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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=269",
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"results": [
{
"id": "jvasp-29502",
"created_at": "2022-09-04T14:37:04.172753Z",
"updated_at": "2022-09-04T14:37:04.172779Z",
"structure_string": "Pb2 S2\n1.0\n4.218599 0.022231 -0.255217\n-0.037344 4.218492 -0.255217\n-0.210308 -0.213299 21.485168\nPb S\n2 2\ndirect\n0.716151 0.736157 0.932933 Pb\n0.263842 0.283849 0.067067 Pb\n0.218688 0.239281 0.941156 S\n0.760719 0.781311 0.058843 S\n",
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{
"id": "jvasp-1112",
"created_at": "2022-09-04T14:37:03.996668Z",
"updated_at": "2022-09-04T14:37:03.996696Z",
"structure_string": "Pb1 S1\n1.0\n3.664950 0.000000 2.115960\n1.221650 3.455348 2.115960\n0.000000 0.000000 4.231920\nPb S\n1 1\ndirect\n0.000000 0.000000 0.000000 Pb\n0.500000 0.500000 0.500000 S\n",
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{
"id": "jvasp-115385",
"created_at": "2022-09-04T14:38:46.324861Z",
"updated_at": "2022-09-04T14:38:46.324888Z",
"structure_string": "Pb1 S2\n1.0\n8.530963 0.000000 -0.177474\n0.000000 3.735045 0.000000\n-0.147343 0.000000 7.037321\nPb S\n1 2\ndirect\n0.611847 0.000000 -0.016500 Pb\n-0.212938 0.000000 -0.232463 S\n0.001090 0.000000 0.648963 S\n",
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"formula_full": "Pb1 S2",
"formula_reduced": "PbS2",
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"spacegroup": 6
},
{
"id": "jvasp-115381",
"created_at": "2022-09-04T14:38:45.651798Z",
"updated_at": "2022-09-04T14:38:45.651828Z",
"structure_string": "Pb1 S1\n1.0\n7.408481 0.000000 0.000000\n0.000000 7.408481 0.000000\n0.000000 0.000000 10.583545\nPb S\n1 1\ndirect\n0.000000 0.000000 0.874685 Pb\n0.000000 0.000000 0.125315 S\n",
"nsites": 2,
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"elements": [
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"chemical_system": "Pb-S",
"density": 0.6839727005083879,
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"volume": 580.8841193146079,
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"formula_full": "Pb1 S1",
"formula_reduced": "PbS",
"formula_anonymous": "AB",
"energy_above_hull": 1.22287041,
"spacegroup": 99
},
{
"id": "jvasp-115388",
"created_at": "2022-09-04T14:38:45.727682Z",
"updated_at": "2022-09-04T14:38:45.727691Z",
"structure_string": "Pb1 S2\n1.0\n3.999269 -0.005380 -0.479650\n1.585169 -6.746110 -2.071832\n0.000594 -2.209592 -3.358530\nPb S\n1 2\ndirect\n0.049778 0.918641 0.854614 Pb\n0.508206 0.231335 -0.000279 S\n0.592062 0.606144 0.708556 S\n",
"nsites": 3,
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"elements": [
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"volume": 73.95267505400844,
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"formula_full": "Pb1 S2",
"formula_reduced": "PbS2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.0897036066666668,
"spacegroup": 12
},
{
"id": "jvasp-115386",
"created_at": "2022-09-04T14:38:43.747309Z",
"updated_at": "2022-09-04T14:38:43.747337Z",
"structure_string": "Pb1 S2\n1.0\n5.174990 0.000000 0.000000\n0.000000 5.500238 0.000000\n0.000000 0.000000 3.237803\nPb S\n1 2\ndirect\n0.000000 0.450693 0.000000 Pb\n0.195974 0.950654 0.000000 S\n0.804026 0.950654 0.000000 S\n",
"nsites": 3,
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"elements": [
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"density": 4.888836284926447,
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"volume": 92.15977764069399,
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"formula_full": "Pb1 S2",
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"spacegroup": 47
},
{
"id": "jvasp-115393",
"created_at": "2022-09-04T14:38:43.781405Z",
"updated_at": "2022-09-04T14:38:43.781430Z",
"structure_string": "Pb2 S2\n1.0\n7.084387 -1.497015 0.692146\n3.497652 -6.168429 1.792722\n0.855816 2.399816 -3.393363\nPb S\n2 2\ndirect\n0.978109 -0.021941 0.011880 Pb\n0.478108 0.978115 0.511884 Pb\n0.477962 0.478334 0.011947 S\n-0.021949 0.478254 0.512165 S\n",
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"elements": [
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"energy_above_hull": 0.3969504099999998,
"spacegroup": 225
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{
"id": "jvasp-115387",
"created_at": "2022-09-04T14:38:46.140668Z",
"updated_at": "2022-09-04T14:38:46.140685Z",
"structure_string": "Pb2 S1\n1.0\n7.034471 0.489679 0.297615\n-3.283839 -4.640342 1.047511\n1.189800 1.993122 -3.359097\nPb S\n2 1\ndirect\n0.429019 0.492148 0.238743 Pb\n0.003532 0.566863 0.026392 Pb\n0.892593 0.956185 0.971225 S\n",
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"formula_full": "Pb2 S1",
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"spacegroup": 38
},
{
"id": "jvasp-115384",
"created_at": "2022-09-04T14:38:45.691024Z",
"updated_at": "2022-09-04T14:38:45.691037Z",
"structure_string": "Pb2 S1\n1.0\n3.714744 0.000000 0.000000\n0.000000 3.418315 0.000000\n0.000000 0.000000 7.528191\nPb S\n2 1\ndirect\n-0.033328 0.000000 0.729954 Pb\n-0.033328 0.000000 0.270045 Pb\n0.466655 0.000000 0.000000 S\n",
"nsites": 3,
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"elements": [
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"spacegroup": 47
},
{
"id": "jvasp-115391",
"created_at": "2022-09-04T14:38:46.356912Z",
"updated_at": "2022-09-04T14:38:46.356935Z",
"structure_string": "Pb1 S1\n1.0\n4.116381 0.870059 0.495369\n-1.344143 -4.015695 0.111326\n-1.832228 0.508367 -3.785128\nPb S\n1 1\ndirect\n0.637140 0.821554 0.066963 Pb\n0.636548 0.321273 0.566488 S\n",
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"spacegroup": 225
},
{
"id": "jvasp-79645",
"created_at": "2022-09-04T14:37:17.873303Z",
"updated_at": "2022-09-04T14:37:17.873324Z",
"structure_string": "Pb2 S2\n1.0\n2.997403 2.979813 -0.215010\n2.997403 -2.979813 -0.215010\n0.854697 0.000000 -6.243965\nPb S\n2 2\ndirect\n0.212585 0.212585 0.234058 Pb\n0.787414 0.787414 0.765943 Pb\n0.691181 0.691181 0.212805 S\n0.308818 0.308818 0.787195 S\n",
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},
{
"id": "jvasp-36357",
"created_at": "2022-09-04T14:36:44.319354Z",
"updated_at": "2022-09-04T14:36:44.319381Z",
"structure_string": "Pb1 S1\n1.0\n2.024092 -3.505830 0.000000\n2.024092 3.505830 -0.000000\n-0.000000 0.000000 3.799572\nPb S\n1 1\ndirect\n0.000000 0.000000 0.000000 Pb\n0.333333 0.666667 0.500000 S\n",
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]
}