915 0.614) 4.034 14.676 ( 2.064 0.825 -0.799) 2.362 14.740 ( 2.621 -4.592 0.822) 5.351 15.018 ( 4.665 2.266 -0.241) 5.192 15.034 ( 4.346 -0.737 1.495) 4.655 15.072 ( 2.037 -1.796 1.565) 3.134 15.102 ( 1.662 -3.455 -2.536) 4.597 16.697 ( -0.158 2.473 -2.256) 3.351 16.739 ( 1.910 -1.786 -1.063) 2.822 17.260 ( -2.177 1.625 5.875) 6.472 17.311 ( -1.097 -3.059 3.433) 4.727 17.949 ( -5.073 7.574 -2.284) 9.398 18.110 ( 0.103 -7.882 -3.517) 8.632 18.719 ( -2.088 1.387 -1.478) 2.910 18.781 ( -0.181 -4.615 -0.212) 4.623 19.689 ( 3.711 4.237 1.931) 5.954 19.761 ( 5.284 -2.929 -0.274) 6.048 19.949 ( 1.994 0.187 -0.972) 2.226 19.969 ( 4.393 -1.922 0.367) 4.809 20.912 ( 1.204 1.137 0.823) 1.849 20.938 ( 2.330 -1.576 0.367) 2.836 22.252 ( -5.440 1.031 -0.333) 5.547 22.293 ( -3.641 -3.284 -0.658) 4.947 23.881 ( -2.358 5.056 5.138) 7.584 23.950 ( -0.920 -2.280 5.249) 5.796 24.039 ( -0.994 3.408 -4.493) 5.726 24.112 ( 0.282 -3.930 -5.738) 6.961 ======================= Grid point 245 (132/138) ======================= q-point: ( 0.22 0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.967 ( -11.437 29.623 -7.981) 32.741 3.211 ( -3.494 4.662 5.468) 7.990 3.264 ( 3.225 -2.581 2.817) 5.000 3.423 ( 3.002 -2.732 0.587) 4.101 3.481 ( -2.401 5.477 4.440) 7.448 3.773 ( -11.518 -10.658 -1.997) 15.819 4.044 ( -2.762 -2.740 0.447) 3.916 4.123 ( 3.332 -4.563 -0.576) 5.680 4.549 ( 1.912 11.745 5.516) 13.116 4.804 ( 1.750 -10.309 2.318) 10.710 5.049 ( 6.120 2.275 -2.068) 6.849 5.078 ( 5.768 0.020 -2.000) 6.105 5.207 ( -0.042 -0.538 5.243) 5.271 5.243 ( -4.522 -4.178 2.631) 6.695 5.803 ( -6.414 10.833 -5.197) 13.620 5.941 ( -7.850 -3.340 -6.060) 10.465 6.337 ( -3.338 9.586 -5.734) 11.658 6.493 ( 7.298 -0.454 -4.075) 8.371 6.588 ( -5.338 -0.548 -5.087) 7.394 6.640 ( 2.262 1.088 -4.304) 4.983 6.877 ( -0.681 2.229 1.757) 2.918 7.027 ( -0.003 -10.156 -0.575) 10.173 7.376 ( 4.925 0.613 4.546) 6.730 7.438 ( 5.844 -5.188 6.120) 9.926 7.627 ( 0.264 3.055 -3.885) 4.949 7.706 ( 0.483 -4.323 -4.701) 6.405 8.087 ( -1.212 3.777 3.125) 5.050 8.135 ( -0.644 -0.769 2.156) 2.378 8.357 ( -1.344 -0.812 6.389) 6.579 8.392 ( -2.511 -3.586 4.059) 5.970 8.644 ( -6.830 1.623 0.911) 7.079 8.756 ( -6.660 -8.269 0.441) 10.626 9.335 ( 4.790 2.140 -7.990) 9.558 9.353 ( 7.107 -0.326 -11.309) 13.361 9.641 ( -5.001 12.563 10.091) 16.872 9.885 ( -7.977 -11.946 11.880) 18.641 10.858 ( 12.781 5.446 -6.747) 15.445 10.949 ( 10.026 -3.816 -4.265) 11.544 12.861 ( -2.251 3.795 2.646) 5.145 12.939 ( -3.508 -4.240 3.479) 6.511 13.258 ( 3.215 5.737 -1.865) 6.836 13.353 ( 1.507 -3.822 -2.580) 4.851 13.739 ( 1.257 2.729 2.281) 3.772 13.777 ( -0.082 -1.041 2.238) 2.469 14.438 ( -1.864 1.339 -2.276) 3.232 14.467 ( -3.177 -1.789 -0.775) 3.728 14.732 ( 3.505 1.622 -0.389) 3.881 14.796 ( 2.758 -4.002 0.586) 4.895 15.068 ( 1.609 0.837 -1.254) 2.205 15.110 ( 1.206 -3.233 -1.666) 3.832 15.152 ( 6.789 1.987 2.802) 7.608 15.202 ( 7.313 -2.955 1.083) 7.961 16.691 ( 0.243 4.351 -2.982) 5.280 16.771 ( 1.107 -3.904 -0.364) 4.075 17.223 ( -2.263 3.201 4.318) 5.832 17.296 ( -1.517 -4.315 5.163) 6.898 17.857 ( -3.475 7.433 -2.121) 8.474 18.062 ( -3.748 -13.037 -3.112) 13.918 18.688 ( -0.519 3.486 -2.687) 4.432 18.760 ( -1.478 -3.972 -0.873) 4.327 19.788 ( 4.608 4.987 3.209) 7.510 19.870 ( 5.231 -3.153 1.444) 6.276 20.003 ( 4.033 3.723 -1.889) 5.805 20.090 ( 7.281 -5.196 -0.550) 8.962 20.958 ( 3.307 1.946 0.761) 3.912 21.001 ( 4.017 -2.582 -0.070) 4.776 22.109 ( -8.489 2.723 -0.732) 8.945 22.179 ( -7.488 -4.528 -0.922) 8.799 23.839 ( -2.465 6.806 3.169) 7.902 23.923 ( -2.613 -1.283 3.153) 4.291 24.023 ( -0.284 1.463 -0.323) 1.525 24.099 ( -0.179 -5.390 -5.087) 7.413 ======================= Grid point 246 (133/138) ======================= q-point: ( 0.33 0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.680 ( -13.034 26.586 -6.244) 30.261 3.108 ( -8.852 -5.838 2.039) 10.798 3.340 ( 0.471 -7.210 -6.593) 9.781 3.430 ( -8.263 -14.727 2.509) 17.072 3.472 ( 2.402 7.181 7.748) 10.834 3.596 ( 3.463 -2.279 0.377) 4.163 4.029 ( 0.625 5.670 -2.634) 6.283 4.180 ( 2.035 -6.924 0.137) 7.219 4.595 ( 2.004 8.017 1.639) 8.425 4.752 ( -5.741 -7.371 0.331) 9.348 5.143 ( 1.447 5.363 0.795) 5.611 5.170 ( 3.567 3.872 -1.194) 5.399 5.218 ( 1.341 -1.788 -2.977) 3.723 5.252 ( 1.737 -6.313 3.993) 7.669 5.704 ( -1.640 7.156 -0.783) 7.383 5.822 ( -1.066 -3.584 -3.278) 4.973 6.199 ( -7.961 10.439 -5.131) 14.095 6.413 ( -7.513 -10.186 -4.212) 13.339 6.659 ( 5.699 10.214 -0.423) 11.704 6.708 ( 2.631 8.104 -1.257) 8.613 6.898 ( 3.308 -5.264 -0.147) 6.219 7.000 ( -2.351 -11.681 2.127) 12.103 7.485 ( 3.819 0.886 5.733) 6.946 7.527 ( 0.466 -2.612 6.964) 7.452 7.631 ( 2.204 0.028 -2.356) 3.226 7.686 ( -0.731 -4.651 -2.210) 5.201 8.082 ( 1.107 4.822 -1.139) 5.077 8.155 ( 2.435 -0.860 -1.186) 2.842 8.311 ( -5.390 -1.713 3.092) 6.446 8.353 ( -3.104 -3.524 4.207) 6.305 8.550 ( -1.876 1.624 -0.530) 2.537 8.637 ( -4.163 -6.306 -1.715) 7.748 9.349 ( -3.041 9.879 8.084) 13.122 9.438 ( 3.645 0.457 -8.100) 8.894 9.667 ( 5.972 2.300 -5.587) 8.495 9.784 ( -4.557 -8.989 7.553) 12.595 11.048 ( 7.592 3.217 -3.925) 9.132 11.093 ( 5.270 -1.369 -2.251) 5.892 12.836 ( -0.747 2.157 1.143) 2.553 12.887 ( -2.327 -3.147 1.486) 4.187 13.301 ( 1.542 4.002 -1.169) 4.445 13.357 ( -0.314 -1.681 -2.058) 2.676 13.776 ( 0.704 2.628 6.866) 7.385 13.795 ( 1.760 1.060 2.575) 3.295 14.401 ( -1.460 0.651 -3.104) 3.492 14.417 ( -1.283 -0.994 -3.593) 3.943 14.803 ( 3.223 0.662 1.057) 3.455 14.847 ( 2.408 -2.935 -0.494) 3.828 15.095 ( 1.228 -0.267 -1.231) 1.759 15.125 ( 0.767 -2.962 -2.291) 3.822 15.289 ( 5.991 2.781 3.416) 7.436 15.340 ( 5.753 -2.290 1.530) 6.378 16.694 ( 0.770 4.581 -2.718) 5.382 16.772 ( -0.938 -3.530 -0.302) 3.665 17.202 ( -0.795 3.409 4.709) 5.867 17.276 ( -1.618 -4.343 4.573) 6.510 17.809 ( -0.855 3.600 -2.133) 4.271 17.970 ( -4.354 -12.569 -3.615) 13.784 18.682 ( 0.357 1.950 -2.852) 3.474 18.726 ( -1.647 -2.754 -0.873) 3.326 19.867 ( 2.790 4.931 3.702) 6.768 19.952 ( 2.440 -3.640 1.642) 4.680 20.105 ( 6.054 6.053 -0.799) 8.598 20.221 ( 5.536 -5.965 -1.768) 8.328 21.043 ( 4.922 2.204 0.579) 5.424 21.091 ( 4.848 -2.742 -0.316) 5.578 21.934 ( -8.493 3.085 -0.662) 9.060 22.010 ( -8.830 -4.865 -1.201) 10.152 23.805 ( -1.795 7.500 3.746) 8.574 23.876 ( -2.128 1.967 0.310) 2.914 24.016 ( -0.709 -1.802 2.188) 2.922 24.086 ( 0.147 -6.762 -5.018) 8.422 ======================= Grid point 247 (134/138) ======================= q-point: ( 0.44 0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.526 ( -0.059 7.896 -1.783) 8.096 2.812 ( -16.346 -19.139 -7.966) 26.400 3.290 ( 0.499 6.461 3.124) 7.194 3.404 ( 0.868 -1.873 -2.399) 3.165 3.591 ( 6.423 7.743 2.701) 10.417 3.694 ( 3.591 -0.417 -0.436) 3.641 4.048 ( 2.843 -2.629 -2.586) 4.656 4.172 ( -3.516 -10.490 -1.488) 11.163 4.631 ( 0.691 3.908 -0.603) 4.014 4.657 ( -1.812 1.243 -1.510) 2.666 5.125 ( -1.120 0.466 0.927) 1.527 5.169 ( -3.929 -2.966 0.387) 4.938 5.242 ( 1.762 3.389 -0.892) 3.923 5.279 ( 0.578 -1.064 -1.250) 1.740 5.748 ( 5.391 8.710 2.241) 10.486 5.906 ( 6.735 -3.310 2.028) 7.774 6.028 ( -6.728 7.246 -4.244) 10.760 6.235 ( -9.415 -10.181 -4.759) 14.661 6.706 ( -0.700 11.466 5.154) 12.590 6.755 ( 1.552 9.914 -0.592) 10.052 6.957 ( -2.657 -10.886 5.317) 12.403 6.971 ( 2.909 -9.151 -0.959) 9.650 7.503 ( -2.092 -1.348 5.693) 6.214 7.510 ( -3.180 -2.312 7.123) 8.136 7.702 ( 4.161 -1.052 -0.164) 4.295 7.712 ( 3.462 -2.034 -1.277) 4.213 8.129 ( 2.076 5.095 -2.600) 6.085 8.156 ( -2.545 5.333 -0.341) 5.919 8.243 ( -4.297 -6.420 3.639) 8.540 8.284 ( 2.513 -7.551 -6.690) 10.396 8.551 ( 1.175 1.240 -0.649) 1.827 8.590 ( -1.005 -2.444 -2.378) 3.555 9.299 ( -3.815 11.017 13.788) 18.057 9.454 ( -1.296 -2.478 1.254) 3.065 9.736 ( -0.259 -0.446 -3.146) 3.188 9.792 ( 7.383 -4.182 -11.776) 14.515 11.135 ( 1.321 1.735 -0.180) 2.188 11.149 ( 1.339 0.282 -1.449) 1.993 12.838 ( 0.817 0.287 -0.166) 0.882 12.856 ( -0.971 -1.602 -0.192) 1.883 13.316 ( 0.219 2.135 -0.037) 2.147 13.340 ( -0.912 -0.261 -1.264) 1.580 13.798 ( -0.129 4.764 7.858) 9.191 13.840 ( 1.554 0.892 3.481) 3.915 14.369 ( -0.768 1.179 -3.365) 3.647 14.398 ( 0.271 -1.629 -5.640) 5.877 14.848 ( 0.688 0.452 2.827) 2.944 14.887 ( 1.773 -2.724 -1.923) 3.777 15.105 ( -0.062 -0.690 -0.414) 0.807 15.126 ( -0.313 -2.557 -1.821) 3.155 15.388 ( 2.828 2.288 3.360) 4.952 15.422 ( 2.150 -1.167 0.855) 2.592 16.712 ( 1.589 2.489 -1.976) 3.553 16.738 ( -2.138 -0.171 -0.397) 2.181 17.208 ( -0.243 1.793 5.984) 6.252 17.258 ( -0.668 -3.291 2.594) 4.244 17.811 ( 1.147 -1.237 -1.581) 2.312 17.892 ( -1.995 -9.241 -5.327) 10.851 18.686 ( 0.520 -0.667 -1.957) 2.132 18.691 ( -1.697 -1.264 -0.429) 2.159 19.918 ( 1.489 4.565 3.968) 6.229 19.980 ( 0.417 -1.362 0.234) 1.443 20.204 ( 3.413 3.321 1.077) 4.883 20.283 ( 1.105 -4.425 -2.692) 5.296 21.136 ( 3.526 1.703 0.638) 3.967 21.166 ( 2.047 -1.338 -0.478) 2.492 21.808 ( -3.111 1.105 -0.134) 3.304 21.855 ( -5.565 -3.790 -1.533) 6.906 23.781 ( -1.726 7.649 5.305) 9.467 23.853 ( 0.096 3.585 -1.963) 4.088 24.005 ( -0.877 -2.978 2.859) 4.220 24.085 ( 0.934 -7.763 -5.138) 9.356 ======================= Grid point 248 (135/138) ======================= q-point: (-0.44 0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.576 ( -3.991 -2.713 -6.504) 8.099 2.681 ( 14.382 -13.106 3.701) 19.806 3.351 ( 3.930 10.566 3.454) 11.790 3.409 ( 0.785 5.444 -8.172) 9.851 3.658 ( -1.424 3.575 -1.618) 4.175 3.734 ( 2.375 -0.223 -6.164) 6.609 4.041 ( -6.148 -5.383 -0.633) 8.196 4.144 ( 3.904 -12.889 -0.196) 13.468 4.629 ( 1.102 5.657 -0.624) 5.797 4.677 ( 3.260 0.568 -3.651) 4.927 5.112 ( -0.716 -0.637 2.376) 2.562 5.150 ( 2.460 -3.784 2.229) 5.034 5.254 ( -2.450 2.666 -2.190) 4.232 5.268 ( 1.279 1.293 -0.311) 1.845 5.798 ( -5.611 10.972 -0.581) 12.337 5.905 ( 1.418 8.715 -0.795) 8.865 6.027 ( -3.782 -6.326 -1.628) 7.548 6.152 ( 8.328 -10.735 2.172) 13.759 6.673 ( -4.161 9.521 7.261) 12.676 6.733 ( -4.168 10.242 2.498) 11.337 6.903 ( -3.542 -7.574 5.058) 9.772 7.006 ( 0.412 -11.162 0.156) 11.171 7.458 ( -2.929 -0.890 7.503) 8.103 7.485 ( -1.264 -3.577 8.438) 9.252 7.740 ( 0.217 1.144 -4.228) 4.385 7.779 ( 1.821 -2.420 -2.915) 4.203 8.070 ( -1.092 2.498 -0.294) 2.742 8.148 ( -3.302 -4.624 3.409) 6.626 8.245 ( 7.024 5.928 -5.866) 10.903 8.390 ( 7.052 -7.899 -7.773) 13.135 8.560 ( -1.685 0.825 -1.025) 2.138 8.576 ( 1.445 -1.486 -0.942) 2.277 9.265 ( -2.976 7.822 13.014) 15.473 9.400 ( -4.933 -4.636 8.100) 10.557 9.744 ( 2.628 7.829 -11.286) 13.985 9.904 ( 6.661 -7.760 -12.778) 16.366 11.100 ( -4.670 3.209 2.189) 6.074 11.142 ( -2.358 -1.091 0.064) 2.599 12.849 ( 0.491 0.374 -1.200) 1.349 12.869 ( 2.466 -1.723 -1.348) 3.296 13.308 ( -1.382 1.700 0.949) 2.387 13.324 ( -0.413 0.011 0.166) 0.446 13.800 ( -1.527 6.042 6.786) 9.213 13.862 ( -0.064 -0.068 2.468) 2.470 14.361 ( 0.733 1.698 -3.073) 3.586 14.402 ( 1.492 -2.405 -5.766) 6.423 14.840 ( -2.101 1.453 2.532) 3.597 14.899 ( -0.322 -4.202 -1.831) 4.595 15.093 ( -1.158 -0.632 1.275) 1.835 15.105 ( -1.432 -1.979 -0.448) 2.484 15.403 ( -2.047 1.480 2.193) 3.345 15.427 ( -1.651 -0.701 0.019) 1.794 16.694 ( -1.858 4.022 -0.130) 4.432 16.749 ( 2.184 -1.470 -1.538) 3.049 17.202 ( -1.541 2.649 5.718) 6.488 17.273 ( 1.416 -4.369 1.980) 5.001 17.819 ( 0.185 -1.292 -2.314) 2.656 17.898 ( 3.769 -8.933 -5.843) 11.320 18.657 ( -1.677 1.004 0.685) 2.071 18.696 ( 0.737 -3.110 -0.822) 3.300 19.944 ( 0.208 3.602 3.695) 5.164 19.971 ( -1.280 1.073 -1.054) 1.975 20.230 ( -1.556 -0.279 1.717) 2.334 20.251 ( -3.371 -2.094 -2.640) 4.766 21.134 ( -3.797 1.814 0.832) 4.289 21.166 ( -2.122 -1.433 -0.401) 2.591 21.811 ( 2.934 0.437 -0.236) 2.976 21.847 ( 5.547 -3.268 -0.970) 6.511 23.764 ( -1.047 8.273 5.145) 9.798 23.869 ( 1.709 1.618 -1.416) 2.746 23.999 ( -0.176 -1.637 2.015) 2.602 24.098 ( 1.466 -7.725 -5.191) 9.421 ======================= Grid point 249 (136/138) ======================= q-point: (-0.33 0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.631 ( 9.359 16.539 -1.580) 19.069 3.024 ( 16.070 -21.390 7.214) 27.710 3.365 ( -1.677 11.250 -8.262) 14.058 3.468 ( 5.136 9.845 3.697) 11.703 3.625 ( 0.659 -4.130 -7.460) 8.553 3.667 ( -6.191 -8.918 -7.736) 13.331 3.984 ( -0.573 5.630 2.572) 6.216 4.157 ( -2.299 -9.252 1.040) 9.590 4.674 ( 3.850 7.523 -5.667) 10.175 4.794 ( 8.565 -5.378 -4.773) 11.183 5.122 ( -3.948 1.431 5.905) 7.246 5.136 ( -3.922 0.633 1.779) 4.352 5.196 ( 0.535 6.971 -3.080) 7.640 5.341 ( 5.395 -8.310 -4.125) 10.732 5.717 ( -0.296 6.819 -1.696) 7.033 5.802 ( -5.345 0.161 -1.367) 5.519 6.111 ( 6.428 7.994 3.442) 10.820 6.322 ( 6.874 -11.434 5.184) 14.313 6.568 ( -8.418 7.730 6.988) 13.396 6.623 ( -6.649 5.992 6.078) 10.819 6.859 ( -1.410 -1.915 3.295) 4.063 6.993 ( -1.550 -11.121 2.125) 11.428 7.438 ( -0.994 0.305 6.701) 6.781 7.486 ( -0.840 -4.484 8.798) 9.911 7.688 ( -3.685 2.872 -6.602) 8.088 7.758 ( -2.495 -3.775 -4.717) 6.536 8.105 ( 4.283 2.174 -3.141) 5.739 8.153 ( 2.838 -1.819 -1.702) 3.776 8.381 ( 7.164 3.987 -3.760) 9.020 8.468 ( 0.368 -2.234 -4.493) 5.031 8.542 ( 1.768 0.381 1.076) 2.104 8.627 ( 4.913 -7.615 -1.311) 9.157 9.226 ( -4.028 3.711 10.136) 11.521 9.304 ( -6.581 -3.605 8.442) 11.294 9.788 ( 4.653 11.824 -12.818) 18.049 9.999 ( 5.773 -9.731 -11.104) 15.853 10.965 ( -9.685 5.632 3.591) 11.765 11.053 ( -6.855 -3.398 1.439) 7.785 12.869 ( 1.986 2.503 -1.937) 3.737 12.928 ( 3.857 -3.548 -2.222) 5.692 13.271 ( -2.633 3.284 1.676) 4.531 13.318 ( -0.577 -1.532 1.724) 2.377 13.766 ( -3.026 6.320 4.769) 8.476 13.849 ( -1.422 -2.002 0.652) 2.541 14.385 ( 2.350 2.052 -2.467) 3.978 14.433 ( 2.889 -2.744 -4.626) 6.105 14.783 ( -3.936 2.489 1.927) 5.040 14.867 ( -2.349 -5.987 -1.242) 6.550 15.068 ( -1.758 -0.333 1.654) 2.437 15.077 ( -1.331 -1.378 1.811) 2.637 15.326 ( -5.680 1.188 0.232) 5.808 15.356 ( -5.546 -1.472 -0.214) 5.742 16.667 ( -0.842 6.631 0.018) 6.684 16.782 ( 1.244 -5.188 -1.342) 5.501 17.188 ( -0.934 5.630 5.273) 7.770 17.310 ( 1.644 -6.721 1.986) 7.199 17.835 ( 2.407 3.071 -4.350) 5.844 17.981 ( 5.345 -11.755 -4.657) 13.727 18.633 ( -0.843 3.562 1.638) 4.010 18.712 ( 0.975 -4.678 0.393) 4.794 19.923 ( -3.108 3.073 -1.293) 4.558 19.944 ( -1.045 1.618 2.328) 3.021 20.119 ( -7.871 1.593 -2.180) 8.321 20.183 ( -4.681 -4.371 1.734) 6.635 21.043 ( -4.802 1.816 0.675) 5.178 21.085 ( -5.185 -2.485 0.185) 5.753 21.930 ( 8.223 2.619 -0.257) 8.634 22.000 ( 8.976 -4.611 -0.292) 10.095 23.767 ( 0.222 8.626 4.820) 9.884 23.904 ( 1.677 -3.156 1.115) 3.743 24.013 ( 1.435 1.915 -0.626) 2.474 24.116 ( 1.405 -6.394 -5.454) 8.520 ======================= Grid point 250 (137/138) ======================= q-point: (-0.22 0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.864 ( 12.113 24.136 2.225) 27.096 3.213 ( -0.267 -5.926 4.889) 7.687 3.339 ( 2.416 4.473 -6.633) 8.357 3.494 ( -6.416 -5.596 -5.693) 10.242 3.540 ( 1.236 8.422 2.024) 8.749 3.749 ( 9.898 -6.265 -1.146) 11.770 3.986 ( -0.195 -0.358 6.093) 6.106 4.111 ( -1.499 -6.057 0.570) 6.266 4.717 ( 0.749 11.081 -10.168) 15.058 4.868 ( -3.556 -1.608 -4.479) 5.940 4.993 ( -7.416 1.373 3.897) 8.489 5.049 ( -2.428 -4.368 1.779) 5.305 5.306 ( 9.769 3.790 -3.797) 11.145 5.408 ( 4.556 -5.749 -14.089) 15.884 5.725 ( 0.288 8.194 1.245) 8.293 5.831 ( 6.045 -2.254 5.659) 8.582 6.211 ( 1.873 8.950 6.577) 11.264 6.362 ( -8.085 -1.127 7.153) 10.853 6.493 ( 5.255 -0.547 3.586) 6.385 6.549 ( -0.132 -0.938 3.756) 3.874 6.869 ( 1.368 0.524 2.347) 2.766 6.968 ( -1.635 -7.798 4.340) 9.073 7.425 ( -2.159 0.595 1.875) 2.921 7.484 ( -1.493 -5.203 3.720) 6.568 7.594 ( -3.589 4.322 -3.498) 6.618 7.688 ( -2.963 -5.024 -4.085) 7.121 8.183 ( 3.055 2.171 -5.433) 6.600 8.199 ( 1.489 1.062 -3.666) 4.097 8.439 ( -0.073 1.446 -0.674) 1.597 8.459 ( 1.000 -0.170 -0.959) 1.396 8.659 ( 9.159 -0.972 -0.494) 9.224 8.756 ( 7.590 -9.301 -0.588) 12.019 9.149 ( -5.440 0.685 7.874) 9.595 9.188 ( -6.617 -2.726 5.726) 9.165 9.873 ( 6.867 12.442 -10.667) 17.769 10.089 ( 5.877 -9.930 -7.626) 13.831 10.738 ( -14.061 8.540 4.068) 16.947 10.880 ( -10.945 -6.109 1.785) 12.661 12.917 ( 3.222 4.391 -2.395) 5.950 13.005 ( 4.248 -4.649 -2.430) 6.750 13.210 ( -4.044 5.081 2.609) 6.998 13.302 ( -1.735 -4.216 2.074) 5.008 13.717 ( -2.396 6.212 3.198) 7.386 13.818 ( -1.524 -4.022 -0.480) 4.328 14.438 ( 3.350 2.550 -2.259) 4.777 14.493 ( 4.024 -3.083 -3.219) 6.005 14.706 ( -3.926 3.177 1.698) 5.329 14.810 ( -3.106 -7.139 -0.338) 7.792 15.034 ( -2.090 1.225 1.844) 3.045 15.061 ( -0.867 -1.574 2.547) 3.117 15.200 ( -6.234 -0.191 -1.128) 6.339 15.219 ( -7.806 -1.789 -0.610) 8.031 16.660 ( 0.034 6.784 0.100) 6.785 16.786 ( -0.530 -6.291 -1.810) 6.568 17.194 ( 0.354 7.241 6.078) 9.461 17.342 ( 1.054 -7.758 1.581) 7.988 17.894 ( 4.588 5.863 -5.263) 9.117 18.069 ( 4.085 -11.700 -3.815) 12.966 18.638 ( 1.083 4.709 1.903) 5.193 18.736 ( 1.285 -5.312 1.263) 5.610 19.841 ( -4.880 3.303 -1.538) 6.090 19.900 ( -5.284 -2.846 -0.897) 6.069 19.963 ( -5.287 6.000 1.200) 8.086 20.075 ( -5.998 -5.673 0.885) 8.303 20.962 ( -3.334 1.107 0.452) 3.542 20.991 ( -4.119 -1.874 0.825) 4.600 22.099 ( 8.334 2.675 0.191) 8.755 22.170 ( 7.826 -4.636 -0.145) 9.097 23.795 ( 1.380 8.210 5.098) 9.762 23.935 ( 0.815 -5.969 3.973) 7.217 24.050 ( 2.656 3.438 -3.905) 5.841 24.124 ( 0.650 -3.989 -5.964) 7.204 ======================= Grid point 251 (138/138) ======================= q-point: (-0.11 0.45 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 6.61e-05 Number of triplets: 248 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.047 ( 4.905 15.575 3.293) 16.658 3.167 ( -2.545 1.985 1.240) 3.457 3.335 ( -2.384 4.890 0.326) 5.450 3.395 ( -2.084 -4.346 -6.798) 8.334 3.621 ( 6.558 15.838 4.049) 17.614 3.895 ( 2.936 8.417 1.207) 8.995 4.004 ( 1.073 -10.179 4.600) 11.222 4.109 ( 0.071 -7.417 2.897) 7.963 4.644 ( -4.724 9.161 -5.868) 11.861 4.707 ( -8.454 3.405 -2.494) 9.449 4.892 ( -3.628 0.475 4.580) 5.862 5.027 ( -0.912 -9.729 -3.271) 10.304 5.435 ( 4.613 6.373 -6.471) 10.187 5.558 ( 6.955 -6.170 -8.869) 12.849 5.729 ( 2.862 11.596 3.031) 12.323 5.919 ( -0.019 -6.914 5.112) 8.599 6.231 ( 0.683 7.303 2.062) 7.619 6.284 ( 1.623 2.668 0.101) 3.124 6.626 ( 6.692 -1.123 3.737) 7.746 6.653 ( 7.437 -4.072 3.758) 9.274 6.901 ( 1.033 -0.282 0.542) 1.200 6.941 ( -2.187 -3.911 3.260) 5.541 7.357 ( -3.659 1.672 -4.361) 5.934 7.403 ( -5.630 -2.301 -3.876) 7.212 7.577 ( 1.202 0.369 1.984) 2.349 7.633 ( -2.135 -4.505 -0.445) 5.005 8.169 ( -2.498 2.064 1.176) 3.447 8.199 ( -0.655 0.599 -3.313) 3.430 8.459 ( -0.720 -0.569 0.396) 1.000 8.472 ( 2.695 -0.024 -3.322) 4.278 8.823 ( 5.646 0.019 -0.244) 5.651 8.888 ( 3.882 -6.516 1.327) 7.700 9.080 ( -2.590 -2.134 5.338) 6.305 9.098 ( -0.667 -4.042 0.428) 4.119 10.011 ( 8.575 11.333 -4.770) 14.991 10.205 ( 6.691 -8.560 -1.145) 10.925 10.449 ( -14.577 10.974 1.187) 18.284 10.643 ( -12.491 -8.730 -0.496) 15.248 12.980 ( 3.377 5.179 -1.572) 6.379 13.063 ( 0.647 -1.410 -0.452) 1.616 13.141 ( -2.200 3.021 3.015) 4.802 13.255 ( -2.783 -6.498 -0.256) 7.074 13.704 ( 0.511 4.692 2.346) 5.270 13.792 ( -1.005 -4.114 -1.153) 4.390 14.502 ( 3.564 3.149 -1.930) 5.133 14.563 ( 2.658 -1.928 -1.770) 3.730 14.650 ( -1.493 1.504 1.539) 2.619 14.748 ( -3.115 -7.153 0.194) 7.804 14.984 ( -3.302 3.031 1.973) 4.897 15.050 ( -1.794 -3.378 2.505) 4.572 15.072 ( -5.218 0.504 -1.160) 5.369 15.109 ( -2.228 -2.802 -1.871) 4.039 16.668 ( 0.794 4.918 0.147) 4.984 16.759 ( -1.431 -4.344 -2.590) 5.256 17.226 ( 1.150 6.044 7.141) 9.426 17.353 ( -0.360 -6.716 1.259) 6.842 17.984 ( 5.515 5.224 -5.256) 9.238 18.103 ( -0.156 -5.877 -3.067) 6.631 18.687 ( 3.308 2.052 1.452) 4.154 18.763 ( 0.855 -5.237 1.401) 5.489 19.734 ( -4.753 1.731 -1.961) 5.425 19.761 ( -6.513 -0.850 -0.462) 6.584 19.918 ( -1.227 2.208 1.847) 3.129 19.976 ( -3.675 -3.485 -0.184) 5.068 20.916 ( -1.415 0.537 0.452) 1.579 20.930 ( -2.249 -1.012 1.059) 2.684 22.240 ( 5.537 1.416 0.636) 5.750 22.291 ( 4.161 -3.734 -0.398) 5.605 23.841 ( 1.873 6.828 6.126) 9.363 23.953 ( -0.079 -4.695 5.143) 6.964 24.089 ( 2.248 1.361 -6.117) 6.658 24.112 ( -0.478 -1.190 -6.205) 6.336 =================== 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 3/35640 10.0 2450.383 3027.080 3218.465 0.000 -51.064 0.000 3/35640 20.0 1511.270 1431.113 1473.182 0.000 -110.846 0.000 3/35640 30.0 607.387 536.802 591.497 0.000 -56.185 0.000 3/35640 40.0 279.327 246.715 279.503 0.000 -27.225 0.000 3/35640 50.0 153.787 137.303 158.734 0.000 -15.527 0.000 3/35640 60.0 97.298 87.892 102.927 0.000 -9.968 0.000 3/35640 70.0 67.957 62.026 73.142 0.000 -6.960 0.000 3/35640 80.0 50.909 46.869 55.440 0.000 -5.174 0.000 3/35640 90.0 40.116 37.193 44.030 0.000 -4.035 0.000 3/35640 100.0 32.814 30.598 36.203 0.000 -3.267 0.000 3/35640 110.0 27.613 25.868 30.567 0.000 -2.723 0.000 3/35640 120.0 23.754 22.338 26.348 0.000 -2.323 0.000 3/35640 130.0 20.796 19.617 23.092 0.000 -2.020 0.000 3/35640 140.0 18.467 17.465 20.514 0.000 -1.783 0.000 3/35640 150.0 16.592 15.725 18.430 0.000 -1.594 0.000 3/35640 160.0 15.055 14.293 16.716 0.000 -1.440 0.000 3/35640 170.0 13.774 13.097 15.284 0.000 -1.313 0.000 3/35640 180.0 12.693 12.084 14.073 0.000 -1.206 0.000 3/35640 190.0 11.769 11.216 13.036 0.000 -1.115 0.000 3/35640 200.0 10.971 10.465 12.140 0.000 -1.037 0.000 3/35640 210.0 10.275 9.809 11.359 0.000 -0.969 0.000 3/35640 220.0 9.664 9.231 10.672 0.000 -0.909 0.000 3/35640 230.0 9.123 8.719 10.064 0.000 -0.857 0.000 3/35640 240.0 8.641 8.262 9.522 0.000 -0.810 0.000 3/35640 250.0 8.208 7.852 9.036 0.000 -0.768 0.000 3/35640 260.0 7.819 7.481 8.598 0.000 -0.731 0.000 3/35640 270.0 7.465 7.145 8.202 0.000 -0.697 0.000 3/35640 280.0 7.144 6.839 7.841 0.000 -0.666 0.000 3/35640 290.0 6.849 6.559 7.512 0.000 -0.638 0.000 3/35640 300.0 6.579 6.302 7.210 0.000 -0.612 0.000 3/35640 310.0 6.331 6.064 6.932 0.000 -0.588 0.000 3/35640 320.0 6.101 5.845 6.675 0.000 -0.566 0.000 3/35640 330.0 5.888 5.642 6.437 0.000 -0.546 0.000 3/35640 340.0 5.690 5.452 6.216 0.000 -0.527 0.000 3/35640 350.0 5.505 5.276 6.010 0.000 -0.509 0.000 3/35640 360.0 5.332 5.111 5.818 0.000 -0.493 0.000 3/35640 370.0 5.170 4.956 5.638 0.000 -0.477 0.000 3/35640 380.0 5.019 4.811 5.469 0.000 -0.463 0.000 3/35640 390.0 4.876 4.674 5.311 0.000 -0.450 0.000 3/35640 400.0 4.741 4.545 5.161 0.000 -0.437 0.000 3/35640 410.0 4.614 4.424 5.020 0.000 -0.425 0.000 3/35640 420.0 4.493 4.308 4.887 0.000 -0.413 0.000 3/35640 430.0 4.380 4.199 4.761 0.000 -0.403 0.000 3/35640 440.0 4.271 4.096 4.641 0.000 -0.393 0.000 3/35640 450.0 4.169 3.997 4.528 0.000 -0.383 0.000 3/35640 460.0 4.071 3.904 4.420 0.000 -0.374 0.000 3/35640 470.0 3.978 3.814 4.317 0.000 -0.365 0.000 3/35640 480.0 3.889 3.729 4.219 0.000 -0.357 0.000 3/35640 490.0 3.804 3.648 4.126 0.000 -0.349 0.000 3/35640 500.0 3.723 3.570 4.037 0.000 -0.341 0.000 3/35640 510.0 3.645 3.496 3.951 0.000 -0.334 0.000 3/35640 520.0 3.571 3.424 3.869 0.000 -0.327 0.000 3/35640 530.0 3.499 3.356 3.791 0.000 -0.320 0.000 3/35640 540.0 3.431 3.290 3.716 0.000 -0.314 0.000 3/35640 550.0 3.365 3.227 3.644 0.000 -0.308 0.000 3/35640 560.0 3.302 3.167 3.574 0.000 -0.302 0.000 3/35640 570.0 3.241 3.108 3.508 0.000 -0.296 0.000 3/35640 580.0 3.183 3.052 3.444 0.000 -0.291 0.000 3/35640 590.0 3.126 2.998 3.382 0.000 -0.285 0.000 3/35640 600.0 3.072 2.946 3.322 0.000 -0.280 0.000 3/35640 610.0 3.019 2.896 3.265 0.000 -0.276 0.000 3/35640 620.0 2.968 2.847 3.209 0.000 -0.271 0.000 3/35640 630.0 2.919 2.800 3.156 0.000 -0.266 0.000 3/35640 640.0 2.872 2.754 3.104 0.000 -0.262 0.000 3/35640 650.0 2.826 2.710 3.054 0.000 -0.258 0.000 3/35640 660.0 2.782 2.668 3.005 0.000 -0.254 0.000 3/35640 670.0 2.739 2.627 2.958 0.000 -0.250 0.000 3/35640 680.0 2.697 2.587 2.913 0.000 -0.246 0.000 3/35640 690.0 2.657 2.548 2.869 0.000 -0.242 0.000 3/35640 700.0 2.617 2.510 2.826 0.000 -0.238 0.000 3/35640 710.0 2.579 2.474 2.785 0.000 -0.235 0.000 3/35640 720.0 2.542 2.438 2.745 0.000 -0.231 0.000 3/35640 730.0 2.507 2.404 2.706 0.000 -0.228 0.000 3/35640 740.0 2.472 2.371 2.668 0.000 -0.225 0.000 3/35640 750.0 2.438 2.338 2.631 0.000 -0.222 0.000 3/35640 760.0 2.405 2.307 2.595 0.000 -0.219 0.000 3/35640 770.0 2.373 2.276 2.560 0.000 -0.216 0.000 3/35640 780.0 2.342 2.246 2.526 0.000 -0.213 0.000 3/35640 790.0 2.311 2.217 2.493 0.000 -0.210 0.000 3/35640 800.0 2.282 2.188 2.461 0.000 -0.207 0.000 3/35640 810.0 2.253 2.161 2.430 0.000 -0.205 0.000 3/35640 820.0 2.225 2.134 2.399 0.000 -0.202 0.000 3/35640 830.0 2.197 2.107 2.369 0.000 -0.200 0.000 3/35640 840.0 2.171 2.082 2.340 0.000 -0.197 0.000 3/35640 850.0 2.144 2.057 2.312 0.000 -0.195 0.000 3/35640 860.0 2.119 2.032 2.284 0.000 -0.193 0.000 3/35640 870.0 2.094 2.009 2.257 0.000 -0.190 0.000 3/35640 880.0 2.070 1.985 2.231 0.000 -0.188 0.000 3/35640 890.0 2.046 1.963 2.205 0.000 -0.186 0.000 3/35640 900.0 2.023 1.940 2.180 0.000 -0.184 0.000 3/35640 910.0 2.000 1.919 2.156 0.000 -0.182 0.000 3/35640 920.0 1.978 1.897 2.132 0.000 -0.180 0.000 3/35640 930.0 1.957 1.877 2.108 0.000 -0.178 0.000 3/35640 940.0 1.935 1.856 2.085 0.000 -0.176 0.000 3/35640 950.0 1.915 1.836 2.063 0.000 -0.174 0.000 3/35640 960.0 1.894 1.817 2.041 0.000 -0.172 0.000 3/35640 970.0 1.875 1.798 2.019 0.000 -0.170 0.000 3/35640 980.0 1.855 1.779 1.998 0.000 -0.168 0.000 3/35640 990.0 1.836 1.761 1.978 0.000 -0.167 0.000 3/35640 1000.0 1.817 1.743 1.958 0.000 -0.165 0.000 3/35640 Thermal conductivity related properties were written into "kappa-m9115.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 08:35:10]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|