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{
"id": "jvasp-10794",
"created_at": "2022-09-04T14:38:06.345668Z",
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"structure_string": "K2 Sm2 Ge2 Se8\n1.0\n0.000000 6.837302 -0.002813\n7.038197 0.000000 0.000000\n0.000000 -2.751662 -8.439439\nK Sm Ge Se\n2 2 2 8\ndirect\n0.750553 0.707235 0.060823 K\n0.249447 0.207235 0.939177 K\n0.269192 0.204455 0.446576 Sm\n0.730808 0.704455 0.553424 Sm\n0.718987 0.237092 0.319629 Ge\n0.281013 0.737092 0.680371 Ge\n0.538307 0.980164 0.730009 Se\n0.461693 0.480164 0.269991 Se\n0.492365 0.460346 0.714887 Se\n0.921323 0.242691 0.148483 Se\n0.078677 0.742691 0.851516 Se\n0.066903 0.803908 0.417624 Se\n0.933097 0.303908 0.582376 Se\n0.507635 0.960346 0.285113 Se\n",
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{
"id": "jvasp-115286",
"created_at": "2022-09-04T14:38:45.647924Z",
"updated_at": "2022-09-04T14:38:45.647962Z",
"structure_string": "Te1 Pb1 O1\n1.0\n3.242298 -0.000000 0.000000\n-0.000000 3.242298 -0.000000\n0.000000 -0.000000 7.644584\nTe Pb O\n1 1 1\ndirect\n0.000000 0.000000 0.737959 Te\n0.000000 0.000000 0.277832 Pb\n0.000000 0.000000 -0.012298 O\n",
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"spacegroup": 99
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{
"id": "jvasp-86105",
"created_at": "2022-09-04T14:36:01.918005Z",
"updated_at": "2022-09-04T14:36:01.918029Z",
"structure_string": "Bi2 Te3\n1.0\n4.274650 -0.112894 8.783287\n1.934361 3.813611 8.783287\n-0.189412 -0.112894 9.766417\nBi Te\n2 3\ndirect\n0.193894 0.193895 0.193894 Bi\n0.596099 0.596101 0.596099 Bi\n0.995155 0.995158 0.995156 Te\n0.395007 0.395008 0.395007 Te\n0.794842 0.794844 0.794843 Te\n",
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"formula_full": "Bi2 Te3",
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{
"id": "jvasp-86705",
"created_at": "2022-09-04T14:35:48.698682Z",
"updated_at": "2022-09-04T14:35:48.698716Z",
"structure_string": "Bi2 Te3\n1.0\n4.274650 -0.112894 8.783287\n1.934361 3.813611 8.783287\n-0.189412 -0.112894 9.766417\nBi Te\n2 3\ndirect\n0.193894 0.193895 0.193894 Bi\n0.596099 0.596101 0.596099 Bi\n0.995155 0.995158 0.995156 Te\n0.395007 0.395008 0.395007 Te\n0.794842 0.794844 0.794843 Te\n",
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{
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"created_at": "2022-09-04T14:38:16.910576Z",
"updated_at": "2022-09-04T14:38:16.910587Z",
"structure_string": "In2 Ga2 O6\n1.0\n1.678044 -2.906458 0.000000\n1.678044 2.906458 0.000000\n-0.000000 0.000000 12.188932\nIn Ga O\n2 2 6\ndirect\n0.000000 0.000000 0.500000 In\n0.000000 0.000000 0.000000 In\n0.666666 0.333332 0.250000 Ga\n0.333332 0.666666 0.750000 Ga\n0.333332 0.666666 0.587304 O\n0.666666 0.333332 0.087304 O\n0.666666 0.333332 0.412696 O\n0.333332 0.666666 0.912696 O\n0.000000 0.000000 0.750000 O\n0.000000 0.000000 0.250000 O\n",
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"formula_full": "In2 Ga2 O6",
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{
"id": "jvasp-118396",
"created_at": "2022-09-04T14:38:51.410755Z",
"updated_at": "2022-09-04T14:38:51.410774Z",
"structure_string": "Ge1 Pb1 S1\n1.0\n3.044633 -0.000000 0.000000\n-0.000000 3.044633 0.000000\n-0.000000 0.000000 8.327973\nGe Pb S\n1 1 1\ndirect\n0.000000 0.000000 0.381747 Ge\n0.000000 0.000000 0.004002 Pb\n0.000000 0.000000 0.661629 S\n",
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"volume": 77.19856170751717,
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"formula_full": "Ge1 Pb1 S1",
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"spacegroup": 99
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{
"id": "jvasp-109363",
"created_at": "2022-09-04T14:38:10.557860Z",
"updated_at": "2022-09-04T14:38:10.557880Z",
"structure_string": "Sn1 Se1 S1\n1.0\n3.800975 0.000000 0.000000\n-1.900487 3.291741 0.000000\n-0.000000 -0.000000 6.026186\nSn Se S\n1 1 1\ndirect\n0.333332 0.666666 0.008087 Sn\n0.000000 0.000000 0.739691 Se\n0.666665 0.333333 0.252224 S\n",
"nsites": 3,
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{
"id": "jvasp-93574",
"created_at": "2022-09-04T14:36:22.452857Z",
"updated_at": "2022-09-04T14:36:22.452885Z",
"structure_string": "Tb1 Ge5\n1.0\n3.989546 0.000000 -0.000000\n-0.000000 6.145826 -0.000000\n-1.994773 -3.072913 5.006441\nTb Ge\n1 5\ndirect\n0.000000 0.000000 0.000000 Tb\n0.667356 0.456511 0.334709 Ge\n0.332646 0.543490 0.665291 Ge\n0.332646 0.121803 0.665291 Ge\n0.667356 0.878198 0.334709 Ge\n0.000000 0.500000 0.000000 Ge\n",
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{
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"created_at": "2022-09-04T14:36:12.768506Z",
"updated_at": "2022-09-04T14:36:12.768531Z",
"structure_string": "K2 Mn2 Cl2\n1.0\n-6.019158 0.000000 0.000000\n-3.009579 -3.009499 5.425409\n-3.009579 3.009499 5.425409\nK Mn Cl\n2 2 2\ndirect\n0.250061 0.750000 0.750000 K\n0.749939 0.250000 0.250000 K\n0.500000 0.000000 0.000000 Mn\n0.000000 0.500000 0.500000 Mn\n0.249938 0.250000 0.250000 Cl\n0.750062 0.750000 0.750000 Cl\n",
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},
{
"id": "jvasp-12921",
"created_at": "2022-09-04T14:37:08.396505Z",
"updated_at": "2022-09-04T14:37:08.396538Z",
"structure_string": "Ba2 Al4 Te8\n1.0\n8.585562 0.000000 0.000000\n0.000000 8.585562 -0.000000\n0.000000 0.000000 6.770951\nBa Al Te\n2 4 8\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.000000 Ba\n0.500000 0.000000 0.500000 Al\n0.000000 0.500000 0.500000 Al\n0.000000 0.500000 0.000000 Al\n0.500000 0.000000 0.000000 Al\n0.668799 0.831201 0.251378 Te\n0.331201 0.168799 0.251378 Te\n0.831201 0.668799 0.748622 Te\n0.668799 0.168799 0.748622 Te\n0.331201 0.831201 0.748622 Te\n0.168799 0.331201 0.748622 Te\n0.168799 0.668799 0.251378 Te\n0.831201 0.331201 0.251378 Te\n",
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{
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"created_at": "2022-09-04T14:35:52.248613Z",
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"structure_string": "Ba1 Ru1 Cl2\n1.0\n4.217642 0.000000 0.000000\n0.000000 4.220135 0.000000\n0.000000 0.000000 6.020712\nBa Ru Cl\n1 1 2\ndirect\n0.500000 0.499999 0.806024 Ba\n0.000000 0.000000 0.474235 Ru\n0.000000 0.000000 0.899766 Cl\n0.500000 0.499999 0.319974 Cl\n",
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