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{
"id": "jvasp-16748",
"created_at": "2022-09-04T14:37:47.441970Z",
"updated_at": "2022-09-04T14:37:47.441982Z",
"structure_string": "Ag1 Sb1 Te2\n1.0\n4.129047 -0.026103 6.147780\n1.853595 3.689701 6.147780\n-0.042627 -0.026103 7.405566\nAg Sb Te\n1 1 2\ndirect\n0.499999 0.500001 0.500000 Ag\n0.000000 0.000000 0.000000 Sb\n0.754824 0.754827 0.754826 Te\n0.245174 0.245175 0.245175 Te\n",
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"structure_string": "Li2 Ca1 Tl1\n1.0\n-10.492601 0.000000 -6.057906\n-6.821612 -0.045395 -0.300434\n-5.750004 2.985567 -2.156512\nLi Ca Tl\n2 1 1\ndirect\n0.721940 -0.000001 -0.000000 Li\n0.278060 -0.000000 -0.000000 Li\n0.000000 0.000000 0.000000 Ca\n0.500000 -0.000001 -0.000000 Tl\n",
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{
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{
"id": "jvasp-107688",
"created_at": "2022-09-04T14:36:56.218913Z",
"updated_at": "2022-09-04T14:36:56.218937Z",
"structure_string": "Pm3 Ti1\n1.0\n4.856110 -0.000000 0.000000\n0.000000 4.856110 0.000000\n-0.000000 -0.000000 4.856110\nPm Ti\n3 1\ndirect\n-0.000000 0.500000 0.500000 Pm\n0.500000 0.000000 0.500000 Pm\n0.500000 0.500000 -0.000000 Pm\n0.000000 0.000000 0.000000 Ti\n",
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"volume": 114.51583583515415,
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"formula_full": "Pm3 Ti1",
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},
{
"id": "jvasp-4140",
"created_at": "2022-09-04T14:36:52.720591Z",
"updated_at": "2022-09-04T14:36:52.720612Z",
"structure_string": "Ga2 Cl6\n1.0\n5.928761 -0.000000 3.375131\n2.036331 5.626611 3.317779\n0.005523 0.043201 6.885098\nGa Cl\n2 6\ndirect\n0.339349 0.084780 0.236520 Ga\n0.660650 0.915219 0.763480 Ga\n0.741109 0.000000 -0.000000 Cl\n0.258891 0.000000 -0.000000 Cl\n0.689347 0.193083 0.428223 Cl\n0.310653 0.806916 0.571778 Cl\n0.828232 0.547985 0.795550 Cl\n0.171767 0.452015 0.204451 Cl\n",
"nsites": 8,
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"spacegroup": 12
},
{
"id": "jvasp-37933",
"created_at": "2022-09-04T14:38:06.429078Z",
"updated_at": "2022-09-04T14:38:06.429101Z",
"structure_string": "Ac1 Mg3\n1.0\n-2.725098 2.725098 3.854917\n2.725098 -2.725098 3.854917\n2.725098 2.725098 -3.854917\nAc Mg\n1 3\ndirect\n0.000000 0.000000 0.000000 Ac\n0.499999 0.499999 0.000000 Mg\n0.750002 0.250001 0.500000 Mg\n0.250001 0.750002 0.500000 Mg\n",
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{
"id": "jvasp-112651",
"created_at": "2022-09-04T14:38:43.068332Z",
"updated_at": "2022-09-04T14:38:43.068354Z",
"structure_string": "Rb1 Ba3 Ga5 Se10 Cl2\n1.0\n7.843422 0.032790 -3.741626\n-1.846536 7.668806 -3.814266\n0.069311 -0.009561 9.957348\nRb Ba Ga Se Cl\n1 3 5 10 2\ndirect\n0.489089 0.353154 0.229889 Rb\n0.748483 0.874474 0.230277 Ba\n0.119556 0.508933 0.773511 Ba\n0.637312 0.236647 0.770061 Ba\n0.006897 0.002218 0.001125 Ga\n0.071103 0.474519 0.337635 Ga\n0.257759 0.852709 0.320859 Ga\n0.145177 0.935491 0.670294 Ga\n0.527747 0.735222 0.664808 Ga\n0.443387 0.953526 0.858097 Se\n0.045579 0.576068 0.139657 Se\n0.807733 0.716454 0.855468 Se\n0.042330 0.144887 0.851196 Se\n0.289440 0.936358 0.131079 Se\n0.167835 0.075379 0.511766 Se\n0.550811 0.823093 0.470438 Se\n0.931739 0.658583 0.496444 Se\n0.346778 0.447833 0.529011 Se\n0.865321 0.192778 0.153377 Se\n0.500311 0.507524 0.992881 Cl\n0.755605 0.244156 0.512123 Cl\n",
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"formula_full": "Rb1 Ba3 Ga5 Se10 Cl2",
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{
"id": "jvasp-2802",
"created_at": "2022-09-04T14:36:48.850632Z",
"updated_at": "2022-09-04T14:36:48.850659Z",
"structure_string": "Tl3 Sb1 S3\n1.0\n5.900258 0.011398 -1.518571\n-1.961577 5.564655 -1.518571\n0.008051 0.011398 6.092539\nTl Sb S\n3 1 3\ndirect\n0.556915 0.556915 0.172234 Tl\n0.556915 0.172234 0.556915 Tl\n0.172233 0.556915 0.556915 Tl\n0.997609 0.997610 0.997609 Sb\n0.577960 0.968936 0.968935 S\n0.968935 0.968936 0.577961 S\n0.968935 0.577962 0.968935 S\n",
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"volume": 200.3759142850978,
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"formula_full": "Tl3 Sb1 S3",
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{
"id": "jvasp-59666",
"created_at": "2022-09-04T14:37:40.744106Z",
"updated_at": "2022-09-04T14:37:40.744139Z",
"structure_string": "U6 Te8\n1.0\n7.584380 0.000000 -2.681483\n-3.792190 6.568265 -2.681483\n-0.000000 -0.000000 8.044449\nU Te\n6 8\ndirect\n0.750000 0.875001 0.125001 U\n0.625000 0.375000 0.250001 U\n0.875000 0.125000 0.750001 U\n0.125000 0.750001 0.875001 U\n0.375000 0.250000 0.625000 U\n0.250000 0.625000 0.375001 U\n0.653252 0.653252 0.653253 Te\n0.346748 0.500000 0.000001 Te\n0.500000 0.000000 0.346749 Te\n0.000000 0.346749 0.500000 Te\n0.500000 0.000000 0.846749 Te\n0.000000 0.846749 0.500001 Te\n0.153252 0.153252 0.153252 Te\n0.846749 0.500000 0.000001 Te\n",
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"spacegroup": 220
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{
"id": "jvasp-28537",
"created_at": "2022-09-04T14:37:33.168665Z",
"updated_at": "2022-09-04T14:37:33.168674Z",
"structure_string": "Te2 Mo1 W2 Se2 S2\n1.0\n3.354611 0.000000 0.000000\n-1.677305 2.904995 -0.001812\n0.000000 -0.019128 26.435489\nTe Mo W Se S\n2 1 2 2 2\ndirect\n0.666963 0.333924 0.523646 Te\n0.667289 0.334579 0.668011 Te\n0.332073 0.664145 0.103242 Mo\n0.333789 0.667577 0.595914 W\n0.667519 0.335037 0.341817 W\n0.664574 0.329146 0.040338 Se\n0.666216 0.332431 0.166197 Se\n0.334311 0.668622 0.399418 S\n0.333865 0.667729 0.284258 S\n",
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{
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"created_at": "2022-09-04T14:36:47.031189Z",
"updated_at": "2022-09-04T14:36:47.031214Z",
"structure_string": "Th1 In1\n1.0\n3.513886 0.000000 0.000000\n0.000000 3.513886 0.000000\n0.000000 -0.000000 4.636454\nTh In\n1 1\ndirect\n0.500001 0.500001 0.500000 Th\n0.000000 0.000000 0.000000 In\n",
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{
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